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Dystrophin AlphaSync

Anchors the extracellular matrix to the cytoskeleton via F-actin. Ligand for dystroglycan. Component of the dystrophin-associated glycoprotein complex which accumulates at the neuromuscular junction (NMJ) and at a variety of synapses in the peripheral and central nervous systems and has a structural function in stabilizing the sarcolemma. Also implicated in signaling events and synaptic transmission.

AlphaFold DB (P11532-3), UniProt , Accession A0A087WV90, Species HUMAN (Homo sapiens, Human), Gene DMD, Length 2,341 aa.

>A0A087WV90_HUMAN|A0A087WV90|DMD
MSARKLRNLSYKKAVRRQKLLEQSIQSAQETEKSLHLIQESLTFIDKQLAAYIADKVDAAQMPQEAQKIQSDLTSHEISLEEMKKHNQGKEAAQRVLSQIDVAQKKLQDVSMKFRLFQKPANFEQRLQESKMILDEVKMHLPALETKSVEQEVVQSQLNHCVNLYKSLSEVKSEVEMVIKTGRQIVQKKQTENPKELDERVTALKLHYNELGAKVTERKQQLEKCLKLSRKMRKEMNVLTEWLAATDMELTKRSAVEGMPSNLDSEVAWGKATQKEIEKQKVHLKSITEVGEALKTVLGKKETLVEDKLSLLNSNWIAVTSRAEEWLNLLLEYQKHMETFDQNVDHITKWIIQADTLLDESEKKKPQQKEDVLKRLKAELNDIRPKVDSTRDQAANLMANRGDHCRKLVEPQISELNHRFAAISHRIKTGKASIPLKELEQFNSDIQKLLEPLEAEIQQGVNLKEEDFNKDMNEDNEGTVKELLQRGDNLQQRITDERKREEIKIKQQLLQTKHNALKDLRSQRRKKALEISHQWYQYKRQADDLLKCLDDIEKKLASLPEPRDERKIKEIDRELQKKKEELNAVRRQAEGLSEDGAAMAVEPTQIQLSKRWREIESKFAQFRRLNFAQIHTVREETMMVMTEDMPLEISYVPSTYLTEITHVSQALLEVEQLLNAPDLCAKDFEDLFKQEESLKNIKDSLQQSSGRIDIIHSKKTAALQSATPVERVKLQEALSQLDFQWEKVNKMYKDRQGRFDRSVEKWRRFHYDIKIFNQWLTEAEQFLRKTQIPENWEHAKYKWYLKELQDGIGQRQTVVRTLNATGEEIIQQSSKTDASILQEKLGSLNLRWQEVCKQLSDRKKRLEEQKNILSEFQRDLNEFVLWLEEADNIASIPLEPGKEQQLKEKLEQVKLLVEELPLRQGILKQLNETGGPVLVSAPISPEEQDKLENKLKQTNLQWIKVSRALPEKQGEIEAQIKDLGQLEKKLEDLEEQLNHLLLWLSPIRNQLEIYNQPNQEGPFDVKETEIAVQAKQPDVEEILSKGQHLYKEKPATQPVKRKLEDLSSEWKAVNRLLQELRAKQPDLAPGLTTIGASPTQTVTLVTQPVVTKETAISKLEMPSSLMLEVPALADFNRAWTELTDWLSLLDQVIKSQRVMVGDLEDINEMIIKQKATMQDLEQRRPQLEELITAAQNLKNKTSNQEARTIITDRIERIQNQWDEVQEHLQNRRQQLNEMLKDSTQWLEAKEEAEQVLGQARAKLESWKEGPYTVDAIQKKITETKQLAKDLRQWQTNVDVANDLALKLLRDYSADDTRKVHMITENINASWRSIHKRVSEREAALEETHRLLQQFPLDLEKFLAWLTEAETTANVLQDATRKERLLEDSKGVKELMKQWQDLQGEIEAHTDVYHNLDENSQKILRSLEGSDDAVLLQRRLDNMNFKWSELRKKSLNIRSHLEASSDQWKRLHLSLQELLVWLQLKDDELSRQAPIGGDFPAVQKQNDVHRAFKRELKTKEPVIMSTLETVRIFLTEQPLEGLEKLYQEPRELPPEERAQNVTRLLRKQAEEVNTEWEKLNLHSADWQRKIDETLERLRELQEATDELDLKLRQAEVIKGSWQPVGDLLIDSLQDHLEKVKALRGEIAPLKENVSHVNDLARQLTTLGIQLSPYNLSTLEDLNTRWKLLQVAVEDRVRQLHEAHRDFGPASQHFLSTSVQGPWERAISPNKVPYYINHETQTTCWDHPKMTELYQSLADLNNVRFSAYRTAMKLRRLQKALCLDLLSLSAACDALDQHNLKQNDQPMDILQIINCLTTIYDRLEQEHNNLVNVPLCVDMCLNWLLNVYDTGRTGRIRVLSFKTGIISLCKAHLEDKYRYLFKQVASSTGFCDQRRLGLLLHDSIQIPRQLGEVASFGGSNIEPSVRSCFQFANNKPEIEAALFLDWMRLEPQSMVWLPVLHRVAAAETAKHQAKCNICKECPIIGFRYRSLKHFNYDICQSCFFSGRVAKGHKMHYPMVEYCTPTTSGEDVRDFAKVLKNKFRTKRYFAKHPRMGYLPVQTVLEGDNMETPVTLINFWPVDSAPASSPQLSHDDTHSRIEHYASRLAEMENSNGSYLNDSISPNESIDDEHLLIQHYCQSLNQDSPLSQPRSPAQILISLESEERGELERILADLEEENRNLQAEYDRLKQQHEHKGLSPLPSPPEMMPTSPQSPRDAELIAEAKLLRQHKGRLEARMQILEDHNKQLESQLHRLRQLLEQPQAEAKVNGTTVSSPSTSLQRSDSSQPMLLRVVGSQTSDSMGEEDLLSPPQDTSTGLEEVMEQLNNSFPSSRGRNTPGKPMREDTM
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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M49.5Very low55.8Low236 Ų236158.8 Ų158.8100%1.16379%0.787SS**  0-22.20-88.7-174166.900115.9A3 R4M1-A3 PolarHBondContact O-N 3.47Å; M1-R4 PolarHBondContact O-N 3.4Å
2S55.6Low56.1Low110 Ų110159.1 Ų159.177%0.76978%0.78SS**THydrogen-bonded Turntrans-59.2-36.8-173.1-162.40000115.5R4 K5S2-R4 PolarHBondContact O-N 3.19Å; S2-K5 PolarHBondContact O-N 3.04Å
3A54.4Low56.3Low87 Ų87160.3 Ų160.372%0.71978%0.778SS**THydrogen-bonded Turntrans-60.6-19.1-175.800000116M1M1-A3 PolarHBondContact O-N 3.47Å
4R53.9Low56.8Low231 Ų231153.4 Ų153.487%0.87276%0.76SS**Hα-helixtrans-77.4-19.3-176.3-122.2179.5-174.4178.41.8114M1 S2M1-R4 PolarHBondContact O-N 3.4Å; S2-R4 PolarHBondContact O-N 3.19Å
5K55.1Low57.6Low184 Ų184148.4 Ų148.480%0.874%0.741SS**Hα-helixtrans-78.6-26.5179.5-88.8-175.8173.1-179.90114S2S2-K5 PolarHBondContact O-N 3.04Å
6L56.3Low58Low144 Ų144151.6 Ų151.675%0.75474%0.742SS**Hα-helixtrans-75.2-32.6-174.1-97.9153.9000114.8
7R56.5Low58.4Low220 Ų220153.6 Ų153.683%0.8374%0.74SS**Hα-helixtrans-69.6-34-179.1-81.7-171176.8-176.8-0.1114.3L9R7-L9 VanDerWaalsContact C-N 3.33Å; R7-L9 PolarHBondContact O-N 3.47Å
8N57.2Low59Low129 Ų129151.7 Ų151.769%0.6973%0.73SS**Hα-helixtrans-72.8-19.3-172.7-94.7-14.5000114.9
9L56.1Low59.5Low140 Ų140151 Ų15173%0.73372%0.723SS**Hα-helixtrans-82.3-29.8179.1-93.4153.7000113.3R7R7-L9 VanDerWaalsContact C-N 3.33Å; R7-L9 PolarHBondContact O-N 3.47Å
10S58.1Low60Low91 Ų91149.1 Ų149.164%0.63672%0.716SS**Hα-helixtrans-73.1-47.4-179-172.30000112.3K12 K13S10-K12 VanDerWaalsContact C-N 3.34Å; S10-K12 PolarHBondContact O-N 3.1Å; S10-K13 PolarHBondContact O-N 3.02Å
11Y61.1Low60.4Low175 Ų175146.9 Ų146.969%0.68671%0.707SS**Hα-helixtrans-57.5-41.1-176.3-172.8-103.5000113.5K13 A14 V15Y11-K13 PolarHBondContact O-N 2.87Å; Y11-A14 PolarHBondContact O-N 3.18Å; Y11-V15 HydrophobicContact CE1-CG2 4.37Å
12K59.1Low61.5Low162 Ų162140.4 Ų140.470%0.70468%0.675SS**Hα-helixtrans-66.7-19.6178.5-74.2-169.6175.5-174.60114.2S10S10-K12 VanDerWaalsContact C-N 3.34Å; S10-K12 PolarHBondContact O-N 3.1Å
13K59.3Low62.3Low175 Ų175141.1 Ų141.176%0.76167%0.666SS**Hα-helixtrans-81.7-37177.8-109.3-176.1176.4-176.30112.6S10 Y11S10-K13 PolarHBondContact O-N 3.02Å; Y11-K13 PolarHBondContact O-N 2.87Å
14A63.4Low62.9Low64 Ų64140.1 Ų140.153%0.52965%0.653SS.*Hα-helixtrans-67.1-50-177.300000112.8Y11 R16 R17 Q18Y11-A14 PolarHBondContact O-N 3.18Å; A14-R16 VanDerWaalsContact C-N 3.26Å; A14-R16 PolarHBondContact O-N 2.97Å; A14-R17 WeakPolarHBondContact O-CB 3.45Å; A14-R17 PolarHBondContact O-N 3.2Å; A14-Q18 PolarHBondContact O-N 3.39Å
15V68.3Low63.7Low78 Ų78134 Ų13447%0.47364%0.637SS.*Hα-helixtrans-59-35.5-177.4179.60000112.4Y11 R17 K19Y11-V15 HydrophobicContact CE1-CG2 4.37Å; V15-R17 VanDerWaalsContact C-N 3.34Å; V15-R17 PolarHBondContact O-N 3.37Å; V15-K19 PolarHBondContact O-N 3.37Å
16R63.7Low64.7Low200 Ų200131 Ų13176%0.75563%0.626SS**Hα-helixtrans-68.1-29.3175.3-79.1-176.4170.6178.9-3.9113.3A14 L20A14-R16 VanDerWaalsContact C-N 3.26Å; A14-R16 PolarHBondContact O-N 2.97Å; R16-L20 WeakPolarHBondContact O-CD1 3.43Å; R16-L20 WeakPolarHBondContact O-CG 3.47Å
17R65.2Low65.4Low186 Ų186125.7 Ų125.770%0.70260%0.601SS**Hα-helixtrans-77-39.5-179.4-164.874173.6-165.80.3111.6A14 V15 L21A14-R17 WeakPolarHBondContact O-CB 3.45Å; A14-R17 PolarHBondContact O-N 3.2Å; V15-R17 VanDerWaalsContact C-N 3.34Å; V15-R17 PolarHBondContact O-N 3.37Å; R17-L21 PolarHBondContact O-N 3.03Å
18Q69.3Low66Low119 Ų119117.1 Ų117.156%0.55658%0.577SS**Hα-helixtrans-61.7-51177.3179.7178.6-10.600111.7A14 L20 L21 E22A14-Q18 PolarHBondContact O-N 3.39Å; Q18-L20 PolarHBondContact O-N 3.48Å; Q18-L20 VanDerWaalsContact O-N 3.16Å; Q18-L21 PolarHBondContact O-N 3.09Å; Q18-E22 WeakPolarHBondContact CG-OE1 3.29Å; Q18-E22 PolarHBondContact NE2-OE1 3.17Å; Q18-E22 PolarHBondContact O-N 3.37Å
19K68.1Low67Low138 Ų138116.5 Ų116.560%0.657%0.57SS**Hα-helixtrans-62-28.2-175.4-155.9174.7-172.6-179.50113.6V15 Q23V15-K19 PolarHBondContact O-N 3.37Å; K19-Q23 WeakPolarHBondContact O-CG 3.43Å
20L69Low68.1Low113 Ų113115.1 Ų115.159%0.59256%0.559SS**Hα-helixtrans-74.1-32.4174-75169.3000113.1R16 Q18 S24R16-L20 WeakPolarHBondContact O-CD1 3.43Å; R16-L20 WeakPolarHBondContact O-CG 3.47Å; Q18-L20 PolarHBondContact O-N 3.48Å; Q18-L20 VanDerWaalsContact O-N 3.16Å; L20-S24 PolarHBondContact O-N 2.93Å
21L68.7Low69Low102 Ų102111.3 Ų111.353%0.53453%0.532SS..Hα-helixtrans-74.2-42.1179.3-75.8164.5000111.8R17 Q18 Q23 S24 I25R17-L21 PolarHBondContact O-N 3.03Å; Q18-L21 PolarHBondContact O-N 3.09Å; L21-Q23 PolarHBondContact O-N 2.99Å; L21-S24 PolarHBondContact O-N 2.74Å; L21-S24 VanDerWaalsContact O-N 3.11Å; L21-I25 PolarHBondContact O-N 3.2Å; L21-I25 VanDerWaalsContact O-N 3.12Å
22E73.9Confident69.9Low101 Ų101107.2 Ų107.247%0.47252%0.519SS..Hα-helixtrans-58.5-46177-71.1165-179.200111.4Q18 S24 I25 Q26Q18-E22 WeakPolarHBondContact CG-OE1 3.29Å; Q18-E22 PolarHBondContact NE2-OE1 3.17Å; Q18-E22 PolarHBondContact O-N 3.37Å; E22-S24 VanDerWaalsContact C-N 3.3Å; E22-S24 PolarHBondContact O-N 2.99Å; E22-I25 PolarHBondContact O-N 2.94Å; E22-Q26 PolarHBondContact O-N 3.06Å
23Q71.6Confident71.1Confident124 Ų124106.6 Ų106.658%0.57952%0.517SS*.Hα-helixtrans-62.2-34.5175.1-71.1-177.8-38.300113K19 L21 S27K19-Q23 WeakPolarHBondContact O-CG 3.43Å; L21-Q23 PolarHBondContact O-N 2.99Å; Q23-S27 PolarHBondContact O-N 3.29Å
24S66.8Low72.3Confident66 Ų66101.1 Ų101.146%0.46250%0.5SS..Hα-helixtrans-72.4-32.9179.8-1680000113.3L20 L21 E22 A28L20-S24 PolarHBondContact O-N 2.93Å; L21-S24 PolarHBondContact O-N 2.74Å; L21-S24 VanDerWaalsContact O-N 3.11Å; E22-S24 VanDerWaalsContact C-N 3.3Å; E22-S24 PolarHBondContact O-N 2.99Å; S24-A28 PolarHBondContact O-N 2.95Å
25I71.9Confident73.4Confident104 Ų10498.1 Ų98.153%0.53348%0.475SS..Hα-helixtrans-71.2-43.5179-67.7169000110.4L21 E22 S27 A28 Q29L21-I25 PolarHBondContact O-N 3.2Å; L21-I25 VanDerWaalsContact O-N 3.12Å; E22-I25 PolarHBondContact O-N 2.94Å; I25-S27 PolarHBondContact O-N 3.16Å; I25-A28 PolarHBondContact O-N 3.44Å; I25-Q29 PolarHBondContact O-N 3.49Å
26Q75.6Confident74.2Confident121 Ų12199.5 Ų99.557%0.56548%0.477SS*.Hα-helixtrans-61.7-44.6-178.5-168.3169.40.500111.9E22 A28 Q29 E30E22-Q26 PolarHBondContact O-N 3.06Å; Q26-A28 VanDerWaalsContact C-N 3.3Å; Q26-A28 PolarHBondContact O-N 3.04Å; Q26-Q29 PolarHBondContact O-N 3.42Å; Q26-E30 PolarHBondContact O-N 3.05Å
27S70.6Confident75.4Confident32 Ų3295.5 Ų95.522%0.22447%0.469CS..Hα-helixtrans-64.5-29.9177.2-179.50000113.7Q23 I25 T31 H86Q23-S27 PolarHBondContact O-N 3.29Å; I25-S27 PolarHBondContact O-N 3.16Å; S27-T31 PolarHBondContact O-N 2.87Å; S27-T31 PolarHBondContact O-OG1 3.43Å; S27-H86 PolarHBondContact OG-NE2 3.32Å
28A70.2Confident76.6Confident39 Ų3987 Ų8732%0.32244%0.438SS..Hα-helixtrans-70.9-42.3176.500000111.7S24 I25 Q26 E30 T31 E32S24-A28 PolarHBondContact O-N 2.95Å; I25-A28 PolarHBondContact O-N 3.44Å; Q26-A28 VanDerWaalsContact C-N 3.3Å; Q26-A28 PolarHBondContact O-N 3.04Å; A28-E30 VanDerWaalsContact C-N 3.34Å; A28-E30 PolarHBondContact O-N 3.35Å; A28-T31 PolarHBondContact O-N 3.42Å; A28-E32 PolarHBondContact O-N 2.95Å; A28-E32 VanDerWaalsContact O-N 3.07Å
29Q77.9Confident77.5Confident116 Ų11684 Ų8454%0.54242%0.424SS..Hα-helixtrans-65.2-34.3178.5-69.7-178.6-16.900113.2I25 Q26 K33I25-Q29 PolarHBondContact O-N 3.49Å; Q26-Q29 PolarHBondContact O-N 3.42Å; Q29-K33 WeakPolarHBondContact O-CG 3.48Å; Q29-K33 PolarHBondContact O-N 2.91Å
30E78.4Confident78.6Confident111 Ų11182.7 Ų82.752%0.51942%0.42SS..Hα-helixtrans-67.9-40.5174-71.8168.9178.300111.4Q26 A28 K33 S34Q26-E30 PolarHBondContact O-N 3.05Å; A28-E30 VanDerWaalsContact C-N 3.34Å; A28-E30 PolarHBondContact O-N 3.35Å; E30-K33 PolarHBondContact O-N 3.36Å; E30-S34 PolarHBondContact O-N 3.1Å; E30-S34 PolarHBondContact O-OG 3.44Å
31T76.9Confident79.7Confident11 Ų1178.9 Ų78.97%0.06740%0.403CS..Hα-helixtrans-63.5-46.6177.6-51.50000111.8S27 A28 K33 S34 L35 M83 V96S27-T31 PolarHBondContact O-N 2.87Å; S27-T31 PolarHBondContact O-OG1 3.43Å; A28-T31 PolarHBondContact O-N 3.42Å; T31-K33 VanDerWaalsContact C-N 3.31Å; T31-K33 PolarHBondContact O-N 3.09Å; T31-S34 PolarHBondContact O-N 3.15Å; T31-L35 WeakPolarHBondContact O-CB 3.43Å; T31-L35 PolarHBondContact O-N 3.34Å; T31-M83 HydrophobicContact CG2-CB 4.33Å; T31-M83 HydrophobicContact CG2-CG 4.08Å; T31-M83 HydrophobicContact CG2-SD 3.86Å; T31-V96 HydrophobicContact CG2-CG1 3.62Å
32E80.4Confident80.8Confident89 Ų8974 Ų7442%0.41638%0.377SS..Hα-helixtrans-62.8-36.2-178.7-168.7168.3-149.600112.1A28 H36A28-E32 PolarHBondContact O-N 2.95Å; A28-E32 VanDerWaalsContact O-N 3.07Å; E32-H36 PolarHBondContact O-N 3.44Å; E32-H36 VanDerWaalsContact O-N 3.13Å
33K85Confident81.6Confident150 Ų15072 Ų7265%0.65237%0.372SS*.Hα-helixtrans-66-49.6174.6-74.7177.2179.91790113Q29 E30 T31 L35 H36 L37Q29-K33 WeakPolarHBondContact O-CG 3.48Å; Q29-K33 PolarHBondContact O-N 2.91Å; E30-K33 PolarHBondContact O-N 3.36Å; T31-K33 VanDerWaalsContact C-N 3.31Å; T31-K33 PolarHBondContact O-N 3.09Å; K33-L35 PolarHBondContact O-N 3.08Å; K33-H36 PolarHBondContact O-N 2.71Å; K33-L37 PolarHBondContact O-N 3.29Å
34S84Confident82.6Confident59 Ų5971.7 Ų71.741%0.41337%0.369SS..Hα-helixtrans-59.2-39.6178.3-65.60000111.2E30 T31 L37 I38E30-S34 PolarHBondContact O-N 3.1Å; E30-S34 PolarHBondContact O-OG 3.44Å; T31-S34 PolarHBondContact O-N 3.15Å; S34-L37 PolarHBondContact O-N 3.5Å; S34-I38 WeakPolarHBondContact O-CG1 3.43Å; S34-I38 PolarHBondContact O-N 3.48Å
35L85.3Confident83.8Confident1 Ų168.7 Ų68.71%0.00535%0.348CS..Hα-helixtrans-64.9-43.1178.6-165.576000113.3T31 K33 L37 I38 Q39 L80 M83 Q99 I100 A103T31-L35 WeakPolarHBondContact O-CB 3.43Å; T31-L35 PolarHBondContact O-N 3.34Å; K33-L35 PolarHBondContact O-N 3.08Å; L35-L37 VanDerWaalsContact C-N 3.29Å; L35-L37 PolarHBondContact O-N 3.18Å; L35-I38 PolarHBondContact O-N 3.23Å; L35-Q39 WeakPolarHBondContact O-CG 3.25Å; L35-Q39 PolarHBondContact O-N 2.82Å; L35-L80 HydrophobicContact CD1-CD2 3.38Å; L35-M83 HydrophobicContact CB-SD 4.46Å; L35-M83 HydrophobicContact CD1-CE 4.12Å; L35-M83 HydrophobicContact CD1-SD 4.47Å; L35-Q99 HydrophobicContact CD2-CB 3.25Å; L35-Q99 HydrophobicContact CD2-CG 4.42Å; L35-I100 HydrophobicContact CD1-CB 4.37Å; L35-I100 HydrophobicContact CD1-CG1 3.7Å; L35-I100 HydrophobicContact CD2-CG1 4.23Å; L35-A103 HydrophobicContact CD1-CB 4Å
36H86.3Confident84.7Confident108 Ų10864.8 Ų64.850%0.533%0.328SS..Hα-helixtrans-63-37.4179.5-159-47000111.7E32 K33 Q39 E40E32-H36 PolarHBondContact O-N 3.44Å; E32-H36 VanDerWaalsContact O-N 3.13Å; K33-H36 PolarHBondContact O-N 2.71Å; H36-Q39 PolarHBondContact O-N 3.03Å; H36-E40 IonicContact CE1-OE1 3.42Å; H36-E40 PolarHBondContact CE1-OE1 3.11Å; H36-E40 IonicContact ND1-OE1 3.93Å; H36-E40 PolarHBondContact ND1-OE1 2.72Å; H36-E40 WeakPolarHBondContact O-CG 3.44Å; H36-E40 PolarHBondContact O-N 3.39Å
37L88.9Confident85.5Confident115 Ų11566 Ų6660%0.60233%0.331SS*.Hα-helixtrans-63.4-41.7173.9-72.3166000112.4K33 S34 L35 S41K33-L37 PolarHBondContact O-N 3.29Å; S34-L37 PolarHBondContact O-N 3.5Å; L35-L37 VanDerWaalsContact C-N 3.29Å; L35-L37 PolarHBondContact O-N 3.18Å; L37-S41 WeakPolarHBondContact O-CB 3.41Å; L37-S41 PolarHBondContact O-N 3.4Å
38I89Confident86.4Confident9 Ų966.5 Ų66.55%0.04633%0.33CS..Hα-helixtrans-64.1-46.1175.3-64.6-177.1000110.6S34 L35 E40 S41 L42 H76 L80 M83S34-I38 WeakPolarHBondContact O-CG1 3.43Å; S34-I38 PolarHBondContact O-N 3.48Å; L35-I38 PolarHBondContact O-N 3.23Å; I38-E40 VanDerWaalsContact C-N 3.33Å; I38-E40 PolarHBondContact O-N 3.3Å; I38-S41 PolarHBondContact O-N 3.39Å; I38-L42 HydrophobicContact CG2-CD1 3.69Å; I38-L42 HydrophobicContact CG2-CG 4.07Å; I38-L42 WeakPolarHBondContact O-CB 3.49Å; I38-L42 VanDerWaalsContact O-CG 3.28Å; I38-L42 WeakPolarHBondContact O-CG 3.41Å; I38-L42 PolarHBondContact O-N 3.28Å; I38-H76 HydrophobicContact CG2-CB 3.9Å; I38-L80 HydrophobicContact CD1-CD2 4.2Å; I38-L80 HydrophobicContact CD1-CG 3.99Å; I38-L80 HydrophobicContact CG2-CD1 4.02Å; I38-L80 HydrophobicContact CG2-CD2 4.35Å; I38-L80 HydrophobicContact CG2-CG 4.17Å; I38-M83 HydrophobicContact CD1-CE 3.45Å; I38-M83 VanDerWaalsContact CD1-CE 3.45Å
39Q89.3Confident87.3Confident54 Ų5464.6 Ų64.625%0.25232%0.315SS..Hα-helixtrans-61.7-38.6179.9-71.6-178.4-4.200112.6L35 H36 T43 Q99 A103L35-Q39 WeakPolarHBondContact O-CG 3.25Å; L35-Q39 PolarHBondContact O-N 2.82Å; H36-Q39 PolarHBondContact O-N 3.03Å; Q39-T43 WeakPolarHBondContact O-CB 3.49Å; Q39-T43 PolarHBondContact O-N 2.99Å; Q39-T43 PolarHBondContact O-OG1 2.88Å; Q39-Q99 PolarHBondContact NE2-O 3.09Å; Q39-A103 HydrophobicContact CG-CB 3.79Å
40E90.7Very high87.8Confident112 Ų11261.1 Ų61.152%0.52331%0.305SS..Hα-helixtrans-65.7-47.2173.3-75.4-178.5177.700112.2H36 I38 L42 T43 F44H36-E40 IonicContact CE1-OE1 3.42Å; H36-E40 PolarHBondContact CE1-OE1 3.11Å; H36-E40 IonicContact ND1-OE1 3.93Å; H36-E40 PolarHBondContact ND1-OE1 2.72Å; H36-E40 WeakPolarHBondContact O-CG 3.44Å; H36-E40 PolarHBondContact O-N 3.39Å; I38-E40 VanDerWaalsContact C-N 3.33Å; I38-E40 PolarHBondContact O-N 3.3Å; E40-L42 PolarHBondContact O-N 3.35Å; E40-T43 PolarHBondContact O-N 2.97Å; E40-F44 PolarHBondContact O-N 3.13Å
41S91.6Very high88.3Confident33 Ų3358 Ų5823%0.23130%0.298CS..Hα-helixtrans-61.5-44.6178.2178.60000112.1L37 I38 T43 F44 I45 H76L37-S41 WeakPolarHBondContact O-CB 3.41Å; L37-S41 PolarHBondContact O-N 3.4Å; I38-S41 PolarHBondContact O-N 3.39Å; S41-T43 VanDerWaalsContact C-N 3.31Å; S41-T43 PolarHBondContact O-N 2.87Å; S41-F44 WeakPolarHBondContact O-CB 3.47Å; S41-F44 PolarHBondContact O-N 2.87Å; S41-F44 VanDerWaalsContact O-N 3.15Å; S41-I45 WeakPolarHBondContact O-CG1 3.25Å; S41-I45 PolarHBondContact O-N 3.16Å; S41-H76 WeakPolarHBondContact CB-NE2 3.45Å; S41-H76 PolarHBondContact OG-NE2 3.49Å
42L92.4Very high88.8Confident0 Ų059.4 Ų59.40%030%0.303CS..Hα-helixtrans-61.1-39.5174.7-68.8174.3000111.9I38 E40 F44 I45 D46 L73 K106 L107I38-L42 HydrophobicContact CG2-CD1 3.69Å; I38-L42 HydrophobicContact CG2-CG 4.07Å; I38-L42 WeakPolarHBondContact O-CB 3.49Å; I38-L42 VanDerWaalsContact O-CG 3.28Å; I38-L42 WeakPolarHBondContact O-CG 3.41Å; I38-L42 PolarHBondContact O-N 3.28Å; E40-L42 PolarHBondContact O-N 3.35Å; L42-F44 VanDerWaalsContact C-N 3.31Å; L42-F44 PolarHBondContact O-N 3.4Å; L42-I45 PolarHBondContact O-N 2.98Å; L42-D46 VanDerWaalsContact O-CB 3.22Å; L42-D46 WeakPolarHBondContact O-CB 3.47Å; L42-D46 PolarHBondContact O-N 2.88Å; L42-L73 HydrophobicContact CD2-CD2 3.71Å; L42-K106 HydrophobicContact CB-CG 4.1Å; L42-K106 HydrophobicContact CD1-CB 4.39Å; L42-K106 HydrophobicContact CD1-CG 4.5Å; L42-L107 HydrophobicContact CD1-CB 3.86Å; L42-L107 HydrophobicContact CD2-CB 4.2Å; L42-L107 HydrophobicContact CD2-CD1 3.7Å
43T90.5Very high89Confident59 Ų5958.3 Ų58.336%0.36230%0.299SS..Hα-helixtrans-67.3-31.8176.5-58.20000112.4Q39 E40 S41 K47Q39-T43 WeakPolarHBondContact O-CB 3.49Å; Q39-T43 PolarHBondContact O-N 2.99Å; Q39-T43 PolarHBondContact O-OG1 2.88Å; E40-T43 PolarHBondContact O-N 2.97Å; S41-T43 VanDerWaalsContact C-N 3.31Å; S41-T43 PolarHBondContact O-N 2.87Å; T43-K47 WeakPolarHBondContact O-CG 3.4Å; T43-K47 PolarHBondContact O-N 3.39Å
44F92.2Very high88.9Confident117 Ų11754.8 Ų54.851%0.51330%0.298SS..Hα-helixtrans-70.8-49.2173.6178.7-100.2000112E40 S41 L42 D46 K47 Q48E40-F44 PolarHBondContact O-N 3.13Å; S41-F44 WeakPolarHBondContact O-CB 3.47Å; S41-F44 PolarHBondContact O-N 2.87Å; S41-F44 VanDerWaalsContact O-N 3.15Å; L42-F44 VanDerWaalsContact C-N 3.31Å; L42-F44 PolarHBondContact O-N 3.4Å; F44-D46 VanDerWaalsContact C-N 3.3Å; F44-D46 PolarHBondContact O-N 3.07Å; F44-K47 PolarHBondContact O-N 2.94Å; F44-Q48 HydrophobicContact CE1-CG 4.21Å; F44-Q48 VanDerWaalsContact CE1-NE2 3.33Å; F44-Q48 HydrophobicContact CZ-CG 4.31Å; F44-Q48 PolarHBondContact O-N 3.3Å
45I92.1Very high88.8Confident3 Ų357.8 Ų57.82%0.01531%0.31CS..Hα-helixtrans-60.7-40.7176.7-63.6166.9000110.5S41 L42 K47 Q48 L49 I69 D72 L73 V110S41-I45 WeakPolarHBondContact O-CG1 3.25Å; S41-I45 PolarHBondContact O-N 3.16Å; L42-I45 PolarHBondContact O-N 2.98Å; I45-K47 VanDerWaalsContact C-N 3.31Å; I45-K47 PolarHBondContact O-N 3.28Å; I45-Q48 PolarHBondContact O-N 3Å; I45-L49 HydrophobicContact CG2-CD1 3.72Å; I45-L49 HydrophobicContact CG2-CG 4.15Å; I45-L49 WeakPolarHBondContact O-CG 3.4Å; I45-L49 PolarHBondContact O-N 3.38Å; I45-I69 HydrophobicContact CG2-CG1 4.31Å; I45-I69 HydrophobicContact CG2-CG2 3.62Å; I45-D72 HydrophobicContact CD1-CB 3.87Å; I45-L73 HydrophobicContact CD1-CD2 4.38Å; I45-L73 HydrophobicContact CG2-CD2 4.48Å; I45-V110 HydrophobicContact CB-CG1 4.05Å; I45-V110 HydrophobicContact CG2-CG1 3.47Å; I45-V110 VanDerWaalsContact CG2-CG1 3.47Å
46D92.5Very high88.6Confident22 Ų2265.3 Ų65.312%0.11834%0.342CS..Hα-helixtrans-55.5-43.3176-169.441000112.8L42 F44 A50 K106 V110 K113L42-D46 VanDerWaalsContact O-CB 3.22Å; L42-D46 WeakPolarHBondContact O-CB 3.47Å; L42-D46 PolarHBondContact O-N 2.88Å; F44-D46 VanDerWaalsContact C-N 3.3Å; F44-D46 PolarHBondContact O-N 3.07Å; D46-A50 VanDerWaalsContact O-CB 3.25Å; D46-A50 WeakPolarHBondContact O-CB 3.47Å; D46-A50 PolarHBondContact O-N 3.41Å; D46-K106 VanDerWaalsContact CG-NZ 3.32Å; D46-K106 IonicContact OD1-NZ 3.17Å; D46-K106 IonicContact OD2-NZ 3.4Å; D46-K106 PolarHBondContact OD2-NZ 2.97Å; D46-V110 HydrophobicContact CB-CG2 3.64Å; D46-K113 VanDerWaalsContact OD1-CD 3.31Å; D46-K113 WeakPolarHBondContact OD1-CD 3.45Å; D46-K113 WeakPolarHBondContact OD1-CE 3.22Å; D46-K113 IonicContact OD1-NZ 3.91Å; D46-K113 PolarHBondContact OD1-NZ 3.06Å; D46-K113 IonicContact OD2-NZ 2.76Å
47K90.9Very high88.3Confident146 Ų14661.8 Ų61.864%0.63533%0.328SS*.Hα-helixtrans-70.1-41.2177.7-73.8177.5178.9-179.50112T43 F44 I45 A50 A51T43-K47 WeakPolarHBondContact O-CG 3.4Å; T43-K47 PolarHBondContact O-N 3.39Å; F44-K47 PolarHBondContact O-N 2.94Å; I45-K47 VanDerWaalsContact C-N 3.31Å; I45-K47 PolarHBondContact O-N 3.28Å; K47-A50 PolarHBondContact O-N 3.46Å; K47-A51 PolarHBondContact O-N 3.01Å
48Q89.9Confident88.1Confident42 Ų4257 Ų5720%0.19630%0.303CS..Hα-helixtrans-63.1-48.5176.5-73-163.1-21.900111.9F44 I45 A50 A51 Y52F44-Q48 HydrophobicContact CE1-CG 4.21Å; F44-Q48 VanDerWaalsContact CE1-NE2 3.33Å; F44-Q48 HydrophobicContact CZ-CG 4.31Å; F44-Q48 PolarHBondContact O-N 3.3Å; I45-Q48 PolarHBondContact O-N 3Å; Q48-A50 VanDerWaalsContact C-N 3.33Å; Q48-A50 PolarHBondContact O-N 3.5Å; Q48-A51 WeakPolarHBondContact O-CB 3.22Å; Q48-A51 PolarHBondContact O-N 2.93Å; Q48-A51 VanDerWaalsContact O-N 3.15Å; Q48-Y52 HydrophobicContact CB-CE2 4.17Å; Q48-Y52 WeakPolarHBondContact O-CD2 3.44Å; Q48-Y52 PolarHBondContact O-N 2.82Å
49L90.3Very high87.8Confident0 Ų057.3 Ų57.30%031%0.308CS..Hα-helixtrans-64.6-38.7178.7-67.4173.2000111.8I45 A51 Y52 I53 I69 V110 K113 F114 F117I45-L49 HydrophobicContact CG2-CD1 3.72Å; I45-L49 HydrophobicContact CG2-CG 4.15Å; I45-L49 WeakPolarHBondContact O-CG 3.4Å; I45-L49 PolarHBondContact O-N 3.38Å; L49-A51 VanDerWaalsContact C-N 3.31Å; L49-A51 PolarHBondContact O-N 3.21Å; L49-Y52 HydrophobicContact CD2-CD2 4.49Å; L49-Y52 PolarHBondContact O-N 3.28Å; L49-I53 WeakPolarHBondContact O-CB 3.36Å; L49-I53 WeakPolarHBondContact O-CD1 3.38Å; L49-I53 WeakPolarHBondContact O-CG1 3.44Å; L49-I53 PolarHBondContact O-N 3.33Å; L49-I69 HydrophobicContact CD1-CG2 4.3Å; L49-I69 HydrophobicContact CD2-CD1 3.95Å; L49-I69 HydrophobicContact CD2-CG2 4.48Å; L49-I69 HydrophobicContact CG-CD1 4.41Å; L49-V110 HydrophobicContact CD1-CG1 3.88Å; L49-K113 HydrophobicContact CB-CB 4.13Å; L49-K113 HydrophobicContact CD1-CB 4.23Å; L49-F114 HydrophobicContact CD1-CB 3.84Å; L49-F114 HydrophobicContact CD1-CD2 4.31Å; L49-F114 HydrophobicContact CD2-CD2 3.9Å; L49-F117 HydrophobicContact CD2-CB 3.91Å; L49-F117 HydrophobicContact CD2-CD1 3.7Å; L49-F117 HydrophobicContact CD2-CE1 4.37Å; L49-F117 HydrophobicContact CD2-CG 3.85Å
50A88Confident87.3Confident42 Ų4258.8 Ų58.835%0.34733%0.329SS..Hα-helixtrans-60.7-39.4173.200000112.5D46 K47 Q48 A54D46-A50 VanDerWaalsContact O-CB 3.25Å; D46-A50 WeakPolarHBondContact O-CB 3.47Å; D46-A50 PolarHBondContact O-N 3.41Å; K47-A50 PolarHBondContact O-N 3.46Å; Q48-A50 VanDerWaalsContact C-N 3.33Å; Q48-A50 PolarHBondContact O-N 3.5Å; A50-A54 WeakPolarHBondContact O-CB 3.42Å; A50-A54 PolarHBondContact O-N 3.24Å; A50-A54 VanDerWaalsContact O-N 3.08Å
51A87.7Confident86.9Confident45 Ų4559 Ų5937%0.37233%0.33SS..Hα-helixtrans-66.8-51175.100000111.9K47 Q48 L49 I53 A54 D55K47-A51 PolarHBondContact O-N 3.01Å; Q48-A51 WeakPolarHBondContact O-CB 3.22Å; Q48-A51 PolarHBondContact O-N 2.93Å; Q48-A51 VanDerWaalsContact O-N 3.15Å; L49-A51 VanDerWaalsContact C-N 3.31Å; L49-A51 PolarHBondContact O-N 3.21Å; A51-I53 VanDerWaalsContact C-N 3.32Å; A51-I53 PolarHBondContact O-N 3.01Å; A51-A54 WeakPolarHBondContact O-CB 3.44Å; A51-A54 PolarHBondContact O-N 3.49Å; A51-A54 VanDerWaalsContact O-N 3.09Å; A51-D55 PolarHBondContact O-N 3.28Å
52Y88.2Confident86.4Confident42 Ų4261 Ų6117%0.16534%0.337CS..Hα-helixtrans-59.2-41.1179.1-61.2-36.9000112.7Q48 L49 D55 K56 V57 I69 F117Q48-Y52 HydrophobicContact CB-CE2 4.17Å; Q48-Y52 WeakPolarHBondContact O-CD2 3.44Å; Q48-Y52 PolarHBondContact O-N 2.82Å; L49-Y52 HydrophobicContact CD2-CD2 4.49Å; L49-Y52 PolarHBondContact O-N 3.28Å; Y52-D55 PolarHBondContact O-N 2.93Å; Y52-K56 PolarHBondContact O-N 3.2Å; Y52-K56 VanDerWaalsContact O-N 3.08Å; Y52-V57 PolarHBondContact O-N 3.39Å; Y52-I69 HydrophobicContact CE2-CD1 4.35Å; Y52-F117 HydrophobicContact CD2-CD2 4.24Å; Y52-F117 HydrophobicContact CD2-CE1 4.49Å; Y52-F117 AromaticContact CD2-CE2 3.74Å; Y52-F117 HydrophobicContact CD2-CE2 3.74Å; Y52-F117 AromaticContact CD2-CZ 3.88Å; Y52-F117 HydrophobicContact CD2-CZ 3.88Å; Y52-F117 HydrophobicContact CE2-CZ 4.41Å; Y52-F117 HydrophobicContact CG-CD2 4.35Å; Y52-F117 AromaticContact CG-CE2 3.87Å; Y52-F117 HydrophobicContact CG-CE2 3.87Å; Y52-F117 HydrophobicContact CG-CZ 4.4Å
53I84.2Confident85.8Confident65 Ų6564.6 Ų64.633%0.33336%0.36SS..Hα-helixtrans-65.1-40.3176-67164.3000111.2L49 A51 K56 K113 L116 F117L49-I53 WeakPolarHBondContact O-CB 3.36Å; L49-I53 WeakPolarHBondContact O-CD1 3.38Å; L49-I53 WeakPolarHBondContact O-CG1 3.44Å; L49-I53 PolarHBondContact O-N 3.33Å; A51-I53 VanDerWaalsContact C-N 3.32Å; A51-I53 PolarHBondContact O-N 3.01Å; I53-K56 PolarHBondContact O-N 3.07Å; I53-K113 HydrophobicContact CD1-CB 4.04Å; I53-K113 HydrophobicContact CD1-CG 4.47Å; I53-L116 HydrophobicContact CD1-CB 3.99Å; I53-F117 HydrophobicContact CG1-CB 4.33Å
54A83Confident85.4Confident77 Ų7769.7 Ų69.764%0.63638%0.38SS*.Hα-helixtrans-65.4-41.4176.600000112.3A50 A51 K56A50-A54 WeakPolarHBondContact O-CB 3.42Å; A50-A54 PolarHBondContact O-N 3.24Å; A50-A54 VanDerWaalsContact O-N 3.08Å; A51-A54 WeakPolarHBondContact O-CB 3.44Å; A51-A54 PolarHBondContact O-N 3.49Å; A51-A54 VanDerWaalsContact O-N 3.09Å; A54-K56 PolarHBondContact O-N 3.46Å
55D82.3Confident85Confident121 Ų12166.5 Ų66.565%0.64737%0.366SS*.THydrogen-bonded Turntrans-78.20.2177.8-65.3-23.6000113.2A51 Y52 V57A51-D55 PolarHBondContact O-N 3.28Å; Y52-D55 PolarHBondContact O-N 2.93Å; D55-V57 HydrophobicContact CB-CG2 4Å; D55-V57 PolarHBondContact O-N 3.06Å
56K79.9Confident84.7Confident159 Ų15966.8 Ų66.869%0.69137%0.369SS*.THydrogen-bonded Turntrans55.727.8-174.8-57.7-176179.3-178.10114.2Y52 I53 A54 A121Y52-K56 PolarHBondContact O-N 3.2Å; Y52-K56 VanDerWaalsContact O-N 3.08Å; I53-K56 PolarHBondContact O-N 3.07Å; A54-K56 PolarHBondContact O-N 3.46Å; K56-A121 HydrophobicContact CB-CB 4.3Å; K56-A121 VanDerWaalsContact O-CB 3.3Å; K56-A121 WeakPolarHBondContact O-CB 3.34Å
57V80.5Confident84.3Confident35 Ų3572.7 Ų72.721%0.21240%0.396CS..  trans-82.5128.9172.1179.70000108.3Y52 D55 Q61 M62 F117Y52-V57 PolarHBondContact O-N 3.39Å; D55-V57 HydrophobicContact CB-CG2 4Å; D55-V57 PolarHBondContact O-N 3.06Å; V57-Q61 HydrophobicContact CG1-CB 4.13Å; V57-M62 HydrophobicContact CG1-CB 4.46Å; V57-M62 HydrophobicContact CG1-CG 3.67Å; V57-F117 HydrophobicContact CG1-CE2 4.48Å; V57-F117 WeakPolarHBondContact O-CD2 3.35Å; V57-F117 VanDerWaalsContact O-CE2 3.29Å; V57-F117 WeakPolarHBondContact O-CE2 3.41Å
58D85.3Confident84.2Confident13 Ų1370.1 Ų70.17%0.0739%0.385CS..  trans-109.3168.8179.668.740000113.2A60 Q61 M62 F117 P120 A121D58-A60 PolarHBondContact O-N 2.66Å; D58-A60 VanDerWaalsContact O-N 3.15Å; D58-A60 WeakPolarHBondContact OD1-CA 3.43Å; D58-A60 WeakPolarHBondContact OD1-CB 3.25Å; D58-A60 PolarHBondContact OD1-N 3.19Å; D58-Q61 WeakPolarHBondContact O-CB 3.29Å; D58-Q61 PolarHBondContact O-N 3.32Å; D58-Q61 PolarHBondContact OD1-N 3.15Å; D58-Q61 VanDerWaalsContact OD1-N 3.13Å; D58-M62 PolarHBondContact O-N 3.39Å; D58-F117 VanDerWaalsContact C-CE2 3.43Å; D58-F117 WeakPolarHBondContact CA-O 3.41Å; D58-P120 WeakPolarHBondContact OD2-CA 3.41Å; D58-A121 HydrophobicContact CB-CB 4.41Å; D58-A121 PolarHBondContact OD2-N 3.2Å
59A82.3Confident84.1Confident17 Ų1768.2 Ų68.214%0.1438%0.376CS..THydrogen-bonded Turntrans-63-17.5-178.500000114.2M62 P63 A66 F117 Q118A59-M62 CarbonylContact O-C 3.59Å; A59-P63 WeakPolarHBondContact O-CA 3.38Å; A59-A66 HydrophobicContact CB-CB 3.75Å; A59-F117 HydrophobicContact CB-CD1 4Å; A59-F117 HydrophobicContact CB-CE1 3.84Å; A59-F117 HydrophobicContact CB-CZ 4.27Å; A59-F117 PolarHBondContact N-O 3.5Å; A59-Q118 HydrophobicContact CB-CG 4.08Å
60A79Confident84Confident85 Ų8572.9 Ų72.970%0.70240%0.398SS*.THydrogen-bonded Turntrans-80.5-29.1174.600000111.6D58D58-A60 PolarHBondContact O-N 2.66Å; D58-A60 VanDerWaalsContact O-N 3.15Å; D58-A60 WeakPolarHBondContact OD1-CA 3.43Å; D58-A60 WeakPolarHBondContact OD1-CB 3.25Å; D58-A60 PolarHBondContact OD1-N 3.19Å
61Q81.7Confident83.9Confident116 Ų11674.6 Ų74.654%0.54241%0.407SS..THydrogen-bonded Turntrans-75.1-33.6172.6-62.2174.61300112.2V57 D58 P63V57-Q61 HydrophobicContact CG1-CB 4.13Å; D58-Q61 WeakPolarHBondContact O-CB 3.29Å; D58-Q61 PolarHBondContact O-N 3.32Å; D58-Q61 PolarHBondContact OD1-N 3.15Å; D58-Q61 VanDerWaalsContact OD1-N 3.13Å; Q61-P63 VanDerWaalsContact C-CD 3.44Å; Q61-P63 WeakPolarHBondContact O-CD 3.37Å
62M82.1Confident84Confident75 Ų7575 Ų7537%0.36940%0.403SS..SBendtrans-124.261.7-178.1-68.7-66-72.700113.1V57 D58 A59 Q64 E65 A66 F117V57-M62 HydrophobicContact CG1-CB 4.46Å; V57-M62 HydrophobicContact CG1-CG 3.67Å; D58-M62 PolarHBondContact O-N 3.39Å; A59-M62 CarbonylContact O-C 3.59Å; M62-Q64 PolarHBondContact O-N 3.33Å; M62-E65 HydrophobicContact CE-CG 3.98Å; M62-E65 PolarHBondContact O-N 2.78Å; M62-A66 WeakPolarHBondContact O-CB 3.4Å; M62-A66 PolarHBondContact O-N 3.09Å; M62-F117 HydrophobicContact CB-CZ 4.19Å
63P79.1Confident84.1Confident76 Ų7673.4 Ų73.449%0.49440%0.397SS..Hα-helixtrans-68.5-31.6-169.326.8-35.6000114.5A59 Q61 A66 Q67A59-P63 WeakPolarHBondContact O-CA 3.38Å; Q61-P63 VanDerWaalsContact C-CD 3.44Å; Q61-P63 WeakPolarHBondContact O-CD 3.37Å; P63-A66 PolarHBondContact O-N 3.07Å; P63-Q67 WeakPolarHBondContact O-CB 3.36Å; P63-Q67 PolarHBondContact O-N 3.19Å
64Q82Confident84.2Confident165 Ų16573.4 Ų73.477%0.77140%0.4SS*.Hα-helixtrans-68.7-45.1178.2-68-176.6-4.900111.7M62 Q67 K68M62-Q64 PolarHBondContact O-N 3.33Å; Q64-Q67 PolarHBondContact O-N 2.82Å; Q64-K68 WeakPolarHBondContact O-CB 3.49Å; Q64-K68 PolarHBondContact O-N 3.15Å
65E83.8Confident84.4Confident51 Ų5172.7 Ų72.724%0.23839%0.391CS..Hα-helixtrans-67.3-37.5174.1-71.1-63.1159.800111.1M62 Q67 K68 I69M62-E65 HydrophobicContact CE-CG 3.98Å; M62-E65 PolarHBondContact O-N 2.78Å; E65-Q67 PolarHBondContact O-N 2.83Å; E65-K68 PolarHBondContact O-N 2.93Å; E65-K68 IonicContact OE1-NZ 2.67Å; E65-K68 PolarHBondContact OE1-NZ 2.86Å; E65-K68 IonicContact OE2-NZ 2.74Å; E65-K68 PolarHBondContact OE2-NZ 3.31Å; E65-I69 WeakPolarHBondContact O-CB 3.18Å; E65-I69 VanDerWaalsContact O-CG1 3.27Å; E65-I69 WeakPolarHBondContact O-CG1 3.48Å; E65-I69 PolarHBondContact O-N 3.07Å
66A85.4Confident84.9Confident8 Ų868.1 Ų68.17%0.06637%0.365CS..Hα-helixtrans-59.3-46.2173.900000112.4A59 M62 P63 Q70 F114 F117A59-A66 HydrophobicContact CB-CB 3.75Å; M62-A66 WeakPolarHBondContact O-CB 3.4Å; M62-A66 PolarHBondContact O-N 3.09Å; P63-A66 PolarHBondContact O-N 3.07Å; A66-Q70 WeakPolarHBondContact O-CB 3.49Å; A66-Q70 PolarHBondContact O-N 3.24Å; A66-F114 HydrophobicContact CB-CE2 4.41Å; A66-F114 VanDerWaalsContact O-CZ 3.23Å; A66-F114 WeakPolarHBondContact O-CZ 3.5Å; A66-F117 HydrophobicContact CB-CE1 3.82Å
67Q83.8Confident85.3Confident146 Ų14666 Ų6668%0.68236%0.358SS*.Hα-helixtrans-66.5-38.7178.8-172.51756.600112.3P63 Q64 E65 Q70 S71P63-Q67 WeakPolarHBondContact O-CB 3.36Å; P63-Q67 PolarHBondContact O-N 3.19Å; Q64-Q67 PolarHBondContact O-N 2.82Å; E65-Q67 PolarHBondContact O-N 2.83Å; Q67-Q70 PolarHBondContact O-N 2.98Å; Q67-S71 PolarHBondContact O-N 3.43Å
68K88.6Confident85.5Confident93 Ų9368.8 Ų68.840%0.40437%0.37SS..Hα-helixtrans-64-51.2175175.4179.5151.1-141.20111.7Q64 E65 Q70 S71 D72Q64-K68 WeakPolarHBondContact O-CB 3.49Å; Q64-K68 PolarHBondContact O-N 3.15Å; E65-K68 PolarHBondContact O-N 2.93Å; E65-K68 IonicContact OE1-NZ 2.67Å; E65-K68 PolarHBondContact OE1-NZ 2.86Å; E65-K68 IonicContact OE2-NZ 2.74Å; E65-K68 PolarHBondContact OE2-NZ 3.31Å; K68-Q70 VanDerWaalsContact C-N 3.27Å; K68-Q70 PolarHBondContact O-N 3.32Å; K68-S71 WeakPolarHBondContact O-CB 3.47Å; K68-S71 PolarHBondContact O-N 3.2Å; K68-S71 VanDerWaalsContact O-N 3.08Å; K68-D72 PolarHBondContact O-N 3.47Å
69I88.6Confident85.5Confident1 Ų170.1 Ų70.11%0.00538%0.381CS..Hα-helixtrans-57.3-41.7176.3-70.8169.1000110.8I45 L49 Y52 E65 D72 L73 F114I45-I69 HydrophobicContact CG2-CG1 4.31Å; I45-I69 HydrophobicContact CG2-CG2 3.62Å; L49-I69 HydrophobicContact CD1-CG2 4.3Å; L49-I69 HydrophobicContact CD2-CD1 3.95Å; L49-I69 HydrophobicContact CD2-CG2 4.48Å; L49-I69 HydrophobicContact CG-CD1 4.41Å; Y52-I69 HydrophobicContact CE2-CD1 4.35Å; E65-I69 WeakPolarHBondContact O-CB 3.18Å; E65-I69 VanDerWaalsContact O-CG1 3.27Å; E65-I69 WeakPolarHBondContact O-CG1 3.48Å; E65-I69 PolarHBondContact O-N 3.07Å; I69-D72 PolarHBondContact O-N 3.35Å; I69-L73 HydrophobicContact CG2-CD1 3.73Å; I69-L73 HydrophobicContact CG2-CG 4.25Å; I69-L73 WeakPolarHBondContact O-CB 3.48Å; I69-L73 WeakPolarHBondContact O-CG 3.4Å; I69-L73 PolarHBondContact O-N 3.33Å; I69-F114 HydrophobicContact CB-CD2 4.33Å; I69-F114 HydrophobicContact CB-CE2 4.02Å; I69-F114 HydrophobicContact CG2-CD2 3.51Å; I69-F114 HydrophobicContact CG2-CE2 3.68Å; I69-F114 HydrophobicContact CG2-CG 4.14Å; I69-F114 HydrophobicContact CG2-CZ 4.43Å
70Q88.9Confident85.7Confident99 Ų9969.3 Ų69.346%0.46337%0.374SS..Hα-helixtrans-61.7-45.6175.7-169.4166.51.500112.2A66 Q67 K68 L73 T74 F114A66-Q70 WeakPolarHBondContact O-CB 3.49Å; A66-Q70 PolarHBondContact O-N 3.24Å; Q67-Q70 PolarHBondContact O-N 2.98Å; K68-Q70 VanDerWaalsContact C-N 3.27Å; K68-Q70 PolarHBondContact O-N 3.32Å; Q70-L73 PolarHBondContact O-N 3.16Å; Q70-T74 PolarHBondContact O-N 3.17Å; Q70-T74 PolarHBondContact O-OG1 3.49Å; Q70-F114 HydrophobicContact CB-CE1 3.71Å; Q70-F114 HydrophobicContact CB-CZ 3.72Å; Q70-F114 HydrophobicContact CG-CE1 3.96Å; Q70-F114 HydrophobicContact CG-CZ 4.42Å
71S86.3Confident85.9Confident77 Ų7769.8 Ų69.854%0.53836%0.362SS..Hα-helixtrans-61.1-44.8176.8-173.10000112Q67 K68 S75Q67-S71 PolarHBondContact O-N 3.43Å; K68-S71 WeakPolarHBondContact O-CB 3.47Å; K68-S71 PolarHBondContact O-N 3.2Å; K68-S71 VanDerWaalsContact O-N 3.08Å; S71-S75 WeakPolarHBondContact O-CB 3.4Å; S71-S75 PolarHBondContact O-N 2.89Å
72D89.5Confident85.9Confident55 Ų5570.6 Ų70.629%0.29437%0.366SS..Hα-helixtrans-63.6-47.3179.3-67.8-16.5000110.7I45 K68 I69 T74 S75 H76I45-D72 HydrophobicContact CD1-CB 3.87Å; K68-D72 PolarHBondContact O-N 3.47Å; I69-D72 PolarHBondContact O-N 3.35Å; D72-T74 PolarHBondContact O-N 3.09Å; D72-S75 WeakPolarHBondContact O-CB 3.41Å; D72-S75 PolarHBondContact O-N 2.83Å; D72-H76 WeakPolarHBondContact O-CB 3.31Å; D72-H76 PolarHBondContact O-CD2 3.13Å; D72-H76 PolarHBondContact O-N 3.4Å
73L89.4Confident85.9Confident8 Ų867.9 Ų67.94%0.04235%0.352CS..Hα-helixtrans-60.9-44.8178.4-69.6171.2000112.2L42 I45 I69 Q70 H76 E77 L107 V110 F114L42-L73 HydrophobicContact CD2-CD2 3.71Å; I45-L73 HydrophobicContact CD1-CD2 4.38Å; I45-L73 HydrophobicContact CG2-CD2 4.48Å; I69-L73 HydrophobicContact CG2-CD1 3.73Å; I69-L73 HydrophobicContact CG2-CG 4.25Å; I69-L73 WeakPolarHBondContact O-CB 3.48Å; I69-L73 WeakPolarHBondContact O-CG 3.4Å; I69-L73 PolarHBondContact O-N 3.33Å; Q70-L73 PolarHBondContact O-N 3.16Å; L73-H76 PolarHBondContact O-N 3.04Å; L73-E77 WeakPolarHBondContact O-CB 3.26Å; L73-E77 PolarHBondContact O-N 3.04Å; L73-L107 HydrophobicContact CB-CD1 4.26Å; L73-L107 HydrophobicContact CD2-CD1 3.68Å; L73-V110 HydrophobicContact CD1-CG1 4.47Å; L73-V110 HydrophobicContact CD2-CB 4.25Å; L73-V110 HydrophobicContact CD2-CG1 3.69Å; L73-F114 HydrophobicContact CD1-CB 3.95Å; L73-F114 HydrophobicContact CD1-CD1 4.13Å; L73-F114 HydrophobicContact CD1-CG 4Å
74T86.8Confident86Confident65 Ų6566.6 Ų66.640%0.39934%0.339SS..Hα-helixtrans-65.9-38.5176.2-59.90000112.2Q70 D72 H76 E77 I78Q70-T74 PolarHBondContact O-N 3.17Å; Q70-T74 PolarHBondContact O-OG1 3.49Å; D72-T74 PolarHBondContact O-N 3.09Å; T74-H76 VanDerWaalsContact C-N 3.34Å; T74-H76 PolarHBondContact O-N 3.49Å; T74-E77 PolarHBondContact O-N 3.31Å; T74-I78 HydrophobicContact CG2-CD1 4.07Å; T74-I78 WeakPolarHBondContact O-CG1 3.35Å; T74-I78 PolarHBondContact O-N 3.46Å; T74-I78 VanDerWaalsContact O-N 3.13Å
75S88.2Confident85.8Confident62 Ų6266.2 Ų66.243%0.43434%0.335SS..Hα-helixtrans-61.7-42174.3-176.10000111.8S71 D72 S79S71-S75 WeakPolarHBondContact O-CB 3.4Å; S71-S75 PolarHBondContact O-N 2.89Å; D72-S75 WeakPolarHBondContact O-CB 3.41Å; D72-S75 PolarHBondContact O-N 2.83Å; S75-S79 WeakPolarHBondContact O-CB 3.3Å; S75-S79 PolarHBondContact O-N 3.21Å; S75-S79 PolarHBondContact O-OG 3.43Å
76H91.1Very high85.3Confident25 Ų2568.4 Ų68.412%0.11635%0.345CS..Hα-helixtrans-68.7-38.1177.5-66.6-33.8000112.5I38 S41 D72 L73 T74 S79 L80 L107I38-H76 HydrophobicContact CG2-CB 3.9Å; S41-H76 WeakPolarHBondContact CB-NE2 3.45Å; S41-H76 PolarHBondContact OG-NE2 3.49Å; D72-H76 WeakPolarHBondContact O-CB 3.31Å; D72-H76 PolarHBondContact O-CD2 3.13Å; D72-H76 PolarHBondContact O-N 3.4Å; L73-H76 PolarHBondContact O-N 3.04Å; T74-H76 VanDerWaalsContact C-N 3.34Å; T74-H76 PolarHBondContact O-N 3.49Å; H76-S79 PolarHBondContact O-N 3.25Å; H76-L80 WeakPolarHBondContact O-CB 3.31Å; H76-L80 VanDerWaalsContact O-CG 3.27Å; H76-L80 WeakPolarHBondContact O-CG 3.36Å; H76-L80 PolarHBondContact O-N 2.99Å; H76-L107 HydrophobicContact CB-CD1 4.33Å
77E89.1Confident84.7Confident115 Ų11568.3 Ų68.354%0.53734%0.343SS..Hα-helixtrans-58.8-51.8175.4-167.9167.9-151.800111.7L73 T74 S79 L80 E81 L107L73-E77 WeakPolarHBondContact O-CB 3.26Å; L73-E77 PolarHBondContact O-N 3.04Å; T74-E77 PolarHBondContact O-N 3.31Å; E77-S79 PolarHBondContact O-N 3.1Å; E77-L80 PolarHBondContact O-N 2.92Å; E77-E81 PolarHBondContact O-N 3.43Å; E77-E81 VanDerWaalsContact O-N 3.11Å; E77-L107 VanDerWaalsContact CA-CD2 3.47Å; E77-L107 HydrophobicContact CB-CD2 3.65Å; E77-L107 HydrophobicContact CG-CD2 3.91Å
78I84.7Confident83.9Confident92 Ų9267 Ų6747%0.47234%0.337SS..Hα-helixtrans-60.5-48.2177.6-64.8165.6000110.3T74 L80 E81 E82T74-I78 HydrophobicContact CG2-CD1 4.07Å; T74-I78 WeakPolarHBondContact O-CG1 3.35Å; T74-I78 PolarHBondContact O-N 3.46Å; T74-I78 VanDerWaalsContact O-N 3.13Å; I78-L80 VanDerWaalsContact C-N 3.35Å; I78-L80 PolarHBondContact O-N 3.46Å; I78-E81 PolarHBondContact O-N 3.04Å; I78-E82 HydrophobicContact CG2-CG 4.49Å; I78-E82 WeakPolarHBondContact O-CG 3.28Å; I78-E82 PolarHBondContact O-N 3.3Å
79S85.3Confident82.8Confident41 Ų4166.7 Ų66.729%0.28736%0.36SS..Hα-helixtrans-62.2-39.3-178.2-59.40000112.7S75 H76 E77 M83S75-S79 WeakPolarHBondContact O-CB 3.3Å; S75-S79 PolarHBondContact O-N 3.21Å; S75-S79 PolarHBondContact O-OG 3.43Å; H76-S79 PolarHBondContact O-N 3.25Å; E77-S79 PolarHBondContact O-N 3.1Å; S79-M83 WeakPolarHBondContact O-CB 3.35Å; S79-M83 WeakPolarHBondContact O-CE 3.34Å; S79-M83 WeakPolarHBondContact O-CG 3.5Å; S79-M83 PolarHBondContact O-N 3.28Å
80L86.7Confident81.5Confident0 Ų070.7 Ų70.70%038%0.377CS..Hα-helixtrans-67.5-40.4176.7-76.4170.5000112.1L35 I38 H76 E77 I78 M83 K84 I100 A103 Q104 L107L35-L80 HydrophobicContact CD1-CD2 3.38Å; I38-L80 HydrophobicContact CD1-CD2 4.2Å; I38-L80 HydrophobicContact CD1-CG 3.99Å; I38-L80 HydrophobicContact CG2-CD1 4.02Å; I38-L80 HydrophobicContact CG2-CD2 4.35Å; I38-L80 HydrophobicContact CG2-CG 4.17Å; H76-L80 WeakPolarHBondContact O-CB 3.31Å; H76-L80 VanDerWaalsContact O-CG 3.27Å; H76-L80 WeakPolarHBondContact O-CG 3.36Å; H76-L80 PolarHBondContact O-N 2.99Å; E77-L80 PolarHBondContact O-N 2.92Å; I78-L80 VanDerWaalsContact C-N 3.35Å; I78-L80 PolarHBondContact O-N 3.46Å; L80-M83 HydrophobicContact CD2-CE 4.18Å; L80-M83 PolarHBondContact O-N 3.29Å; L80-K84 WeakPolarHBondContact O-CB 3.48Å; L80-K84 PolarHBondContact O-N 2.86Å; L80-I100 HydrophobicContact CD2-CG2 4.36Å; L80-A103 HydrophobicContact CD1-CB 4.01Å; L80-A103 HydrophobicContact CD2-CB 3.53Å; L80-A103 HydrophobicContact CG-CB 4.46Å; L80-Q104 HydrophobicContact CB-CG 3.92Å; L80-Q104 HydrophobicContact CD1-CG 4.02Å; L80-Q104 HydrophobicContact CG-CG 4.45Å; L80-L107 HydrophobicContact CD1-CB 4.36Å; L80-L107 HydrophobicContact CD1-CD2 4.07Å
81E83.6Confident80Confident96 Ų9675 Ų7545%0.44940%0.397SS..Hα-helixtrans-70.5-38.6179.7-167.955.9-152.700112.1E77 I78 K84 K85 Q104E77-E81 PolarHBondContact O-N 3.43Å; E77-E81 VanDerWaalsContact O-N 3.11Å; I78-E81 PolarHBondContact O-N 3.04Å; E81-K84 WeakPolarHBondContact O-CB 3.35Å; E81-K84 PolarHBondContact O-N 2.89Å; E81-K85 WeakPolarHBondContact O-CB 3.44Å; E81-K85 PolarHBondContact O-N 2.94Å; E81-Q104 PolarHBondContact OE2-NE2 3.45Å
82E81.4Confident78.5Confident132 Ų13276.3 Ų76.362%0.61741%0.413SS*.Hα-helixtrans-62.1-45.1171.2-71.8-172.7164.100112.1I78 K84 K85 H86I78-E82 HydrophobicContact CG2-CG 4.49Å; I78-E82 WeakPolarHBondContact O-CG 3.28Å; I78-E82 PolarHBondContact O-N 3.3Å; E82-K84 VanDerWaalsContact C-N 3.32Å; E82-K84 PolarHBondContact O-N 3.17Å; E82-K85 PolarHBondContact O-N 3.19Å; E82-H86 PolarHBondContact O-N 2.7Å
83M82.3Confident77.2Confident19 Ų1974 Ų749%0.09440%0.402CS..Hα-helixtrans-62.1-38174.8-78.5-169.6-80.700112.4T31 L35 I38 S79 L80 N87 I100T31-M83 HydrophobicContact CG2-CB 4.33Å; T31-M83 HydrophobicContact CG2-CG 4.08Å; T31-M83 HydrophobicContact CG2-SD 3.86Å; L35-M83 HydrophobicContact CB-SD 4.46Å; L35-M83 HydrophobicContact CD1-CE 4.12Å; L35-M83 HydrophobicContact CD1-SD 4.47Å; I38-M83 HydrophobicContact CD1-CE 3.45Å; I38-M83 VanDerWaalsContact CD1-CE 3.45Å; S79-M83 WeakPolarHBondContact O-CB 3.35Å; S79-M83 WeakPolarHBondContact O-CE 3.34Å; S79-M83 WeakPolarHBondContact O-CG 3.5Å; S79-M83 PolarHBondContact O-N 3.28Å; L80-M83 HydrophobicContact CD2-CE 4.18Å; L80-M83 PolarHBondContact O-N 3.29Å; M83-N87 PolarHBondContact O-N 3.49Å; M83-N87 PolarHBondContact O-ND2 2.85Å; M83-I100 HydrophobicContact CB-CD1 4Å; M83-I100 HydrophobicContact CB-CG1 4.45Å
84K80.5Confident76.3Confident48 Ų4881 Ų8121%0.20943%0.434CS..Hα-helixtrans-62.2-49.9175.4-164.9159.7178.3153.10110.8L80 E81 E82 H86 N87 Q88 L97 I100 D101L80-K84 WeakPolarHBondContact O-CB 3.48Å; L80-K84 PolarHBondContact O-N 2.86Å; E81-K84 WeakPolarHBondContact O-CB 3.35Å; E81-K84 PolarHBondContact O-N 2.89Å; E82-K84 VanDerWaalsContact C-N 3.32Å; E82-K84 PolarHBondContact O-N 3.17Å; K84-H86 PolarHBondContact O-N 3.43Å; K84-N87 PolarHBondContact O-N 3.14Å; K84-Q88 WeakPolarHBondContact O-CG 3.44Å; K84-Q88 PolarHBondContact O-N 3.36Å; K84-L97 HydrophobicContact CG-CD2 4.44Å; K84-I100 HydrophobicContact CB-CG2 3.99Å; K84-I100 HydrophobicContact CD-CG2 4.2Å; K84-I100 HydrophobicContact CG-CG2 4.3Å; K84-D101 IonicContact NZ-OD1 3.32Å; K84-D101 PolarHBondContact NZ-OD1 3.4Å
85K78Confident75.8Confident157 Ų15786.8 Ų86.868%0.68345%0.449SS*.Hα-helixtrans-61.4-40.5179.6-168.6176.5-176.9178.10113E81 E82 N87E81-K85 WeakPolarHBondContact O-CB 3.44Å; E81-K85 PolarHBondContact O-N 2.94Å; E82-K85 PolarHBondContact O-N 3.19Å; K85-N87 VanDerWaalsContact C-N 3.25Å; K85-N87 PolarHBondContact O-N 3.2Å
86H72.7Confident75.2Confident97 Ų9784.7 Ų84.745%0.44943%0.434SS..Hα-helixtrans-68.5-20.1179.2-173.461.9000114.2S27 E82 K84 K90S27-H86 PolarHBondContact OG-NE2 3.32Å; E82-H86 PolarHBondContact O-N 2.7Å; K84-H86 PolarHBondContact O-N 3.43Å; H86-K90 PolarHBondContact O-NZ 3.32Å
87N72.6Confident74.6Confident6 Ų685.4 Ų85.43%0.03244%0.438CS..Hα-helixtrans-104.1-5.6-177.2-72.2-70.3000114.6M83 K84 K85 G89 A93 L97M83-N87 PolarHBondContact O-N 3.49Å; M83-N87 PolarHBondContact O-ND2 2.85Å; K84-N87 PolarHBondContact O-N 3.14Å; K85-N87 VanDerWaalsContact C-N 3.25Å; K85-N87 PolarHBondContact O-N 3.2Å; N87-G89 PolarHBondContact O-N 3.31Å; N87-A93 HydrophobicContact CB-CB 4.32Å; N87-L97 HydrophobicContact CB-CD2 3.84Å; N87-L97 HydrophobicContact CB-CG 4.15Å
88Q68.1Low74.2Confident119 Ų11983.1 Ų83.156%0.55644%0.435SS*.THydrogen-bonded Turntrans-63133.3172.6-75168.29.100111.5K84K84-Q88 WeakPolarHBondContact O-CG 3.44Å; K84-Q88 PolarHBondContact O-N 3.36Å
89G65.4Low74.2Confident86 Ų8681.1 Ų81.189%0.88742%0.423SS*.THydrogen-bonded Turntrans86.80.8174.900000116.9N87N87-G89 PolarHBondContact O-N 3.31Å
90K61.6Low74.1Confident85 Ų8579.2 Ų79.237%0.3741%0.41SS..  trans-100.3106.6173.6-65.6166-174.6157.10109.5H86 A92 A93H86-K90 PolarHBondContact O-NZ 3.32Å; K90-A92 PolarHBondContact O-N 3.47Å; K90-A92 VanDerWaalsContact O-N 3.14Å; K90-A93 HydrophobicContact CB-CB 3.82Å; K90-A93 VanDerWaalsContact O-CB 3.31Å; K90-A93 WeakPolarHBondContact O-CB 3.49Å; K90-A93 PolarHBondContact O-N 3.21Å
91E56.5Low74Confident189 Ų18982.8 Ų82.888%0.88343%0.429SS*.G310 helixtrans-55.3-34.5-179.4-71.8-178140.100113.1A93E91-A93 PolarHBondContact O-N 2.84Å; E91-A93 VanDerWaalsContact O-N 3.17Å
92A55.9Low74.2Confident106 Ų10682.7 Ų82.788%0.87644%0.435SS*.G310 helixtrans-71.3-0.417600000115K90K90-A92 PolarHBondContact O-N 3.47Å; K90-A92 VanDerWaalsContact O-N 3.14Å
93A62.1Low74.4Confident7 Ų776.4 Ų76.46%0.05841%0.406CS..G310 helixtrans-106.72.5-173.800000115.2N87 K90 E91 R95 V96 L97N87-A93 HydrophobicContact CB-CB 4.32Å; K90-A93 HydrophobicContact CB-CB 3.82Å; K90-A93 VanDerWaalsContact O-CB 3.31Å; K90-A93 WeakPolarHBondContact O-CB 3.49Å; K90-A93 PolarHBondContact O-N 3.21Å; E91-A93 PolarHBondContact O-N 2.84Å; E91-A93 VanDerWaalsContact O-N 3.17Å; A93-R95 PolarHBondContact O-N 3.4Å; A93-R95 VanDerWaalsContact O-N 3.13Å; A93-V96 PolarHBondContact O-N 3.19Å; A93-L97 PolarHBondContact O-N 3.12Å; A93-L97 VanDerWaalsContact O-N 3.16Å
94Q70.2Confident74.7Confident153 Ų15377.2 Ų77.272%0.71541%0.409SS*.Hα-helixtrans-53-37.3-177.6-80.9-174.5-20.100114.2V96 L97 S98Q94-V96 VanDerWaalsContact C-N 3.32Å; Q94-V96 PolarHBondContact O-N 2.8Å; Q94-L97 PolarHBondContact O-N 2.99Å; Q94-S98 PolarHBondContact O-N 2.99Å; Q94-S98 VanDerWaalsContact O-N 3.13Å
95R75.5Confident75.1Confident188 Ų18881.5 Ų81.571%0.70943%0.428SS*.Hα-helixtrans-65.3-31.9177.7-178.6175.5174.6142.6-0.4113.4A93 S98 Q99A93-R95 PolarHBondContact O-N 3.4Å; A93-R95 VanDerWaalsContact O-N 3.13Å; R95-S98 PolarHBondContact O-OG 2.8Å; R95-Q99 WeakPolarHBondContact O-CG 3.17Å
96V76.3Confident75.6Confident18 Ų1876.6 Ų76.611%0.10941%0.406CS..Hα-helixtrans-77.8-40.9178.6-179.30000109.8T31 A93 Q94 S98 Q99 I100T31-V96 HydrophobicContact CG2-CG1 3.62Å; A93-V96 PolarHBondContact O-N 3.19Å; Q94-V96 VanDerWaalsContact C-N 3.32Å; Q94-V96 PolarHBondContact O-N 2.8Å; V96-S98 PolarHBondContact O-N 2.99Å; V96-Q99 PolarHBondContact O-N 3.05Å; V96-I100 HydrophobicContact CG1-CD1 4.02Å; V96-I100 WeakPolarHBondContact O-CG1 3.37Å; V96-I100 PolarHBondContact O-N 3.49Å
97L78.9Confident76.5Confident40 Ų4072.3 Ų72.321%0.20939%0.387CS..Hα-helixtrans-59.1-43.7175.6-72169.7000112.4K84 N87 A93 Q94 Q99 I100 D101K84-L97 HydrophobicContact CG-CD2 4.44Å; N87-L97 HydrophobicContact CB-CD2 3.84Å; N87-L97 HydrophobicContact CB-CG 4.15Å; A93-L97 PolarHBondContact O-N 3.12Å; A93-L97 VanDerWaalsContact O-N 3.16Å; Q94-L97 PolarHBondContact O-N 2.99Å; L97-Q99 VanDerWaalsContact C-N 3.34Å; L97-Q99 PolarHBondContact O-N 3.28Å; L97-I100 HydrophobicContact CD2-CD1 4.47Å; L97-I100 WeakPolarHBondContact O-CB 3.36Å; L97-I100 PolarHBondContact O-N 3.14Å; L97-I100 VanDerWaalsContact O-N 3.14Å; L97-D101 PolarHBondContact O-N 2.99Å
98S81.2Confident77.2Confident67 Ų6778.4 Ų78.447%0.46942%0.415SS..Hα-helixtrans-66.3-33.5178.867.70000113.4Q94 R95 V96 D101 V102Q94-S98 PolarHBondContact O-N 2.99Å; Q94-S98 VanDerWaalsContact O-N 3.13Å; R95-S98 PolarHBondContact O-OG 2.8Å; V96-S98 PolarHBondContact O-N 2.99Å; S98-D101 PolarHBondContact O-N 3.35Å; S98-V102 WeakPolarHBondContact O-CG2 3.47Å; S98-V102 PolarHBondContact O-N 2.91Å; S98-V102 VanDerWaalsContact O-N 3.15Å
99Q82.7Confident78.1Confident50 Ų5076.2 Ų76.223%0.23441%0.407CS..Hα-helixtrans-70.1-35.4172.9-64.8175.5-1200111.6L35 Q39 R95 V96 L97 V102 A103L35-Q99 HydrophobicContact CD2-CB 3.25Å; L35-Q99 HydrophobicContact CD2-CG 4.42Å; Q39-Q99 PolarHBondContact NE2-O 3.09Å; R95-Q99 WeakPolarHBondContact O-CG 3.17Å; V96-Q99 PolarHBondContact O-N 3.05Å; L97-Q99 VanDerWaalsContact C-N 3.34Å; L97-Q99 PolarHBondContact O-N 3.28Å; Q99-V102 PolarHBondContact O-N 2.86Å; Q99-A103 PolarHBondContact O-N 2.87Å
100I84.3Confident79.4Confident0 Ų072.1 Ų72.10%037%0.365CS..Hα-helixtrans-60.9-44.6173-69.1160.6000110.4L35 L80 M83 K84 V96 L97 V102 A103 Q104L35-I100 HydrophobicContact CD1-CB 4.37Å; L35-I100 HydrophobicContact CD1-CG1 3.7Å; L35-I100 HydrophobicContact CD2-CG1 4.23Å; L80-I100 HydrophobicContact CD2-CG2 4.36Å; M83-I100 HydrophobicContact CB-CD1 4Å; M83-I100 HydrophobicContact CB-CG1 4.45Å; K84-I100 HydrophobicContact CB-CG2 3.99Å; K84-I100 HydrophobicContact CD-CG2 4.2Å; K84-I100 HydrophobicContact CG-CG2 4.3Å; V96-I100 HydrophobicContact CG1-CD1 4.02Å; V96-I100 WeakPolarHBondContact O-CG1 3.37Å; V96-I100 PolarHBondContact O-N 3.49Å; L97-I100 HydrophobicContact CD2-CD1 4.47Å; L97-I100 WeakPolarHBondContact O-CB 3.36Å; L97-I100 PolarHBondContact O-N 3.14Å; L97-I100 VanDerWaalsContact O-N 3.14Å; I100-V102 VanDerWaalsContact C-N 3.34Å; I100-V102 PolarHBondContact O-N 3.33Å; I100-A103 PolarHBondContact O-N 2.77Å; I100-A103 VanDerWaalsContact O-N 3.16Å; I100-Q104 HydrophobicContact CG2-CG 4.41Å; I100-Q104 PolarHBondContact O-N 2.96Å
101D84.6Confident80.6Confident76 Ų7669.9 Ų69.941%0.40636%0.36SS..Hα-helixtrans-62.9-38.5177.5-67.5-32.5000112.3K84 L97 S98 Q104 K105K84-D101 IonicContact NZ-OD1 3.32Å; K84-D101 PolarHBondContact NZ-OD1 3.4Å; L97-D101 PolarHBondContact O-N 2.99Å; S98-D101 PolarHBondContact O-N 3.35Å; D101-Q104 PolarHBondContact O-N 3.04Å; D101-K105 WeakPolarHBondContact O-CB 3.34Å; D101-K105 PolarHBondContact O-N 3Å
102V86.9Confident81.9Confident94 Ų9464.8 Ų64.857%0.5734%0.337SS*.Hα-helixtrans-62.8-41.6172.9170.60000111.5S98 Q99 I100 K105 K106S98-V102 WeakPolarHBondContact O-CG2 3.47Å; S98-V102 PolarHBondContact O-N 2.91Å; S98-V102 VanDerWaalsContact O-N 3.15Å; Q99-V102 PolarHBondContact O-N 2.86Å; I100-V102 VanDerWaalsContact C-N 3.34Å; I100-V102 PolarHBondContact O-N 3.33Å; V102-K105 PolarHBondContact O-N 3.34Å; V102-K106 PolarHBondContact O-N 2.96Å
103A87Confident83.3Confident0 Ų062.8 Ų62.80%031%0.309CS..Hα-helixtrans-68.9-41176.800000112.5L35 Q39 L80 Q99 I100 K105 K106 L107L35-A103 HydrophobicContact CD1-CB 4Å; Q39-A103 HydrophobicContact CG-CB 3.79Å; L80-A103 HydrophobicContact CD1-CB 4.01Å; L80-A103 HydrophobicContact CD2-CB 3.53Å; L80-A103 HydrophobicContact CG-CB 4.46Å; Q99-A103 PolarHBondContact O-N 2.87Å; I100-A103 PolarHBondContact O-N 2.77Å; I100-A103 VanDerWaalsContact O-N 3.16Å; A103-K105 VanDerWaalsContact C-N 3.35Å; A103-K105 PolarHBondContact O-N 3.49Å; A103-K106 PolarHBondContact O-N 3Å; A103-L107 WeakPolarHBondContact O-CB 3.33Å; A103-L107 PolarHBondContact O-N 2.95Å
104Q88Confident84.6Confident35 Ų3563.1 Ų63.116%0.16431%0.309CS..Hα-helixtrans-62-41.3174.1-78.5-169.6-35.600111.4L80 E81 I100 D101 L107 Q108L80-Q104 HydrophobicContact CB-CG 3.92Å; L80-Q104 HydrophobicContact CD1-CG 4.02Å; L80-Q104 HydrophobicContact CG-CG 4.45Å; E81-Q104 PolarHBondContact OE2-NE2 3.45Å; I100-Q104 HydrophobicContact CG2-CG 4.41Å; I100-Q104 PolarHBondContact O-N 2.96Å; D101-Q104 PolarHBondContact O-N 3.04Å; Q104-L107 WeakPolarHBondContact O-CB 3.42Å; Q104-L107 PolarHBondContact O-N 3.32Å; Q104-Q108 WeakPolarHBondContact O-CG 3.46Å; Q104-Q108 PolarHBondContact O-N 3.35Å; Q104-Q108 VanDerWaalsContact O-N 3.07Å
105K88Confident85.3Confident138 Ų13860.3 Ų60.360%0.629%0.291SS*.Hα-helixtrans-62-45.5173.5-172.7174.2-178.5177.70111.6D101 V102 A103 L107 Q108 D109D101-K105 WeakPolarHBondContact O-CB 3.34Å; D101-K105 PolarHBondContact O-N 3Å; V102-K105 PolarHBondContact O-N 3.34Å; A103-K105 VanDerWaalsContact C-N 3.35Å; A103-K105 PolarHBondContact O-N 3.49Å; K105-L107 VanDerWaalsContact C-N 3.31Å; K105-L107 PolarHBondContact O-N 2.91Å; K105-Q108 WeakPolarHBondContact O-CB 3.35Å; K105-Q108 PolarHBondContact O-N 3.32Å; K105-Q108 VanDerWaalsContact O-N 3.14Å; K105-D109 PolarHBondContact O-N 2.8Å
106K89.8Confident85.6Confident55 Ų5555.3 Ų55.324%0.23928%0.279CS..Hα-helixtrans-62.8-37.9177.9-171.161.1-179.1172.80112.3L42 D46 V102 A103 Q108 D109 V110L42-K106 HydrophobicContact CB-CG 4.1Å; L42-K106 HydrophobicContact CD1-CB 4.39Å; L42-K106 HydrophobicContact CD1-CG 4.5Å; D46-K106 VanDerWaalsContact CG-NZ 3.32Å; D46-K106 IonicContact OD1-NZ 3.17Å; D46-K106 IonicContact OD2-NZ 3.4Å; D46-K106 PolarHBondContact OD2-NZ 2.97Å; V102-K106 PolarHBondContact O-N 2.96Å; A103-K106 PolarHBondContact O-N 3Å; K106-Q108 VanDerWaalsContact C-N 3.33Å; K106-Q108 PolarHBondContact O-N 2.84Å; K106-D109 PolarHBondContact O-N 3.05Å; K106-V110 VanDerWaalsContact O-CG2 3.26Å; K106-V110 WeakPolarHBondContact O-CG2 3.31Å; K106-V110 PolarHBondContact O-N 3.4Å
107L91.4Very high85.9Confident7 Ų754.6 Ų54.64%0.03727%0.274CS..Hα-helixtrans-61-41.1174171.969.7000111.8L42 L73 H76 E77 L80 A103 Q104 K105 V110 S111L42-L107 HydrophobicContact CD1-CB 3.86Å; L42-L107 HydrophobicContact CD2-CB 4.2Å; L42-L107 HydrophobicContact CD2-CD1 3.7Å; L73-L107 HydrophobicContact CB-CD1 4.26Å; L73-L107 HydrophobicContact CD2-CD1 3.68Å; H76-L107 HydrophobicContact CB-CD1 4.33Å; E77-L107 VanDerWaalsContact CA-CD2 3.47Å; E77-L107 HydrophobicContact CB-CD2 3.65Å; E77-L107 HydrophobicContact CG-CD2 3.91Å; L80-L107 HydrophobicContact CD1-CB 4.36Å; L80-L107 HydrophobicContact CD1-CD2 4.07Å; A103-L107 WeakPolarHBondContact O-CB 3.33Å; A103-L107 PolarHBondContact O-N 2.95Å; Q104-L107 WeakPolarHBondContact O-CB 3.42Å; Q104-L107 PolarHBondContact O-N 3.32Å; K105-L107 VanDerWaalsContact C-N 3.31Å; K105-L107 PolarHBondContact O-N 2.91Å; L107-V110 PolarHBondContact O-N 3.3Å; L107-S111 VanDerWaalsContact O-CB 3.24Å; L107-S111 WeakPolarHBondContact O-CB 3.39Å; L107-S111 PolarHBondContact O-N 3.36Å; L107-S111 PolarHBondContact O-OG 2.91Å
108Q87.4Confident86.2Confident134 Ų13454.6 Ų54.663%0.62627%0.273SS*.Hα-helixtrans-64.1-46.4176.2-71.1173.4-5.600111.6Q104 K105 K106 V110 S111 M112Q104-Q108 WeakPolarHBondContact O-CG 3.46Å; Q104-Q108 PolarHBondContact O-N 3.35Å; Q104-Q108 VanDerWaalsContact O-N 3.07Å; K105-Q108 WeakPolarHBondContact O-CB 3.35Å; K105-Q108 PolarHBondContact O-N 3.32Å; K105-Q108 VanDerWaalsContact O-N 3.14Å; K106-Q108 VanDerWaalsContact C-N 3.33Å; K106-Q108 PolarHBondContact O-N 2.84Å; Q108-V110 VanDerWaalsContact C-N 3.32Å; Q108-V110 PolarHBondContact O-N 2.68Å; Q108-S111 PolarHBondContact O-N 3.21Å; Q108-M112 PolarHBondContact O-N 3.32Å
109D87.2Confident86.2Confident73 Ų7353.9 Ų53.939%0.3926%0.261SS..Hα-helixtrans-57.1-45.3176.7-62.1-24.8000111.5K105 K106 M112 K113K105-D109 PolarHBondContact O-N 2.8Å; K106-D109 PolarHBondContact O-N 3.05Å; D109-M112 WeakPolarHBondContact O-CB 3.27Å; D109-M112 PolarHBondContact O-N 2.98Å; D109-K113 PolarHBondContact O-N 3.23Å
110V91.7Very high86.1Confident0 Ų053.2 Ų53.20%026%0.261CS..Hα-helixtrans-70.4-38.3-179.9178.90000111.5I45 D46 L49 L73 K106 L107 Q108 M112 K113 F114I45-V110 HydrophobicContact CB-CG1 4.05Å; I45-V110 HydrophobicContact CG2-CG1 3.47Å; I45-V110 VanDerWaalsContact CG2-CG1 3.47Å; D46-V110 HydrophobicContact CB-CG2 3.64Å; L49-V110 HydrophobicContact CD1-CG1 3.88Å; L73-V110 HydrophobicContact CD1-CG1 4.47Å; L73-V110 HydrophobicContact CD2-CB 4.25Å; L73-V110 HydrophobicContact CD2-CG1 3.69Å; K106-V110 VanDerWaalsContact O-CG2 3.26Å; K106-V110 WeakPolarHBondContact O-CG2 3.31Å; K106-V110 PolarHBondContact O-N 3.4Å; L107-V110 PolarHBondContact O-N 3.3Å; Q108-V110 VanDerWaalsContact C-N 3.32Å; Q108-V110 PolarHBondContact O-N 2.68Å; V110-M112 PolarHBondContact O-N 3.18Å; V110-K113 PolarHBondContact O-N 3.33Å; V110-F114 PolarHBondContact O-N 3.4Å
111S86.6Confident85.9Confident37 Ų3755.6 Ų55.626%0.25928%0.281SS..Hα-helixtrans-66.3-24.6174.3-59.70000113.3L107 Q108 R115L107-S111 VanDerWaalsContact O-CB 3.24Å; L107-S111 WeakPolarHBondContact O-CB 3.39Å; L107-S111 PolarHBondContact O-N 3.36Å; L107-S111 PolarHBondContact O-OG 2.91Å; Q108-S111 PolarHBondContact O-N 3.21Å; S111-R115 PolarHBondContact O-N 2.93Å; S111-R115 PolarHBondContact O-NE 2.81Å
112M84.9Confident85.8Confident82 Ų8255.9 Ų55.940%0.40428%0.282SS..Hα-helixtrans-72.4-48.3171.3-165.1165.7-179.400110.8Q108 D109 V110 F114 R115 L116 E192Q108-M112 PolarHBondContact O-N 3.32Å; D109-M112 WeakPolarHBondContact O-CB 3.27Å; D109-M112 PolarHBondContact O-N 2.98Å; V110-M112 PolarHBondContact O-N 3.18Å; M112-F114 VanDerWaalsContact C-N 3.27Å; M112-F114 PolarHBondContact O-N 3.44Å; M112-R115 PolarHBondContact O-N 3.39Å; M112-R115 VanDerWaalsContact O-N 3.14Å; M112-L116 PolarHBondContact O-N 2.86Å; M112-E192 HydrophobicContact CE-CG 4.4Å; M112-E192 WeakPolarHBondContact CE-OE1 3.4Å; M112-E192 VanDerWaalsContact CE-OE2 3.27Å; M112-E192 WeakPolarHBondContact CE-OE2 3.15Å
113K85.5Confident85.9Confident65 Ų6551.6 Ų51.628%0.28326%0.256SS..Hα-helixtrans-59.6-36.3172.4-68-178.3-177.4176.90112.7D46 L49 I53 D109 V110 R115 L116 F117D46-K113 VanDerWaalsContact OD1-CD 3.31Å; D46-K113 WeakPolarHBondContact OD1-CD 3.45Å; D46-K113 WeakPolarHBondContact OD1-CE 3.22Å; D46-K113 IonicContact OD1-NZ 3.91Å; D46-K113 PolarHBondContact OD1-NZ 3.06Å; D46-K113 IonicContact OD2-NZ 2.76Å; L49-K113 HydrophobicContact CB-CB 4.13Å; L49-K113 HydrophobicContact CD1-CB 4.23Å; I53-K113 HydrophobicContact CD1-CB 4.04Å; I53-K113 HydrophobicContact CD1-CG 4.47Å; D109-K113 PolarHBondContact O-N 3.23Å; V110-K113 PolarHBondContact O-N 3.33Å; K113-R115 VanDerWaalsContact C-N 3.31Å; K113-R115 PolarHBondContact O-N 2.87Å; K113-L116 WeakPolarHBondContact O-CB 3.42Å; K113-L116 PolarHBondContact O-N 3.44Å; K113-L116 VanDerWaalsContact O-N 3.16Å; K113-F117 PolarHBondContact O-N 2.94Å
114F88.8Confident85.9Confident13 Ų1354.8 Ų54.86%0.05727%0.271CS..Hα-helixtrans-63.3-37.2177.3-173.7-120.6000112.3L49 A66 I69 Q70 L73 V110 M112 F117 Q118L49-F114 HydrophobicContact CD1-CB 3.84Å; L49-F114 HydrophobicContact CD1-CD2 4.31Å; L49-F114 HydrophobicContact CD2-CD2 3.9Å; A66-F114 HydrophobicContact CB-CE2 4.41Å; A66-F114 VanDerWaalsContact O-CZ 3.23Å; A66-F114 WeakPolarHBondContact O-CZ 3.5Å; I69-F114 HydrophobicContact CB-CD2 4.33Å; I69-F114 HydrophobicContact CB-CE2 4.02Å; I69-F114 HydrophobicContact CG2-CD2 3.51Å; I69-F114 HydrophobicContact CG2-CE2 3.68Å; I69-F114 HydrophobicContact CG2-CG 4.14Å; I69-F114 HydrophobicContact CG2-CZ 4.43Å; Q70-F114 HydrophobicContact CB-CE1 3.71Å; Q70-F114 HydrophobicContact CB-CZ 3.72Å; Q70-F114 HydrophobicContact CG-CE1 3.96Å; Q70-F114 HydrophobicContact CG-CZ 4.42Å; L73-F114 HydrophobicContact CD1-CB 3.95Å; L73-F114 HydrophobicContact CD1-CD1 4.13Å; L73-F114 HydrophobicContact CD1-CG 4Å; V110-F114 PolarHBondContact O-N 3.4Å; M112-F114 VanDerWaalsContact C-N 3.27Å; M112-F114 PolarHBondContact O-N 3.44Å; F114-F117 AromaticContact CD2-CD1 4Å; F114-F117 HydrophobicContact CD2-CD1 4Å; F114-F117 AromaticContact CE2-CD1 3.95Å; F114-F117 HydrophobicContact CE2-CD1 3.95Å; F114-F117 HydrophobicContact CE2-CE1 4.36Å; F114-F117 PolarHBondContact O-N 3.16Å; F114-Q118 HydrophobicContact CE1-CG 4.29Å; F114-Q118 HydrophobicContact CE2-CG 4.46Å; F114-Q118 HydrophobicContact CZ-CG 4.19Å; F114-Q118 WeakPolarHBondContact O-CG 3.29Å; F114-Q118 PolarHBondContact O-N 3.11Å
115R84.4Confident85.8Confident94 Ų9458.6 Ų58.636%0.35529%0.289SS..Hα-helixtrans-64.8-37.9172.8-77.2179-75.7146-4.5112.6S111 M112 K113 Q118 K119S111-R115 PolarHBondContact O-N 2.93Å; S111-R115 PolarHBondContact O-NE 2.81Å; M112-R115 PolarHBondContact O-N 3.39Å; M112-R115 VanDerWaalsContact O-N 3.14Å; K113-R115 VanDerWaalsContact C-N 3.31Å; K113-R115 PolarHBondContact O-N 2.87Å; R115-Q118 WeakPolarHBondContact O-CB 3.36Å; R115-Q118 PolarHBondContact O-N 2.87Å; R115-K119 PolarHBondContact O-N 3.17Å
116L81.3Confident85.9Confident84 Ų8455.4 Ų55.444%0.4427%0.273SS..Hα-helixtrans-63.8-44.4174.2-64.7175.1000111.7I53 M112 K113 Q118 K119I53-L116 HydrophobicContact CD1-CB 3.99Å; M112-L116 PolarHBondContact O-N 2.86Å; K113-L116 WeakPolarHBondContact O-CB 3.42Å; K113-L116 PolarHBondContact O-N 3.44Å; K113-L116 VanDerWaalsContact O-N 3.16Å; L116-Q118 PolarHBondContact O-N 3.41Å; L116-K119 PolarHBondContact O-N 3.45Å; L116-K119 VanDerWaalsContact O-N 3.14Å
117F83.1Confident86Confident3 Ų353.1 Ų53.11%0.01326%0.264CS..Hα-helixtrans-61.9-27.3173.8174.2-116.3000113.2L49 Y52 I53 V57 D58 A59 M62 A66 K113 F114L49-F117 HydrophobicContact CD2-CB 3.91Å; L49-F117 HydrophobicContact CD2-CD1 3.7Å; L49-F117 HydrophobicContact CD2-CE1 4.37Å; L49-F117 HydrophobicContact CD2-CG 3.85Å; Y52-F117 HydrophobicContact CD2-CD2 4.24Å; Y52-F117 HydrophobicContact CD2-CE1 4.49Å; Y52-F117 AromaticContact CD2-CE2 3.74Å; Y52-F117 HydrophobicContact CD2-CE2 3.74Å; Y52-F117 AromaticContact CD2-CZ 3.88Å; Y52-F117 HydrophobicContact CD2-CZ 3.88Å; Y52-F117 HydrophobicContact CE2-CZ 4.41Å; Y52-F117 HydrophobicContact CG-CD2 4.35Å; Y52-F117 AromaticContact CG-CE2 3.87Å; Y52-F117 HydrophobicContact CG-CE2 3.87Å; Y52-F117 HydrophobicContact CG-CZ 4.4Å; I53-F117 HydrophobicContact CG1-CB 4.33Å; V57-F117 HydrophobicContact CG1-CE2 4.48Å; V57-F117 WeakPolarHBondContact O-CD2 3.35Å; V57-F117 VanDerWaalsContact O-CE2 3.29Å; V57-F117 WeakPolarHBondContact O-CE2 3.41Å; D58-F117 VanDerWaalsContact C-CE2 3.43Å; D58-F117 WeakPolarHBondContact CA-O 3.41Å; A59-F117 HydrophobicContact CB-CD1 4Å; A59-F117 HydrophobicContact CB-CE1 3.84Å; A59-F117 HydrophobicContact CB-CZ 4.27Å; A59-F117 PolarHBondContact N-O 3.5Å; M62-F117 HydrophobicContact CB-CZ 4.19Å; A66-F117 HydrophobicContact CB-CE1 3.82Å; K113-F117 PolarHBondContact O-N 2.94Å; F114-F117 AromaticContact CD2-CD1 4Å; F114-F117 HydrophobicContact CD2-CD1 4Å; F114-F117 AromaticContact CE2-CD1 3.95Å; F114-F117 HydrophobicContact CE2-CD1 3.95Å; F114-F117 HydrophobicContact CE2-CE1 4.36Å; F114-F117 PolarHBondContact O-N 3.16Å
118Q84.8Confident85.8Confident39 Ų3957 Ų5718%0.18228%0.281CS..Hα-helixtrans-78.5-14.7175.3-77.5-173-15.500115A59 F114 R115 L116 Q190A59-Q118 HydrophobicContact CB-CG 4.08Å; F114-Q118 HydrophobicContact CE1-CG 4.29Å; F114-Q118 HydrophobicContact CE2-CG 4.46Å; F114-Q118 HydrophobicContact CZ-CG 4.19Å; F114-Q118 WeakPolarHBondContact O-CG 3.29Å; F114-Q118 PolarHBondContact O-N 3.11Å; R115-Q118 WeakPolarHBondContact O-CB 3.36Å; R115-Q118 PolarHBondContact O-N 2.87Å; L116-Q118 PolarHBondContact O-N 3.41Å; Q118-Q190 HydrophobicContact CB-CG 4.11Å
119K81.6Confident85.9Confident53 Ų5354.6 Ų54.623%0.2327%0.27CS..SBendtrans-79.9129.6175.1-175.9-178.4174.2-176.50109.3R115 L116 A121 E124 I185R115-K119 PolarHBondContact O-N 3.17Å; L116-K119 PolarHBondContact O-N 3.45Å; L116-K119 VanDerWaalsContact O-N 3.14Å; K119-A121 PolarHBondContact O-N 3.23Å; K119-E124 IonicContact NZ-OE2 3.61Å; K119-E124 PolarHBondContact NZ-OE2 3.25Å; K119-I185 HydrophobicContact CG-CD1 4.4Å
120P81.2Confident86.1Confident35 Ų3551.1 Ų51.123%0.22725%0.252CS..  trans-58.3125.9177.1-23.132.5000111.8D58 N122 F123 T181 I185D58-P120 WeakPolarHBondContact OD2-CA 3.41Å; P120-N122 VanDerWaalsContact C-N 3.28Å; P120-N122 PolarHBondContact O-N 3.22Å; P120-F123 HydrophobicContact CB-CB 4.29Å; P120-F123 WeakPolarHBondContact O-CB 3.46Å; P120-F123 PolarHBondContact O-N 3.31Å; P120-F123 VanDerWaalsContact O-N 3.14Å; P120-T181 HydrophobicContact CG-CG2 4.46Å; P120-I185 HydrophobicContact CG-CD1 4.43Å
121A79.1Confident86.1Confident51 Ų5155.8 Ų55.842%0.42127%0.272SS..THydrogen-bonded Turntrans-65-29-164.600000114.1K56 D58 K119K56-A121 HydrophobicContact CB-CB 4.3Å; K56-A121 VanDerWaalsContact O-CB 3.3Å; K56-A121 WeakPolarHBondContact O-CB 3.34Å; D58-A121 HydrophobicContact CB-CB 4.41Å; D58-A121 PolarHBondContact OD2-N 3.2Å; K119-A121 PolarHBondContact O-N 3.23Å
122N84.1Confident86.1Confident81 Ų8159.4 Ų59.443%0.43329%0.286SS..THydrogen-bonded Turntrans-94.1-1.2-179.568-4.9000114.5P120 E124 Q125 R126P120-N122 VanDerWaalsContact C-N 3.28Å; P120-N122 PolarHBondContact O-N 3.22Å; N122-E124 VanDerWaalsContact C-N 3.35Å; N122-E124 PolarHBondContact O-N 3.18Å; N122-Q125 PolarHBondContact O-N 3.21Å; N122-R126 WeakPolarHBondContact O-CG 3.39Å; N122-R126 PolarHBondContact O-N 2.87Å; N122-R126 VanDerWaalsContact O-N 3.13Å
123F88Confident86.3Confident5 Ų558.6 Ų58.62%0.02228%0.283CS..Hα-helixtrans-60.3-43.3-173.8172.4-93.5000112.8P120 Q125 R126 L127 V178 T181 G182 I185 L197P120-F123 HydrophobicContact CB-CB 4.29Å; P120-F123 WeakPolarHBondContact O-CB 3.46Å; P120-F123 PolarHBondContact O-N 3.31Å; P120-F123 VanDerWaalsContact O-N 3.14Å; F123-Q125 VanDerWaalsContact C-N 3.33Å; F123-Q125 PolarHBondContact O-N 2.87Å; F123-R126 PolarHBondContact O-N 3.36Å; F123-L127 HydrophobicContact CE1-CB 4.47Å; F123-L127 HydrophobicContact CE1-CD2 3.98Å; F123-L127 HydrophobicContact CZ-CB 4.47Å; F123-L127 HydrophobicContact CZ-CD2 4.18Å; F123-L127 WeakPolarHBondContact O-CB 3.45Å; F123-L127 PolarHBondContact O-N 3.45Å; F123-V178 HydrophobicContact CE2-CG1 4.13Å; F123-V178 WeakPolarHBondContact CE2-O 3.25Å; F123-V178 HydrophobicContact CZ-CG1 4.35Å; F123-T181 HydrophobicContact CD2-CG2 3.66Å; F123-T181 HydrophobicContact CE2-CG2 4.14Å; F123-G182 VanDerWaalsContact CZ-CA 3.46Å; F123-I185 HydrophobicContact CB-CD1 4.25Å; F123-I185 HydrophobicContact CD1-CD1 3.83Å; F123-I185 HydrophobicContact CD2-CD1 3.87Å; F123-I185 HydrophobicContact CE1-CD1 4.22Å; F123-I185 HydrophobicContact CE2-CD1 4.24Å; F123-I185 HydrophobicContact CG-CD1 3.66Å; F123-I185 HydrophobicContact CZ-CD1 4.41Å; F123-L197 HydrophobicContact CE1-CD1 3.58Å; F123-L197 HydrophobicContact CZ-CD1 3.94Å
124E86.4Confident86.6Confident66 Ų6655.5 Ų55.531%0.30827%0.269SS..Hα-helixtrans-63.9-40.1-177-157.966.1-138.900111.9K119 N122 Q128 R200K119-E124 IonicContact NZ-OE2 3.61Å; K119-E124 PolarHBondContact NZ-OE2 3.25Å; N122-E124 VanDerWaalsContact C-N 3.35Å; N122-E124 PolarHBondContact O-N 3.18Å; E124-Q128 PolarHBondContact O-N 3.3Å; E124-Q128 VanDerWaalsContact O-N 3.13Å; E124-R200 IonicContact OE1-CZ 3.54Å; E124-R200 IonicContact OE1-NH1 3.16Å; E124-R200 PolarHBondContact OE1-NH1 2.76Å; E124-R200 IonicContact OE1-NH2 2.8Å; E124-R200 PolarHBondContact OE1-NH2 3.26Å
125Q86.5Confident86.6Confident115 Ų11557.6 Ų57.654%0.53728%0.281SS..Hα-helixtrans-63.4-51176175.8177.6-6.600110.8N122 F123 L127 Q128 E129N122-Q125 PolarHBondContact O-N 3.21Å; F123-Q125 VanDerWaalsContact C-N 3.33Å; F123-Q125 PolarHBondContact O-N 2.87Å; Q125-L127 VanDerWaalsContact C-N 3.28Å; Q125-L127 PolarHBondContact O-N 3.43Å; Q125-Q128 PolarHBondContact O-N 3.15Å; Q125-E129 HydrophobicContact CG-CG 4.28Å; Q125-E129 WeakPolarHBondContact CG-OE1 3.36Å; Q125-E129 PolarHBondContact NE2-OE1 2.99Å; Q125-E129 WeakPolarHBondContact O-CG 3.02Å; Q125-E129 PolarHBondContact O-N 3.33Å
126R90.8Very high86.7Confident72 Ų7258.8 Ų58.827%0.27229%0.291SS..Hα-helixtrans-61.5-35.4-179.6-66.8176.169.3173.78.2112.8N122 F123 S130 E174 V178N122-R126 WeakPolarHBondContact O-CG 3.39Å; N122-R126 PolarHBondContact O-N 2.87Å; N122-R126 VanDerWaalsContact O-N 3.13Å; F123-R126 PolarHBondContact O-N 3.36Å; R126-S130 VanDerWaalsContact O-CB 3.26Å; R126-S130 WeakPolarHBondContact O-CB 3.33Å; R126-S130 PolarHBondContact O-N 3.48Å; R126-S130 PolarHBondContact O-OG 3.07Å; R126-E174 IonicContact CZ-OE1 3.99Å; R126-E174 IonicContact CZ-OE2 2.58Å; R126-E174 IonicContact NE-OE1 3.96Å; R126-E174 PolarHBondContact NE-OE1 3.4Å; R126-E174 IonicContact NE-OE2 3.94Å; R126-E174 IonicContact NH2-OE1 2.75Å; R126-E174 PolarHBondContact NH2-OE1 3.05Å; R126-E174 IonicContact NH2-OE2 3.97Å; R126-E174 PolarHBondContact NH2-OE2 3.48Å; R126-V178 HydrophobicContact CB-CG2 3.96Å
127L90.4Very high87.2Confident7 Ų755 Ų554%0.03727%0.271CS..Hα-helixtrans-64.7-43173.5173.958.3000111.9F123 Q125 K131 V178 L197 L204F123-L127 HydrophobicContact CE1-CB 4.47Å; F123-L127 HydrophobicContact CE1-CD2 3.98Å; F123-L127 HydrophobicContact CZ-CB 4.47Å; F123-L127 HydrophobicContact CZ-CD2 4.18Å; F123-L127 WeakPolarHBondContact O-CB 3.45Å; F123-L127 PolarHBondContact O-N 3.45Å; Q125-L127 VanDerWaalsContact C-N 3.28Å; Q125-L127 PolarHBondContact O-N 3.43Å; L127-K131 PolarHBondContact O-N 3.11Å; L127-K131 VanDerWaalsContact O-N 3.11Å; L127-V178 HydrophobicContact CB-CG1 3.91Å; L127-V178 HydrophobicContact CD1-CG1 3.65Å; L127-V178 HydrophobicContact CG-CG1 4.34Å; L127-L197 HydrophobicContact CD2-CD1 4.42Å; L127-L204 HydrophobicContact CD1-CD2 3.96Å
128Q88.7Confident87.4Confident87 Ų8760.1 Ų60.141%0.40729%0.293SS..Hα-helixtrans-70.8-42.5178.2-174.460.124.300112.3E124 Q125 K131 M132E124-Q128 PolarHBondContact O-N 3.3Å; E124-Q128 VanDerWaalsContact O-N 3.13Å; Q125-Q128 PolarHBondContact O-N 3.15Å; Q128-K131 WeakPolarHBondContact O-CB 3.43Å; Q128-K131 PolarHBondContact O-N 3.38Å; Q128-M132 HydrophobicContact CG-SD 4.41Å; Q128-M132 WeakPolarHBondContact O-CG 3.44Å; Q128-M132 PolarHBondContact O-N 3.21Å
129E89.6Confident87.5Confident84 Ų8465.9 Ų65.939%0.39332%0.322SS..Hα-helixtrans-59.9-46.8174.7-72.2168.1170.900111.2Q125 K131 M132 I133Q125-E129 HydrophobicContact CG-CG 4.28Å; Q125-E129 WeakPolarHBondContact CG-OE1 3.36Å; Q125-E129 PolarHBondContact NE2-OE1 2.99Å; Q125-E129 WeakPolarHBondContact O-CG 3.02Å; Q125-E129 PolarHBondContact O-N 3.33Å; E129-K131 VanDerWaalsContact C-N 3.28Å; E129-K131 PolarHBondContact O-N 3.29Å; E129-M132 PolarHBondContact O-N 3.07Å; E129-I133 WeakPolarHBondContact O-CG1 3.29Å; E129-I133 PolarHBondContact O-N 3.35Å; E129-I133 VanDerWaalsContact O-N 3.16Å
130S91.4Very high87.6Confident1 Ų167.2 Ų67.21%0.00733%0.329CS..Hα-helixtrans-58-39.6174.5-64.20000112.4R126 L134R126-S130 VanDerWaalsContact O-CB 3.26Å; R126-S130 WeakPolarHBondContact O-CB 3.33Å; R126-S130 PolarHBondContact O-N 3.48Å; R126-S130 PolarHBondContact O-OG 3.07Å; S130-L134 WeakPolarHBondContact O-CG 3.48Å
131K90.4Very high87.7Confident97 Ų9766.6 Ų66.642%0.42232%0.324SS..Hα-helixtrans-66.8-46.9176.7-176.2-174.5169.5-174.40111.4L127 Q128 E129 I133 L134 D135 L204L127-K131 PolarHBondContact O-N 3.11Å; L127-K131 VanDerWaalsContact O-N 3.11Å; Q128-K131 WeakPolarHBondContact O-CB 3.43Å; Q128-K131 PolarHBondContact O-N 3.38Å; E129-K131 VanDerWaalsContact C-N 3.28Å; E129-K131 PolarHBondContact O-N 3.29Å; K131-I133 VanDerWaalsContact C-N 3.33Å; K131-I133 PolarHBondContact O-N 3.19Å; K131-L134 PolarHBondContact O-N 3.43Å; K131-L134 VanDerWaalsContact O-N 3.08Å; K131-D135 VanDerWaalsContact CE-OD2 3.28Å; K131-D135 WeakPolarHBondContact CE-OD2 3.29Å; K131-D135 PolarHBondContact O-N 3.42Å; K131-L204 HydrophobicContact CB-CD1 4.04Å
132M88.1Confident87.8Confident113 Ų11368.1 Ų68.156%0.55733%0.329SS*.Hα-helixtrans-59-41.4-178-74.4178.262.200112.7Q128 E129 L134 D135 E136Q128-M132 HydrophobicContact CG-SD 4.41Å; Q128-M132 WeakPolarHBondContact O-CG 3.44Å; Q128-M132 PolarHBondContact O-N 3.21Å; E129-M132 PolarHBondContact O-N 3.07Å; M132-L134 VanDerWaalsContact C-N 3.29Å; M132-L134 PolarHBondContact O-N 3.46Å; M132-D135 PolarHBondContact O-N 3.09Å; M132-E136 PolarHBondContact O-N 2.76Å
133I88.6Confident87.4Confident65 Ų6566.6 Ų66.633%0.33333%0.328SS..Hα-helixtrans-63-35.9177.1-64.5164.7000111.4E129 K131 V137 V171E129-I133 WeakPolarHBondContact O-CG1 3.29Å; E129-I133 PolarHBondContact O-N 3.35Å; E129-I133 VanDerWaalsContact O-N 3.16Å; K131-I133 VanDerWaalsContact C-N 3.33Å; K131-I133 PolarHBondContact O-N 3.19Å; I133-V137 WeakPolarHBondContact O-CG2 3.24Å; I133-V137 PolarHBondContact O-N 3.23Å; I133-V137 VanDerWaalsContact O-N 3.16Å; I133-V171 HydrophobicContact CB-CG2 4.09Å; I133-V171 HydrophobicContact CD1-CG2 3.78Å; I133-V171 HydrophobicContact CG2-CB 3.98Å; I133-V171 HydrophobicContact CG2-CG1 4.26Å; I133-V171 HydrophobicContact CG2-CG2 3.85Å
134L91.4Very high86.8Confident0 Ų066.3 Ų66.30%033%0.327CS..Hα-helixtrans-72.9-40175.7-62.3176.7000112.1S130 K131 M132 E136 V137 K138 L168 V171 V175 L204 Y208 L211S130-L134 WeakPolarHBondContact O-CG 3.48Å; K131-L134 PolarHBondContact O-N 3.43Å; K131-L134 VanDerWaalsContact O-N 3.08Å; M132-L134 VanDerWaalsContact C-N 3.29Å; M132-L134 PolarHBondContact O-N 3.46Å; L134-E136 VanDerWaalsContact C-N 3.3Å; L134-E136 PolarHBondContact O-N 3.46Å; L134-V137 PolarHBondContact O-N 2.81Å; L134-K138 WeakPolarHBondContact O-CB 3.34Å; L134-K138 PolarHBondContact O-N 2.95Å; L134-L168 HydrophobicContact CD2-CD2 3.62Å; L134-V171 HydrophobicContact CD2-CG1 3.99Å; L134-V175 HydrophobicContact CD1-CG2 4.35Å; L134-L204 HydrophobicContact CD1-CD1 3.81Å; L134-L204 HydrophobicContact CD1-CG 4.35Å; L134-Y208 HydrophobicContact CD2-CD2 3.97Å; L134-L211 HydrophobicContact CB-CD1 3.9Å; L134-L211 HydrophobicContact CD2-CD1 4.22Å; L134-L211 WeakPolarHBondContact O-CD1 3.46Å
135D89.1Confident86.2Confident58 Ų5867.5 Ų67.531%0.3133%0.332SS..Hα-helixtrans-61.9-37.9174.7-69.2-28.2000111.1K131 M132 K138 M139 H207K131-D135 VanDerWaalsContact CE-OD2 3.28Å; K131-D135 WeakPolarHBondContact CE-OD2 3.29Å; K131-D135 PolarHBondContact O-N 3.42Å; M132-D135 PolarHBondContact O-N 3.09Å; D135-K138 WeakPolarHBondContact O-CB 3.46Å; D135-K138 PolarHBondContact O-N 2.77Å; D135-M139 PolarHBondContact O-N 3.38Å; D135-H207 IonicContact OD1-CE1 2.87Å; D135-H207 PolarHBondContact OD1-CE1 2.97Å; D135-H207 IonicContact OD1-ND1 3.19Å
136E87.1Confident85.3Confident119 Ų11963 Ų6356%0.55631%0.313SS*.Hα-helixtrans-63.4-47.7173.3-174.1178.5-172.500112.2M132 L134 K138 M139 H140M132-E136 PolarHBondContact O-N 2.76Å; L134-E136 VanDerWaalsContact C-N 3.3Å; L134-E136 PolarHBondContact O-N 3.46Å; E136-K138 PolarHBondContact O-N 2.67Å; E136-M139 PolarHBondContact O-N 3.4Å; E136-M139 VanDerWaalsContact O-N 3.11Å; E136-H140 PolarHBondContact O-CD2 2.68Å; E136-H140 PolarHBondContact O-N 3.5Å
137V89.9Confident84.3Confident5 Ų566.2 Ų66.23%0.0333%0.328CS..Hα-helixtrans-58.9-37.5174.3170.90000111.5I133 L134 H140 L141 L164 L168 L211 V215I133-V137 WeakPolarHBondContact O-CG2 3.24Å; I133-V137 PolarHBondContact O-N 3.23Å; I133-V137 VanDerWaalsContact O-N 3.16Å; L134-V137 PolarHBondContact O-N 2.81Å; V137-H140 PolarHBondContact O-N 2.87Å; V137-L141 PolarHBondContact O-N 2.98Å; V137-L164 HydrophobicContact CG1-CB 4.4Å; V137-L168 HydrophobicContact CB-CD2 4.46Å; V137-L168 HydrophobicContact CG1-CD1 4.03Å; V137-L168 HydrophobicContact CG1-CD2 4.05Å; V137-L168 HydrophobicContact CG1-CG 3.96Å; V137-L168 HydrophobicContact CG2-CD2 4.35Å; V137-L168 HydrophobicContact CG2-CG 4.37Å; V137-L211 HydrophobicContact CB-CD1 4.42Å; V137-L211 HydrophobicContact CG1-CD1 4.36Å; V137-V215 HydrophobicContact CG1-CG2 4.4Å
138K88.2Confident83.6Confident109 Ų10967.2 Ų67.247%0.47434%0.336SS..Hα-helixtrans-64.3-39.6175.8-176.1166.2170.9176.90112.4L134 D135 E136 H140 L141 H207 L211L134-K138 WeakPolarHBondContact O-CB 3.34Å; L134-K138 PolarHBondContact O-N 2.95Å; D135-K138 WeakPolarHBondContact O-CB 3.46Å; D135-K138 PolarHBondContact O-N 2.77Å; E136-K138 PolarHBondContact O-N 2.67Å; K138-H140 VanDerWaalsContact C-N 3.34Å; K138-H140 PolarHBondContact O-N 3.35Å; K138-L141 WeakPolarHBondContact O-CB 3.28Å; K138-L141 PolarHBondContact O-N 3.26Å; K138-H207 VanDerWaalsContact CD-NE2 3.28Å; K138-H207 WeakPolarHBondContact CD-NE2 3.44Å; K138-L211 HydrophobicContact CB-CD1 4.38Å; K138-L211 HydrophobicContact CB-CD2 3.8Å; K138-L211 HydrophobicContact CG-CD2 4.18Å
139M86.6Confident83Confident160 Ų16063.5 Ų63.579%0.78832%0.32SS*.Hα-helixtrans-65.7-32.8177.4-74.5-156.870.700113.5D135 E136 P142D135-M139 PolarHBondContact O-N 3.38Å; E136-M139 PolarHBondContact O-N 3.4Å; E136-M139 VanDerWaalsContact O-N 3.11Å; M139-P142 WeakPolarHBondContact O-CD 3.41Å
140H85.1Confident82.6Confident82 Ų8262.8 Ų62.838%0.3832%0.316SS..Hα-helixtrans-81.4-13.9178.5-76.1-70.5000114.4E136 V137 K138 A143 H160 L164E136-H140 PolarHBondContact O-CD2 2.68Å; E136-H140 PolarHBondContact O-N 3.5Å; V137-H140 PolarHBondContact O-N 2.87Å; K138-H140 VanDerWaalsContact C-N 3.34Å; K138-H140 PolarHBondContact O-N 3.35Å; H140-A143 WeakPolarHBondContact O-CB 3.4Å; H140-A143 PolarHBondContact O-N 2.85Å; H140-H160 AromaticContact ND1-NE2 3.86Å; H140-L164 HydrophobicContact CB-CD1 3.77Å; H140-L164 HydrophobicContact CB-CD2 3.75Å; H140-L164 HydrophobicContact CB-CG 4.36Å
141L83.1Confident82.1Confident22 Ų2265.6 Ų65.612%0.11533%0.329CS..G310 helixtrans-59.8-38.1-174.4-140.7148.5000114.5V137 K138 A143 L144 L211 K214 V215V137-L141 PolarHBondContact O-N 2.98Å; K138-L141 WeakPolarHBondContact O-CB 3.28Å; K138-L141 PolarHBondContact O-N 3.26Å; L141-A143 VanDerWaalsContact C-N 3.26Å; L141-A143 PolarHBondContact O-N 3.13Å; L141-L144 WeakPolarHBondContact O-CB 3.32Å; L141-L144 PolarHBondContact O-N 3.41Å; L141-L211 HydrophobicContact CD1-CD2 3.67Å; L141-K214 HydrophobicContact CD1-CB 4.04Å; L141-K214 HydrophobicContact CD2-CB 4.23Å; L141-V215 HydrophobicContact CD1-CG2 3.99Å; L141-V215 HydrophobicContact CG-CG2 4.44Å
142P79.8Confident81.6Confident83 Ų8368.3 Ų68.354%0.53934%0.343SS..G310 helixtrans-64.1-22.3173.8-23.535.4000114.9M139 L144 E145M139-P142 WeakPolarHBondContact O-CD 3.41Å; P142-L144 PolarHBondContact O-N 2.95Å; P142-E145 WeakPolarHBondContact O-CG 3.18Å; P142-E145 PolarHBondContact O-N 3.24Å
143A75.8Confident81.3Confident48 Ų4865.8 Ų65.840%0.39733%0.334SS..G310 helixtrans-68.5-15.4176.700000112.9H140 L141 Q157H140-A143 WeakPolarHBondContact O-CB 3.4Å; H140-A143 PolarHBondContact O-N 2.85Å; L141-A143 VanDerWaalsContact C-N 3.26Å; L141-A143 PolarHBondContact O-N 3.13Å; A143-Q157 PolarHBondContact O-NE2 3.04Å
144L74.9Confident81.2Confident0 Ų062.7 Ų62.70%032%0.318CS..G310 helixtrans-87.23.5179-56.4-177.6000114.4L141 P142 T146 H160 C161 L164L141-L144 WeakPolarHBondContact O-CB 3.32Å; L141-L144 PolarHBondContact O-N 3.41Å; P142-L144 PolarHBondContact O-N 2.95Å; L144-T146 PolarHBondContact O-N 2.68Å; L144-H160 HydrophobicContact CD2-CB 3.93Å; L144-C161 HydrophobicContact CD1-CB 3.92Å; L144-C161 HydrophobicContact CD2-CB 3.78Å; L144-C161 HydrophobicContact CG-CB 4.46Å; L144-L164 HydrophobicContact CD1-CD1 3.86Å; L144-L164 HydrophobicContact CG-CD1 4.41Å
145E74.4Confident80.9Confident91 Ų9165.3 Ų65.343%0.42533%0.331SS..SBendtrans-68.1124.9175-68-156.2143.500112.1P142 K147 Q157P142-E145 WeakPolarHBondContact O-CG 3.18Å; P142-E145 PolarHBondContact O-N 3.24Å; E145-K147 WeakPolarHBondContact O-CG 3.39Å; E145-K147 PolarHBondContact O-N 3.02Å; E145-Q157 PolarHBondContact O-NE2 2.87Å
146T68.1Low80.7Confident21 Ų2166.2 Ų66.213%0.12934%0.341CS..  trans-55.1114.5178.8-23.10000110.1L144 L222 L298 K301L144-T146 PolarHBondContact O-N 2.68Å; T146-L222 HydrophobicContact CG2-CD2 4.22Å; T146-L298 HydrophobicContact CG2-CD2 3.82Å; T146-K301 WeakPolarHBondContact O-CD 3.32Å; T146-K301 PolarHBondContact O-NZ 3.3Å
147K69.2Low80.7Confident138 Ų13861.5 Ų61.560%0.632%0.319SS*.  trans-111.5-13.3-176.9-80.9175.9-174.4-174.80114E145E145-K147 WeakPolarHBondContact O-CG 3.39Å; E145-K147 PolarHBondContact O-N 3.02Å
148S75.2Confident80.6Confident28 Ų2862 Ų6220%0.19632%0.322CS..  trans-153.2160.4-177.4-176.10000110.2E150 V154S148-E150 PolarHBondContact OG-N 3.1Å; S148-E150 VanDerWaalsContact OG-N 3.07Å; S148-V154 WeakPolarHBondContact O-CG2 3.46Å
149V77.8Confident80.6Confident10 Ų1060.8 Ų60.86%0.06132%0.32CS..  trans-95.8-9.1171.5-169.20000110.9Q151 S229 L294 L298 L304 V305V149-Q151 PolarHBondContact O-N 3.42Å; V149-S229 WeakPolarHBondContact O-CB 3.31Å; V149-S229 PolarHBondContact O-OG 3.14Å; V149-L294 HydrophobicContact CG1-CD2 3.56Å; V149-L294 HydrophobicContact CG1-CG 4.27Å; V149-L298 HydrophobicContact CG2-CD1 3.69Å; V149-L298 HydrophobicContact CG2-CD2 4.42Å; V149-L304 HydrophobicContact CG2-CB 3.66Å; V149-L304 HydrophobicContact CG2-CD1 4.27Å; V149-V305 HydrophobicContact CG2-CG2 4.11Å
150E80.2Confident80.6Confident69 Ų6956 Ų5632%0.32230%0.296SS..  trans-67.2129.5-178.5-63.8-52.9150.400112.2S148 E152 V153 V154 R233 K308S148-E150 PolarHBondContact OG-N 3.1Å; S148-E150 VanDerWaalsContact OG-N 3.07Å; E150-E152 PolarHBondContact O-N 2.69Å; E150-E152 VanDerWaalsContact O-N 3.07Å; E150-V153 HydrophobicContact CB-CG2 4.23Å; E150-V153 PolarHBondContact O-N 3.34Å; E150-V154 PolarHBondContact O-N 2.86Å; E150-R233 IonicContact OE2-CZ 2.72Å; E150-R233 IonicContact OE2-NH2 2.7Å; E150-R233 PolarHBondContact OE2-NH2 3.43Å; E150-K308 IonicContact OE1-NZ 2.7Å; E150-K308 PolarHBondContact OE1-NZ 2.8Å; E150-K308 IonicContact OE2-NZ 2.71Å
151Q81Confident80.8Confident60 Ų6052.1 Ų52.128%0.2828%0.278SS..Hα-helixtrans-49.8-40.5-173.4176.4-179.9-37.500113.5V149 Q155 L226 R230V149-Q151 PolarHBondContact O-N 3.42Å; Q151-Q155 WeakPolarHBondContact O-CB 3.48Å; Q151-Q155 PolarHBondContact O-N 3.11Å; Q151-L226 HydrophobicContact CG-CD1 3.99Å; Q151-R230 HydrophobicContact CG-CG 4.25Å
152E79.7Confident81Confident153 Ų15354 Ų5472%0.71529%0.29SS*.Hα-helixtrans-69.7-41.2-177.2-70163.4-153.600111.9E150 S156E150-E152 PolarHBondContact O-N 2.69Å; E150-E152 VanDerWaalsContact O-N 3.07Å; E152-S156 WeakPolarHBondContact O-CB 3.44Å; E152-S156 PolarHBondContact O-N 3.44Å
153V82.4Confident81.5Confident60 Ų6054.5 Ų54.536%0.36429%0.289SS..Hα-helixtrans-68-49.5177.5-175.50000110E150 Q155 S156 Q157E150-V153 HydrophobicContact CB-CG2 4.23Å; E150-V153 PolarHBondContact O-N 3.34Å; V153-Q155 VanDerWaalsContact C-N 3.31Å; V153-Q155 PolarHBondContact O-N 3.06Å; V153-S156 WeakPolarHBondContact O-CB 3.37Å; V153-S156 PolarHBondContact O-N 2.67Å; V153-S156 VanDerWaalsContact O-N 3.13Å; V153-Q157 WeakPolarHBondContact O-CG 3.43Å; V153-Q157 PolarHBondContact O-N 3.45Å
154V85.5Confident82.1Confident0 Ų052.8 Ų52.80%027%0.272CS..Hα-helixtrans-62.6-38.6178.9-175.20000111.2S148 E150 Q157 L158 L222 C225 L226S148-V154 WeakPolarHBondContact O-CG2 3.46Å; E150-V154 PolarHBondContact O-N 2.86Å; V154-Q157 PolarHBondContact O-N 3.02Å; V154-L158 WeakPolarHBondContact O-CB 3.14Å; V154-L158 PolarHBondContact O-N 3.34Å; V154-L222 HydrophobicContact CG1-CD2 4.18Å; V154-C225 HydrophobicContact CG1-CB 4.26Å; V154-L226 HydrophobicContact CB-CD1 4.31Å; V154-L226 HydrophobicContact CG1-CB 3.86Å; V154-L226 HydrophobicContact CG1-CD1 4.36Å
155Q86.2Confident82.8Confident56 Ų5657.8 Ų57.826%0.26229%0.292SS..Hα-helixtrans-64.3-40.7174.4-176.369.573.100111.9Q151 V153 L158 N159 L226Q151-Q155 WeakPolarHBondContact O-CB 3.48Å; Q151-Q155 PolarHBondContact O-N 3.11Å; V153-Q155 VanDerWaalsContact C-N 3.31Å; V153-Q155 PolarHBondContact O-N 3.06Å; Q155-L158 PolarHBondContact O-N 2.93Å; Q155-N159 PolarHBondContact NE2-OD1 2.98Å; Q155-N159 PolarHBondContact O-N 3.04Å; Q155-N159 PolarHBondContact O-ND2 3.27Å; Q155-N159 PolarHBondContact O-OD1 2.9Å; Q155-L226 HydrophobicContact CB-CD1 4.41Å
156S84.9Confident83.4Confident77 Ų7759 Ų5954%0.53830%0.296SS..Hα-helixtrans-62.9-45.9175.4-172.60000111.9E152 V153 L158 N159 H160E152-S156 WeakPolarHBondContact O-CB 3.44Å; E152-S156 PolarHBondContact O-N 3.44Å; V153-S156 WeakPolarHBondContact O-CB 3.37Å; V153-S156 PolarHBondContact O-N 2.67Å; V153-S156 VanDerWaalsContact O-N 3.13Å; S156-L158 PolarHBondContact O-N 2.84Å; S156-N159 WeakPolarHBondContact O-CB 3.35Å; S156-N159 PolarHBondContact O-N 2.86Å; S156-H160 PolarHBondContact O-N 3.3Å
157Q86.8Confident84.3Confident19 Ų1960.3 Ų60.39%0.08931%0.306CS..Hα-helixtrans-63.4-39.8176.3-65-168.1-67.300112.2A143 E145 V153 V154 H160 C161 L222A143-Q157 PolarHBondContact O-NE2 3.04Å; E145-Q157 PolarHBondContact O-NE2 2.87Å; V153-Q157 WeakPolarHBondContact O-CG 3.43Å; V153-Q157 PolarHBondContact O-N 3.45Å; V154-Q157 PolarHBondContact O-N 3.02Å; Q157-H160 PolarHBondContact O-N 3.26Å; Q157-C161 WeakPolarHBondContact O-CB 3.47Å; Q157-C161 PolarHBondContact O-N 3.46Å; Q157-L222 HydrophobicContact CB-CD1 4.24Å; Q157-L222 HydrophobicContact CB-CD2 4.08Å
158L87.7Confident85.3Confident15 Ų1554 Ų548%0.07928%0.278CS..Hα-helixtrans-63.1-41.6173.9179.558.4000111.8V154 Q155 S156 H160 C161 V162 K219 L222 E223 L226V154-L158 WeakPolarHBondContact O-CB 3.14Å; V154-L158 PolarHBondContact O-N 3.34Å; Q155-L158 PolarHBondContact O-N 2.93Å; S156-L158 PolarHBondContact O-N 2.84Å; L158-H160 PolarHBondContact O-N 3.01Å; L158-C161 WeakPolarHBondContact O-CB 3.47Å; L158-C161 PolarHBondContact O-N 2.91Å; L158-V162 HydrophobicContact CD1-CG2 4.32Å; L158-V162 WeakPolarHBondContact O-CG2 3.18Å; L158-V162 PolarHBondContact O-N 2.72Å; L158-K219 HydrophobicContact CD1-CG 4.06Å; L158-L222 HydrophobicContact CB-CB 4.25Å; L158-L222 HydrophobicContact CD1-CB 4.06Å; L158-E223 HydrophobicContact CD1-CG 3.77Å; L158-E223 HydrophobicContact CD2-CG 3.9Å; L158-L226 HydrophobicContact CD2-CD2 3.87Å
159N87.7Confident85.9Confident84 Ų8456.1 Ų56.145%0.44929%0.294SS..Hα-helixtrans-62.4-42176.2-65.8-7.7000111.3Q155 S156 C161 V162 N163Q155-N159 PolarHBondContact NE2-OD1 2.98Å; Q155-N159 PolarHBondContact O-N 3.04Å; Q155-N159 PolarHBondContact O-ND2 3.27Å; Q155-N159 PolarHBondContact O-OD1 2.9Å; S156-N159 WeakPolarHBondContact O-CB 3.35Å; S156-N159 PolarHBondContact O-N 2.86Å; N159-C161 VanDerWaalsContact C-N 3.35Å; N159-C161 PolarHBondContact O-N 2.68Å; N159-V162 PolarHBondContact O-N 3.26Å; N159-N163 PolarHBondContact O-N 2.87Å; N159-N163 VanDerWaalsContact O-N 3.1Å
160H86.8Confident86.4Confident61 Ų6161.1 Ų61.128%0.28232%0.316SS..Hα-helixtrans-63.7-39.7174.2-166.458000111.9H140 L144 S156 Q157 L158 V162 N163 L164H140-H160 AromaticContact ND1-NE2 3.86Å; L144-H160 HydrophobicContact CD2-CB 3.93Å; S156-H160 PolarHBondContact O-N 3.3Å; Q157-H160 PolarHBondContact O-N 3.26Å; L158-H160 PolarHBondContact O-N 3.01Å; H160-V162 PolarHBondContact O-N 3.41Å; H160-N163 WeakPolarHBondContact O-CB 3.32Å; H160-N163 PolarHBondContact O-N 3.48Å; H160-L164 PolarHBondContact O-N 3.49Å; H160-L164 VanDerWaalsContact O-N 3.15Å
161C89.1Confident86.9Confident0 Ų058.2 Ų58.20%030%0.303CS..Hα-helixtrans-61.8-44175.8-168.10000112.2L144 Q157 L158 N159 N163 L164 Y165 V215 K219 L222L144-C161 HydrophobicContact CD1-CB 3.92Å; L144-C161 HydrophobicContact CD2-CB 3.78Å; L144-C161 HydrophobicContact CG-CB 4.46Å; Q157-C161 WeakPolarHBondContact O-CB 3.47Å; Q157-C161 PolarHBondContact O-N 3.46Å; L158-C161 WeakPolarHBondContact O-CB 3.47Å; L158-C161 PolarHBondContact O-N 2.91Å; N159-C161 VanDerWaalsContact C-N 3.35Å; N159-C161 PolarHBondContact O-N 2.68Å; C161-N163 VanDerWaalsContact C-N 3.28Å; C161-N163 PolarHBondContact O-N 2.87Å; C161-L164 PolarHBondContact O-N 2.8Å; C161-Y165 PolarHBondContact O-N 2.85Å; C161-V215 PolarHBondContact SG-O 3.39Å; C161-K219 PolarHBondContact SG-N 3.38Å; C161-L222 HydrophobicContact CB-CD1 4.05Å
162V88.7Confident87.5Confident61 Ų6159.6 Ų59.637%0.3731%0.308SS..Hα-helixtrans-63-34.4176.5169.90000111.5L158 N159 H160 Y165 K166L158-V162 HydrophobicContact CD1-CG2 4.32Å; L158-V162 WeakPolarHBondContact O-CG2 3.18Å; L158-V162 PolarHBondContact O-N 2.72Å; N159-V162 PolarHBondContact O-N 3.26Å; H160-V162 PolarHBondContact O-N 3.41Å; V162-Y165 PolarHBondContact O-N 3Å; V162-K166 PolarHBondContact O-N 2.77Å
163N88.8Confident87.9Confident94 Ų9456.3 Ų56.350%0.50330%0.302SS..Hα-helixtrans-65.6-45.6173.9-69.5-14.3000112.1N159 H160 C161 Y165 K166 S167N159-N163 PolarHBondContact O-N 2.87Å; N159-N163 VanDerWaalsContact O-N 3.1Å; H160-N163 WeakPolarHBondContact O-CB 3.32Å; H160-N163 PolarHBondContact O-N 3.48Å; C161-N163 VanDerWaalsContact C-N 3.28Å; C161-N163 PolarHBondContact O-N 2.87Å; N163-Y165 VanDerWaalsContact C-N 3.31Å; N163-Y165 PolarHBondContact O-N 2.85Å; N163-K166 WeakPolarHBondContact O-CB 3.37Å; N163-K166 PolarHBondContact O-N 2.68Å; N163-K166 VanDerWaalsContact O-N 3.14Å; N163-S167 PolarHBondContact O-N 3.42Å; N163-S167 PolarHBondContact O-OG 3.11Å
164L89.6Confident88.3Confident11 Ų1156 Ų566%0.05830%0.297CS..Hα-helixtrans-62.8-38175.2-61.1-169.2000112.2V137 H140 L144 H160 C161 K166 S167 L168 V215V137-L164 HydrophobicContact CG1-CB 4.4Å; H140-L164 HydrophobicContact CB-CD1 3.77Å; H140-L164 HydrophobicContact CB-CD2 3.75Å; H140-L164 HydrophobicContact CB-CG 4.36Å; L144-L164 HydrophobicContact CD1-CD1 3.86Å; L144-L164 HydrophobicContact CG-CD1 4.41Å; H160-L164 PolarHBondContact O-N 3.49Å; H160-L164 VanDerWaalsContact O-N 3.15Å; C161-L164 PolarHBondContact O-N 2.8Å; L164-K166 VanDerWaalsContact C-N 3.3Å; L164-K166 PolarHBondContact O-N 3.49Å; L164-S167 PolarHBondContact O-N 3.14Å; L164-L168 PolarHBondContact O-N 3.36Å; L164-V215 HydrophobicContact CB-CG1 4.2Å; L164-V215 HydrophobicContact CB-CG2 4.34Å
165Y88.4Confident88.6Confident105 Ų10556.2 Ų56.241%0.41230%0.298SS..Hα-helixtrans-61.4-39.4174.1-172.6-89.5000111.9C161 V162 N163 S169 V215C161-Y165 PolarHBondContact O-N 2.85Å; V162-Y165 PolarHBondContact O-N 3Å; N163-Y165 VanDerWaalsContact C-N 3.31Å; N163-Y165 PolarHBondContact O-N 2.85Å; Y165-S169 WeakPolarHBondContact O-CB 3.21Å; Y165-S169 PolarHBondContact O-N 2.67Å; Y165-V215 HydrophobicContact CD2-CG1 4.33Å
166K88.4Confident88.9Confident118 Ų11858.6 Ų58.651%0.51331%0.309SS..Hα-helixtrans-64.5-47.3174.8-174.8174.8-178.7-78.70111.6V162 N163 L164 L168 S169 E170V162-K166 PolarHBondContact O-N 2.77Å; N163-K166 WeakPolarHBondContact O-CB 3.37Å; N163-K166 PolarHBondContact O-N 2.68Å; N163-K166 VanDerWaalsContact O-N 3.14Å; L164-K166 VanDerWaalsContact C-N 3.3Å; L164-K166 PolarHBondContact O-N 3.49Å; K166-L168 VanDerWaalsContact C-N 3.34Å; K166-L168 PolarHBondContact O-N 3.46Å; K166-S169 WeakPolarHBondContact O-CB 3.33Å; K166-S169 PolarHBondContact O-N 3.07Å; K166-E170 VanDerWaalsContact CE-OE1 3.28Å; K166-E170 WeakPolarHBondContact CE-OE1 3.35Å; K166-E170 WeakPolarHBondContact CG-OE1 3.48Å; K166-E170 IonicContact NZ-OE1 3.66Å; K166-E170 PolarHBondContact NZ-OE1 3.18Å; K166-E170 IonicContact NZ-OE2 2.78Å; K166-E170 WeakPolarHBondContact O-CG 3.49Å; K166-E170 PolarHBondContact O-N 2.78Å
167S86.5Confident89Confident47 Ų4759.1 Ų59.133%0.32930%0.304SS..Hα-helixtrans-58.4-43.5176.9-55.20000112.5N163 L164 S169 E170 V171N163-S167 PolarHBondContact O-N 3.42Å; N163-S167 PolarHBondContact O-OG 3.11Å; L164-S167 PolarHBondContact O-N 3.14Å; S167-S169 VanDerWaalsContact C-N 3.35Å; S167-S169 PolarHBondContact O-N 3.48Å; S167-E170 PolarHBondContact O-N 2.97Å; S167-V171 PolarHBondContact O-N 2.88Å
168L90.4Very high89.3Confident5 Ų558.3 Ų58.33%0.02630%0.301CS..Hα-helixtrans-62.5-40.3173.7-72.9171.9000112.2L134 V137 L164 K166 E170 K172 Y208 L211 V215L134-L168 HydrophobicContact CD2-CD2 3.62Å; V137-L168 HydrophobicContact CB-CD2 4.46Å; V137-L168 HydrophobicContact CG1-CD1 4.03Å; V137-L168 HydrophobicContact CG1-CD2 4.05Å; V137-L168 HydrophobicContact CG1-CG 3.96Å; V137-L168 HydrophobicContact CG2-CD2 4.35Å; V137-L168 HydrophobicContact CG2-CG 4.37Å; L164-L168 PolarHBondContact O-N 3.36Å; K166-L168 VanDerWaalsContact C-N 3.34Å; K166-L168 PolarHBondContact O-N 3.46Å; L168-E170 VanDerWaalsContact C-N 3.32Å; L168-E170 PolarHBondContact O-N 3.46Å; L168-K172 PolarHBondContact O-N 2.98Å; L168-K172 VanDerWaalsContact O-N 3.15Å; L168-Y208 HydrophobicContact CD2-CD2 4.48Å; L168-Y208 WeakPolarHBondContact O-CE2 3.35Å; L168-L211 HydrophobicContact CD1-CB 4.22Å; L168-L211 HydrophobicContact CD2-CB 4.14Å; L168-V215 HydrophobicContact CD1-CB 4.09Å; L168-V215 HydrophobicContact CD1-CG2 3.88Å
169S87.4Confident89.5Confident74 Ų7458.8 Ų58.852%0.51730%0.303SS..Hα-helixtrans-67.3-31.8177.3-169.40000113.2Y165 K166 S167Y165-S169 WeakPolarHBondContact O-CB 3.21Å; Y165-S169 PolarHBondContact O-N 2.67Å; K166-S169 WeakPolarHBondContact O-CB 3.33Å; K166-S169 PolarHBondContact O-N 3.07Å; S167-S169 VanDerWaalsContact C-N 3.35Å; S167-S169 PolarHBondContact O-N 3.48Å
170E89Confident89.6Confident114 Ų11462 Ų6253%0.53331%0.313SS..Hα-helixtrans-73.9-46.1178.5-74.5171.4-18000111.1K166 S167 L168 K172K166-E170 VanDerWaalsContact CE-OE1 3.28Å; K166-E170 WeakPolarHBondContact CE-OE1 3.35Å; K166-E170 WeakPolarHBondContact CG-OE1 3.48Å; K166-E170 IonicContact NZ-OE1 3.66Å; K166-E170 PolarHBondContact NZ-OE1 3.18Å; K166-E170 IonicContact NZ-OE2 2.78Å; K166-E170 WeakPolarHBondContact O-CG 3.49Å; K166-E170 PolarHBondContact O-N 2.78Å; S167-E170 PolarHBondContact O-N 2.97Å; L168-E170 VanDerWaalsContact C-N 3.32Å; L168-E170 PolarHBondContact O-N 3.46Å; E170-K172 VanDerWaalsContact C-N 3.27Å; E170-K172 PolarHBondContact O-N 3.42Å
171V91.2Very high89.7Confident8 Ų860.5 Ų60.55%0.04831%0.308CS..Hα-helixtrans-72.6-16.6179.484.40000113.6I133 L134 S167 S173 E174 V175 Y208I133-V171 HydrophobicContact CB-CG2 4.09Å; I133-V171 HydrophobicContact CD1-CG2 3.78Å; I133-V171 HydrophobicContact CG2-CB 3.98Å; I133-V171 HydrophobicContact CG2-CG1 4.26Å; I133-V171 HydrophobicContact CG2-CG2 3.85Å; L134-V171 HydrophobicContact CD2-CG1 3.99Å; S167-V171 PolarHBondContact O-N 2.88Å; V171-S173 PolarHBondContact O-N 2.87Å; V171-E174 WeakPolarHBondContact O-CB 3.17Å; V171-E174 PolarHBondContact O-N 2.97Å; V171-E174 VanDerWaalsContact O-N 3.11Å; V171-V175 HydrophobicContact CG1-CG2 4.24Å; V171-V175 HydrophobicContact CG2-CG2 4.15Å; V171-V175 PolarHBondContact O-N 3.34Å; V171-Y208 HydrophobicContact CG1-CD2 4.47Å; V171-Y208 HydrophobicContact CG1-CE2 4.41Å
172K91.9Very high89.7Confident90 Ų9060.5 Ų60.539%0.39131%0.308SS..Hα-helixtrans-49.7-51.2-177-179.5-179.5175.1-179.40113.7L168 E170 E174 V175 E176 Y208L168-K172 PolarHBondContact O-N 2.98Å; L168-K172 VanDerWaalsContact O-N 3.15Å; E170-K172 VanDerWaalsContact C-N 3.27Å; E170-K172 PolarHBondContact O-N 3.42Å; K172-E174 PolarHBondContact O-N 3.21Å; K172-V175 PolarHBondContact O-N 2.7Å; K172-E176 WeakPolarHBondContact CE-OE1 3.07Å; K172-E176 IonicContact NZ-OE1 3.87Å; K172-E176 WeakPolarHBondContact O-CB 3.37Å; K172-E176 WeakPolarHBondContact O-CG 2.93Å; K172-E176 PolarHBondContact O-N 3.36Å; K172-Y208 HydrophobicContact CB-CE2 4.03Å; K172-Y208 WeakPolarHBondContact CB-OH 2.93Å; K172-Y208 WeakPolarHBondContact CD-OH 3.23Å; K172-Y208 HydrophobicContact CG-CE2 4.37Å; K172-Y208 WeakPolarHBondContact CG-OH 3.18Å
173S89.1Confident89.7Confident84 Ų8462.8 Ų62.859%0.58731%0.31SS*.Hα-helixtrans-65.8-31.6-175.565.60000112.4V171 M177V171-S173 PolarHBondContact O-N 2.87Å; S173-M177 WeakPolarHBondContact O-CB 3.38Å; S173-M177 PolarHBondContact O-N 3.37Å
174E89.9Confident89.6Confident54 Ų5462.7 Ų62.725%0.25231%0.306SS..Hα-helixtrans-73-47.2177.2-172.656.1-152.200110.9R126 V171 K172 E176 M177 V178R126-E174 IonicContact CZ-OE1 3.99Å; R126-E174 IonicContact CZ-OE2 2.58Å; R126-E174 IonicContact NE-OE1 3.96Å; R126-E174 PolarHBondContact NE-OE1 3.4Å; R126-E174 IonicContact NE-OE2 3.94Å; R126-E174 IonicContact NH2-OE1 2.75Å; R126-E174 PolarHBondContact NH2-OE1 3.05Å; R126-E174 IonicContact NH2-OE2 3.97Å; R126-E174 PolarHBondContact NH2-OE2 3.48Å; V171-E174 WeakPolarHBondContact O-CB 3.17Å; V171-E174 PolarHBondContact O-N 2.97Å; V171-E174 VanDerWaalsContact O-N 3.11Å; K172-E174 PolarHBondContact O-N 3.21Å; E174-E176 PolarHBondContact O-N 2.66Å; E174-M177 PolarHBondContact O-N 2.94Å; E174-M177 VanDerWaalsContact O-N 3.15Å; E174-V178 WeakPolarHBondContact O-CG2 3.3Å; E174-V178 PolarHBondContact O-N 3.36Å
175V92.8Very high89.4Confident3 Ų362.3 Ų62.32%0.01830%0.304CS..Hα-helixtrans-57.4-46173.51690000111.2L134 V171 K172 M177 V178 I179 L204 Y208L134-V175 HydrophobicContact CD1-CG2 4.35Å; V171-V175 HydrophobicContact CG1-CG2 4.24Å; V171-V175 HydrophobicContact CG2-CG2 4.15Å; V171-V175 PolarHBondContact O-N 3.34Å; K172-V175 PolarHBondContact O-N 2.7Å; V175-M177 VanDerWaalsContact C-N 3.35Å; V175-M177 PolarHBondContact O-N 3.12Å; V175-V178 PolarHBondContact O-N 2.8Å; V175-I179 HydrophobicContact CG1-CD1 3.63Å; V175-I179 HydrophobicContact CG1-CG1 4.43Å; V175-I179 WeakPolarHBondContact O-CB 3.5Å; V175-I179 WeakPolarHBondContact O-CD1 3.48Å; V175-I179 WeakPolarHBondContact O-CG1 3.44Å; V175-I179 PolarHBondContact O-N 3Å; V175-L204 HydrophobicContact CG1-CD2 4.08Å; V175-L204 HydrophobicContact CG1-CG 4.3Å; V175-L204 HydrophobicContact CG2-CD2 4.46Å; V175-Y208 HydrophobicContact CG1-CD2 4.37Å; V175-Y208 HydrophobicContact CG1-CG 4.24Å; V175-Y208 HydrophobicContact CG2-CD2 4.37Å
176E91.2Very high89.3Confident106 Ų10658.8 Ų58.850%0.49529%0.294SS..Hα-helixtrans-62-40.2176.4-75178.7176.100112.3K172 E174 K180K172-E176 WeakPolarHBondContact CE-OE1 3.07Å; K172-E176 IonicContact NZ-OE1 3.87Å; K172-E176 WeakPolarHBondContact O-CB 3.37Å; K172-E176 WeakPolarHBondContact O-CG 2.93Å; K172-E176 PolarHBondContact O-N 3.36Å; E174-E176 PolarHBondContact O-N 2.66Å; E176-K180 WeakPolarHBondContact O-CB 3.37Å; E176-K180 PolarHBondContact O-N 3.41Å
177M88.5Confident89.1Confident89 Ų8961 Ų6144%0.43831%0.306SS..Hα-helixtrans-66.8-43.9176.7-172.562.971.500112.1S173 E174 V175 K180 T181S173-M177 WeakPolarHBondContact O-CB 3.38Å; S173-M177 PolarHBondContact O-N 3.37Å; E174-M177 PolarHBondContact O-N 2.94Å; E174-M177 VanDerWaalsContact O-N 3.15Å; V175-M177 VanDerWaalsContact C-N 3.35Å; V175-M177 PolarHBondContact O-N 3.12Å; M177-K180 PolarHBondContact O-N 3.38Å; M177-T181 VanDerWaalsContact O-CB 3.31Å; M177-T181 WeakPolarHBondContact O-CB 3.27Å; M177-T181 PolarHBondContact O-N 3.45Å; M177-T181 PolarHBondContact O-OG1 2.93Å
178V92.3Very high88.9Confident2 Ų264.3 Ų64.31%0.01232%0.315CS..Hα-helixtrans-61.6-46.7175.3167.60000110.5F123 R126 L127 E174 V175 K180 T181 G182 L204F123-V178 HydrophobicContact CE2-CG1 4.13Å; F123-V178 WeakPolarHBondContact CE2-O 3.25Å; F123-V178 HydrophobicContact CZ-CG1 4.35Å; R126-V178 HydrophobicContact CB-CG2 3.96Å; L127-V178 HydrophobicContact CB-CG1 3.91Å; L127-V178 HydrophobicContact CD1-CG1 3.65Å; L127-V178 HydrophobicContact CG-CG1 4.34Å; E174-V178 WeakPolarHBondContact O-CG2 3.3Å; E174-V178 PolarHBondContact O-N 3.36Å; V175-V178 PolarHBondContact O-N 2.8Å; V178-K180 VanDerWaalsContact C-N 3.34Å; V178-K180 PolarHBondContact O-N 3.26Å; V178-T181 PolarHBondContact O-N 3.15Å; V178-G182 PolarHBondContact O-N 2.9Å; V178-L204 HydrophobicContact CB-CD2 4.46Å; V178-L204 HydrophobicContact CG1-CD2 3.94Å
179I91.3Very high88.3Confident24 Ų2471.9 Ų71.912%0.12335%0.347CS..Hα-helixtrans-58.7-46.7177.2-70161.8000111V175 R183 V201 L204 K205V175-I179 HydrophobicContact CG1-CD1 3.63Å; V175-I179 HydrophobicContact CG1-CG1 4.43Å; V175-I179 WeakPolarHBondContact O-CB 3.5Å; V175-I179 WeakPolarHBondContact O-CD1 3.48Å; V175-I179 WeakPolarHBondContact O-CG1 3.44Å; V175-I179 PolarHBondContact O-N 3Å; I179-R183 WeakPolarHBondContact O-CB 3.26Å; I179-R183 WeakPolarHBondContact O-CG 3.4Å; I179-R183 PolarHBondContact O-N 3.24Å; I179-R183 VanDerWaalsContact O-N 3.11Å; I179-V201 HydrophobicContact CB-CG1 4.04Å; I179-V201 HydrophobicContact CG1-CG1 4.06Å; I179-V201 HydrophobicContact CG2-CG1 3.81Å; I179-L204 HydrophobicContact CG1-CD2 4.45Å; I179-K205 HydrophobicContact CD1-CB 3.71Å; I179-K205 HydrophobicContact CD1-CG 4Å; I179-K205 HydrophobicContact CG1-CB 4.45Å
180K90.2Very high87.9Confident151 Ų15169.8 Ų69.866%0.65733%0.329SS*.Hα-helixtrans-64.3-44.4179.8-174.5179.1179.4-177.80112E176 M177 V178 Q184E176-K180 WeakPolarHBondContact O-CB 3.37Å; E176-K180 PolarHBondContact O-N 3.41Å; M177-K180 PolarHBondContact O-N 3.38Å; V178-K180 VanDerWaalsContact C-N 3.34Å; V178-K180 PolarHBondContact O-N 3.26Å; K180-Q184 PolarHBondContact O-N 2.93Å; K180-Q184 VanDerWaalsContact O-N 3.1Å
181T88.1Confident87.5Confident30 Ų3065.7 Ų65.718%0.18431%0.312CS..Hα-helixtrans-68.1-44.6-179-53.50000111.1P120 F123 M177 V178 R183 Q184 I185P120-T181 HydrophobicContact CG-CG2 4.46Å; F123-T181 HydrophobicContact CD2-CG2 3.66Å; F123-T181 HydrophobicContact CE2-CG2 4.14Å; M177-T181 VanDerWaalsContact O-CB 3.31Å; M177-T181 WeakPolarHBondContact O-CB 3.27Å; M177-T181 PolarHBondContact O-N 3.45Å; M177-T181 PolarHBondContact O-OG1 2.93Å; V178-T181 PolarHBondContact O-N 3.15Å; T181-R183 PolarHBondContact O-N 3.45Å; T181-Q184 WeakPolarHBondContact O-CB 3.45Å; T181-Q184 PolarHBondContact O-N 3.5Å; T181-Q184 VanDerWaalsContact O-N 3.11Å; T181-I185 HydrophobicContact CG2-CD1 4.21Å; T181-I185 WeakPolarHBondContact O-CG1 3.11Å; T181-I185 PolarHBondContact O-N 3.5Å
182G89.7Confident86.8Confident0 Ų069.7 Ų69.70%033%0.33CS..Hα-helixtrans-60.2-45.9177.600000112.2F123 V178 Q184 I185 V186F123-G182 VanDerWaalsContact CZ-CA 3.46Å; V178-G182 PolarHBondContact O-N 2.9Å; G182-Q184 VanDerWaalsContact C-N 3.29Å; G182-Q184 PolarHBondContact O-N 3.13Å; G182-I185 WeakPolarHBondContact O-CB 3.39Å; G182-I185 PolarHBondContact O-N 2.97Å; G182-V186 WeakPolarHBondContact O-CG2 3.07Å; G182-V186 PolarHBondContact O-N 3.4Å
183R88.9Confident86.3Confident109 Ų10969.7 Ų69.741%0.41134%0.335SS..Hα-helixtrans-61.3-35.5174-75.2176.9172.6-140.9-10.1112.9I179 T181 V186 Q187 D198 V201I179-R183 WeakPolarHBondContact O-CB 3.26Å; I179-R183 WeakPolarHBondContact O-CG 3.4Å; I179-R183 PolarHBondContact O-N 3.24Å; I179-R183 VanDerWaalsContact O-N 3.11Å; T181-R183 PolarHBondContact O-N 3.45Å; R183-V186 PolarHBondContact O-N 3.17Å; R183-Q187 WeakPolarHBondContact O-CB 3.16Å; R183-Q187 PolarHBondContact O-N 2.77Å; R183-D198 IonicContact NE-OD1 3.94Å; R183-V201 HydrophobicContact CG-CG1 4.15Å
184Q86.1Confident86.1Confident92 Ų9268.4 Ų68.443%0.4332%0.324SS..Hα-helixtrans-68.6-38.8176.1-166176.423.500112.5K180 T181 G182 Q187 K188K180-Q184 PolarHBondContact O-N 2.93Å; K180-Q184 VanDerWaalsContact O-N 3.1Å; T181-Q184 WeakPolarHBondContact O-CB 3.45Å; T181-Q184 PolarHBondContact O-N 3.5Å; T181-Q184 VanDerWaalsContact O-N 3.11Å; G182-Q184 VanDerWaalsContact C-N 3.29Å; G182-Q184 PolarHBondContact O-N 3.13Å; Q184-Q187 PolarHBondContact O-N 3.32Å; Q184-K188 HydrophobicContact CG-CD 4.24Å; Q184-K188 WeakPolarHBondContact O-CB 3.41Å; Q184-K188 WeakPolarHBondContact O-CG 3.49Å; Q184-K188 PolarHBondContact O-N 3.07Å
185I86.6Confident85.7Confident3 Ų373.1 Ų73.12%0.01534%0.344CS..Hα-helixtrans-61.4-45.4174.4-67163.3000110.3K119 P120 F123 T181 G182 K189 Q190 T191 L197K119-I185 HydrophobicContact CG-CD1 4.4Å; P120-I185 HydrophobicContact CG-CD1 4.43Å; F123-I185 HydrophobicContact CB-CD1 4.25Å; F123-I185 HydrophobicContact CD1-CD1 3.83Å; F123-I185 HydrophobicContact CD2-CD1 3.87Å; F123-I185 HydrophobicContact CE1-CD1 4.22Å; F123-I185 HydrophobicContact CE2-CD1 4.24Å; F123-I185 HydrophobicContact CG-CD1 3.66Å; F123-I185 HydrophobicContact CZ-CD1 4.41Å; T181-I185 HydrophobicContact CG2-CD1 4.21Å; T181-I185 WeakPolarHBondContact O-CG1 3.11Å; T181-I185 PolarHBondContact O-N 3.5Å; G182-I185 WeakPolarHBondContact O-CB 3.39Å; G182-I185 PolarHBondContact O-N 2.97Å; I185-K189 PolarHBondContact O-N 3.1Å; I185-Q190 HydrophobicContact CG2-CB 4.04Å; I185-Q190 PolarHBondContact O-N 2.99Å; I185-T191 HydrophobicContact CG2-CG2 4.08Å; I185-L197 HydrophobicContact CB-CD2 3.97Å; I185-L197 HydrophobicContact CG2-CD2 3.6Å
186V85.5Confident85.4Confident32 Ų3277 Ų7719%0.19436%0.362CS..Hα-helixtrans-60.7-51.4175.3173.50000110.9G182 R183 K188 K189 P194 L197 D198G182-V186 WeakPolarHBondContact O-CG2 3.07Å; G182-V186 PolarHBondContact O-N 3.4Å; R183-V186 PolarHBondContact O-N 3.17Å; V186-K188 VanDerWaalsContact C-N 3.3Å; V186-K188 PolarHBondContact O-N 3.14Å; V186-K189 PolarHBondContact O-N 2.66Å; V186-P194 HydrophobicContact CG1-CB 4Å; V186-P194 WeakPolarHBondContact CG2-O 3.48Å; V186-L197 HydrophobicContact CG2-CB 3.9Å; V186-L197 HydrophobicContact CG2-CD2 3.8Å; V186-L197 HydrophobicContact CG2-CG 3.78Å; V186-D198 HydrophobicContact CG2-CB 4.33Å
187Q85.3Confident85.2Confident164 Ų16472.2 Ų72.277%0.76634%0.34SS*.Hα-helixtrans-61-36.9-178-170.6-17919.100112.9R183 Q184 K189R183-Q187 WeakPolarHBondContact O-CB 3.16Å; R183-Q187 PolarHBondContact O-N 2.77Å; Q184-Q187 PolarHBondContact O-N 3.32Å; Q187-K189 VanDerWaalsContact C-N 3.31Å
188K81.4Confident85.2Confident116 Ų11670.8 Ų70.850%0.50433%0.334SS..THydrogen-bonded Turntrans-830.3177.7-70.3-178.6174.3179.10114.2Q184 V186 Q190Q184-K188 HydrophobicContact CG-CD 4.24Å; Q184-K188 WeakPolarHBondContact O-CB 3.41Å; Q184-K188 WeakPolarHBondContact O-CG 3.49Å; Q184-K188 PolarHBondContact O-N 3.07Å; V186-K188 VanDerWaalsContact C-N 3.3Å; V186-K188 PolarHBondContact O-N 3.14Å; K188-Q190 HydrophobicContact CB-CG 3.71Å; K188-Q190 PolarHBondContact O-N 3.02Å
189K77.4Confident85.1Confident165 Ų16575.2 Ų75.272%0.71735%0.354SS*.THydrogen-bonded Turntrans55.635.2-174.3-56.2-176.3178.7-177.80113.6I185 V186 Q187 T191I185-K189 PolarHBondContact O-N 3.1Å; V186-K189 PolarHBondContact O-N 2.66Å; Q187-K189 VanDerWaalsContact C-N 3.31Å; K189-T191 PolarHBondContact O-N 3.25Å
190Q80Confident85.1Confident29 Ų2977.9 Ų77.914%0.13636%0.363CS..  trans-87.821.8-179.9-67175.6-4200112.8Q118 I185 K188Q118-Q190 HydrophobicContact CB-CG 4.11Å; I185-Q190 HydrophobicContact CG2-CB 4.04Å; I185-Q190 PolarHBondContact O-N 2.99Å; K188-Q190 HydrophobicContact CB-CG 3.71Å; K188-Q190 PolarHBondContact O-N 3.02Å
191T80.8Confident85.1Confident29 Ų2970.7 Ų70.718%0.17833%0.332CS..SBendtrans-144.7152.2178.6-179.40000109.4I185 K189 N193 P194 L197I185-T191 HydrophobicContact CG2-CG2 4.08Å; K189-T191 PolarHBondContact O-N 3.25Å; T191-N193 PolarHBondContact OG1-N 3.44Å; T191-P194 HydrophobicContact CG2-CB 4.09Å; T191-L197 HydrophobicContact CG2-CD2 4.07Å
192E76.1Confident85.2Confident91 Ų9171.5 Ų71.543%0.42534%0.337SS..SBendtrans-77.9-35.6177.5-65177.7-167.100111.5M112 P194M112-E192 HydrophobicContact CE-CG 4.4Å; M112-E192 WeakPolarHBondContact CE-OE1 3.4Å; M112-E192 VanDerWaalsContact CE-OE2 3.27Å; M112-E192 WeakPolarHBondContact CE-OE2 3.15Å; E192-P194 VanDerWaalsContact C-CD 3.48Å; E192-P194 WeakPolarHBondContact O-CD 3.5Å
193N82.2Confident85.3Confident91 Ų9174.1 Ų74.149%0.48736%0.359SS..  trans-109.983.3174.1-75.5-12.8000111.3T191 E196 L197T191-N193 PolarHBondContact OG1-N 3.44Å; N193-E196 HydrophobicContact CB-CB 3.86Å; N193-E196 WeakPolarHBondContact CB-OE2 3.37Å; N193-E196 PolarHBondContact ND2-OE2 2.97Å; N193-L197 PolarHBondContact O-N 3.44Å
194P83.1Confident85.5Confident56 Ų5669.4 Ų69.436%0.36434%0.341SS..Hα-helixtrans-67.7-32.2177.424.7-32.9000113.4V186 T191 E192 D198V186-P194 HydrophobicContact CG1-CB 4Å; V186-P194 WeakPolarHBondContact CG2-O 3.48Å; T191-P194 HydrophobicContact CG2-CB 4.09Å; E192-P194 VanDerWaalsContact C-CD 3.48Å; E192-P194 WeakPolarHBondContact O-CD 3.5Å; P194-D198 PolarHBondContact O-N 3.37Å
195K82.5Confident85.8Confident154 Ų15469.6 Ų69.667%0.6734%0.341SS*.Hα-helixtrans-68.9-52.2-179.4-165.3-174.6-176.2-101.80111.7L197 D198 E199K195-L197 VanDerWaalsContact C-N 3.27Å; K195-L197 PolarHBondContact O-N 3.48Å; K195-D198 PolarHBondContact O-N 3.04Å; K195-D198 VanDerWaalsContact O-N 3.16Å; K195-E199 VanDerWaalsContact CE-OE1 3.31Å; K195-E199 WeakPolarHBondContact CE-OE1 3.42Å; K195-E199 WeakPolarHBondContact CG-OE1 3.49Å; K195-E199 IonicContact NZ-OE1 3.65Å; K195-E199 PolarHBondContact NZ-OE1 3.26Å; K195-E199 WeakPolarHBondContact O-CG 3.46Å; K195-E199 PolarHBondContact O-N 2.78Å
196E86.9Confident86Confident83 Ų8374.8 Ų74.839%0.38837%0.368SS..Hα-helixtrans-55.6-41.4177.5-169.6-155.1138.400111.9N193 E199 R200N193-E196 HydrophobicContact CB-CB 3.86Å; N193-E196 WeakPolarHBondContact CB-OE2 3.37Å; N193-E196 PolarHBondContact ND2-OE2 2.97Å; E196-E199 PolarHBondContact O-N 3.24Å; E196-R200 WeakPolarHBondContact O-CB 3.5Å; E196-R200 VanDerWaalsContact O-CG 3.29Å; E196-R200 WeakPolarHBondContact O-CG 3.42Å; E196-R200 PolarHBondContact O-N 2.95Å; E196-R200 IonicContact OE1-NH1 2.68Å
197L86.7Confident86.2Confident7 Ų774.5 Ų74.54%0.03736%0.364CS..Hα-helixtrans-67.8-40.7178.9179.156.3000112.5F123 L127 I185 V186 T191 N193 K195 V201F123-L197 HydrophobicContact CE1-CD1 3.58Å; F123-L197 HydrophobicContact CZ-CD1 3.94Å; L127-L197 HydrophobicContact CD2-CD1 4.42Å; I185-L197 HydrophobicContact CB-CD2 3.97Å; I185-L197 HydrophobicContact CG2-CD2 3.6Å; V186-L197 HydrophobicContact CG2-CB 3.9Å; V186-L197 HydrophobicContact CG2-CD2 3.8Å; V186-L197 HydrophobicContact CG2-CG 3.78Å; T191-L197 HydrophobicContact CG2-CD2 4.07Å; N193-L197 PolarHBondContact O-N 3.44Å; K195-L197 VanDerWaalsContact C-N 3.27Å; K195-L197 PolarHBondContact O-N 3.48Å; L197-V201 HydrophobicContact CD1-CG2 4.19Å; L197-V201 WeakPolarHBondContact O-CB 3.49Å; L197-V201 VanDerWaalsContact O-CG2 3.25Å; L197-V201 WeakPolarHBondContact O-CG2 3.44Å; L197-V201 PolarHBondContact O-N 3.46Å
198D87.7Confident86.6Confident58 Ų5868.6 Ų68.631%0.3134%0.335SS..Hα-helixtrans-69.7-35.1176.3-16659.5000112.2R183 V186 P194 K195 T202R183-D198 IonicContact NE-OD1 3.94Å; V186-D198 HydrophobicContact CG2-CB 4.33Å; P194-D198 PolarHBondContact O-N 3.37Å; K195-D198 PolarHBondContact O-N 3.04Å; K195-D198 VanDerWaalsContact O-N 3.16Å; D198-T202 VanDerWaalsContact O-CB 3.24Å; D198-T202 WeakPolarHBondContact O-CB 3.32Å; D198-T202 PolarHBondContact O-N 3.48Å; D198-T202 PolarHBondContact O-OG1 3.17Å
199E89.8Confident87.1Confident96 Ų9667 Ų6745%0.44933%0.333SS..Hα-helixtrans-61.9-49.9172.3-73.6167.4177.800111K195 E196 V201 T202 A203K195-E199 VanDerWaalsContact CE-OE1 3.31Å; K195-E199 WeakPolarHBondContact CE-OE1 3.42Å; K195-E199 WeakPolarHBondContact CG-OE1 3.49Å; K195-E199 IonicContact NZ-OE1 3.65Å; K195-E199 PolarHBondContact NZ-OE1 3.26Å; K195-E199 WeakPolarHBondContact O-CG 3.46Å; K195-E199 PolarHBondContact O-N 2.78Å; E196-E199 PolarHBondContact O-N 3.24Å; E199-V201 PolarHBondContact O-N 2.95Å; E199-T202 PolarHBondContact O-N 2.84Å; E199-A203 WeakPolarHBondContact O-CB 3.29Å; E199-A203 PolarHBondContact O-N 2.75Å
200R91.5Very high87.7Confident79 Ų7963 Ų6330%0.29832%0.316SS..Hα-helixtrans-61.7-40.5177.2-72.7174.464.6-158.8-6.7112.8E124 E196 L204E124-R200 IonicContact OE1-CZ 3.54Å; E124-R200 IonicContact OE1-NH1 3.16Å; E124-R200 PolarHBondContact OE1-NH1 2.76Å; E124-R200 IonicContact OE1-NH2 2.8Å; E124-R200 PolarHBondContact OE1-NH2 3.26Å; E196-R200 WeakPolarHBondContact O-CB 3.5Å; E196-R200 VanDerWaalsContact O-CG 3.29Å; E196-R200 WeakPolarHBondContact O-CG 3.42Å; E196-R200 PolarHBondContact O-N 2.95Å; E196-R200 IonicContact OE1-NH1 2.68Å; R200-L204 PolarHBondContact O-N 3.44Å; R200-L204 VanDerWaalsContact O-N 3.09Å
201V91.5Very high88.3Confident0 Ų061.8 Ų61.80%031%0.311CS..Hα-helixtrans-65.8-39.7175162.70000111.8I179 R183 L197 E199 K205I179-V201 HydrophobicContact CB-CG1 4.04Å; I179-V201 HydrophobicContact CG1-CG1 4.06Å; I179-V201 HydrophobicContact CG2-CG1 3.81Å; R183-V201 HydrophobicContact CG-CG1 4.15Å; L197-V201 HydrophobicContact CD1-CG2 4.19Å; L197-V201 WeakPolarHBondContact O-CB 3.49Å; L197-V201 VanDerWaalsContact O-CG2 3.25Å; L197-V201 WeakPolarHBondContact O-CG2 3.44Å; L197-V201 PolarHBondContact O-N 3.46Å; E199-V201 PolarHBondContact O-N 2.95Å; V201-K205 PolarHBondContact O-N 3.07Å
202T90.3Very high88.6Confident47 Ų4761.3 Ų61.329%0.28831%0.311SS..Hα-helixtrans-71.7-38.5178.7-62.60000111.4D198 E199 K205 L206D198-T202 VanDerWaalsContact O-CB 3.24Å; D198-T202 WeakPolarHBondContact O-CB 3.32Å; D198-T202 PolarHBondContact O-N 3.48Å; D198-T202 PolarHBondContact O-OG1 3.17Å; E199-T202 PolarHBondContact O-N 2.84Å; T202-K205 WeakPolarHBondContact O-CB 3.27Å; T202-K205 PolarHBondContact O-N 3.45Å; T202-L206 HydrophobicContact CG2-CD1 4.31Å; T202-L206 WeakPolarHBondContact O-CG 3.4Å; T202-L206 PolarHBondContact O-N 2.83Å
203A90.8Very high89.2Confident56 Ų5659.9 Ų59.946%0.46332%0.315SS..Hα-helixtrans-60.5-44.2172.500000112.2E199 K205 L206 H207E199-A203 WeakPolarHBondContact O-CB 3.29Å; E199-A203 PolarHBondContact O-N 2.75Å; A203-K205 VanDerWaalsContact C-N 3.32Å; A203-K205 PolarHBondContact O-N 3.28Å; A203-L206 PolarHBondContact O-N 3.04Å; A203-H207 WeakPolarHBondContact O-CB 3.4Å; A203-H207 PolarHBondContact O-N 3.42Å
204L92.9Very high89.5Confident9 Ų959.7 Ų59.75%0.04731%0.31CS..Hα-helixtrans-58.6-43.4174.7-170.478.1000111.6L127 K131 L134 V175 V178 I179 R200 H207 Y208L127-L204 HydrophobicContact CD1-CD2 3.96Å; K131-L204 HydrophobicContact CB-CD1 4.04Å; L134-L204 HydrophobicContact CD1-CD1 3.81Å; L134-L204 HydrophobicContact CD1-CG 4.35Å; V175-L204 HydrophobicContact CG1-CD2 4.08Å; V175-L204 HydrophobicContact CG1-CG 4.3Å; V175-L204 HydrophobicContact CG2-CD2 4.46Å; V178-L204 HydrophobicContact CB-CD2 4.46Å; V178-L204 HydrophobicContact CG1-CD2 3.94Å; I179-L204 HydrophobicContact CG1-CD2 4.45Å; R200-L204 PolarHBondContact O-N 3.44Å; R200-L204 VanDerWaalsContact O-N 3.09Å; L204-H207 PolarHBondContact O-N 3.42Å; L204-Y208 PolarHBondContact O-N 3.14Å
205K92.4Very high89.9Confident96 Ų9657 Ų5742%0.41729%0.293SS..Hα-helixtrans-63.1-44.1177.6-172-176.8177-173.20112.3I179 V201 T202 A203 N209I179-K205 HydrophobicContact CD1-CB 3.71Å; I179-K205 HydrophobicContact CD1-CG 4Å; I179-K205 HydrophobicContact CG1-CB 4.45Å; V201-K205 PolarHBondContact O-N 3.07Å; T202-K205 WeakPolarHBondContact O-CB 3.27Å; T202-K205 PolarHBondContact O-N 3.45Å; A203-K205 VanDerWaalsContact C-N 3.32Å; A203-K205 PolarHBondContact O-N 3.28Å; K205-N209 WeakPolarHBondContact O-CB 3.44Å; K205-N209 VanDerWaalsContact O-CG 3.28Å; K205-N209 PolarHBondContact O-N 3.05Å; K205-N209 VanDerWaalsContact O-N 3.14Å; K205-N209 PolarHBondContact O-ND2 3.29Å
206L90.8Very high90.1Very high113 Ų11352 Ų5259%0.59228%0.275SS*.Hα-helixtrans-62.9-46177.1-71.2169.7000110.7T202 A203 Y208 N209 E210T202-L206 HydrophobicContact CG2-CD1 4.31Å; T202-L206 WeakPolarHBondContact O-CG 3.4Å; T202-L206 PolarHBondContact O-N 2.83Å; A203-L206 PolarHBondContact O-N 3.04Å; L206-Y208 PolarHBondContact O-N 3.31Å; L206-N209 PolarHBondContact O-N 3.05Å; L206-E210 WeakPolarHBondContact O-CB 3.27Å; L206-E210 PolarHBondContact O-N 2.99Å
207H91.3Very high90Very high25 Ų2552.8 Ų52.812%0.11628%0.279CS..Hα-helixtrans-62.5-45.2-179.2-166.5-155.7000112.5D135 K138 A203 L204 N209 E210 L211D135-H207 IonicContact OD1-CE1 2.87Å; D135-H207 PolarHBondContact OD1-CE1 2.97Å; D135-H207 IonicContact OD1-ND1 3.19Å; K138-H207 VanDerWaalsContact CD-NE2 3.28Å; K138-H207 WeakPolarHBondContact CD-NE2 3.44Å; A203-H207 WeakPolarHBondContact O-CB 3.4Å; A203-H207 PolarHBondContact O-N 3.42Å; L204-H207 PolarHBondContact O-N 3.42Å; H207-N209 PolarHBondContact O-N 3.33Å; H207-E210 PolarHBondContact O-N 3.25Å; H207-L211 WeakPolarHBondContact O-CG 3.43Å; H207-L211 PolarHBondContact O-N 3.31Å; H207-L211 VanDerWaalsContact O-N 3.07Å
208Y93.7Very high90Very high41 Ų4155.6 Ų55.616%0.16129%0.289CS..Hα-helixtrans-58.1-46174.2174-87.9000112L134 L168 V171 K172 V175 L204 L206 G212L134-Y208 HydrophobicContact CD2-CD2 3.97Å; L168-Y208 HydrophobicContact CD2-CD2 4.48Å; L168-Y208 WeakPolarHBondContact O-CE2 3.35Å; V171-Y208 HydrophobicContact CG1-CD2 4.47Å; V171-Y208 HydrophobicContact CG1-CE2 4.41Å; K172-Y208 HydrophobicContact CB-CE2 4.03Å; K172-Y208 WeakPolarHBondContact CB-OH 2.93Å; K172-Y208 WeakPolarHBondContact CD-OH 3.23Å; K172-Y208 HydrophobicContact CG-CE2 4.37Å; K172-Y208 WeakPolarHBondContact CG-OH 3.18Å; V175-Y208 HydrophobicContact CG1-CD2 4.37Å; V175-Y208 HydrophobicContact CG1-CG 4.24Å; V175-Y208 HydrophobicContact CG2-CD2 4.37Å; L204-Y208 PolarHBondContact O-N 3.14Å; L206-Y208 PolarHBondContact O-N 3.31Å; Y208-G212 PolarHBondContact O-N 3.42Å
209N91Very high90Very high83 Ų8355.5 Ų55.544%0.44429%0.286SS..Hα-helixtrans-65.9-41.6-179.3-75.7-12.8000112.4K205 L206 H207 G212 A213K205-N209 WeakPolarHBondContact O-CB 3.44Å; K205-N209 VanDerWaalsContact O-CG 3.28Å; K205-N209 PolarHBondContact O-N 3.05Å; K205-N209 VanDerWaalsContact O-N 3.14Å; K205-N209 PolarHBondContact O-ND2 3.29Å; L206-N209 PolarHBondContact O-N 3.05Å; H207-N209 PolarHBondContact O-N 3.33Å; N209-G212 PolarHBondContact O-N 3.1Å; N209-A213 WeakPolarHBondContact O-CB 3.48Å; N209-A213 PolarHBondContact O-N 3.37Å
210E90.9Very high89.8Confident81 Ų8156.7 Ų56.738%0.37929%0.291SS..Hα-helixtrans-63.2-47.3178.8-169.8-165.4161.800111.4L206 H207 A213 K214L206-E210 WeakPolarHBondContact O-CB 3.27Å; L206-E210 PolarHBondContact O-N 2.99Å; H207-E210 PolarHBondContact O-N 3.25Å; E210-A213 PolarHBondContact O-N 2.9Å; E210-K214 HydrophobicContact CG-CD 4.33Å; E210-K214 WeakPolarHBondContact O-CG 3.35Å; E210-K214 PolarHBondContact O-N 3.1Å; E210-K214 WeakPolarHBondContact OE1-CE 3.22Å; E210-K214 IonicContact OE1-NZ 2.93Å; E210-K214 PolarHBondContact OE1-NZ 2.91Å
211L90.9Very high89.6Confident2 Ų256 Ų561%0.0129%0.291CS..Hα-helixtrans-65.1-41.7176.3-66.1174.1000111.7L134 V137 K138 L141 L168 H207 A213 K214 V215L134-L211 HydrophobicContact CB-CD1 3.9Å; L134-L211 HydrophobicContact CD2-CD1 4.22Å; L134-L211 WeakPolarHBondContact O-CD1 3.46Å; V137-L211 HydrophobicContact CB-CD1 4.42Å; V137-L211 HydrophobicContact CG1-CD1 4.36Å; K138-L211 HydrophobicContact CB-CD1 4.38Å; K138-L211 HydrophobicContact CB-CD2 3.8Å; K138-L211 HydrophobicContact CG-CD2 4.18Å; L141-L211 HydrophobicContact CD1-CD2 3.67Å; L168-L211 HydrophobicContact CD1-CB 4.22Å; L168-L211 HydrophobicContact CD2-CB 4.14Å; H207-L211 WeakPolarHBondContact O-CG 3.43Å; H207-L211 PolarHBondContact O-N 3.31Å; H207-L211 VanDerWaalsContact O-N 3.07Å; L211-A213 VanDerWaalsContact C-N 3.34Å; L211-A213 PolarHBondContact O-N 3.48Å; L211-K214 PolarHBondContact O-N 3.05Å; L211-V215 WeakPolarHBondContact O-CB 3.31Å; L211-V215 WeakPolarHBondContact O-CG2 3.33Å; L211-V215 PolarHBondContact O-N 3Å
212G88.8Confident89.4Confident19 Ų1956 Ų5620%0.19629%0.291CS..Hα-helixtrans-57.6-44.1175.100000112.9Y208 N209 T216Y208-G212 PolarHBondContact O-N 3.42Å; N209-G212 PolarHBondContact O-N 3.1Å; G212-T216 VanDerWaalsContact O-CB 3.27Å; G212-T216 WeakPolarHBondContact O-CB 3.4Å; G212-T216 PolarHBondContact O-N 3.23Å; G212-T216 VanDerWaalsContact O-N 3.17Å; G212-T216 PolarHBondContact O-OG1 3.38Å
213A88.4Confident89.3Confident61 Ų6157.9 Ų57.950%0.50430%0.297SS..Hα-helixtrans-63.4-53.5174.400000111.7N209 E210 L211 V215 T216 E217N209-A213 WeakPolarHBondContact O-CB 3.48Å; N209-A213 PolarHBondContact O-N 3.37Å; E210-A213 PolarHBondContact O-N 2.9Å; L211-A213 VanDerWaalsContact C-N 3.34Å; L211-A213 PolarHBondContact O-N 3.48Å; A213-V215 PolarHBondContact O-N 3.41Å; A213-T216 PolarHBondContact O-N 3.43Å; A213-E217 PolarHBondContact O-N 3.31Å
214K88.4Confident89.1Confident87 Ų8760.7 Ų60.738%0.37830%0.299SS..Hα-helixtrans-60-45.5-177-73.3178.3178.4179.10112.9L141 E210 L211 E217 R218L141-K214 HydrophobicContact CD1-CB 4.04Å; L141-K214 HydrophobicContact CD2-CB 4.23Å; E210-K214 HydrophobicContact CG-CD 4.33Å; E210-K214 WeakPolarHBondContact O-CG 3.35Å; E210-K214 PolarHBondContact O-N 3.1Å; E210-K214 WeakPolarHBondContact OE1-CE 3.22Å; E210-K214 IonicContact OE1-NZ 2.93Å; E210-K214 PolarHBondContact OE1-NZ 2.91Å; L211-K214 PolarHBondContact O-N 3.05Å; K214-E217 PolarHBondContact O-N 3.25Å; K214-R218 WeakPolarHBondContact O-CG 3.31Å; K214-R218 PolarHBondContact O-N 3.17Å
215V90.4Very high88.9Confident0 Ų060.3 Ų60.30%030%0.297CS..Hα-helixtrans-66.7-38.7178.2175.20000111.1V137 L141 C161 L164 Y165 L168 L211 A213 K219V137-V215 HydrophobicContact CG1-CG2 4.4Å; L141-V215 HydrophobicContact CD1-CG2 3.99Å; L141-V215 HydrophobicContact CG-CG2 4.44Å; C161-V215 PolarHBondContact SG-O 3.39Å; L164-V215 HydrophobicContact CB-CG1 4.2Å; L164-V215 HydrophobicContact CB-CG2 4.34Å; Y165-V215 HydrophobicContact CD2-CG1 4.33Å; L168-V215 HydrophobicContact CD1-CB 4.09Å; L168-V215 HydrophobicContact CD1-CG2 3.88Å; L211-V215 WeakPolarHBondContact O-CB 3.31Å; L211-V215 WeakPolarHBondContact O-CG2 3.33Å; L211-V215 PolarHBondContact O-N 3Å; A213-V215 PolarHBondContact O-N 3.41Å; V215-K219 WeakPolarHBondContact O-CB 3.44Å; V215-K219 PolarHBondContact O-N 3.41Å
216T86.8Confident88.7Confident48 Ų4856.1 Ų56.129%0.29428%0.279SS..Hα-helixtrans-65.4-42.8177.1-57.80000111.9G212 A213 K219 Q220G212-T216 VanDerWaalsContact O-CB 3.27Å; G212-T216 WeakPolarHBondContact O-CB 3.4Å; G212-T216 PolarHBondContact O-N 3.23Å; G212-T216 VanDerWaalsContact O-N 3.17Å; G212-T216 PolarHBondContact O-OG1 3.38Å; A213-T216 PolarHBondContact O-N 3.43Å; T216-K219 PolarHBondContact O-N 2.93Å; T216-Q220 WeakPolarHBondContact O-CG 3.41Å; T216-Q220 PolarHBondContact O-N 3.29Å; T216-Q220 VanDerWaalsContact O-N 3.15Å
217E85.7Confident88.5Confident101 Ų10158.6 Ų58.647%0.47229%0.285SS..Hα-helixtrans-62.2-50.4176.3-172.4-168.8179.200111.5A213 K214 K219 Q220 Q221A213-E217 PolarHBondContact O-N 3.31Å; K214-E217 PolarHBondContact O-N 3.25Å; E217-K219 VanDerWaalsContact C-N 3.28Å; E217-K219 PolarHBondContact O-N 2.69Å; E217-Q220 PolarHBondContact O-N 3.06Å; E217-Q220 VanDerWaalsContact O-N 3.11Å; E217-Q221 WeakPolarHBondContact O-CG 3.47Å; E217-Q221 PolarHBondContact O-N 3.46Å; E217-Q221 PolarHBondContact OE1-NE2 3.05Å
218R85.9Confident88.4Confident65 Ų6558.7 Ų58.725%0.24529%0.286CS..Hα-helixtrans-61.5-35.8178.7-67.3-56.4-175.9117.2-0.1112.3K214 Q221 L222K214-R218 WeakPolarHBondContact O-CG 3.31Å; K214-R218 PolarHBondContact O-N 3.17Å; R218-Q221 PolarHBondContact O-N 3.28Å; R218-L222 WeakPolarHBondContact O-CB 3.5Å; R218-L222 VanDerWaalsContact O-CG 3.31Å; R218-L222 WeakPolarHBondContact O-CG 3.34Å; R218-L222 PolarHBondContact O-N 3.16Å
219K88Confident88.1Confident56 Ų5657 Ų5724%0.24328%0.28CS..Hα-helixtrans-58.8-50.7171.8-175.9-174.6165.4-173.50111.5L158 C161 V215 T216 E217 Q221 L222 E223L158-K219 HydrophobicContact CD1-CG 4.06Å; C161-K219 PolarHBondContact SG-N 3.38Å; V215-K219 WeakPolarHBondContact O-CB 3.44Å; V215-K219 PolarHBondContact O-N 3.41Å; T216-K219 PolarHBondContact O-N 2.93Å; E217-K219 VanDerWaalsContact C-N 3.28Å; E217-K219 PolarHBondContact O-N 2.69Å; K219-Q221 VanDerWaalsContact C-N 3.34Å; K219-Q221 PolarHBondContact O-N 3.01Å; K219-L222 PolarHBondContact O-N 2.91Å; K219-E223 WeakPolarHBondContact CE-OE1 3.44Å; K219-E223 IonicContact NZ-OE1 3.9Å; K219-E223 WeakPolarHBondContact O-CB 3.26Å; K219-E223 WeakPolarHBondContact O-CG 3.48Å; K219-E223 PolarHBondContact O-N 2.84Å
220Q86.5Confident87.9Confident122 Ų12257.4 Ų57.457%0.5728%0.276SS*.Hα-helixtrans-62.3-40.2179.9-69.1176.17.700112.3T216 E217 K224T216-Q220 WeakPolarHBondContact O-CG 3.41Å; T216-Q220 PolarHBondContact O-N 3.29Å; T216-Q220 VanDerWaalsContact O-N 3.15Å; E217-Q220 PolarHBondContact O-N 3.06Å; E217-Q220 VanDerWaalsContact O-N 3.11Å; Q220-K224 WeakPolarHBondContact O-CB 3.42Å; Q220-K224 PolarHBondContact O-N 2.86Å
221Q86Confident87.7Confident63 Ų6357.7 Ų57.729%0.29428%0.275SS..Hα-helixtrans-62.4-47.1175.7-70.1173.3-0.700111.6E217 R218 K219 K224 C225E217-Q221 WeakPolarHBondContact O-CG 3.47Å; E217-Q221 PolarHBondContact O-N 3.46Å; E217-Q221 PolarHBondContact OE1-NE2 3.05Å; R218-Q221 PolarHBondContact O-N 3.28Å; K219-Q221 VanDerWaalsContact C-N 3.34Å; K219-Q221 PolarHBondContact O-N 3.01Å; Q221-K224 PolarHBondContact O-N 3.28Å; Q221-C225 VanDerWaalsContact O-CB 3.29Å; Q221-C225 WeakPolarHBondContact O-CB 3.13Å; Q221-C225 PolarHBondContact O-N 3.25Å
222L87.8Confident87.6Confident1 Ų157.9 Ų57.91%0.00528%0.277CS..Hα-helixtrans-66-39.3178.2-72.1167.6000112.6T146 V154 Q157 L158 C161 R218 K219 C225 L226T146-L222 HydrophobicContact CG2-CD2 4.22Å; V154-L222 HydrophobicContact CG1-CD2 4.18Å; Q157-L222 HydrophobicContact CB-CD1 4.24Å; Q157-L222 HydrophobicContact CB-CD2 4.08Å; L158-L222 HydrophobicContact CB-CB 4.25Å; L158-L222 HydrophobicContact CD1-CB 4.06Å; C161-L222 HydrophobicContact CB-CD1 4.05Å; R218-L222 WeakPolarHBondContact O-CB 3.5Å; R218-L222 VanDerWaalsContact O-CG 3.31Å; R218-L222 WeakPolarHBondContact O-CG 3.34Å; R218-L222 PolarHBondContact O-N 3.16Å; K219-L222 PolarHBondContact O-N 2.91Å; L222-C225 PolarHBondContact O-N 3.4Å; L222-L226 VanDerWaalsContact O-CB 3.27Å; L222-L226 WeakPolarHBondContact O-CB 3.42Å; L222-L226 PolarHBondContact O-N 3.34Å
223E87.4Confident87.4Confident86 Ų8660.7 Ų60.740%0.40228%0.281SS..Hα-helixtrans-62.1-43.5173.7-74.6175.216600111.9L158 K219 K227L158-E223 HydrophobicContact CD1-CG 3.77Å; L158-E223 HydrophobicContact CD2-CG 3.9Å; K219-E223 WeakPolarHBondContact CE-OE1 3.44Å; K219-E223 IonicContact NZ-OE1 3.9Å; K219-E223 WeakPolarHBondContact O-CB 3.26Å; K219-E223 WeakPolarHBondContact O-CG 3.48Å; K219-E223 PolarHBondContact O-N 2.84Å; E223-K227 WeakPolarHBondContact O-CB 3.35Å; E223-K227 PolarHBondContact O-N 2.59Å; E223-K227 VanDerWaalsContact O-N 3.1Å
224K88.1Confident87.3Confident116 Ų11665.3 Ų65.350%0.50429%0.29SS..Hα-helixtrans-65.9-45.3176.4-170.5-178.1172.6-164.20111.4Q220 Q221 K227 L228 V297Q220-K224 WeakPolarHBondContact O-CB 3.42Å; Q220-K224 PolarHBondContact O-N 2.86Å; Q221-K224 PolarHBondContact O-N 3.28Å; K224-K227 PolarHBondContact O-N 2.94Å; K224-L228 HydrophobicContact CG-CD1 4.09Å; K224-L228 WeakPolarHBondContact O-CG 3.49Å; K224-L228 PolarHBondContact O-N 2.87Å; K224-L228 VanDerWaalsContact O-N 3.08Å; K224-V297 HydrophobicContact CD-CG2 3.6Å; K224-V297 VanDerWaalsContact CE-CG2 3.47Å; K224-V297 HydrophobicContact CG-CG2 4.01Å
225C87.6Confident87.2Confident1 Ų163.2 Ų63.21%0.00728%0.282CS..Hα-helixtrans-58.2-49.6176.6-174.50000111.5V154 Q221 L222 K227 L228 S229 V297V154-C225 HydrophobicContact CG1-CB 4.26Å; Q221-C225 VanDerWaalsContact O-CB 3.29Å; Q221-C225 WeakPolarHBondContact O-CB 3.13Å; Q221-C225 PolarHBondContact O-N 3.25Å; L222-C225 PolarHBondContact O-N 3.4Å; C225-K227 VanDerWaalsContact C-N 3.34Å; C225-K227 PolarHBondContact O-N 3.24Å; C225-L228 PolarHBondContact O-N 3.47Å; C225-S229 WeakPolarHBondContact O-CB 3.32Å; C225-S229 PolarHBondContact O-N 2.88Å; C225-V297 HydrophobicContact CB-CG1 3.81Å
226L87.7Confident87.1Confident8 Ų864.7 Ų64.74%0.04229%0.289CS..Hα-helixtrans-60.8-40.6178.8-177.663.4000112.6Q151 V154 Q155 L158 L222 R230Q151-L226 HydrophobicContact CG-CD1 3.99Å; V154-L226 HydrophobicContact CB-CD1 4.31Å; V154-L226 HydrophobicContact CG1-CB 3.86Å; V154-L226 HydrophobicContact CG1-CD1 4.36Å; Q155-L226 HydrophobicContact CB-CD1 4.41Å; L158-L226 HydrophobicContact CD2-CD2 3.87Å; L222-L226 VanDerWaalsContact O-CB 3.27Å; L222-L226 WeakPolarHBondContact O-CB 3.42Å; L222-L226 PolarHBondContact O-N 3.34Å; L226-R230 WeakPolarHBondContact O-CB 3.43Å; L226-R230 VanDerWaalsContact O-CG 3.31Å; L226-R230 WeakPolarHBondContact O-CG 3.17Å; L226-R230 PolarHBondContact O-N 2.61Å; L226-R230 VanDerWaalsContact O-N 3.08Å
227K88.2Confident87.1Confident164 Ų16466.2 Ų66.271%0.71330%0.295SS*.Hα-helixtrans-64.6-43.3177.8-173.5-178.9178.8-178.60111.8E223 K224 C225 K231E223-K227 WeakPolarHBondContact O-CB 3.35Å; E223-K227 PolarHBondContact O-N 2.59Å; E223-K227 VanDerWaalsContact O-N 3.1Å; K224-K227 PolarHBondContact O-N 2.94Å; C225-K227 VanDerWaalsContact C-N 3.34Å; C225-K227 PolarHBondContact O-N 3.24Å; K227-K231 PolarHBondContact O-N 3.39Å
228L88.7Confident87.2Confident28 Ų2865.2 Ų65.215%0.14730%0.296CS..Hα-helixtrans-71.8-45.7179.9-72168.9000112K224 C225 R230 K231 M232 V290 A293 L294 V297K224-L228 HydrophobicContact CG-CD1 4.09Å; K224-L228 WeakPolarHBondContact O-CG 3.49Å; K224-L228 PolarHBondContact O-N 2.87Å; K224-L228 VanDerWaalsContact O-N 3.08Å; C225-L228 PolarHBondContact O-N 3.47Å; L228-R230 VanDerWaalsContact C-N 3.32Å; L228-R230 PolarHBondContact O-N 3.06Å; L228-K231 PolarHBondContact O-N 2.82Å; L228-M232 PolarHBondContact O-N 3.25Å; L228-V290 HydrophobicContact CD2-CG1 4.25Å; L228-A293 HydrophobicContact CD1-CB 4.26Å; L228-A293 WeakPolarHBondContact CD1-O 3.5Å; L228-A293 HydrophobicContact CD2-CB 4.06Å; L228-L294 HydrophobicContact CB-CB 4.3Å; L228-L294 HydrophobicContact CB-CD1 3.91Å; L228-V297 HydrophobicContact CD1-CG2 4.05Å
229S86.2Confident87.4Confident5 Ų562.1 Ų62.14%0.03528%0.284CS..Hα-helixtrans-54.5-45.9173.4166.50000111.9V149 C225 K231 M232 R233V149-S229 WeakPolarHBondContact O-CB 3.31Å; V149-S229 PolarHBondContact O-OG 3.14Å; C225-S229 WeakPolarHBondContact O-CB 3.32Å; C225-S229 PolarHBondContact O-N 2.88Å; S229-K231 VanDerWaalsContact C-N 3.33Å; S229-K231 PolarHBondContact O-N 2.9Å; S229-M232 PolarHBondContact O-N 3.47Å; S229-R233 WeakPolarHBondContact O-CB 3.36Å; S229-R233 PolarHBondContact O-N 3.38Å
230R87.4Confident87.5Confident92 Ų9262 Ų6235%0.34729%0.288SS..Hα-helixtrans-62.3-34.1174.5-78.4177.2175.1152.79.9113.6Q151 L226 L228 K234Q151-R230 HydrophobicContact CG-CG 4.25Å; L226-R230 WeakPolarHBondContact O-CB 3.43Å; L226-R230 VanDerWaalsContact O-CG 3.31Å; L226-R230 WeakPolarHBondContact O-CG 3.17Å; L226-R230 PolarHBondContact O-N 2.61Å; L226-R230 VanDerWaalsContact O-N 3.08Å; L228-R230 VanDerWaalsContact C-N 3.32Å; L228-R230 PolarHBondContact O-N 3.06Å; R230-K234 WeakPolarHBondContact O-CG 3.38Å; R230-K234 PolarHBondContact O-N 2.97Å
231K88.1Confident87.6Confident86 Ų8662.5 Ų62.537%0.37429%0.29SS..Hα-helixtrans-72.4-49.8176.4-173.2-177.1169.1-1530110.4K227 L228 S229 R233 K234 E235 S286 V290K227-K231 PolarHBondContact O-N 3.39Å; L228-K231 PolarHBondContact O-N 2.82Å; S229-K231 VanDerWaalsContact C-N 3.33Å; S229-K231 PolarHBondContact O-N 2.9Å; K231-R233 PolarHBondContact O-N 3.09Å; K231-K234 PolarHBondContact O-N 3.5Å; K231-E235 VanDerWaalsContact CE-CD 3.46Å; K231-E235 WeakPolarHBondContact CE-OE1 3.44Å; K231-E235 IonicContact NZ-OE1 3.24Å; K231-E235 IonicContact NZ-OE2 2.69Å; K231-E235 PolarHBondContact O-N 2.69Å; K231-E235 VanDerWaalsContact O-N 3.11Å; K231-S286 PolarHBondContact NZ-OG 3.34Å; K231-V290 HydrophobicContact CB-CG1 4.14Å; K231-V290 HydrophobicContact CD-CG1 4.35Å; K231-V290 HydrophobicContact CD-CG2 3.5Å; K231-V290 VanDerWaalsContact CE-CG2 3.46Å; K231-V290 HydrophobicContact CG-CG1 4.32Å; K231-V290 HydrophobicContact CG-CG2 4.1Å
232M87.5Confident88Confident7 Ų761.6 Ų61.63%0.03428%0.284CS..Hα-helixtrans-54.9-51.7178.8-171.4-174.4177.100111.2L228 S229 K234 E235 M236 I287 V290 L294 V305 K308 L309L228-M232 PolarHBondContact O-N 3.25Å; S229-M232 PolarHBondContact O-N 3.47Å; M232-K234 VanDerWaalsContact C-N 3.32Å; M232-K234 PolarHBondContact O-N 3.08Å; M232-E235 PolarHBondContact O-N 3.36Å; M232-M236 HydrophobicContact CE-SD 4.5Å; M232-M236 WeakPolarHBondContact O-CB 3.36Å; M232-M236 PolarHBondContact O-N 3.02Å; M232-I287 HydrophobicContact CG-CG2 4.47Å; M232-V290 HydrophobicContact CB-CG1 3.88Å; M232-L294 HydrophobicContact SD-CD2 3.96Å; M232-V305 HydrophobicContact CE-CG1 3.89Å; M232-V305 HydrophobicContact SD-CG1 4.05Å; M232-K308 HydrophobicContact CE-CB 4.04Å; M232-L309 HydrophobicContact CE-CD2 3.8Å; M232-L309 HydrophobicContact CE-CG 3.92Å
233R85.3Confident88.3Confident77 Ų7761.8 Ų61.829%0.29129%0.285SS..Hα-helixtrans-59.1-40.5-179.4-169.3-171.1-75.4-174.6-9.8112.3E150 S229 K231 N237E150-R233 IonicContact OE2-CZ 2.72Å; E150-R233 IonicContact OE2-NH2 2.7Å; E150-R233 PolarHBondContact OE2-NH2 3.43Å; S229-R233 WeakPolarHBondContact O-CB 3.36Å; S229-R233 PolarHBondContact O-N 3.38Å; K231-R233 PolarHBondContact O-N 3.09Å; R233-N237 WeakPolarHBondContact O-CB 3.38Å; R233-N237 PolarHBondContact O-N 3.05Å; R233-N237 PolarHBondContact O-OD1 2.92Å; R233-N237 VanDerWaalsContact O-OD1 3.06Å
234K86.2Confident88.3Confident158 Ų15860.5 Ų60.569%0.68729%0.289SS*.Hα-helixtrans-65.9-48178.6-78.6-176.7175.4-167.60112.6R230 K231 M232 V238R230-K234 WeakPolarHBondContact O-CG 3.38Å; R230-K234 PolarHBondContact O-N 2.97Å; K231-K234 PolarHBondContact O-N 3.5Å; M232-K234 VanDerWaalsContact C-N 3.32Å; M232-K234 PolarHBondContact O-N 3.08Å; K234-V238 WeakPolarHBondContact O-CG2 3.37Å; K234-V238 PolarHBondContact O-N 3.42Å
235E86.8Confident88.4Confident44 Ų4457.9 Ų57.921%0.20629%0.289CS..Hα-helixtrans-71.5-38.9-177.9-67.5178.2-172.500111.3K231 M232 V238 L239 S286 I287K231-E235 VanDerWaalsContact CE-CD 3.46Å; K231-E235 WeakPolarHBondContact CE-OE1 3.44Å; K231-E235 IonicContact NZ-OE1 3.24Å; K231-E235 IonicContact NZ-OE2 2.69Å; K231-E235 PolarHBondContact O-N 2.69Å; K231-E235 VanDerWaalsContact O-N 3.11Å; M232-E235 PolarHBondContact O-N 3.36Å; E235-V238 PolarHBondContact O-N 3.02Å; E235-L239 PolarHBondContact O-N 3.04Å; E235-L239 VanDerWaalsContact O-N 3.11Å; E235-S286 WeakPolarHBondContact OE2-CB 3.11Å; E235-S286 PolarHBondContact OE2-OG 2.71Å; E235-I287 HydrophobicContact CB-CD1 4.03Å; E235-I287 HydrophobicContact CB-CG1 3.46Å; E235-I287 VanDerWaalsContact CB-CG1 3.46Å; E235-I287 WeakPolarHBondContact O-CD1 3.34Å
236M87.6Confident88.5Confident31 Ų3158.5 Ų58.515%0.15329%0.293CS..Hα-helixtrans-61.4-42.3174.9-178.1172-179.700112.7M232 L239 T240 K308 L312M232-M236 HydrophobicContact CE-SD 4.5Å; M232-M236 WeakPolarHBondContact O-CB 3.36Å; M232-M236 PolarHBondContact O-N 3.02Å; M236-L239 PolarHBondContact O-N 2.9Å; M236-T240 WeakPolarHBondContact O-CB 2.81Å; M236-T240 PolarHBondContact O-N 3.09Å; M236-T240 PolarHBondContact O-OG1 3.3Å; M236-K308 HydrophobicContact CE-CB 4.04Å; M236-K308 VanDerWaalsContact CE-O 3.29Å; M236-K308 WeakPolarHBondContact CE-O 3.33Å; M236-K308 HydrophobicContact SD-CB 4.22Å; M236-L312 HydrophobicContact CE-CB 4.31Å; M236-L312 HydrophobicContact CG-CD1 4.35Å; M236-L312 HydrophobicContact CG-CD2 4.11Å
237N86.6Confident88.7Confident80 Ų8060.7 Ų60.743%0.42831%0.305SS..Hα-helixtrans-62.2-47.6176.6-76.420.2000111.7R233 L239 T240 E241R233-N237 WeakPolarHBondContact O-CB 3.38Å; R233-N237 PolarHBondContact O-N 3.05Å; R233-N237 PolarHBondContact O-OD1 2.92Å; R233-N237 VanDerWaalsContact O-OD1 3.06Å; N237-L239 VanDerWaalsContact C-N 3.3Å; N237-L239 PolarHBondContact O-N 3.01Å; N237-T240 PolarHBondContact O-N 3.35Å; N237-T240 VanDerWaalsContact O-N 3.15Å; N237-E241 WeakPolarHBondContact O-CB 3.46Å; N237-E241 WeakPolarHBondContact O-CG 3.44Å; N237-E241 PolarHBondContact O-N 3.47Å
238V87.8Confident88.6Confident79 Ų7959.9 Ų59.948%0.47931%0.305SS..Hα-helixtrans-57.7-43.7178.6171.60000111.4K234 E235 W242K234-V238 WeakPolarHBondContact O-CG2 3.37Å; K234-V238 PolarHBondContact O-N 3.42Å; E235-V238 PolarHBondContact O-N 3.02Å; V238-W242 WeakPolarHBondContact O-CB 3.35Å; V238-W242 PolarHBondContact O-N 3.06Å; V238-W242 VanDerWaalsContact O-N 3.13Å
239L91.1Very high88.5Confident1 Ų161 Ų611%0.00531%0.31CS..Hα-helixtrans-69.4-37.4178.5-166.862.7000112.2E235 M236 N237 W242 L243 Q280 L284 I287 L312 W316E235-L239 PolarHBondContact O-N 3.04Å; E235-L239 VanDerWaalsContact O-N 3.11Å; M236-L239 PolarHBondContact O-N 2.9Å; N237-L239 VanDerWaalsContact C-N 3.3Å; N237-L239 PolarHBondContact O-N 3.01Å; L239-W242 HydrophobicContact CD1-CE3 4.24Å; L239-W242 PolarHBondContact O-N 3.42Å; L239-L243 HydrophobicContact CG-CD1 4.31Å; L239-L243 WeakPolarHBondContact O-CB 3.21Å; L239-L243 VanDerWaalsContact O-CG 3.26Å; L239-L243 WeakPolarHBondContact O-CG 3.3Å; L239-L243 PolarHBondContact O-N 3.1Å; L239-Q280 HydrophobicContact CD1-CB 3.92Å; L239-L284 HydrophobicContact CD2-CB 3.9Å; L239-L284 HydrophobicContact CD2-CD1 3.88Å; L239-L284 HydrophobicContact CD2-CG 4.48Å; L239-I287 HydrophobicContact CB-CD1 4Å; L239-I287 HydrophobicContact CD2-CD1 3.79Å; L239-L312 HydrophobicContact CB-CD1 4.46Å; L239-L312 HydrophobicContact CD2-CD1 4.18Å; L239-L312 HydrophobicContact CD2-CD2 4.16Å; L239-L312 HydrophobicContact CD2-CG 4.29Å; L239-L312 HydrophobicContact CG-CD1 4.4Å; L239-W316 HydrophobicContact CD1-CE3 4.04Å; L239-W316 HydrophobicContact CD1-CZ3 3.78Å; L239-W316 HydrophobicContact CD2-CE3 4.24Å; L239-W316 HydrophobicContact CG-CE3 4.4Å
240T89.7Confident88.6Confident54 Ų5461 Ų6133%0.33131%0.309SS..Hα-helixtrans-68-42.1178.7-54.20000111.8M236 N237 L243 A244M236-T240 WeakPolarHBondContact O-CB 2.81Å; M236-T240 PolarHBondContact O-N 3.09Å; M236-T240 PolarHBondContact O-OG1 3.3Å; N237-T240 PolarHBondContact O-N 3.35Å; N237-T240 VanDerWaalsContact O-N 3.15Å; T240-L243 PolarHBondContact O-N 3.33Å; T240-A244 WeakPolarHBondContact O-CB 3.4Å; T240-A244 PolarHBondContact O-N 2.69Å
241E88.3Confident88.4Confident131 Ų13159.6 Ų59.661%0.61231%0.311SS*.Hα-helixtrans-61.6-43.1174.4-73.4169.2-161.200111.3N237 A244 A245N237-E241 WeakPolarHBondContact O-CB 3.46Å; N237-E241 WeakPolarHBondContact O-CG 3.44Å; N237-E241 PolarHBondContact O-N 3.47Å; E241-A244 PolarHBondContact O-N 3.41Å; E241-A245 WeakPolarHBondContact O-CB 3.45Å; E241-A245 PolarHBondContact O-N 3.39Å
242W93.7Very high88.2Confident44 Ų4462.2 Ų62.217%0.16732%0.323CS..Hα-helixtrans-65.2-42176178.184.8000112.7V238 L239 A245 T246 E276 I277 Q280 W316V238-W242 WeakPolarHBondContact O-CB 3.35Å; V238-W242 PolarHBondContact O-N 3.06Å; V238-W242 VanDerWaalsContact O-N 3.13Å; L239-W242 HydrophobicContact CD1-CE3 4.24Å; L239-W242 PolarHBondContact O-N 3.42Å; W242-A245 PolarHBondContact O-N 3.05Å; W242-T246 HydrophobicContact CH2-CG2 4.46Å; W242-T246 HydrophobicContact CZ2-CG2 4.41Å; W242-T246 WeakPolarHBondContact O-CB 3.46Å; W242-T246 PolarHBondContact O-N 2.8Å; W242-T246 PolarHBondContact O-OG1 2.96Å; W242-E276 HydrophobicContact CZ2-CB 4.36Å; W242-E276 HydrophobicContact CZ2-CG 4.06Å; W242-I277 HydrophobicContact CH2-CG1 3.73Å; W242-I277 HydrophobicContact CZ2-CG1 4.29Å; W242-Q280 HydrophobicContact CD2-CB 4.47Å; W242-Q280 HydrophobicContact CD2-CG 3.78Å; W242-Q280 HydrophobicContact CE3-CB 4.28Å; W242-Q280 HydrophobicContact CE3-CG 4.1Å; W242-Q280 HydrophobicContact CG-CG 4.24Å; W242-Q280 HydrophobicContact CH2-CG 4.45Å; W242-Q280 HydrophobicContact CZ2-CG 4.12Å; W242-Q280 HydrophobicContact CZ3-CB 4.33Å; W242-Q280 HydrophobicContact CZ3-CG 4.42Å; W242-W316 HydrophobicContact CE3-CZ3 4.31Å; W242-W316 HydrophobicContact CH2-CZ3 4.42Å; W242-W316 HydrophobicContact CZ3-CE3 4.26Å; W242-W316 HydrophobicContact CZ3-CH2 4.44Å; W242-W316 AromaticContact CZ3-CZ3 3.68Å; W242-W316 HydrophobicContact CZ3-CZ3 3.68Å
243L93.7Very high88.1Confident5 Ų564 Ų643%0.02633%0.329CS..Hα-helixtrans-61-47.4176-76.6167.9000111.5L239 T240 T246 D247 L312 N315 W316 V319L239-L243 HydrophobicContact CG-CD1 4.31Å; L239-L243 WeakPolarHBondContact O-CB 3.21Å; L239-L243 VanDerWaalsContact O-CG 3.26Å; L239-L243 WeakPolarHBondContact O-CG 3.3Å; L239-L243 PolarHBondContact O-N 3.1Å; T240-L243 PolarHBondContact O-N 3.33Å; L243-T246 PolarHBondContact O-N 3.06Å; L243-D247 WeakPolarHBondContact O-CB 3.25Å; L243-D247 PolarHBondContact O-N 3.13Å; L243-L312 HydrophobicContact CD1-CD1 4.24Å; L243-N315 HydrophobicContact CD1-CB 4.19Å; L243-W316 HydrophobicContact CD1-CB 4.38Å; L243-W316 HydrophobicContact CD2-CE3 4.05Å; L243-V319 HydrophobicContact CD2-CB 3.79Å; L243-V319 HydrophobicContact CD2-CG1 4.15Å; L243-V319 HydrophobicContact CD2-CG2 4.1Å
244A88.8Confident87.8Confident59 Ų5963 Ų6349%0.48833%0.334SS..Hα-helixtrans-63.8-41.9179.200000112.7T240 E241 M248T240-A244 WeakPolarHBondContact O-CB 3.4Å; T240-A244 PolarHBondContact O-N 2.69Å; E241-A244 PolarHBondContact O-N 3.41Å; A244-M248 PolarHBondContact O-N 2.95Å; A244-M248 VanDerWaalsContact O-N 3.09Å
245A88.9Confident87.3Confident61 Ų6159.2 Ų59.250%0.50433%0.332SS..Hα-helixtrans-64.8-39.617600000112.2E241 W242 E249E241-A245 WeakPolarHBondContact O-CB 3.45Å; E241-A245 PolarHBondContact O-N 3.39Å; W242-A245 PolarHBondContact O-N 3.05Å; A245-E249 PolarHBondContact O-N 3.35Å
246T90.4Very high86.6Confident15 Ų1560.8 Ų60.89%0.09234%0.344CS..Hα-helixtrans-68.1-43.2178.2-55.90000111.2W242 L243 E249 L250 T273 V319W242-T246 HydrophobicContact CH2-CG2 4.46Å; W242-T246 HydrophobicContact CZ2-CG2 4.41Å; W242-T246 WeakPolarHBondContact O-CB 3.46Å; W242-T246 PolarHBondContact O-N 2.8Å; W242-T246 PolarHBondContact O-OG1 2.96Å; L243-T246 PolarHBondContact O-N 3.06Å; T246-E249 PolarHBondContact O-N 3.14Å; T246-L250 VanDerWaalsContact O-CB 3.23Å; T246-L250 WeakPolarHBondContact O-CB 3.47Å; T246-L250 PolarHBondContact O-N 3.23Å; T246-T273 HydrophobicContact CG2-CG2 4.09Å; T246-V319 HydrophobicContact CG2-CG1 3.82Å
247D91.1Very high85.7Confident53 Ų5368.4 Ų68.428%0.28338%0.379SS..Hα-helixtrans-63.9-40.2177.6-172.840.7000113L243 T251 V319 R322L243-D247 WeakPolarHBondContact O-CB 3.25Å; L243-D247 PolarHBondContact O-N 3.13Å; D247-T251 VanDerWaalsContact O-CB 3.26Å; D247-T251 WeakPolarHBondContact O-CB 3.3Å; D247-T251 PolarHBondContact O-N 3.18Å; D247-T251 PolarHBondContact O-OG1 2.95Å; D247-V319 HydrophobicContact CB-CG1 4.39Å; D247-V319 HydrophobicContact CB-CG2 3.91Å; D247-R322 IonicContact OD1-CZ 3.53Å; D247-R322 IonicContact OD1-NH1 2.83Å; D247-R322 PolarHBondContact OD1-NH1 2.92Å; D247-R322 IonicContact OD1-NH2 3.67Å
248M86.7Confident85.1Confident147 Ų14765.5 Ų65.572%0.72437%0.368SS*.Hα-helixtrans-60.3-50174.2-94.3-174.955.800112.5A244 T251 K252A244-M248 PolarHBondContact O-N 2.95Å; A244-M248 VanDerWaalsContact O-N 3.09Å; M248-T251 PolarHBondContact O-N 3.39Å; M248-K252 WeakPolarHBondContact O-CB 3.25Å; M248-K252 PolarHBondContact O-N 2.77Å; M248-K252 VanDerWaalsContact O-N 3.1Å
249E86.1Confident84.8Confident53 Ų5362.4 Ų62.425%0.24835%0.349CS..Hα-helixtrans-70.5-34.9-178.8-178.966.1-175.100111.3A245 T246 K252 R253 W269A245-E249 PolarHBondContact O-N 3.35Å; T246-E249 PolarHBondContact O-N 3.14Å; E249-K252 PolarHBondContact O-N 3.05Å; E249-K252 IonicContact OE1-NZ 3.04Å; E249-K252 IonicContact OE2-NZ 3.93Å; E249-K252 PolarHBondContact OE2-NZ 3.37Å; E249-R253 WeakPolarHBondContact O-CG 3.46Å; E249-R253 PolarHBondContact O-N 2.96Å; E249-R253 IonicContact OE1-CZ 3.86Å; E249-R253 VanDerWaalsContact OE1-CZ 3.27Å; E249-R253 IonicContact OE1-NE 3.34Å; E249-R253 PolarHBondContact OE1-NE 2.9Å; E249-R253 IonicContact OE1-NH2 3.87Å; E249-R253 PolarHBondContact OE1-NH2 3.17Å; E249-W269 HydrophobicContact CB-CZ2 4.3Å; E249-W269 HydrophobicContact CG-CZ2 3.66Å
250L88.2Confident84.3Confident3 Ų362.9 Ų62.92%0.01635%0.352CS..Hα-helixtrans-62.9-48.3173.7-168.277.7000111.4T246 K252 R253 S254 W269 R322 A323 W326T246-L250 VanDerWaalsContact O-CB 3.23Å; T246-L250 WeakPolarHBondContact O-CB 3.47Å; T246-L250 PolarHBondContact O-N 3.23Å; L250-K252 VanDerWaalsContact C-N 3.26Å; L250-K252 PolarHBondContact O-N 2.75Å; L250-R253 PolarHBondContact O-N 2.97Å; L250-R253 VanDerWaalsContact O-N 3.08Å; L250-S254 WeakPolarHBondContact O-CB 3.44Å; L250-S254 PolarHBondContact O-N 2.85Å; L250-S254 PolarHBondContact O-OG 3.36Å; L250-S254 VanDerWaalsContact O-OG 3.14Å; L250-W269 HydrophobicContact CB-CH2 4.49Å; L250-W269 HydrophobicContact CD1-CH2 3.94Å; L250-W269 HydrophobicContact CD1-CZ3 3.86Å; L250-R322 HydrophobicContact CD2-CB 3.43Å; L250-R322 VanDerWaalsContact CD2-CB 3.43Å; L250-A323 HydrophobicContact CD1-CB 4.31Å; L250-A323 HydrophobicContact CD2-CB 4.42Å; L250-W326 HydrophobicContact CD1-CB 3.89Å; L250-W326 HydrophobicContact CD1-CG 4.01Å
251T84.6Confident83.6Confident64 Ų6464.8 Ų64.839%0.39337%0.367SS..Hα-helixtrans-60-36.9178.4-59.70000111.9D247 M248 S254 A255 R322D247-T251 VanDerWaalsContact O-CB 3.26Å; D247-T251 WeakPolarHBondContact O-CB 3.3Å; D247-T251 PolarHBondContact O-N 3.18Å; D247-T251 PolarHBondContact O-OG1 2.95Å; M248-T251 PolarHBondContact O-N 3.39Å; T251-S254 PolarHBondContact O-OG 3.29Å; T251-A255 PolarHBondContact O-N 2.89Å; T251-R322 PolarHBondContact OG1-NH2 3.34Å
252K83.3Confident83.3Confident140 Ų14063 Ų6361%0.60936%0.362SS*.Hα-helixtrans-68.8-35.9174.7177.4-177.8155.3-145.80113M248 E249 L250M248-K252 WeakPolarHBondContact O-CB 3.25Å; M248-K252 PolarHBondContact O-N 2.77Å; M248-K252 VanDerWaalsContact O-N 3.1Å; E249-K252 PolarHBondContact O-N 3.05Å; E249-K252 IonicContact OE1-NZ 3.04Å; E249-K252 IonicContact OE2-NZ 3.93Å; E249-K252 PolarHBondContact OE2-NZ 3.37Å; L250-K252 VanDerWaalsContact C-N 3.26Å; L250-K252 PolarHBondContact O-N 2.75Å
253R84.4Confident82.8Confident46 Ų4662 Ų6217%0.17436%0.36CS..Hα-helixtrans-75.4-43.9177.5-73.4170.8-179.5-90.1-14.7112.2E249 L250 A255 V256 E266 W269 W326E249-R253 WeakPolarHBondContact O-CG 3.46Å; E249-R253 PolarHBondContact O-N 2.96Å; E249-R253 IonicContact OE1-CZ 3.86Å; E249-R253 VanDerWaalsContact OE1-CZ 3.27Å; E249-R253 IonicContact OE1-NE 3.34Å; E249-R253 PolarHBondContact OE1-NE 2.9Å; E249-R253 IonicContact OE1-NH2 3.87Å; E249-R253 PolarHBondContact OE1-NH2 3.17Å; L250-R253 PolarHBondContact O-N 2.97Å; L250-R253 VanDerWaalsContact O-N 3.08Å; R253-A255 PolarHBondContact O-N 3.37Å; R253-V256 PolarHBondContact O-N 2.87Å; R253-E266 WeakPolarHBondContact CD-OE2 3.31Å; R253-E266 IonicContact CZ-OE1 2.78Å; R253-E266 IonicContact CZ-OE2 2.67Å; R253-E266 IonicContact NH1-OE1 3.67Å; R253-E266 PolarHBondContact NH1-OE1 3.27Å; R253-E266 IonicContact NH1-OE2 2.77Å; R253-E266 PolarHBondContact NH1-OE2 2.81Å; R253-W269 VanDerWaalsContact CZ-CG 3.48Å; R253-W326 HydrophobicContact CB-CZ2 4.1Å; R253-W326 WeakPolarHBondContact O-CH2 3.44Å
254S78.8Confident82.4Confident55 Ų5567.2 Ų67.239%0.38539%0.388SS..THydrogen-bonded Turntrans-71.3-6.2179.966.90000114.3L250 T251 V256L250-S254 WeakPolarHBondContact O-CB 3.44Å; L250-S254 PolarHBondContact O-N 2.85Å; L250-S254 PolarHBondContact O-OG 3.36Å; L250-S254 VanDerWaalsContact O-OG 3.14Å; T251-S254 PolarHBondContact O-OG 3.29Å; S254-V256 VanDerWaalsContact C-N 3.27Å
255A77.4Confident82.1Confident78 Ų7866.9 Ų66.965%0.64538%0.382SS*.THydrogen-bonded Turntrans-78-7.317600000113.8T251 R253T251-A255 PolarHBondContact O-N 2.89Å; R253-A255 PolarHBondContact O-N 3.37Å
256V71.7Confident82.1Confident77 Ų7765.4 Ų65.447%0.46737%0.365SS..SBendtrans-84.4111.3175.4-178.20000109.1R253 S254 G258R253-V256 PolarHBondContact O-N 2.87Å; S254-V256 VanDerWaalsContact C-N 3.27Å; V256-G258 PolarHBondContact O-N 3.41Å
257E68.3Low81.9Confident191 Ų19165 Ų6589%0.89336%0.362SS*.  trans-70.8123.8177.4-68.1-172.9156.200111.9
258G74.4Confident81.8Confident19 Ų1965.2 Ų65.220%0.19637%0.371CS..SBendtrans87.8-160.9178.800000114.2V256 P260V256-G258 PolarHBondContact O-N 3.41Å; G258-P260 WeakPolarHBondContact O-CD 3.33Å
259M80.9Confident82Confident14 Ų1460.8 Ų60.87%0.06935%0.346CS..SBendtrans-73.3123.5-176.1-171.4-178.679.100111.4L263 Y333 M337 R401 C405 L408M259-L263 HydrophobicContact CG-CD2 4.37Å; M259-L263 HydrophobicContact SD-CD2 4.19Å; M259-Y333 HydrophobicContact CB-CD2 4.09Å; M259-Y333 HydrophobicContact CB-CE2 4.3Å; M259-Y333 HydrophobicContact CB-CG 4.46Å; M259-Y333 HydrophobicContact CG-CD2 3.94Å; M259-Y333 HydrophobicContact CG-CG 4.19Å; M259-M337 HydrophobicContact CE-CE 3.62Å; M259-M337 HydrophobicContact SD-CE 3.59Å; M259-M337 VanDerWaalsContact SD-CE 3.59Å; M259-R401 HydrophobicContact CB-CB 4.38Å; M259-R401 WeakPolarHBondContact CB-O 3.23Å; M259-R401 PolarHBondContact N-O 3.42Å; M259-C405 HydrophobicContact CE-CB 3.92Å; M259-C405 HydrophobicContact SD-CB 4.45Å; M259-L408 HydrophobicContact CE-CD1 4.3Å
260P80.7Confident82.1Confident11 Ų1158.4 Ų58.47%0.07134%0.337CS..  trans-59.5147.9178.6-25.835.3000113.3G258 N262 E266 W326 L330G258-P260 WeakPolarHBondContact O-CD 3.33Å; P260-N262 PolarHBondContact O-N 3.07Å; P260-N262 VanDerWaalsContact O-N 3.1Å; P260-E266 HydrophobicContact CB-CG 3.9Å; P260-E266 HydrophobicContact CG-CG 4.14Å; P260-W326 HydrophobicContact CG-CH2 4.35Å; P260-W326 HydrophobicContact CG-CZ2 4.4Å; P260-L330 HydrophobicContact CG-CD2 3.81Å
261S75.6Confident82.1Confident94 Ų9462.4 Ų62.466%0.65735%0.354SS*.THydrogen-bonded Turntrans-66.1-12.9-177.2-40.60000115.1
262N81.8Confident82.3Confident94 Ų9462.1 Ų62.150%0.50336%0.358SS..THydrogen-bonded Turntrans-14270.8176.2-172.6-17.8000109P260 D264 S265 E266P260-N262 PolarHBondContact O-N 3.07Å; P260-N262 VanDerWaalsContact O-N 3.1Å; N262-D264 VanDerWaalsContact C-N 3.29Å; N262-D264 PolarHBondContact O-N 3.12Å; N262-S265 WeakPolarHBondContact CB-OG 3.36Å; N262-S265 PolarHBondContact O-N 3.4Å; N262-S265 VanDerWaalsContact O-N 3.11Å; N262-S265 PolarHBondContact O-OG 2.99Å; N262-S265 WeakPolarHBondContact OD1-CB 3.44Å; N262-S265 PolarHBondContact OD1-N 3.1Å; N262-S265 PolarHBondContact OD1-OG 3.14Å; N262-E266 PolarHBondContact O-N 2.95Å
263L83.9Confident82.7Confident23 Ų2356.2 Ų56.212%0.1233%0.333CS..Hα-helixtrans-53.9-42-175-177.760.1000112.9M259 S265 E266 V267 L330 Y333 Q334M259-L263 HydrophobicContact CG-CD2 4.37Å; M259-L263 HydrophobicContact SD-CD2 4.19Å; L263-S265 VanDerWaalsContact C-N 3.3Å; L263-S265 PolarHBondContact O-N 3.1Å; L263-E266 PolarHBondContact O-N 3.46Å; L263-V267 HydrophobicContact CD1-CG2 4.18Å; L263-V267 HydrophobicContact CG-CG2 4.3Å; L263-V267 WeakPolarHBondContact O-CG2 3.16Å; L263-V267 PolarHBondContact O-N 3.3Å; L263-L330 HydrophobicContact CD1-CB 4.22Å; L263-L330 HydrophobicContact CD1-CD2 3.72Å; L263-Y333 HydrophobicContact CD1-CD2 4.31Å; L263-Q334 HydrophobicContact CD2-CB 4.15Å
264D83.5Confident82.8Confident114 Ų11457.9 Ų57.961%0.6134%0.343SS*.Hα-helixtrans-59-40.2178.4-69.8-35000112.6N262 A268N262-D264 VanDerWaalsContact C-N 3.29Å; N262-D264 PolarHBondContact O-N 3.12Å; D264-A268 VanDerWaalsContact O-CB 3.26Å; D264-A268 WeakPolarHBondContact O-CB 3.33Å; D264-A268 PolarHBondContact O-N 3.39Å
265S82.8Confident83.1Confident52 Ų5261.8 Ų61.836%0.36435%0.353SS..Hα-helixtrans-68.5-35.6178.372.50000112.8N262 L263 W269N262-S265 WeakPolarHBondContact CB-OG 3.36Å; N262-S265 PolarHBondContact O-N 3.4Å; N262-S265 VanDerWaalsContact O-N 3.11Å; N262-S265 PolarHBondContact O-OG 2.99Å; N262-S265 WeakPolarHBondContact OD1-CB 3.44Å; N262-S265 PolarHBondContact OD1-N 3.1Å; N262-S265 PolarHBondContact OD1-OG 3.14Å; L263-S265 VanDerWaalsContact C-N 3.3Å; L263-S265 PolarHBondContact O-N 3.1Å; S265-W269 PolarHBondContact O-N 2.7Å
266E88.6Confident83.6Confident31 Ų3160.6 Ų60.615%0.14533%0.334CS..Hα-helixtrans-72.4-42.6175.5-68.7-56.3128.100111.5R253 P260 N262 L263 A268 W269 G270 L330R253-E266 WeakPolarHBondContact CD-OE2 3.31Å; R253-E266 IonicContact CZ-OE1 2.78Å; R253-E266 IonicContact CZ-OE2 2.67Å; R253-E266 IonicContact NH1-OE1 3.67Å; R253-E266 PolarHBondContact NH1-OE1 3.27Å; R253-E266 IonicContact NH1-OE2 2.77Å; R253-E266 PolarHBondContact NH1-OE2 2.81Å; P260-E266 HydrophobicContact CB-CG 3.9Å; P260-E266 HydrophobicContact CG-CG 4.14Å; N262-E266 PolarHBondContact O-N 2.95Å; L263-E266 PolarHBondContact O-N 3.46Å; E266-A268 VanDerWaalsContact C-N 3.3Å; E266-A268 PolarHBondContact O-N 2.71Å; E266-W269 PolarHBondContact O-N 3.01Å; E266-G270 PolarHBondContact O-N 2.95Å; E266-L330 HydrophobicContact CB-CD1 3.77Å; E266-L330 HydrophobicContact CB-CD2 3.8Å; E266-L330 HydrophobicContact CB-CG 4.44Å
267V88.1Confident84.5Confident5 Ų558.2 Ų58.23%0.0332%0.319CS..Hα-helixtrans-61.1-40.4173.3170.30000110.9L263 G270 K271 L330 L331L263-V267 HydrophobicContact CD1-CG2 4.18Å; L263-V267 HydrophobicContact CG-CG2 4.3Å; L263-V267 WeakPolarHBondContact O-CG2 3.16Å; L263-V267 PolarHBondContact O-N 3.3Å; V267-G270 PolarHBondContact O-N 3.46Å; V267-K271 HydrophobicContact CG1-CD 3.85Å; V267-K271 VanDerWaalsContact CG1-CE 3.47Å; V267-K271 HydrophobicContact CG1-CG 4.48Å; V267-K271 WeakPolarHBondContact O-CB 3.42Å; V267-K271 VanDerWaalsContact O-CG 3.31Å; V267-K271 WeakPolarHBondContact O-CG 3.48Å; V267-K271 PolarHBondContact O-N 3.42Å; V267-L330 HydrophobicContact CG2-CB 3.75Å; V267-L331 HydrophobicContact CG1-CD2 4.13Å
268A87Confident85.2Confident58 Ų5855.2 Ų55.248%0.47931%0.305SS..Hα-helixtrans-63.8-41.7174.900000111.9D264 E266 A272D264-A268 VanDerWaalsContact O-CB 3.26Å; D264-A268 WeakPolarHBondContact O-CB 3.33Å; D264-A268 PolarHBondContact O-N 3.39Å; E266-A268 VanDerWaalsContact C-N 3.3Å; E266-A268 PolarHBondContact O-N 2.71Å; A268-A272 WeakPolarHBondContact O-CB 3.36Å; A268-A272 PolarHBondContact O-N 3.38Å
269W91.4Very high85.8Confident54 Ų5460 Ų6021%0.20532%0.32CS..Hα-helixtrans-65.4-43.7175-177.890000112.4E249 L250 R253 S265 E266 A272 T273E249-W269 HydrophobicContact CB-CZ2 4.3Å; E249-W269 HydrophobicContact CG-CZ2 3.66Å; L250-W269 HydrophobicContact CB-CH2 4.49Å; L250-W269 HydrophobicContact CD1-CH2 3.94Å; L250-W269 HydrophobicContact CD1-CZ3 3.86Å; R253-W269 VanDerWaalsContact CZ-CG 3.48Å; S265-W269 PolarHBondContact O-N 2.7Å; E266-W269 PolarHBondContact O-N 3.01Å; W269-A272 PolarHBondContact O-N 2.99Å; W269-T273 HydrophobicContact CH2-CG2 4.34Å; W269-T273 WeakPolarHBondContact O-CB 3.37Å; W269-T273 PolarHBondContact O-N 3.44Å; W269-T273 PolarHBondContact O-OG1 2.95Å
270G89.6Confident86.2Confident4 Ų460.3 Ų60.34%0.04132%0.321CS..Hα-helixtrans-61.8-45.7176.500000112.1E266 V267 A272 T273 Q274E266-G270 PolarHBondContact O-N 2.95Å; V267-G270 PolarHBondContact O-N 3.46Å; G270-A272 VanDerWaalsContact C-N 3.33Å; G270-A272 PolarHBondContact O-N 3.41Å; G270-T273 PolarHBondContact O-N 3.22Å; G270-Q274 PolarHBondContact O-N 3.1Å
271K88.2Confident86.5Confident87 Ų8766.3 Ų66.338%0.37835%0.346SS..Hα-helixtrans-63.9-34174.6-72.8170.7-179162.60112.8V267 K275 L327V267-K271 HydrophobicContact CG1-CD 3.85Å; V267-K271 VanDerWaalsContact CG1-CE 3.47Å; V267-K271 HydrophobicContact CG1-CG 4.48Å; V267-K271 WeakPolarHBondContact O-CB 3.42Å; V267-K271 VanDerWaalsContact O-CG 3.31Å; V267-K271 WeakPolarHBondContact O-CG 3.48Å; V267-K271 PolarHBondContact O-N 3.42Å; K271-K275 WeakPolarHBondContact O-CG 3.33Å; K271-K275 PolarHBondContact O-N 3.46Å; K271-L327 HydrophobicContact CG-CD1 4.05Å
272A88.8Confident87Confident57 Ų5766.6 Ų66.647%0.47134%0.344SS..Hα-helixtrans-69.6-41.9173.800000111.7A268 W269 G270 K275 E276A268-A272 WeakPolarHBondContact O-CB 3.36Å; A268-A272 PolarHBondContact O-N 3.38Å; W269-A272 PolarHBondContact O-N 2.99Å; G270-A272 VanDerWaalsContact C-N 3.33Å; G270-A272 PolarHBondContact O-N 3.41Å; A272-K275 PolarHBondContact O-N 3.35Å; A272-E276 PolarHBondContact O-N 2.82Å
273T89.7Confident87.2Confident16 Ų1666.1 Ų66.110%0.09834%0.338CS..Hα-helixtrans-65.4-40.5177.4-56.50000111.4T246 W269 G270 K275 E276 I277T246-T273 HydrophobicContact CG2-CG2 4.09Å; W269-T273 HydrophobicContact CH2-CG2 4.34Å; W269-T273 WeakPolarHBondContact O-CB 3.37Å; W269-T273 PolarHBondContact O-N 3.44Å; W269-T273 PolarHBondContact O-OG1 2.95Å; G270-T273 PolarHBondContact O-N 3.22Å; T273-K275 PolarHBondContact O-N 2.81Å; T273-E276 CarbonylContact O-C 3.59Å; T273-E276 WeakPolarHBondContact O-CA 3.3Å; T273-E276 WeakPolarHBondContact O-CB 3.15Å; T273-E276 PolarHBondContact O-N 3.05Å; T273-I277 HydrophobicContact CG2-CD1 4.4Å; T273-I277 WeakPolarHBondContact O-CG1 3.44Å; T273-I277 PolarHBondContact O-N 2.96Å
274Q88.3Confident87.5Confident82 Ų8266 Ų6638%0.38334%0.338SS..Hα-helixtrans-59.6-42.6173.7-167.5176.433.200112.4G270 E276 I277 E278 L327G270-Q274 PolarHBondContact O-N 3.1Å; Q274-E276 VanDerWaalsContact C-N 3.26Å; Q274-E276 PolarHBondContact O-N 3.25Å; Q274-I277 WeakPolarHBondContact O-CB 3.47Å; Q274-I277 PolarHBondContact O-N 3.28Å; Q274-E278 WeakPolarHBondContact O-CG 3.37Å; Q274-E278 PolarHBondContact O-N 3.3Å; Q274-L327 HydrophobicContact CB-CD2 4.19Å; Q274-L327 VanDerWaalsContact OE1-CD2 3.31Å
275K84.6Confident87.6Confident136 Ų13666.6 Ų66.659%0.59134%0.335SS*.Hα-helixtrans-66-26.8172.9-72.3178.2179.5179.70113.4K271 A272 T273 K279K271-K275 WeakPolarHBondContact O-CG 3.33Å; K271-K275 PolarHBondContact O-N 3.46Å; A272-K275 PolarHBondContact O-N 3.35Å; T273-K275 PolarHBondContact O-N 2.81Å; K275-K279 WeakPolarHBondContact O-CG 3.4Å; K275-K279 PolarHBondContact O-N 3.47Å
276E88Confident87.8Confident53 Ų5365.4 Ų65.425%0.24833%0.326CS..Hα-helixtrans-76.8-40.9173.9-164.156.7-142.500111W242 A272 T273 Q274 E278 K279 Q280W242-E276 HydrophobicContact CZ2-CB 4.36Å; W242-E276 HydrophobicContact CZ2-CG 4.06Å; A272-E276 PolarHBondContact O-N 2.82Å; T273-E276 CarbonylContact O-C 3.59Å; T273-E276 WeakPolarHBondContact O-CA 3.3Å; T273-E276 WeakPolarHBondContact O-CB 3.15Å; T273-E276 PolarHBondContact O-N 3.05Å; Q274-E276 VanDerWaalsContact C-N 3.26Å; Q274-E276 PolarHBondContact O-N 3.25Å; E276-E278 VanDerWaalsContact C-N 3.27Å; E276-E278 PolarHBondContact O-N 3.45Å; E276-K279 WeakPolarHBondContact O-CB 3.46Å; E276-K279 PolarHBondContact O-N 3.07Å; E276-K279 WeakPolarHBondContact OE2-CE 3.36Å; E276-K279 IonicContact OE2-NZ 2.83Å; E276-K279 PolarHBondContact OE2-NZ 2.94Å; E276-Q280 HydrophobicContact CG-CG 4.26Å; E276-Q280 WeakPolarHBondContact O-CG 3.41Å; E276-Q280 PolarHBondContact O-N 3.26Å; E276-Q280 PolarHBondContact OE1-NE2 3.11Å
277I89.4Confident87.9Confident27 Ų2763.9 Ų63.914%0.13832%0.32CS..Hα-helixtrans-52.5-45.9170-68.3166.6000110.5W242 T273 Q274 K279 Q280 K281 W316 T320 A323W242-I277 HydrophobicContact CH2-CG1 3.73Å; W242-I277 HydrophobicContact CZ2-CG1 4.29Å; T273-I277 HydrophobicContact CG2-CD1 4.4Å; T273-I277 WeakPolarHBondContact O-CG1 3.44Å; T273-I277 PolarHBondContact O-N 2.96Å; Q274-I277 WeakPolarHBondContact O-CB 3.47Å; Q274-I277 PolarHBondContact O-N 3.28Å; I277-K279 VanDerWaalsContact C-N 3.32Å; I277-K279 PolarHBondContact O-N 2.94Å; I277-Q280 PolarHBondContact O-N 3.13Å; I277-K281 WeakPolarHBondContact O-CB 3.22Å; I277-K281 PolarHBondContact O-N 3Å; I277-W316 HydrophobicContact CG2-CH2 4.06Å; I277-W316 HydrophobicContact CG2-CZ2 3.89Å; I277-W316 WeakPolarHBondContact O-CH2 3.39Å; I277-T320 HydrophobicContact CD1-CG2 4.08Å; I277-T320 HydrophobicContact CG1-CG2 4.03Å; I277-T320 HydrophobicContact CG2-CG2 3.75Å; I277-A323 HydrophobicContact CD1-CB 4Å
278E84.1Confident87.9Confident128 Ų12866.5 Ų66.560%0.59834%0.335SS*.Hα-helixtrans-59-38.3177-72.6177.3163.800113.4Q274 E276Q274-E278 WeakPolarHBondContact O-CG 3.37Å; Q274-E278 PolarHBondContact O-N 3.3Å; E276-E278 VanDerWaalsContact C-N 3.27Å; E276-E278 PolarHBondContact O-N 3.45Å
279K86.4Confident87.9Confident120 Ų12068.9 Ų68.952%0.52234%0.337SS..Hα-helixtrans-71-48174.4-63.8176.3-146.91560111.7K275 E276 I277 K281 V282K275-K279 WeakPolarHBondContact O-CG 3.4Å; K275-K279 PolarHBondContact O-N 3.47Å; E276-K279 WeakPolarHBondContact O-CB 3.46Å; E276-K279 PolarHBondContact O-N 3.07Å; E276-K279 WeakPolarHBondContact OE2-CE 3.36Å; E276-K279 IonicContact OE2-NZ 2.83Å; E276-K279 PolarHBondContact OE2-NZ 2.94Å; I277-K279 VanDerWaalsContact C-N 3.32Å; I277-K279 PolarHBondContact O-N 2.94Å; K279-K281 PolarHBondContact O-N 2.96Å; K279-V282 VanDerWaalsContact O-CB 3.31Å; K279-V282 WeakPolarHBondContact O-CB 3.39Å; K279-V282 PolarHBondContact O-N 3.46Å
280Q89.6Confident87.8Confident20 Ų2066.6 Ų66.69%0.09333%0.329CS..Hα-helixtrans-66.9-23.4-176.4-61.8-58.4-25.500112.4L239 W242 E276 I277 V282 H283 L284 W316L239-Q280 HydrophobicContact CD1-CB 3.92Å; W242-Q280 HydrophobicContact CD2-CB 4.47Å; W242-Q280 HydrophobicContact CD2-CG 3.78Å; W242-Q280 HydrophobicContact CE3-CB 4.28Å; W242-Q280 HydrophobicContact CE3-CG 4.1Å; W242-Q280 HydrophobicContact CG-CG 4.24Å; W242-Q280 HydrophobicContact CH2-CG 4.45Å; W242-Q280 HydrophobicContact CZ2-CG 4.12Å; W242-Q280 HydrophobicContact CZ3-CB 4.33Å; W242-Q280 HydrophobicContact CZ3-CG 4.42Å; E276-Q280 HydrophobicContact CG-CG 4.26Å; E276-Q280 WeakPolarHBondContact O-CG 3.41Å; E276-Q280 PolarHBondContact O-N 3.26Å; E276-Q280 PolarHBondContact OE1-NE2 3.11Å; I277-Q280 PolarHBondContact O-N 3.13Å; Q280-V282 PolarHBondContact O-N 2.96Å; Q280-H283 WeakPolarHBondContact O-CA 3.5Å; Q280-H283 WeakPolarHBondContact O-CB 3.39Å; Q280-H283 PolarHBondContact O-N 3.44Å; Q280-H283 PolarHBondContact OE1-CD2 3.21Å; Q280-H283 VanDerWaalsContact OE1-CD2 3.26Å; Q280-L284 PolarHBondContact O-N 3.12Å; Q280-W316 HydrophobicContact CB-CH2 3.78Å; Q280-W316 HydrophobicContact CB-CZ3 3.68Å
281K87.6Confident87.7Confident138 Ų13866.4 Ų66.460%0.633%0.327SS*.Hα-helixtrans-59-28.6170.1-166.2171-175.1171.10113.1I277 K279 K285 W316I277-K281 WeakPolarHBondContact O-CB 3.22Å; I277-K281 PolarHBondContact O-N 3Å; K279-K281 PolarHBondContact O-N 2.96Å; K281-K285 PolarHBondContact O-N 3.24Å; K281-K285 VanDerWaalsContact O-N 3.12Å; K281-W316 HydrophobicContact CB-CH2 4.17Å; K281-W316 HydrophobicContact CB-CZ2 3.91Å; K281-W316 HydrophobicContact CG-CZ2 4.29Å
282V86.3Confident87.7Confident100 Ų10066.3 Ų66.361%0.60633%0.328SS*.Hα-helixtrans-70.7-37.9173.1-174.30000111K279 Q280 K285 S286K279-V282 VanDerWaalsContact O-CB 3.31Å; K279-V282 WeakPolarHBondContact O-CB 3.39Å; K279-V282 PolarHBondContact O-N 3.46Å; Q280-V282 PolarHBondContact O-N 2.96Å; V282-K285 PolarHBondContact O-N 3.15Å; V282-S286 PolarHBondContact O-N 3.37Å
283H85.2Confident87.5Confident83 Ų8365.2 Ų65.238%0.38432%0.318SS..Hα-helixtrans-65.8-43.4173.7-72.9-69.5000111.8Q280 K285 S286 I287Q280-H283 WeakPolarHBondContact O-CA 3.5Å; Q280-H283 WeakPolarHBondContact O-CB 3.39Å; Q280-H283 PolarHBondContact O-N 3.44Å; Q280-H283 PolarHBondContact OE1-CD2 3.21Å; Q280-H283 VanDerWaalsContact OE1-CD2 3.26Å; H283-K285 VanDerWaalsContact C-N 3.32Å; H283-K285 PolarHBondContact O-N 3.32Å; H283-S286 PolarHBondContact O-N 3.41Å; H283-I287 WeakPolarHBondContact O-CD1 3.45Å; H283-I287 VanDerWaalsContact O-CG1 3.28Å; H283-I287 WeakPolarHBondContact O-CG1 3.42Å; H283-I287 PolarHBondContact O-N 3.25Å
284L89.5Confident87.4Confident20 Ų2064.4 Ų64.411%0.10531%0.314CS..Hα-helixtrans-55.1-47.8172.9-17763.8000111.3L239 Q280 S286 I287 T288 L312 W316L239-L284 HydrophobicContact CD2-CB 3.9Å; L239-L284 HydrophobicContact CD2-CD1 3.88Å; L239-L284 HydrophobicContact CD2-CG 4.48Å; Q280-L284 PolarHBondContact O-N 3.12Å; L284-S286 PolarHBondContact O-N 3.18Å; L284-I287 WeakPolarHBondContact O-CB 3.48Å; L284-I287 PolarHBondContact O-N 3.14Å; L284-I287 VanDerWaalsContact O-N 3.15Å; L284-T288 PolarHBondContact O-N 3.11Å; L284-T288 PolarHBondContact O-OG1 3Å; L284-T288 VanDerWaalsContact O-OG1 3.11Å; L284-L312 HydrophobicContact CD1-CD2 4.06Å; L284-L312 HydrophobicContact CD1-CG 4.28Å; L284-W316 HydrophobicContact CD2-CB 4.45Å; L284-W316 HydrophobicContact CD2-CD2 3.86Å; L284-W316 HydrophobicContact CD2-CG 3.76Å
285K86.4Confident87.2Confident128 Ų12861.2 Ų61.256%0.55730%0.298SS*.Hα-helixtrans-59.9-42.6177.3-166.7179.8-173.6-96.80112.7K281 V282 H283 I287 T288 E289K281-K285 PolarHBondContact O-N 3.24Å; K281-K285 VanDerWaalsContact O-N 3.12Å; V282-K285 PolarHBondContact O-N 3.15Å; H283-K285 VanDerWaalsContact C-N 3.32Å; H283-K285 PolarHBondContact O-N 3.32Å; K285-I287 VanDerWaalsContact C-N 3.34Å; K285-I287 PolarHBondContact O-N 3.45Å; K285-T288 PolarHBondContact O-N 2.81Å; K285-E289 WeakPolarHBondContact CE-OE1 3.32Å; K285-E289 IonicContact NZ-OE1 3.14Å; K285-E289 PolarHBondContact NZ-OE1 3.42Å; K285-E289 WeakPolarHBondContact O-CG 3.21Å; K285-E289 PolarHBondContact O-N 2.9Å
286S86.7Confident87.1Confident26 Ų2659.6 Ų59.618%0.18230%0.3CS..Hα-helixtrans-61.4-41.1174.9-178.70000111.8K231 E235 V282 H283 L284 E289 V290K231-S286 PolarHBondContact NZ-OG 3.34Å; E235-S286 WeakPolarHBondContact OE2-CB 3.11Å; E235-S286 PolarHBondContact OE2-OG 2.71Å; V282-S286 PolarHBondContact O-N 3.37Å; H283-S286 PolarHBondContact O-N 3.41Å; L284-S286 PolarHBondContact O-N 3.18Å; S286-E289 PolarHBondContact O-N 3.31Å; S286-V290 WeakPolarHBondContact O-CB 3.49Å; S286-V290 WeakPolarHBondContact O-CG2 3.29Å; S286-V290 PolarHBondContact O-N 3.23Å
287I90.9Very high87Confident0 Ų058.1 Ų58.10%030%0.295CS..Hα-helixtrans-63.8-44.1177.5-64.6157000110.7M232 E235 L239 H283 L284 K285 V290 G291 L309 L312M232-I287 HydrophobicContact CG-CG2 4.47Å; E235-I287 HydrophobicContact CB-CD1 4.03Å; E235-I287 HydrophobicContact CB-CG1 3.46Å; E235-I287 VanDerWaalsContact CB-CG1 3.46Å; E235-I287 WeakPolarHBondContact O-CD1 3.34Å; L239-I287 HydrophobicContact CB-CD1 4Å; L239-I287 HydrophobicContact CD2-CD1 3.79Å; H283-I287 WeakPolarHBondContact O-CD1 3.45Å; H283-I287 VanDerWaalsContact O-CG1 3.28Å; H283-I287 WeakPolarHBondContact O-CG1 3.42Å; H283-I287 PolarHBondContact O-N 3.25Å; L284-I287 WeakPolarHBondContact O-CB 3.48Å; L284-I287 PolarHBondContact O-N 3.14Å; L284-I287 VanDerWaalsContact O-N 3.15Å; K285-I287 VanDerWaalsContact C-N 3.34Å; K285-I287 PolarHBondContact O-N 3.45Å; I287-V290 PolarHBondContact O-N 2.7Å; I287-G291 PolarHBondContact O-N 2.72Å; I287-L309 HydrophobicContact CG2-CD2 3.87Å; I287-L312 HydrophobicContact CB-CD2 4.49Å; I287-L312 HydrophobicContact CD1-CD2 3.97Å; I287-L312 HydrophobicContact CG2-CD2 3.81Å
288T87.7Confident86.5Confident59 Ų5957.8 Ų57.836%0.36229%0.293SS..Hα-helixtrans-61.3-47.7174.6-48.60000111.5L284 K285 V290 G291 E292L284-T288 PolarHBondContact O-N 3.11Å; L284-T288 PolarHBondContact O-OG1 3Å; L284-T288 VanDerWaalsContact O-OG1 3.11Å; K285-T288 PolarHBondContact O-N 2.81Å; T288-V290 VanDerWaalsContact C-N 3.29Å; T288-V290 PolarHBondContact O-N 3.33Å; T288-G291 WeakPolarHBondContact O-CA 3.37Å; T288-G291 PolarHBondContact O-N 3.18Å; T288-G291 VanDerWaalsContact O-N 3.09Å; T288-E292 WeakPolarHBondContact O-CG 3.35Å; T288-E292 PolarHBondContact O-N 3.28Å
289E87.8Confident86.1Confident108 Ų10853.7 Ų53.751%0.50529%0.285SS..Hα-helixtrans-60.5-36.2177.5-73.6173.4-169.500112.6K285 S286 A293K285-E289 WeakPolarHBondContact CE-OE1 3.32Å; K285-E289 IonicContact NZ-OE1 3.14Å; K285-E289 PolarHBondContact NZ-OE1 3.42Å; K285-E289 WeakPolarHBondContact O-CG 3.21Å; K285-E289 PolarHBondContact O-N 2.9Å; S286-E289 PolarHBondContact O-N 3.31Å; E289-A293 WeakPolarHBondContact O-CB 3.41Å; E289-A293 PolarHBondContact O-N 3.02Å; E289-A293 VanDerWaalsContact O-N 3.1Å
290V88.5Confident85.4Confident7 Ų758.3 Ų58.34%0.04231%0.305CS..Hα-helixtrans-73.1-35.5174.4176.50000111.8L228 K231 M232 S286 I287 T288 A293 L294L228-V290 HydrophobicContact CD2-CG1 4.25Å; K231-V290 HydrophobicContact CB-CG1 4.14Å; K231-V290 HydrophobicContact CD-CG1 4.35Å; K231-V290 HydrophobicContact CD-CG2 3.5Å; K231-V290 VanDerWaalsContact CE-CG2 3.46Å; K231-V290 HydrophobicContact CG-CG1 4.32Å; K231-V290 HydrophobicContact CG-CG2 4.1Å; M232-V290 HydrophobicContact CB-CG1 3.88Å; S286-V290 WeakPolarHBondContact O-CB 3.49Å; S286-V290 WeakPolarHBondContact O-CG2 3.29Å; S286-V290 PolarHBondContact O-N 3.23Å; I287-V290 PolarHBondContact O-N 2.7Å; T288-V290 VanDerWaalsContact C-N 3.29Å; T288-V290 PolarHBondContact O-N 3.33Å; V290-A293 PolarHBondContact O-N 2.82Å; V290-L294 VanDerWaalsContact O-CB 3.31Å; V290-L294 WeakPolarHBondContact O-CB 3.38Å; V290-L294 PolarHBondContact O-N 3.44Å
291G88.6Confident84.5Confident0 Ų060.8 Ų60.80%032%0.316CS..Hα-helixtrans-63.1-4817400000112.2I287 T288 A293 L294 K295I287-G291 PolarHBondContact O-N 2.72Å; T288-G291 WeakPolarHBondContact O-CA 3.37Å; T288-G291 PolarHBondContact O-N 3.18Å; T288-G291 VanDerWaalsContact O-N 3.09Å; G291-A293 PolarHBondContact O-N 2.73Å; G291-L294 CarbonylContact O-C 3.6Å; G291-L294 WeakPolarHBondContact O-CA 3.42Å; G291-L294 WeakPolarHBondContact O-CB 3.24Å; G291-L294 PolarHBondContact O-N 3.43Å; G291-K295 PolarHBondContact O-N 3.16Å
292E87.7Confident83.9Confident85 Ų8557.9 Ų57.940%0.39730%0.304SS..Hα-helixtrans-64.6-37.7175.7-66.4-55.6134.800112.3T288 L294 K295 T296T288-E292 WeakPolarHBondContact O-CG 3.35Å; T288-E292 PolarHBondContact O-N 3.28Å; E292-L294 PolarHBondContact O-N 3.13Å; E292-K295 PolarHBondContact O-N 2.86Å; E292-K295 WeakPolarHBondContact OE1-CD 3.46Å; E292-K295 WeakPolarHBondContact OE1-CE 3.4Å; E292-K295 IonicContact OE1-NZ 3.85Å; E292-K295 PolarHBondContact OE1-NZ 3.37Å; E292-K295 IonicContact OE2-NZ 3.7Å; E292-T296 PolarHBondContact O-N 3.21Å; E292-T296 VanDerWaalsContact O-N 3.13Å; E292-T296 PolarHBondContact O-OG1 3.08Å
293A85.6Confident83.4Confident33 Ų3357.3 Ų57.327%0.27330%0.301SS..Hα-helixtrans-65-22.1171.500000113.4L228 E289 V290 G291 T296 V297L228-A293 HydrophobicContact CD1-CB 4.26Å; L228-A293 WeakPolarHBondContact CD1-O 3.5Å; L228-A293 HydrophobicContact CD2-CB 4.06Å; E289-A293 WeakPolarHBondContact O-CB 3.41Å; E289-A293 PolarHBondContact O-N 3.02Å; E289-A293 VanDerWaalsContact O-N 3.1Å; V290-A293 PolarHBondContact O-N 2.82Å; G291-A293 PolarHBondContact O-N 2.73Å; A293-T296 WeakPolarHBondContact CA-OG1 3.42Å; A293-T296 PolarHBondContact O-OG1 3.03Å; A293-V297 WeakPolarHBondContact O-CG2 3.2Å
294L87Confident82.8Confident0 Ų056.5 Ų56.50%030%0.299CS..Hα-helixtrans-90.2-39.5178.1-175.255.1000111.5V149 L228 M232 V290 G291 E292 T296 V297 L298 V305V149-L294 HydrophobicContact CG1-CD2 3.56Å; V149-L294 HydrophobicContact CG1-CG 4.27Å; L228-L294 HydrophobicContact CB-CB 4.3Å; L228-L294 HydrophobicContact CB-CD1 3.91Å; M232-L294 HydrophobicContact SD-CD2 3.96Å; V290-L294 VanDerWaalsContact O-CB 3.31Å; V290-L294 WeakPolarHBondContact O-CB 3.38Å; V290-L294 PolarHBondContact O-N 3.44Å; G291-L294 CarbonylContact O-C 3.6Å; G291-L294 WeakPolarHBondContact O-CA 3.42Å; G291-L294 WeakPolarHBondContact O-CB 3.24Å; G291-L294 PolarHBondContact O-N 3.43Å; E292-L294 PolarHBondContact O-N 3.13Å; L294-T296 PolarHBondContact O-N 2.67Å; L294-V297 PolarHBondContact O-N 2.94Å; L294-L298 HydrophobicContact CD1-CD1 4.48Å; L294-L298 HydrophobicContact CG-CD1 4.18Å; L294-L298 WeakPolarHBondContact O-CG 3.36Å; L294-L298 PolarHBondContact O-N 3.28Å; L294-L298 VanDerWaalsContact O-N 3.12Å; L294-V305 HydrophobicContact CB-CG2 4.46Å; L294-V305 HydrophobicContact CD2-CG2 4.1Å; L294-V305 HydrophobicContact CG-CG2 3.97Å
295K84.2Confident82.7Confident15 Ų1555.5 Ų55.57%0.06529%0.294CS..Hα-helixtrans-50.6-53.7168.3-79.8-174.7178.9173.20111.4G291 E292 V297 L298 G299 E302 V305 E306G291-K295 PolarHBondContact O-N 3.16Å; E292-K295 PolarHBondContact O-N 2.86Å; E292-K295 WeakPolarHBondContact OE1-CD 3.46Å; E292-K295 WeakPolarHBondContact OE1-CE 3.4Å; E292-K295 IonicContact OE1-NZ 3.85Å; E292-K295 PolarHBondContact OE1-NZ 3.37Å; E292-K295 IonicContact OE2-NZ 3.7Å; K295-V297 PolarHBondContact O-N 3.37Å; K295-L298 WeakPolarHBondContact O-CA 3.49Å; K295-L298 PolarHBondContact O-N 2.68Å; K295-G299 PolarHBondContact O-N 2.64Å; K295-E302 HydrophobicContact CB-CB 4.24Å; K295-E302 HydrophobicContact CB-CG 3.64Å; K295-E302 HydrophobicContact CD-CB 4.24Å; K295-E302 HydrophobicContact CD-CG 4.42Å; K295-E302 HydrophobicContact CG-CB 3.9Å; K295-E302 HydrophobicContact CG-CG 3.89Å; K295-V305 HydrophobicContact CG-CB 4.09Å; K295-V305 HydrophobicContact CG-CG1 4.29Å; K295-V305 HydrophobicContact CG-CG2 4.49Å; K295-E306 WeakPolarHBondContact CE-OE1 3.49Å; K295-E306 IonicContact NZ-OE1 2.72Å; K295-E306 PolarHBondContact NZ-OE1 2.96Å; K295-E306 IonicContact NZ-OE2 2.7Å
296T83.1Confident82.5Confident102 Ų10253.7 Ų53.763%0.62629%0.287SS*.Hα-helixtrans-61.3-13.317647.20000115.5E292 A293 L294E292-T296 PolarHBondContact O-N 3.21Å; E292-T296 VanDerWaalsContact O-N 3.13Å; E292-T296 PolarHBondContact O-OG1 3.08Å; A293-T296 WeakPolarHBondContact CA-OG1 3.42Å; A293-T296 PolarHBondContact O-OG1 3.03Å; L294-T296 PolarHBondContact O-N 2.67Å
297V84Confident82.2Confident22 Ų2257.5 Ų57.513%0.13331%0.306CS..Hα-helixtrans-95.1-19.6171.8174.60000112.3K224 C225 L228 A293 L294 K295K224-V297 HydrophobicContact CD-CG2 3.6Å; K224-V297 VanDerWaalsContact CE-CG2 3.47Å; K224-V297 HydrophobicContact CG-CG2 4.01Å; C225-V297 HydrophobicContact CB-CG1 3.81Å; L228-V297 HydrophobicContact CD1-CG2 4.05Å; A293-V297 WeakPolarHBondContact O-CG2 3.2Å; L294-V297 PolarHBondContact O-N 2.94Å; K295-V297 PolarHBondContact O-N 3.37Å
298L79.6Confident81.7Confident19 Ų1960.9 Ų60.910%0.09932%0.321CS..Hα-helixtrans-93.3-28.1179.4-66.8165.2000113T146 V149 L294 K295 K300 K301 V305T146-L298 HydrophobicContact CG2-CD2 3.82Å; V149-L298 HydrophobicContact CG2-CD1 3.69Å; V149-L298 HydrophobicContact CG2-CD2 4.42Å; L294-L298 HydrophobicContact CD1-CD1 4.48Å; L294-L298 HydrophobicContact CG-CD1 4.18Å; L294-L298 WeakPolarHBondContact O-CG 3.36Å; L294-L298 PolarHBondContact O-N 3.28Å; L294-L298 VanDerWaalsContact O-N 3.12Å; K295-L298 WeakPolarHBondContact O-CA 3.49Å; K295-L298 PolarHBondContact O-N 2.68Å; L298-K300 PolarHBondContact O-N 2.88Å; L298-K300 VanDerWaalsContact O-N 3.09Å; L298-K301 HydrophobicContact CB-CB 4.5Å; L298-V305 HydrophobicContact CD1-CG2 3.49Å; L298-V305 VanDerWaalsContact CD1-CG2 3.49Å
299G75.5Confident81.8Confident42 Ų4259.1 Ų59.143%0.43331%0.309SS..SBendtrans64.8-104.2175.400000112.5K295 K301 E302K295-G299 PolarHBondContact O-N 2.64Å; G299-K301 PolarHBondContact O-N 3.13Å; G299-E302 VanDerWaalsContact O-CG 3.25Å; G299-E302 WeakPolarHBondContact O-CG 3.41Å
300K72.1Confident81.5Confident217 Ų21756.9 Ų56.994%0.94331%0.305SS*.THydrogen-bonded Turntrans-748.8-178.4-65-169.4177-1730115L298L298-K300 PolarHBondContact O-N 2.88Å; L298-K300 VanDerWaalsContact O-N 3.09Å
301K70.2Confident81.4Confident72 Ų7261.5 Ų61.531%0.31333%0.329SS..THydrogen-bonded Turntrans-131.938.7-174.6-61-174.2-172.4174.40113.1T146 L298 G299 T303 L304T146-K301 WeakPolarHBondContact O-CD 3.32Å; T146-K301 PolarHBondContact O-NZ 3.3Å; L298-K301 HydrophobicContact CB-CB 4.5Å; G299-K301 PolarHBondContact O-N 3.13Å; K301-T303 VanDerWaalsContact C-N 3.34Å; K301-T303 PolarHBondContact O-N 3.18Å; K301-L304 HydrophobicContact CB-CD1 4.39Å
302E75Confident81.4Confident78 Ų7861.6 Ų61.636%0.36433%0.33SS..THydrogen-bonded Turntrans-69.2-27.8-176.4-73.6173.1176.200114K295 G299 L304 V305 E306K295-E302 HydrophobicContact CB-CB 4.24Å; K295-E302 HydrophobicContact CB-CG 3.64Å; K295-E302 HydrophobicContact CD-CB 4.24Å; K295-E302 HydrophobicContact CD-CG 4.42Å; K295-E302 HydrophobicContact CG-CB 3.9Å; K295-E302 HydrophobicContact CG-CG 3.89Å; G299-E302 VanDerWaalsContact O-CG 3.25Å; G299-E302 WeakPolarHBondContact O-CG 3.41Å; E302-L304 PolarHBondContact O-N 3.36Å; E302-L304 VanDerWaalsContact O-N 3.16Å; E302-V305 PolarHBondContact O-N 3.08Å; E302-E306 PolarHBondContact O-N 3.46Å
303T76.5Confident81.5Confident88 Ų8861 Ų6154%0.5433%0.329SS..Hα-helixtrans-53.4-36.5179.852.60000113.5K301 V305 E306 D307K301-T303 VanDerWaalsContact C-N 3.34Å; K301-T303 PolarHBondContact O-N 3.18Å; T303-V305 PolarHBondContact O-N 3.2Å; T303-E306 WeakPolarHBondContact O-CB 3.29Å; T303-E306 PolarHBondContact O-N 3.17Å; T303-D307 PolarHBondContact O-N 3.14Å
304L73.4Confident81.5Confident65 Ų6562.9 Ų62.934%0.3434%0.34SS..Hα-helixtrans-60.1-15.5177.6-61.9174.7000114.6V149 K301 E302V149-L304 HydrophobicContact CG2-CB 3.66Å; V149-L304 HydrophobicContact CG2-CD1 4.27Å; K301-L304 HydrophobicContact CB-CD1 4.39Å; E302-L304 PolarHBondContact O-N 3.36Å; E302-L304 VanDerWaalsContact O-N 3.16Å
305V85.4Confident81.6Confident0 Ų066.2 Ų66.20%036%0.358CS..Hα-helixtrans-101.5-36.5174.4-176.60000110.9V149 M232 L294 K295 L298 E302 T303 D307 K308 L309V149-V305 HydrophobicContact CG2-CG2 4.11Å; M232-V305 HydrophobicContact CE-CG1 3.89Å; M232-V305 HydrophobicContact SD-CG1 4.05Å; L294-V305 HydrophobicContact CB-CG2 4.46Å; L294-V305 HydrophobicContact CD2-CG2 4.1Å; L294-V305 HydrophobicContact CG-CG2 3.97Å; K295-V305 HydrophobicContact CG-CB 4.09Å; K295-V305 HydrophobicContact CG-CG1 4.29Å; K295-V305 HydrophobicContact CG-CG2 4.49Å; L298-V305 HydrophobicContact CD1-CG2 3.49Å; L298-V305 VanDerWaalsContact CD1-CG2 3.49Å; E302-V305 PolarHBondContact O-N 3.08Å; T303-V305 PolarHBondContact O-N 3.2Å; V305-D307 PolarHBondContact O-N 3.09Å; V305-K308 PolarHBondContact O-N 3.03Å; V305-L309 HydrophobicContact CG1-CD1 3.99Å; V305-L309 HydrophobicContact CG1-CG 4.33Å; V305-L309 PolarHBondContact O-N 3.48Å
306E82.8Confident82Confident89 Ų8966.5 Ų66.542%0.41636%0.358SS..Hα-helixtrans-53.9-52.2179.9-156.3100.1-106.800111.8K295 E302 T303 K308 L309 S310K295-E306 WeakPolarHBondContact CE-OE1 3.49Å; K295-E306 IonicContact NZ-OE1 2.72Å; K295-E306 PolarHBondContact NZ-OE1 2.96Å; K295-E306 IonicContact NZ-OE2 2.7Å; E302-E306 PolarHBondContact O-N 3.46Å; T303-E306 WeakPolarHBondContact O-CB 3.29Å; T303-E306 PolarHBondContact O-N 3.17Å; E306-K308 PolarHBondContact O-N 3Å; E306-K308 VanDerWaalsContact O-N 3.14Å; E306-L309 PolarHBondContact O-N 3.29Å; E306-S310 PolarHBondContact O-N 3.29Å; E306-S310 PolarHBondContact O-OG 2.93Å
307D80.1Confident82.4Confident106 Ų10666 Ų6657%0.56735%0.351SS*.Hα-helixtrans-58.7-31.1-177-57.6-22000113T303 V305 S310 L311T303-D307 PolarHBondContact O-N 3.14Å; V305-D307 PolarHBondContact O-N 3.09Å; D307-S310 PolarHBondContact O-OG 3.24Å; D307-S310 VanDerWaalsContact O-OG 3.08Å; D307-L311 PolarHBondContact O-N 3.48Å
308K81.8Confident82.5Confident72 Ų7267.2 Ų67.231%0.31336%0.364SS..Hα-helixtrans-82.3-33.9179.1-66.2-167.1-179.8-169.20112.4E150 M232 M236 V305 E306 L312E150-K308 IonicContact OE1-NZ 2.7Å; E150-K308 PolarHBondContact OE1-NZ 2.8Å; E150-K308 IonicContact OE2-NZ 2.71Å; M232-K308 HydrophobicContact CE-CB 4.04Å; M236-K308 HydrophobicContact CE-CB 4.04Å; M236-K308 VanDerWaalsContact CE-O 3.29Å; M236-K308 WeakPolarHBondContact CE-O 3.33Å; M236-K308 HydrophobicContact SD-CB 4.22Å; V305-K308 PolarHBondContact O-N 3.03Å; E306-K308 PolarHBondContact O-N 3Å; E306-K308 VanDerWaalsContact O-N 3.14Å; K308-L312 WeakPolarHBondContact O-CB 3.43Å; K308-L312 PolarHBondContact O-N 3.01Å
309L88.4Confident82.9Confident21 Ų2166.9 Ų66.911%0.1136%0.363CS..Hα-helixtrans-71.9-41.2174.8-69.8174.8000111.2M232 I287 V305 E306 L312 N313M232-L309 HydrophobicContact CE-CD2 3.8Å; M232-L309 HydrophobicContact CE-CG 3.92Å; I287-L309 HydrophobicContact CG2-CD2 3.87Å; V305-L309 HydrophobicContact CG1-CD1 3.99Å; V305-L309 HydrophobicContact CG1-CG 4.33Å; V305-L309 PolarHBondContact O-N 3.48Å; E306-L309 PolarHBondContact O-N 3.29Å; L309-L312 PolarHBondContact O-N 2.88Å; L309-N313 WeakPolarHBondContact O-CB 3.49Å; L309-N313 PolarHBondContact O-N 2.96Å
310S82.5Confident83.7Confident61 Ų6166 Ų6643%0.42735%0.348SS..Hα-helixtrans-63.5-48.8-18063.40000111.5E306 D307 L312 N313 S314E306-S310 PolarHBondContact O-N 3.29Å; E306-S310 PolarHBondContact O-OG 2.93Å; D307-S310 PolarHBondContact O-OG 3.24Å; D307-S310 VanDerWaalsContact O-OG 3.08Å; S310-L312 VanDerWaalsContact C-N 3.34Å; S310-L312 PolarHBondContact O-N 3.35Å; S310-N313 PolarHBondContact O-N 3.22Å; S310-N313 VanDerWaalsContact O-N 3.17Å; S310-S314 PolarHBondContact O-N 3.4Å; S310-S314 PolarHBondContact O-OG 2.98Å
311L85.3Confident84.4Confident104 Ų10457.6 Ų57.655%0.54532%0.317SS..Hα-helixtrans-59.3-42.5177-178.961.5000112.6D307 N315D307-L311 PolarHBondContact O-N 3.48Å; L311-N315 PolarHBondContact O-N 3.39Å; L311-N315 VanDerWaalsContact O-N 3.09Å
312L89.8Confident85.3Confident3 Ų358.2 Ų58.22%0.01632%0.318CS..Hα-helixtrans-63.7-42.5176.1-17666.9000111.8M236 L239 L243 L284 I287 K308 L309 S310 N315 W316M236-L312 HydrophobicContact CE-CB 4.31Å; M236-L312 HydrophobicContact CG-CD1 4.35Å; M236-L312 HydrophobicContact CG-CD2 4.11Å; L239-L312 HydrophobicContact CB-CD1 4.46Å; L239-L312 HydrophobicContact CD2-CD1 4.18Å; L239-L312 HydrophobicContact CD2-CD2 4.16Å; L239-L312 HydrophobicContact CD2-CG 4.29Å; L239-L312 HydrophobicContact CG-CD1 4.4Å; L243-L312 HydrophobicContact CD1-CD1 4.24Å; L284-L312 HydrophobicContact CD1-CD2 4.06Å; L284-L312 HydrophobicContact CD1-CG 4.28Å; I287-L312 HydrophobicContact CB-CD2 4.49Å; I287-L312 HydrophobicContact CD1-CD2 3.97Å; I287-L312 HydrophobicContact CG2-CD2 3.81Å; K308-L312 WeakPolarHBondContact O-CB 3.43Å; K308-L312 PolarHBondContact O-N 3.01Å; L309-L312 PolarHBondContact O-N 2.88Å; S310-L312 VanDerWaalsContact C-N 3.34Å; S310-L312 PolarHBondContact O-N 3.35Å; L312-N315 PolarHBondContact O-N 2.87Å; L312-W316 WeakPolarHBondContact O-CB 3.45Å; L312-W316 PolarHBondContact O-N 3.2Å
313N89Confident85.9Confident73 Ų7355 Ų5539%0.3930%0.304SS..Hα-helixtrans-68.3-38.4-179.8-167.354.6000111.9L309 S310 W316 I317L309-N313 WeakPolarHBondContact O-CB 3.49Å; L309-N313 PolarHBondContact O-N 2.96Å; S310-N313 PolarHBondContact O-N 3.22Å; S310-N313 VanDerWaalsContact O-N 3.17Å; N313-W316 WeakPolarHBondContact O-CB 3.48Å; N313-W316 PolarHBondContact O-N 2.96Å; N313-I317 VanDerWaalsContact O-CG1 3.28Å; N313-I317 WeakPolarHBondContact O-CG1 3.41Å; N313-I317 PolarHBondContact O-N 2.92Å
314S86.3Confident86.4Confident71 Ų7156 Ų5650%0.49730%0.303SS..Hα-helixtrans-62.7-46173.5-640000112.1S310 W316 I317 A318S310-S314 PolarHBondContact O-N 3.4Å; S310-S314 PolarHBondContact O-OG 2.98Å; S314-W316 VanDerWaalsContact C-N 3.34Å; S314-W316 PolarHBondContact O-N 3.4Å; S314-I317 PolarHBondContact O-N 3.29Å; S314-A318 WeakPolarHBondContact O-CB 3.32Å; S314-A318 PolarHBondContact O-N 2.64Å
315N87.9Confident86.9Confident71 Ų7158.8 Ų58.838%0.3831%0.314SS..Hα-helixtrans-63.7-39.8175.3-71.4-15.5000111.9L243 L311 L312 A318 V319L243-N315 HydrophobicContact CD1-CB 4.19Å; L311-N315 PolarHBondContact O-N 3.39Å; L311-N315 VanDerWaalsContact O-N 3.09Å; L312-N315 PolarHBondContact O-N 2.87Å; N315-A318 PolarHBondContact O-N 2.97Å; N315-V319 WeakPolarHBondContact O-CG2 3.33Å; N315-V319 PolarHBondContact O-N 3.44Å; N315-V319 VanDerWaalsContact O-N 3.12Å
316W93.9Very high87.1Confident20 Ų2059.6 Ų59.68%0.07632%0.317CS..Hα-helixtrans-58.5-51.5174.1173.8-89.6000111.8L239 W242 L243 I277 Q280 K281 L284 L312 N313 S314 A318 T320L239-W316 HydrophobicContact CD1-CE3 4.04Å; L239-W316 HydrophobicContact CD1-CZ3 3.78Å; L239-W316 HydrophobicContact CD2-CE3 4.24Å; L239-W316 HydrophobicContact CG-CE3 4.4Å; W242-W316 HydrophobicContact CE3-CZ3 4.31Å; W242-W316 HydrophobicContact CH2-CZ3 4.42Å; W242-W316 HydrophobicContact CZ3-CE3 4.26Å; W242-W316 HydrophobicContact CZ3-CH2 4.44Å; W242-W316 AromaticContact CZ3-CZ3 3.68Å; W242-W316 HydrophobicContact CZ3-CZ3 3.68Å; L243-W316 HydrophobicContact CD1-CB 4.38Å; L243-W316 HydrophobicContact CD2-CE3 4.05Å; I277-W316 HydrophobicContact CG2-CH2 4.06Å; I277-W316 HydrophobicContact CG2-CZ2 3.89Å; I277-W316 WeakPolarHBondContact O-CH2 3.39Å; Q280-W316 HydrophobicContact CB-CH2 3.78Å; Q280-W316 HydrophobicContact CB-CZ3 3.68Å; K281-W316 HydrophobicContact CB-CH2 4.17Å; K281-W316 HydrophobicContact CB-CZ2 3.91Å; K281-W316 HydrophobicContact CG-CZ2 4.29Å; L284-W316 HydrophobicContact CD2-CB 4.45Å; L284-W316 HydrophobicContact CD2-CD2 3.86Å; L284-W316 HydrophobicContact CD2-CG 3.76Å; L312-W316 WeakPolarHBondContact O-CB 3.45Å; L312-W316 PolarHBondContact O-N 3.2Å; N313-W316 WeakPolarHBondContact O-CB 3.48Å; N313-W316 PolarHBondContact O-N 2.96Å; S314-W316 VanDerWaalsContact C-N 3.34Å; S314-W316 PolarHBondContact O-N 3.4Å; W316-A318 PolarHBondContact O-N 2.9Å; W316-T320 HydrophobicContact CD2-CG2 4.01Å; W316-T320 HydrophobicContact CE3-CG2 4.4Å; W316-T320 HydrophobicContact CG-CG2 4.45Å; W316-T320 HydrophobicContact CH2-CG2 4.27Å; W316-T320 HydrophobicContact CZ2-CG2 3.89Å; W316-T320 WeakPolarHBondContact O-CB 3.49Å; W316-T320 VanDerWaalsContact O-CG2 3.27Å; W316-T320 WeakPolarHBondContact O-CG2 3.41Å; W316-T320 PolarHBondContact O-N 2.92Å; W316-T320 PolarHBondContact O-OG1 3.35Å
317I90.9Very high87.5Confident91 Ų9155.6 Ų55.647%0.46730%0.298SS..Hα-helixtrans-58.8-49.6179.1-68.7164.1000110.4N313 S314 V319 T320 S321N313-I317 VanDerWaalsContact O-CG1 3.28Å; N313-I317 WeakPolarHBondContact O-CG1 3.41Å; N313-I317 PolarHBondContact O-N 2.92Å; S314-I317 PolarHBondContact O-N 3.29Å; I317-V319 PolarHBondContact O-N 3.23Å; I317-T320 PolarHBondContact O-N 3.38Å; I317-T320 PolarHBondContact O-OG1 2.87Å; I317-S321 WeakPolarHBondContact O-CB 3.45Å; I317-S321 PolarHBondContact O-N 3.04Å; I317-S321 PolarHBondContact O-OG 3.32Å; I317-S321 VanDerWaalsContact O-OG 3.09Å
318A85.4Confident87.9Confident49 Ų4954.6 Ų54.641%0.40529%0.293SS..Hα-helixtrans-61.2-41.2-176.700000114.1S314 N315 W316 S321 R322S314-A318 WeakPolarHBondContact O-CB 3.32Å; S314-A318 PolarHBondContact O-N 2.64Å; N315-A318 PolarHBondContact O-N 2.97Å; W316-A318 PolarHBondContact O-N 2.9Å; A318-S321 PolarHBondContact O-OG 3.3Å; A318-R322 WeakPolarHBondContact O-CG 3.45Å; A318-R322 PolarHBondContact O-N 3.01Å
319V89.5Confident88.1Confident12 Ų1253.8 Ų53.87%0.07329%0.292CS..Hα-helixtrans-77-39.7179.6179.40000111.2L243 T246 D247 N315 I317 A323L243-V319 HydrophobicContact CD2-CB 3.79Å; L243-V319 HydrophobicContact CD2-CG1 4.15Å; L243-V319 HydrophobicContact CD2-CG2 4.1Å; T246-V319 HydrophobicContact CG2-CG1 3.82Å; D247-V319 HydrophobicContact CB-CG1 4.39Å; D247-V319 HydrophobicContact CB-CG2 3.91Å; N315-V319 WeakPolarHBondContact O-CG2 3.33Å; N315-V319 PolarHBondContact O-N 3.44Å; N315-V319 VanDerWaalsContact O-N 3.12Å; I317-V319 PolarHBondContact O-N 3.23Å; V319-A323 WeakPolarHBondContact O-CB 3.47Å; V319-A323 PolarHBondContact O-N 2.95Å
320T91.3Very high88.1Confident22 Ų2252.8 Ų52.814%0.13529%0.287CS..Hα-helixtrans-70.1-38.2179.856.20000112.9I277 W316 I317 A323 E324I277-T320 HydrophobicContact CD1-CG2 4.08Å; I277-T320 HydrophobicContact CG1-CG2 4.03Å; I277-T320 HydrophobicContact CG2-CG2 3.75Å; W316-T320 HydrophobicContact CD2-CG2 4.01Å; W316-T320 HydrophobicContact CE3-CG2 4.4Å; W316-T320 HydrophobicContact CG-CG2 4.45Å; W316-T320 HydrophobicContact CH2-CG2 4.27Å; W316-T320 HydrophobicContact CZ2-CG2 3.89Å; W316-T320 WeakPolarHBondContact O-CB 3.49Å; W316-T320 VanDerWaalsContact O-CG2 3.27Å; W316-T320 WeakPolarHBondContact O-CG2 3.41Å; W316-T320 PolarHBondContact O-N 2.92Å; W316-T320 PolarHBondContact O-OG1 3.35Å; I317-T320 PolarHBondContact O-N 3.38Å; I317-T320 PolarHBondContact O-OG1 2.87Å; T320-A323 PolarHBondContact O-N 3.13Å; T320-E324 WeakPolarHBondContact O-CB 3.43Å; T320-E324 PolarHBondContact O-N 3.06Å
321S87.7Confident88.4Confident42 Ų4252.7 Ų52.729%0.29428%0.281SS..Hα-helixtrans-65.4-47.8176.5670000111.4I317 A318 A323 E324 E325I317-S321 WeakPolarHBondContact O-CB 3.45Å; I317-S321 PolarHBondContact O-N 3.04Å; I317-S321 PolarHBondContact O-OG 3.32Å; I317-S321 VanDerWaalsContact O-OG 3.09Å; A318-S321 PolarHBondContact O-OG 3.3Å; S321-A323 VanDerWaalsContact C-N 3.28Å; S321-A323 PolarHBondContact O-N 3.42Å; S321-E324 PolarHBondContact O-N 3.02Å; S321-E324 VanDerWaalsContact O-N 3.15Å; S321-E325 WeakPolarHBondContact O-CB 3.41Å; S321-E325 WeakPolarHBondContact O-CG 3.22Å; S321-E325 PolarHBondContact O-N 3.05Å
322R87.3Confident88.4Confident85 Ų8551.5 Ų51.532%0.32127%0.273SS..Hα-helixtrans-61.5-35.3176.1-71.9176.857.7-155.3-9.6112.4D247 L250 T251 A318 W326D247-R322 IonicContact OD1-CZ 3.53Å; D247-R322 IonicContact OD1-NH1 2.83Å; D247-R322 PolarHBondContact OD1-NH1 2.92Å; D247-R322 IonicContact OD1-NH2 3.67Å; L250-R322 HydrophobicContact CD2-CB 3.43Å; L250-R322 VanDerWaalsContact CD2-CB 3.43Å; T251-R322 PolarHBondContact OG1-NH2 3.34Å; A318-R322 WeakPolarHBondContact O-CG 3.45Å; A318-R322 PolarHBondContact O-N 3.01Å; R322-W326 WeakPolarHBondContact O-CB 3.47Å; R322-W326 PolarHBondContact O-N 3.22Å
323A88Confident88.2Confident9 Ų952.4 Ų52.47%0.07428%0.276CS..Hα-helixtrans-68.8-37.3175.900000112.6L250 I277 V319 T320 S321 L327L250-A323 HydrophobicContact CD1-CB 4.31Å; L250-A323 HydrophobicContact CD2-CB 4.42Å; I277-A323 HydrophobicContact CD1-CB 4Å; V319-A323 WeakPolarHBondContact O-CB 3.47Å; V319-A323 PolarHBondContact O-N 2.95Å; T320-A323 PolarHBondContact O-N 3.13Å; S321-A323 VanDerWaalsContact C-N 3.28Å; S321-A323 PolarHBondContact O-N 3.42Å; A323-L327 PolarHBondContact O-N 3.36Å; A323-L327 VanDerWaalsContact O-N 3.09Å
324E87.6Confident88.1Confident110 Ų11050.9 Ų50.951%0.51427%0.267SS..Hα-helixtrans-69.3-43.2173.7-179.3166.9-163.200111.8T320 S321 W326 L327 N328T320-E324 WeakPolarHBondContact O-CB 3.43Å; T320-E324 PolarHBondContact O-N 3.06Å; S321-E324 PolarHBondContact O-N 3.02Å; S321-E324 VanDerWaalsContact O-N 3.15Å; E324-W326 PolarHBondContact O-N 3.39Å; E324-L327 PolarHBondContact O-N 3.34Å; E324-N328 WeakPolarHBondContact O-CB 3.45Å; E324-N328 VanDerWaalsContact O-CG 3.23Å; E324-N328 PolarHBondContact O-N 3.02Å; E324-N328 PolarHBondContact O-ND2 3.3Å; E324-N328 VanDerWaalsContact O-ND2 3.15Å
325E84.6Confident88.1Confident123 Ų12354.2 Ų54.258%0.57527%0.272SS*.Hα-helixtrans-57.4-46.6173-73.9168.2-174.400111.9S321 N328 L329S321-E325 WeakPolarHBondContact O-CB 3.41Å; S321-E325 WeakPolarHBondContact O-CG 3.22Å; S321-E325 PolarHBondContact O-N 3.05Å; E325-N328 PolarHBondContact O-N 2.61Å; E325-L329 WeakPolarHBondContact O-CB 3.31Å; E325-L329 PolarHBondContact O-N 3Å
326W89.2Confident87.9Confident18 Ų1854.4 Ų54.47%0.06827%0.271CS..Hα-helixtrans-62-46.5176.5-176.3-118.5000112L250 R253 P260 R322 E324 N328 L329 L330L250-W326 HydrophobicContact CD1-CB 3.89Å; L250-W326 HydrophobicContact CD1-CG 4.01Å; R253-W326 HydrophobicContact CB-CZ2 4.1Å; R253-W326 WeakPolarHBondContact O-CH2 3.44Å; P260-W326 HydrophobicContact CG-CH2 4.35Å; P260-W326 HydrophobicContact CG-CZ2 4.4Å; R322-W326 WeakPolarHBondContact O-CB 3.47Å; R322-W326 PolarHBondContact O-N 3.22Å; E324-W326 PolarHBondContact O-N 3.39Å; W326-N328 VanDerWaalsContact C-N 3.34Å; W326-N328 PolarHBondContact O-N 3.39Å; W326-L329 HydrophobicContact CE3-CD2 4.18Å; W326-L329 HydrophobicContact CZ3-CD2 4.07Å; W326-L329 PolarHBondContact O-N 3.05Å; W326-L330 HydrophobicContact CD2-CD1 4.35Å; W326-L330 HydrophobicContact CD2-CG 4.44Å; W326-L330 HydrophobicContact CG-CD1 4.3Å; W326-L330 HydrophobicContact CH2-CD2 4.47Å; W326-L330 HydrophobicContact CZ2-CD1 4.45Å; W326-L330 HydrophobicContact CZ2-CD2 4.07Å; W326-L330 HydrophobicContact CZ2-CG 4.47Å; W326-L330 VanDerWaalsContact O-CG 3.25Å; W326-L330 WeakPolarHBondContact O-CG 3.31Å; W326-L330 PolarHBondContact O-N 3Å
327L90Very high87.5Confident4 Ų454.6 Ų54.62%0.02127%0.273CS..Hα-helixtrans-62-41.1176.4175.358.6000111.9K271 Q274 A323 E324 L330 L331K271-L327 HydrophobicContact CG-CD1 4.05Å; Q274-L327 HydrophobicContact CB-CD2 4.19Å; Q274-L327 VanDerWaalsContact OE1-CD2 3.31Å; A323-L327 PolarHBondContact O-N 3.36Å; A323-L327 VanDerWaalsContact O-N 3.09Å; E324-L327 PolarHBondContact O-N 3.34Å; L327-L330 PolarHBondContact O-N 3.25Å; L327-L331 HydrophobicContact CD1-CD1 4.02Å; L327-L331 HydrophobicContact CD1-CG 4.02Å; L327-L331 HydrophobicContact CG-CD1 3.97Å; L327-L331 HydrophobicContact CG-CG 4.42Å; L327-L331 WeakPolarHBondContact O-CB 3.44Å; L327-L331 VanDerWaalsContact O-CG 3.28Å; L327-L331 WeakPolarHBondContact O-CG 3.32Å; L327-L331 PolarHBondContact O-N 3.08Å
328N88.5Confident87.2Confident86 Ų8654.4 Ų54.446%0.4627%0.27SS..Hα-helixtrans-64.1-41.9178-74.9-32000111.8E324 E325 W326 L330 L331 E332E324-N328 WeakPolarHBondContact O-CB 3.45Å; E324-N328 VanDerWaalsContact O-CG 3.23Å; E324-N328 PolarHBondContact O-N 3.02Å; E324-N328 PolarHBondContact O-ND2 3.3Å; E324-N328 VanDerWaalsContact O-ND2 3.15Å; E325-N328 PolarHBondContact O-N 2.61Å; W326-N328 VanDerWaalsContact C-N 3.34Å; W326-N328 PolarHBondContact O-N 3.39Å; N328-L330 PolarHBondContact O-N 2.91Å; N328-L331 PolarHBondContact O-N 3.1Å; N328-E332 WeakPolarHBondContact O-CB 3.46Å; N328-E332 PolarHBondContact O-N 3.15Å
329L87.9Confident87.2Confident55 Ų5554.2 Ų54.229%0.28826%0.264SS..Hα-helixtrans-62.1-41.8174.7-176.764.5000112.1E325 W326 E332 Y333E325-L329 WeakPolarHBondContact O-CB 3.31Å; E325-L329 PolarHBondContact O-N 3Å; W326-L329 HydrophobicContact CE3-CD2 4.18Å; W326-L329 HydrophobicContact CZ3-CD2 4.07Å; W326-L329 PolarHBondContact O-N 3.05Å; L329-E332 WeakPolarHBondContact O-CB 3.4Å; L329-E332 PolarHBondContact O-N 3.19Å; L329-Y333 HydrophobicContact CD1-CD1 4.46Å; L329-Y333 HydrophobicContact CD1-CE1 3.71Å; L329-Y333 HydrophobicContact CD1-CE2 4.43Å; L329-Y333 HydrophobicContact CD2-CE2 4.37Å; L329-Y333 HydrophobicContact CG-CE1 4.16Å; L329-Y333 HydrophobicContact CG-CE2 3.99Å; L329-Y333 PolarHBondContact O-N 3.21Å
330L88.4Confident87.3Confident0 Ų053.8 Ų53.80%026%0.261CS..Hα-helixtrans-66.4-40.3176.2-65.6168.9000112.3P260 L263 E266 V267 W326 L327 N328 E332 Y333 Q334P260-L330 HydrophobicContact CG-CD2 3.81Å; L263-L330 HydrophobicContact CD1-CB 4.22Å; L263-L330 HydrophobicContact CD1-CD2 3.72Å; E266-L330 HydrophobicContact CB-CD1 3.77Å; E266-L330 HydrophobicContact CB-CD2 3.8Å; E266-L330 HydrophobicContact CB-CG 4.44Å; V267-L330 HydrophobicContact CG2-CB 3.75Å; W326-L330 HydrophobicContact CD2-CD1 4.35Å; W326-L330 HydrophobicContact CD2-CG 4.44Å; W326-L330 HydrophobicContact CG-CD1 4.3Å; W326-L330 HydrophobicContact CH2-CD2 4.47Å; W326-L330 HydrophobicContact CZ2-CD1 4.45Å; W326-L330 HydrophobicContact CZ2-CD2 4.07Å; W326-L330 HydrophobicContact CZ2-CG 4.47Å; W326-L330 VanDerWaalsContact O-CG 3.25Å; W326-L330 WeakPolarHBondContact O-CG 3.31Å; W326-L330 PolarHBondContact O-N 3Å; L327-L330 PolarHBondContact O-N 3.25Å; N328-L330 PolarHBondContact O-N 2.91Å; L330-E332 VanDerWaalsContact C-N 3.32Å; L330-Y333 PolarHBondContact O-N 3.03Å; L330-Q334 PolarHBondContact O-N 2.61Å
331L88.1Confident87.1Confident58 Ų5856 Ų5630%0.30427%0.272SS..Hα-helixtrans-66.6-34.3174-71.3171.8000112V267 L327 N328 Q334 K335V267-L331 HydrophobicContact CG1-CD2 4.13Å; L327-L331 HydrophobicContact CD1-CD1 4.02Å; L327-L331 HydrophobicContact CD1-CG 4.02Å; L327-L331 HydrophobicContact CG-CD1 3.97Å; L327-L331 HydrophobicContact CG-CG 4.42Å; L327-L331 WeakPolarHBondContact O-CB 3.44Å; L327-L331 VanDerWaalsContact O-CG 3.28Å; L327-L331 WeakPolarHBondContact O-CG 3.32Å; L327-L331 PolarHBondContact O-N 3.08Å; N328-L331 PolarHBondContact O-N 3.1Å; L331-Q334 PolarHBondContact O-N 3.13Å; L331-K335 WeakPolarHBondContact O-CB 3.33Å; L331-K335 PolarHBondContact O-N 3.19Å
332E86Confident87Confident80 Ų8059.9 Ų59.937%0.37429%0.285SS..Hα-helixtrans-64.8-44.3172.3-175.3-170143.300111.2N328 L329 L330 K335 H336 R401N328-E332 WeakPolarHBondContact O-CB 3.46Å; N328-E332 PolarHBondContact O-N 3.15Å; L329-E332 WeakPolarHBondContact O-CB 3.4Å; L329-E332 PolarHBondContact O-N 3.19Å; L330-E332 VanDerWaalsContact C-N 3.32Å; E332-K335 PolarHBondContact O-N 3.41Å; E332-H336 WeakPolarHBondContact CG-CE1 3.49Å; E332-H336 WeakPolarHBondContact CG-ND1 3.45Å; E332-H336 PolarHBondContact O-N 3.42Å; E332-H336 PolarHBondContact O-ND1 3.31Å; E332-H336 IonicContact OE1-CE1 2.61Å; E332-H336 PolarHBondContact OE1-CE1 3.33Å; E332-H336 IonicContact OE1-ND1 2.64Å; E332-R401 IonicContact OE1-CZ 3.12Å; E332-R401 IonicContact OE1-NH1 2.66Å; E332-R401 PolarHBondContact OE1-NH1 2.88Å; E332-R401 IonicContact OE1-NH2 2.68Å; E332-R401 PolarHBondContact OE1-NH2 2.9Å
333Y85.5Confident87.1Confident22 Ų2257.8 Ų57.89%0.08628%0.28CS..Hα-helixtrans-60.9-43.8173.1-65.2-17.6000111.6M259 L263 L329 L330 H336 M337M259-Y333 HydrophobicContact CB-CD2 4.09Å; M259-Y333 HydrophobicContact CB-CE2 4.3Å; M259-Y333 HydrophobicContact CB-CG 4.46Å; M259-Y333 HydrophobicContact CG-CD2 3.94Å; M259-Y333 HydrophobicContact CG-CG 4.19Å; L263-Y333 HydrophobicContact CD1-CD2 4.31Å; L329-Y333 HydrophobicContact CD1-CD1 4.46Å; L329-Y333 HydrophobicContact CD1-CE1 3.71Å; L329-Y333 HydrophobicContact CD1-CE2 4.43Å; L329-Y333 HydrophobicContact CD2-CE2 4.37Å; L329-Y333 HydrophobicContact CG-CE1 4.16Å; L329-Y333 HydrophobicContact CG-CE2 3.99Å; L329-Y333 PolarHBondContact O-N 3.21Å; L330-Y333 PolarHBondContact O-N 3.03Å; Y333-H336 PolarHBondContact O-N 3.1Å; Y333-M337 PolarHBondContact O-N 2.74Å; Y333-M337 VanDerWaalsContact O-N 3.09Å
334Q85.9Confident87.2Confident41 Ų4158.2 Ų58.219%0.19228%0.282CS..Hα-helixtrans-59.9-51.3178.5177.8173.36.100110.6L263 L330 L331 H336 M337 E338L263-Q334 HydrophobicContact CD2-CB 4.15Å; L330-Q334 PolarHBondContact O-N 2.61Å; L331-Q334 PolarHBondContact O-N 3.13Å; Q334-H336 VanDerWaalsContact C-N 3.34Å; Q334-H336 PolarHBondContact O-N 3.48Å; Q334-M337 PolarHBondContact O-N 2.84Å; Q334-E338 HydrophobicContact CG-CG 4.34Å; Q334-E338 VanDerWaalsContact CG-OE1 3.28Å; Q334-E338 WeakPolarHBondContact CG-OE1 3.4Å; Q334-E338 PolarHBondContact NE2-OE1 3.04Å; Q334-E338 WeakPolarHBondContact O-CB 3.45Å; Q334-E338 WeakPolarHBondContact O-CG 3.2Å; Q334-E338 PolarHBondContact O-N 2.83Å
335K86.5Confident87Confident141 Ų14156.9 Ų56.961%0.61328%0.278SS*.Hα-helixtrans-59.3-42179.7-176.5-176.1176.5-172.10112.6L331 E332 T339L331-K335 WeakPolarHBondContact O-CB 3.33Å; L331-K335 PolarHBondContact O-N 3.19Å; E332-K335 PolarHBondContact O-N 3.41Å; K335-T339 WeakPolarHBondContact O-CB 3.32Å; K335-T339 PolarHBondContact O-N 2.7Å; K335-T339 PolarHBondContact O-OG1 2.72Å
336H83.7Confident87.1Confident74 Ų7455.1 Ų55.134%0.34327%0.27SS..Hα-helixtrans-67.2-39179.5-74117.1000112.4E332 Y333 Q334 F340 L397 R401E332-H336 WeakPolarHBondContact CG-CE1 3.49Å; E332-H336 WeakPolarHBondContact CG-ND1 3.45Å; E332-H336 PolarHBondContact O-N 3.42Å; E332-H336 PolarHBondContact O-ND1 3.31Å; E332-H336 IonicContact OE1-CE1 2.61Å; E332-H336 PolarHBondContact OE1-CE1 3.33Å; E332-H336 IonicContact OE1-ND1 2.64Å; Y333-H336 PolarHBondContact O-N 3.1Å; Q334-H336 VanDerWaalsContact C-N 3.34Å; Q334-H336 PolarHBondContact O-N 3.48Å; H336-F340 PolarHBondContact O-N 3.41Å; H336-F340 VanDerWaalsContact O-N 3.12Å; H336-L397 HydrophobicContact CB-CD2 4.05Å; H336-R401 PolarHBondContact CE1-NH2 3.47Å; H336-R401 VanDerWaalsContact CE1-NH2 3.25Å; H336-R401 PolarHBondContact ND1-NH2 3.26Å
337M86.2Confident87.2Confident24 Ų2454.2 Ų54.212%0.11827%0.267CS..Hα-helixtrans-67.3-47.7175.2-162.565.664.300111.3M259 Y333 Q334 T339 F340 D341 V409M259-M337 HydrophobicContact CE-CE 3.62Å; M259-M337 HydrophobicContact SD-CE 3.59Å; M259-M337 VanDerWaalsContact SD-CE 3.59Å; Y333-M337 PolarHBondContact O-N 2.74Å; Y333-M337 VanDerWaalsContact O-N 3.09Å; Q334-M337 PolarHBondContact O-N 2.84Å; M337-T339 PolarHBondContact O-N 2.9Å; M337-F340 PolarHBondContact O-N 3.38Å; M337-F340 VanDerWaalsContact O-N 3.08Å; M337-F340 HydrophobicContact SD-CD1 4.44Å; M337-D341 PolarHBondContact O-N 3.39Å; M337-V409 HydrophobicContact SD-CG2 4.26Å
338E84.6Confident87.1Confident87 Ų8755.7 Ų55.741%0.40728%0.276SS..Hα-helixtrans-57.5-37.1176.6-73.9175.1-179.100112.5Q334 Q342Q334-E338 HydrophobicContact CG-CG 4.34Å; Q334-E338 VanDerWaalsContact CG-OE1 3.28Å; Q334-E338 WeakPolarHBondContact CG-OE1 3.4Å; Q334-E338 PolarHBondContact NE2-OE1 3.04Å; Q334-E338 WeakPolarHBondContact O-CB 3.45Å; Q334-E338 WeakPolarHBondContact O-CG 3.2Å; Q334-E338 PolarHBondContact O-N 2.83Å; E338-Q342 VanDerWaalsContact O-CB 3.29Å; E338-Q342 WeakPolarHBondContact O-CB 3.45Å; E338-Q342 WeakPolarHBondContact O-CG 3.4Å; E338-Q342 PolarHBondContact O-N 2.9Å; E338-Q342 PolarHBondContact O-NE2 3.43Å
339T85.9Confident87Confident46 Ų4656.8 Ų56.828%0.28228%0.277SS..Hα-helixtrans-68.2-42.6176.5-55.10000111.4K335 M337 N343K335-T339 WeakPolarHBondContact O-CB 3.32Å; K335-T339 PolarHBondContact O-N 2.7Å; K335-T339 PolarHBondContact O-OG1 2.72Å; M337-T339 PolarHBondContact O-N 2.9Å; T339-N343 WeakPolarHBondContact O-CB 3.19Å; T339-N343 PolarHBondContact O-N 2.85Å; T339-N343 VanDerWaalsContact O-N 3.08Å; T339-N343 PolarHBondContact O-ND2 3.19Å
340F89.8Confident87.2Confident2 Ų255.1 Ų55.11%0.00927%0.267CS..Hα-helixtrans-64.6-49.9176.6172.3-106.1000111.4H336 M337 Q342 N343 V344 T390 A394 L397 V409 Q412H336-F340 PolarHBondContact O-N 3.41Å; H336-F340 VanDerWaalsContact O-N 3.12Å; M337-F340 PolarHBondContact O-N 3.38Å; M337-F340 VanDerWaalsContact O-N 3.08Å; M337-F340 HydrophobicContact SD-CD1 4.44Å; F340-Q342 PolarHBondContact O-N 3.08Å; F340-N343 PolarHBondContact O-N 3.14Å; F340-N343 VanDerWaalsContact O-N 3.14Å; F340-V344 HydrophobicContact CD1-CG2 4.4Å; F340-V344 HydrophobicContact CD2-CG2 4.12Å; F340-V344 HydrophobicContact CE1-CG2 3.97Å; F340-V344 HydrophobicContact CE2-CG2 3.63Å; F340-V344 HydrophobicContact CG-CG2 4.48Å; F340-V344 HydrophobicContact CZ-CG2 3.55Å; F340-V344 WeakPolarHBondContact O-CG2 3.31Å; F340-V344 PolarHBondContact O-N 3.1Å; F340-T390 HydrophobicContact CD2-CG2 3.96Å; F340-T390 HydrophobicContact CE2-CG2 3.82Å; F340-A394 HydrophobicContact CD2-CB 4.43Å; F340-A394 HydrophobicContact CE2-CB 3.77Å; F340-A394 HydrophobicContact CZ-CB 4.36Å; F340-L397 HydrophobicContact CB-CD1 3.7Å; F340-L397 HydrophobicContact CD1-CD1 4.31Å; F340-L397 HydrophobicContact CD2-CD1 4.31Å; F340-L397 HydrophobicContact CG-CD1 3.84Å; F340-V409 HydrophobicContact CD1-CG2 4.11Å; F340-V409 HydrophobicContact CE1-CB 4.21Å; F340-V409 HydrophobicContact CE1-CG1 4.03Å; F340-V409 HydrophobicContact CE1-CG2 3.87Å; F340-V409 HydrophobicContact CE2-CG1 4.21Å; F340-V409 HydrophobicContact CZ-CB 4.38Å; F340-V409 HydrophobicContact CZ-CG1 3.75Å; F340-V409 HydrophobicContact CZ-CG2 4.44Å; F340-Q412 HydrophobicContact CE1-CB 4.45Å; F340-Q412 VanDerWaalsContact CE1-OE1 3.22Å; F340-Q412 HydrophobicContact CZ-CB 4.34Å
341D87.3Confident87.2Confident68 Ų6855.4 Ų55.436%0.36427%0.268SS..Hα-helixtrans-57.7-45.9177.2-75.7-38.2000111.2M337 N343 V344 D345M337-D341 PolarHBondContact O-N 3.39Å; D341-N343 VanDerWaalsContact C-N 3.32Å; D341-N343 PolarHBondContact O-N 3.4Å; D341-V344 PolarHBondContact O-N 3.18Å; D341-D345 WeakPolarHBondContact O-CB 3.4Å; D341-D345 PolarHBondContact O-N 3.3Å
342Q86.8Confident87.1Confident125 Ų12557 Ų5758%0.58428%0.276SS*.Hα-helixtrans-59.8-40176.5-77.1170.143.500113E338 F340 H346E338-Q342 VanDerWaalsContact O-CB 3.29Å; E338-Q342 WeakPolarHBondContact O-CB 3.45Å; E338-Q342 WeakPolarHBondContact O-CG 3.4Å; E338-Q342 PolarHBondContact O-N 2.9Å; E338-Q342 PolarHBondContact O-NE2 3.43Å; F340-Q342 PolarHBondContact O-N 3.08Å; Q342-H346 VanDerWaalsContact O-CB 3.28Å; Q342-H346 WeakPolarHBondContact O-CB 3.28Å; Q342-H346 PolarHBondContact O-N 3.1Å
343N89.1Confident87Confident40 Ų4058.8 Ų58.821%0.21428%0.284CS..Hα-helixtrans-68.4-46.3177.7-79.6-26.1000111.8T339 F340 D341 D345 H346 I347 T390 Q393T339-N343 WeakPolarHBondContact O-CB 3.19Å; T339-N343 PolarHBondContact O-N 2.85Å; T339-N343 VanDerWaalsContact O-N 3.08Å; T339-N343 PolarHBondContact O-ND2 3.19Å; F340-N343 PolarHBondContact O-N 3.14Å; F340-N343 VanDerWaalsContact O-N 3.14Å; D341-N343 VanDerWaalsContact C-N 3.32Å; D341-N343 PolarHBondContact O-N 3.4Å; N343-D345 VanDerWaalsContact C-N 3.3Å; N343-D345 PolarHBondContact O-N 3.46Å; N343-H346 PolarHBondContact O-N 3.38Å; N343-I347 WeakPolarHBondContact O-CB 3.46Å; N343-I347 WeakPolarHBondContact O-CD1 3.43Å; N343-I347 VanDerWaalsContact O-CG1 3.27Å; N343-I347 WeakPolarHBondContact O-CG1 3.35Å; N343-I347 PolarHBondContact O-N 3.11Å; N343-T390 HydrophobicContact CB-CG2 4.01Å; N343-T390 WeakPolarHBondContact CB-OG1 3.26Å; N343-Q393 PolarHBondContact ND2-OE1 3.48Å
344V88.9Confident87Confident18 Ų1857.8 Ų57.811%0.10928%0.28CS..Hα-helixtrans-57.5-44.3174173.10000110.6F340 D341 T348 T390 L416F340-V344 HydrophobicContact CD1-CG2 4.4Å; F340-V344 HydrophobicContact CD2-CG2 4.12Å; F340-V344 HydrophobicContact CE1-CG2 3.97Å; F340-V344 HydrophobicContact CE2-CG2 3.63Å; F340-V344 HydrophobicContact CG-CG2 4.48Å; F340-V344 HydrophobicContact CZ-CG2 3.55Å; F340-V344 WeakPolarHBondContact O-CG2 3.31Å; F340-V344 PolarHBondContact O-N 3.1Å; D341-V344 PolarHBondContact O-N 3.18Å; V344-T348 WeakPolarHBondContact O-CB 3.36Å; V344-T348 PolarHBondContact O-N 2.98Å; V344-T348 PolarHBondContact O-OG1 2.84Å; V344-T390 HydrophobicContact CG2-CG2 3.9Å; V344-L416 HydrophobicContact CG2-CD2 4.31Å
345D84.4Confident86.7Confident82 Ų8258.6 Ų58.644%0.43929%0.286SS..Hα-helixtrans-69.4-38.6-178.3-155.641.9000112D341 N343 K349D341-D345 WeakPolarHBondContact O-CB 3.4Å; D341-D345 PolarHBondContact O-N 3.3Å; N343-D345 VanDerWaalsContact C-N 3.3Å; N343-D345 PolarHBondContact O-N 3.46Å; D345-K349 WeakPolarHBondContact O-CB 3.12Å; D345-K349 WeakPolarHBondContact O-CD 3.47Å; D345-K349 VanDerWaalsContact O-CG 3.23Å; D345-K349 WeakPolarHBondContact O-CG 3.3Å; D345-K349 PolarHBondContact O-N 3.05Å; D345-K349 IonicContact OD1-NZ 2.64Å; D345-K349 VanDerWaalsContact OD2-CE 3.3Å; D345-K349 WeakPolarHBondContact OD2-CE 3.31Å; D345-K349 IonicContact OD2-NZ 2.67Å; D345-K349 PolarHBondContact OD2-NZ 2.93Å
346H86.7Confident86.4Confident86 Ų8655.3 Ų55.340%0.39828%0.278SS..Hα-helixtrans-64.7-48.4173.9178.968.3000112.3Q342 N343 K349 W350 K386Q342-H346 VanDerWaalsContact O-CB 3.28Å; Q342-H346 WeakPolarHBondContact O-CB 3.28Å; Q342-H346 PolarHBondContact O-N 3.1Å; N343-H346 PolarHBondContact O-N 3.38Å; H346-K349 PolarHBondContact O-N 2.86Å; H346-W350 PolarHBondContact O-N 3.39Å; H346-K386 PolarHBondContact NE2-NZ 2.99Å
347I90.4Very high86.3Confident0 Ų054.2 Ų54.20%027%0.274CS..Hα-helixtrans-65.6-42.4178.6-64.6160.6000110.1N343 K349 W350 I351 I383 K386 V387 T390 L416N343-I347 WeakPolarHBondContact O-CB 3.46Å; N343-I347 WeakPolarHBondContact O-CD1 3.43Å; N343-I347 VanDerWaalsContact O-CG1 3.27Å; N343-I347 WeakPolarHBondContact O-CG1 3.35Å; N343-I347 PolarHBondContact O-N 3.11Å; I347-K349 VanDerWaalsContact C-N 3.34Å; I347-K349 PolarHBondContact O-N 3.2Å; I347-W350 PolarHBondContact O-N 2.87Å; I347-W350 VanDerWaalsContact O-N 3.16Å; I347-I351 HydrophobicContact CG2-CD1 3.91Å; I347-I351 HydrophobicContact CG2-CG1 4.31Å; I347-I351 WeakPolarHBondContact O-CG1 3.49Å; I347-I351 PolarHBondContact O-N 3.22Å; I347-I383 HydrophobicContact CG1-CD1 4.4Å; I347-I383 HydrophobicContact CG1-CG1 4.39Å; I347-K386 HydrophobicContact CD1-CB 4.37Å; I347-V387 HydrophobicContact CD1-CB 4.49Å; I347-V387 HydrophobicContact CD1-CG2 4.07Å; I347-V387 HydrophobicContact CG1-CG2 4.32Å; I347-V387 HydrophobicContact CG2-CG2 3.79Å; I347-T390 HydrophobicContact CD1-CG2 4.31Å; I347-T390 VanDerWaalsContact CD1-OG1 3.23Å; I347-T390 WeakPolarHBondContact CD1-OG1 3.35Å; I347-L416 HydrophobicContact CB-CD1 4.09Å; I347-L416 HydrophobicContact CB-CD2 4.29Å; I347-L416 HydrophobicContact CD1-CD2 4.05Å; I347-L416 HydrophobicContact CG2-CD1 3.7Å; I347-L416 HydrophobicContact CG2-CD2 4.11Å; I347-L416 HydrophobicContact CG2-CG 4.06Å
348T88.5Confident85.9Confident34 Ų3453.4 Ų53.421%0.20927%0.27CS..Hα-helixtrans-61.3-42.4177.9-60.30000111.5V344 I351 I352 L416V344-T348 WeakPolarHBondContact O-CB 3.36Å; V344-T348 PolarHBondContact O-N 2.98Å; V344-T348 PolarHBondContact O-OG1 2.84Å; T348-I351 PolarHBondContact O-N 3.31Å; T348-I352 HydrophobicContact CG2-CD1 3.98Å; T348-I352 VanDerWaalsContact O-CG1 3.29Å; T348-I352 WeakPolarHBondContact O-CG1 3.42Å; T348-I352 PolarHBondContact O-N 3.4Å; T348-L416 WeakPolarHBondContact OG1-CD1 3.26Å
349K87.1Confident85.6Confident110 Ų11053.1 Ų53.148%0.47827%0.271SS..Hα-helixtrans-61.7-42.1173.5-75164.6-168.7163.20112.2D345 H346 I347 I352 Q353D345-K349 WeakPolarHBondContact O-CB 3.12Å; D345-K349 WeakPolarHBondContact O-CD 3.47Å; D345-K349 VanDerWaalsContact O-CG 3.23Å; D345-K349 WeakPolarHBondContact O-CG 3.3Å; D345-K349 PolarHBondContact O-N 3.05Å; D345-K349 IonicContact OD1-NZ 2.64Å; D345-K349 VanDerWaalsContact OD2-CE 3.3Å; D345-K349 WeakPolarHBondContact OD2-CE 3.31Å; D345-K349 IonicContact OD2-NZ 2.67Å; D345-K349 PolarHBondContact OD2-NZ 2.93Å; H346-K349 PolarHBondContact O-N 2.86Å; I347-K349 VanDerWaalsContact C-N 3.34Å; I347-K349 PolarHBondContact O-N 3.2Å; K349-I352 PolarHBondContact O-N 2.94Å; K349-Q353 WeakPolarHBondContact O-CG 3.41Å; K349-Q353 PolarHBondContact O-N 3.49Å
350W92.1Very high85.2Confident20 Ų2055.2 Ų55.28%0.07628%0.278CS..Hα-helixtrans-63.1-46.4174.8178.878000112.1H346 I347 I352 Q353 A354 E379 L380 I383 F420 I423 I427H346-W350 PolarHBondContact O-N 3.39Å; I347-W350 PolarHBondContact O-N 2.87Å; I347-W350 VanDerWaalsContact O-N 3.16Å; W350-I352 VanDerWaalsContact C-N 3.31Å; W350-I352 PolarHBondContact O-N 3.47Å; W350-Q353 PolarHBondContact O-N 3Å; W350-Q353 VanDerWaalsContact O-N 3.14Å; W350-A354 HydrophobicContact CD2-CB 4.35Å; W350-A354 HydrophobicContact CE3-CB 4.5Å; W350-A354 HydrophobicContact CH2-CB 4.03Å; W350-A354 HydrophobicContact CZ2-CB 3.86Å; W350-A354 HydrophobicContact CZ3-CB 4.34Å; W350-A354 WeakPolarHBondContact O-CB 3.48Å; W350-A354 PolarHBondContact O-N 3.02Å; W350-E379 HydrophobicContact CZ2-CB 4.03Å; W350-E379 PolarHBondContact NE1-OE2 2.88Å; W350-L380 HydrophobicContact CH2-CB 4.14Å; W350-L380 HydrophobicContact CH2-CD1 3.86Å; W350-L380 HydrophobicContact CZ2-CB 4.34Å; W350-L380 HydrophobicContact CZ3-CD1 4.4Å; W350-I383 HydrophobicContact CB-CD1 4.07Å; W350-I383 HydrophobicContact CB-CG1 4.35Å; W350-I383 HydrophobicContact CD2-CB 4.2Å; W350-I383 HydrophobicContact CD2-CG1 4Å; W350-I383 HydrophobicContact CD2-CG2 4Å; W350-I383 HydrophobicContact CE3-CB 4.31Å; W350-I383 HydrophobicContact CE3-CG1 4.02Å; W350-I383 HydrophobicContact CE3-CG2 3.74Å; W350-I383 HydrophobicContact CG-CD1 4.11Å; W350-I383 HydrophobicContact CG-CG1 4.12Å; W350-I383 HydrophobicContact CH2-CG2 3.89Å; W350-I383 HydrophobicContact CZ2-CG2 4.13Å; W350-I383 HydrophobicContact CZ3-CG2 3.7Å; W350-F420 HydrophobicContact CH2-CE2 4.45Å; W350-F420 HydrophobicContact CZ3-CD2 4.08Å; W350-F420 AromaticContact CZ3-CE2 3.82Å; W350-F420 HydrophobicContact CZ3-CE2 3.82Å; W350-I423 HydrophobicContact CH2-CG1 4.49Å; W350-I423 HydrophobicContact CH2-CG2 4.41Å; W350-I423 HydrophobicContact CZ3-CG2 3.94Å; W350-I427 HydrophobicContact CH2-CD1 4Å; W350-I427 HydrophobicContact CZ2-CD1 4.38Å
351I87.9Confident84.3Confident5 Ų555.1 Ų55.13%0.02628%0.278CS..Hα-helixtrans-56.5-46.4177.9-68.6171.2000110.6I347 T348 Q353 A354 D355 L416 R419 F420 I423I347-I351 HydrophobicContact CG2-CD1 3.91Å; I347-I351 HydrophobicContact CG2-CG1 4.31Å; I347-I351 WeakPolarHBondContact O-CG1 3.49Å; I347-I351 PolarHBondContact O-N 3.22Å; T348-I351 PolarHBondContact O-N 3.31Å; I351-Q353 PolarHBondContact O-N 3.37Å; I351-A354 PolarHBondContact O-N 3.4Å; I351-D355 PolarHBondContact O-N 3.1Å; I351-L416 HydrophobicContact CD1-CD1 4.13Å; I351-R419 HydrophobicContact CD1-CB 4.08Å; I351-R419 HydrophobicContact CG2-CB 4.16Å; I351-F420 HydrophobicContact CD1-CB 4.09Å; I351-F420 HydrophobicContact CD1-CD2 4.45Å; I351-I423 HydrophobicContact CG1-CG2 4.37Å
352I85Confident83.3Confident92 Ų9257.6 Ų57.647%0.47229%0.287SS..Hα-helixtrans-61.9-42.9178.2-67.6164.9000111.3T348 K349 W350 T356T348-I352 HydrophobicContact CG2-CD1 3.98Å; T348-I352 VanDerWaalsContact O-CG1 3.29Å; T348-I352 WeakPolarHBondContact O-CG1 3.42Å; T348-I352 PolarHBondContact O-N 3.4Å; K349-I352 PolarHBondContact O-N 2.94Å; W350-I352 VanDerWaalsContact C-N 3.31Å; W350-I352 PolarHBondContact O-N 3.47Å; I352-T356 WeakPolarHBondContact O-CB 3.48Å; I352-T356 PolarHBondContact O-N 2.9Å; I352-T356 VanDerWaalsContact O-N 3.07Å; I352-T356 PolarHBondContact O-OG1 3.45Å
353Q85Confident82.5Confident118 Ų11860.6 Ų60.655%0.55130%0.298SS*.Hα-helixtrans-65.5-41.7176.4-72.9175.10.400112K349 W350 I351 T356 L357K349-Q353 WeakPolarHBondContact O-CG 3.41Å; K349-Q353 PolarHBondContact O-N 3.49Å; W350-Q353 PolarHBondContact O-N 3Å; W350-Q353 VanDerWaalsContact O-N 3.14Å; I351-Q353 PolarHBondContact O-N 3.37Å; Q353-T356 PolarHBondContact O-N 3.48Å; Q353-L357 WeakPolarHBondContact O-CB 3.38Å; Q353-L357 VanDerWaalsContact O-CG 3.3Å; Q353-L357 WeakPolarHBondContact O-CG 3.4Å; Q353-L357 PolarHBondContact O-N 2.9Å
354A84.7Confident81.4Confident0 Ų062.4 Ų62.40%030%0.304CS..Hα-helixtrans-65.2-44.2178.900000112.2W350 I351 L357 L358 L376 I423W350-A354 HydrophobicContact CD2-CB 4.35Å; W350-A354 HydrophobicContact CE3-CB 4.5Å; W350-A354 HydrophobicContact CH2-CB 4.03Å; W350-A354 HydrophobicContact CZ2-CB 3.86Å; W350-A354 HydrophobicContact CZ3-CB 4.34Å; W350-A354 WeakPolarHBondContact O-CB 3.48Å; W350-A354 PolarHBondContact O-N 3.02Å; I351-A354 PolarHBondContact O-N 3.4Å; A354-L357 PolarHBondContact O-N 2.74Å; A354-L358 WeakPolarHBondContact O-CG 3.41Å; A354-L358 PolarHBondContact O-N 3.48Å; A354-L376 HydrophobicContact CB-CD2 3.92Å; A354-I423 HydrophobicContact CB-CD1 3.85Å; A354-I423 HydrophobicContact CB-CG1 3.84Å
355D80.2Confident80.1Confident58 Ų5869.3 Ų69.331%0.3133%0.333SS..Hα-helixtrans-62.4-45.4174.4-102.8-27.9000110.6I351 L357 L358 D359 I423 R426I351-D355 PolarHBondContact O-N 3.1Å; D355-L357 VanDerWaalsContact C-N 3.31Å; D355-L357 PolarHBondContact O-N 2.94Å; D355-L358 PolarHBondContact O-N 3.09Å; D355-D359 WeakPolarHBondContact O-CB 3.36Å; D355-D359 VanDerWaalsContact O-CG 3.29Å; D355-D359 PolarHBondContact O-N 3.3Å; D355-I423 HydrophobicContact CB-CD1 3.97Å; D355-I423 VanDerWaalsContact CG-CD1 3.46Å; D355-I423 WeakPolarHBondContact OD1-CD1 3.34Å; D355-R426 IonicContact OD1-CZ 2.69Å; D355-R426 IonicContact OD1-NH1 2.61Å; D355-R426 PolarHBondContact OD1-NH1 3.29Å
356T80.8Confident78.9Confident72 Ų7270.7 Ų70.744%0.44235%0.346SS..Hα-helixtrans-58-43.3176.6-53.70000111.5I352 Q353 D359 E360I352-T356 WeakPolarHBondContact O-CB 3.48Å; I352-T356 PolarHBondContact O-N 2.9Å; I352-T356 VanDerWaalsContact O-N 3.07Å; I352-T356 PolarHBondContact O-OG1 3.45Å; Q353-T356 PolarHBondContact O-N 3.48Å; T356-D359 PolarHBondContact O-N 3.06Å; T356-E360 WeakPolarHBondContact O-CB 3.42Å; T356-E360 WeakPolarHBondContact O-CG 3.41Å; T356-E360 PolarHBondContact O-N 2.93Å
357L81.6Confident77.8Confident51 Ų5173.9 Ų73.927%0.26736%0.362SS..Hα-helixtrans-67.8-38.4178-76.2171.3000112.7Q353 A354 D355 S361 V372 L376Q353-L357 WeakPolarHBondContact O-CB 3.38Å; Q353-L357 VanDerWaalsContact O-CG 3.3Å; Q353-L357 WeakPolarHBondContact O-CG 3.4Å; Q353-L357 PolarHBondContact O-N 2.9Å; A354-L357 PolarHBondContact O-N 2.74Å; D355-L357 VanDerWaalsContact C-N 3.31Å; D355-L357 PolarHBondContact O-N 2.94Å; L357-S361 VanDerWaalsContact O-CB 3.27Å; L357-S361 WeakPolarHBondContact O-CB 3.49Å; L357-S361 PolarHBondContact O-N 2.88Å; L357-V372 HydrophobicContact CB-CG1 4.26Å; L357-L376 HydrophobicContact CB-CD1 4.09Å; L357-L376 HydrophobicContact CB-CD2 4.31Å; L357-L376 HydrophobicContact CD1-CD2 3.98Å
358L77.1Confident76.7Confident7 Ų778.9 Ų78.94%0.03739%0.385CS..Hα-helixtrans-63.6-48.6173.8-72.4171.1000111.3A354 D355 E360 S361 E362 L373 L376 I423 R426 I427A354-L358 WeakPolarHBondContact O-CG 3.41Å; A354-L358 PolarHBondContact O-N 3.48Å; D355-L358 PolarHBondContact O-N 3.09Å; L358-E360 VanDerWaalsContact C-N 3.32Å; L358-E360 PolarHBondContact O-N 3.32Å; L358-S361 WeakPolarHBondContact O-CA 3.29Å; L358-S361 WeakPolarHBondContact O-CB 3.31Å; L358-S361 PolarHBondContact O-N 3.47Å; L358-S361 PolarHBondContact O-OG 3.35Å; L358-E362 PolarHBondContact O-N 3.12Å; L358-E362 VanDerWaalsContact O-N 3.14Å; L358-L373 HydrophobicContact CD2-CD2 4.42Å; L358-L376 HydrophobicContact CD2-CD1 3.54Å; L358-L376 HydrophobicContact CG-CD1 3.62Å; L358-I423 HydrophobicContact CD1-CD1 3.52Å; L358-I423 HydrophobicContact CD1-CG1 4.38Å; L358-R426 HydrophobicContact CD1-CB 3.63Å; L358-R426 HydrophobicContact CD1-CG 4.34Å; L358-I427 HydrophobicContact CD1-CG1 4.07Å; L358-I427 HydrophobicContact CD2-CG1 4.33Å
359D77.5Confident75.2Confident81 Ų8180.8 Ų80.843%0.43339%0.39SS..Hα-helixtrans-64.6-35.7-178.9-69.41.1000112.1D355 T356 R426D355-D359 WeakPolarHBondContact O-CB 3.36Å; D355-D359 VanDerWaalsContact O-CG 3.29Å; D355-D359 PolarHBondContact O-N 3.3Å; T356-D359 PolarHBondContact O-N 3.06Å; D359-R426 IonicContact OD1-CZ 3.49Å; D359-R426 VanDerWaalsContact OD1-CZ 3.24Å; D359-R426 IonicContact OD1-NH1 3.98Å; D359-R426 PolarHBondContact OD1-NH1 3.47Å; D359-R426 IonicContact OD1-NH2 2.62Å; D359-R426 PolarHBondContact OD1-NH2 3.31Å
360E79.1Confident74.2Confident90 Ų9079.1 Ų79.142%0.42138%0.384SS..Hα-helixtrans-68.1-38.1168.3-80.5-164.9-17100112.9T356 L358 E362 K363 K364T356-E360 WeakPolarHBondContact O-CB 3.42Å; T356-E360 WeakPolarHBondContact O-CG 3.41Å; T356-E360 PolarHBondContact O-N 2.93Å; L358-E360 VanDerWaalsContact C-N 3.32Å; L358-E360 PolarHBondContact O-N 3.32Å; E360-E362 VanDerWaalsContact C-N 3.26Å; E360-E362 PolarHBondContact O-N 3.04Å; E360-K363 PolarHBondContact O-N 3.44Å; E360-K364 WeakPolarHBondContact O-CG 3.33Å; E360-K364 IonicContact OE2-NZ 3.7Å; E360-K364 PolarHBondContact OE2-NZ 3.43Å
361S71Confident73.3Confident1 Ų182.9 Ų82.91%0.00741%0.406CS..Hα-helixtrans-64.9-30-177.482.10000112.7L357 L358 K363 K364L357-S361 VanDerWaalsContact O-CB 3.27Å; L357-S361 WeakPolarHBondContact O-CB 3.49Å; L357-S361 PolarHBondContact O-N 2.88Å; L358-S361 WeakPolarHBondContact O-CA 3.29Å; L358-S361 WeakPolarHBondContact O-CB 3.31Å; L358-S361 PolarHBondContact O-N 3.47Å; L358-S361 PolarHBondContact O-OG 3.35Å; S361-K363 PolarHBondContact O-N 3.43Å; S361-K364 PolarHBondContact O-N 2.99Å; S361-K364 VanDerWaalsContact O-N 3.13Å
362E66.4Low72.8Confident120 Ų12083.8 Ų83.856%0.56141%0.411SS*.THydrogen-bonded Turntrans-64.7-22.6176.5-70.7-175.9-170.600113.2L358 E360 R426L358-E362 PolarHBondContact O-N 3.12Å; L358-E362 VanDerWaalsContact O-N 3.14Å; E360-E362 VanDerWaalsContact C-N 3.26Å; E360-E362 PolarHBondContact O-N 3.04Å; E362-R426 IonicContact OE1-NH2 2.59Å; E362-R426 PolarHBondContact OE1-NH2 2.93Å
363K70Confident72.3Confident188 Ų18880.9 Ų80.982%0.81740%0.397SS*.THydrogen-bonded Turntrans-92.5-8.4176.4-59.7173.6-172.6167.10113.5E360 S361E360-K363 PolarHBondContact O-N 3.44Å; S361-K363 PolarHBondContact O-N 3.43Å
364K64.2Low71.8Confident78 Ų7881.2 Ų81.234%0.33940%0.396SS..SBendtrans-96.3162.3-174-69.1170.7-170.6170.50111.2E360 S361 Q368E360-K364 WeakPolarHBondContact O-CG 3.33Å; E360-K364 IonicContact OE2-NZ 3.7Å; E360-K364 PolarHBondContact OE2-NZ 3.43Å; S361-K364 PolarHBondContact O-N 2.99Å; S361-K364 VanDerWaalsContact O-N 3.13Å; K364-Q368 HydrophobicContact CB-CB 4.09Å
365K62.4Low71.6Confident162 Ų16289.1 Ų89.170%0.70443%0.426SS*.  trans-63150.7-178.2-71.6-178.2178.6178.70110.6Q367 Q368 K369K365-Q367 PolarHBondContact O-N 3.12Å; K365-Q368 WeakPolarHBondContact O-CA 3.45Å; K365-Q368 WeakPolarHBondContact O-CB 3.27Å; K365-Q368 PolarHBondContact O-N 3.26Å; K365-K369 PolarHBondContact O-N 3.25Å
366P59Low71.8Confident112 Ų11286.3 Ų86.373%0.72741%0.411SS*.Hα-helixtrans-50.4-39.8-170.8-30.335.5000114.9K369 E370P366-K369 WeakPolarHBondContact O-CB 3.39Å; P366-K369 PolarHBondContact O-N 3.28Å; P366-E370 PolarHBondContact O-N 2.95Å
367Q63.8Low71.7Confident153 Ų15386.1 Ų86.172%0.71540%0.404SS*.Hα-helixtrans-69.6-38.2-179.8-155.8155.84.800112.7K365 K369 E370 D371K365-Q367 PolarHBondContact O-N 3.12Å; Q367-K369 VanDerWaalsContact C-N 3.32Å; Q367-E370 PolarHBondContact O-N 3.37Å; Q367-D371 PolarHBondContact O-N 3.5Å
368Q66.4Low71.6Confident104 Ų10486 Ų8649%0.48641%0.411SS..Hα-helixtrans-68.2-33.1172.1-65.3175.7-41.400111.8K364 K365 D371 V372K364-Q368 HydrophobicContact CB-CB 4.09Å; K365-Q368 WeakPolarHBondContact O-CA 3.45Å; K365-Q368 WeakPolarHBondContact O-CB 3.27Å; K365-Q368 PolarHBondContact O-N 3.26Å; Q368-D371 PolarHBondContact O-N 3.28Å; Q368-V372 WeakPolarHBondContact O-CG2 3.36Å; Q368-V372 PolarHBondContact O-N 3.46Å
369K58.6Low72Confident74 Ų7488.2 Ų88.232%0.32242%0.421SS..Hα-helixtrans-66.6-37.9173.9-172.3174.7-174.4178.70111.3K365 P366 Q367 L373K365-K369 PolarHBondContact O-N 3.25Å; P366-K369 WeakPolarHBondContact O-CB 3.39Å; P366-K369 PolarHBondContact O-N 3.28Å; Q367-K369 VanDerWaalsContact C-N 3.32Å; K369-L373 HydrophobicContact CG-CD1 4.4Å; K369-L373 WeakPolarHBondContact O-CB 3.49Å; K369-L373 PolarHBondContact O-N 3.09Å
370E64.9Low72.3Confident76 Ų7684.4 Ų84.436%0.35540%0.4SS..Hα-helixtrans-65.7-43.1173.8-165-173.314800112.2P366 Q367 L373 K374P366-E370 PolarHBondContact O-N 2.95Å; Q367-E370 PolarHBondContact O-N 3.37Å; E370-L373 PolarHBondContact O-N 3.2Å; E370-K374 PolarHBondContact O-N 3.42Å; E370-K374 IonicContact OE1-NZ 2.7Å; E370-K374 PolarHBondContact OE1-NZ 3.03Å; E370-K374 VanDerWaalsContact OE1-NZ 3.1Å
371D74.2Confident72.4Confident99 Ų9984.8 Ų84.853%0.52941%0.405SS..Hα-helixtrans-62.7-42.3176.6-68.9-31.1000112.2Q367 Q368 K374 R375Q367-D371 PolarHBondContact O-N 3.5Å; Q368-D371 PolarHBondContact O-N 3.28Å; D371-K374 PolarHBondContact O-N 3.35Å; D371-R375 PolarHBondContact O-N 3.46Å
372V76.9Confident72.9Confident24 Ų2490.2 Ų90.215%0.14543%0.434CS..Hα-helixtrans-64.9-42174.2173.80000111.1L357 Q368 K374 R375 L376L357-V372 HydrophobicContact CB-CG1 4.26Å; Q368-V372 WeakPolarHBondContact O-CG2 3.36Å; Q368-V372 PolarHBondContact O-N 3.46Å; V372-K374 VanDerWaalsContact C-N 3.34Å; V372-K374 PolarHBondContact O-N 3.48Å; V372-R375 PolarHBondContact O-N 3.02Å; V372-L376 HydrophobicContact CG1-CD1 3.81Å; V372-L376 HydrophobicContact CG1-CG 4.25Å; V372-L376 WeakPolarHBondContact O-CB 3.45Å; V372-L376 WeakPolarHBondContact O-CG 3.41Å; V372-L376 PolarHBondContact O-N 3.06Å
373L73.4Confident74Confident31 Ų3184.9 Ų84.916%0.16241%0.41CS..Hα-helixtrans-63.3-36.4175-93.9161.6000112.8L358 K369 E370 K377 I427L358-L373 HydrophobicContact CD2-CD2 4.42Å; K369-L373 HydrophobicContact CG-CD1 4.4Å; K369-L373 WeakPolarHBondContact O-CB 3.49Å; K369-L373 PolarHBondContact O-N 3.09Å; E370-L373 PolarHBondContact O-N 3.2Å; L373-K377 VanDerWaalsContact O-CB 3.32Å; L373-K377 WeakPolarHBondContact O-CB 3.29Å; L373-K377 VanDerWaalsContact O-CG 3.26Å; L373-K377 WeakPolarHBondContact O-CG 3.34Å; L373-K377 PolarHBondContact O-N 3.43Å; L373-I427 WeakPolarHBondContact CD2-O 3.42Å
374K75.7Confident74.7Confident124 Ų12481.2 Ų81.254%0.53939%0.391SS..Hα-helixtrans-65.4-47.4172.9-84.7177.5176.61570111.8E370 D371 V372 K377 A378E370-K374 PolarHBondContact O-N 3.42Å; E370-K374 IonicContact OE1-NZ 2.7Å; E370-K374 PolarHBondContact OE1-NZ 3.03Å; E370-K374 VanDerWaalsContact OE1-NZ 3.1Å; D371-K374 PolarHBondContact O-N 3.35Å; V372-K374 VanDerWaalsContact C-N 3.34Å; V372-K374 PolarHBondContact O-N 3.48Å; K374-K377 PolarHBondContact O-N 3.34Å; K374-A378 PolarHBondContact O-N 3.45Å; K374-A378 VanDerWaalsContact O-N 3.14Å
375R80.3Confident75.7Confident166 Ų16681.5 Ų81.563%0.62640%0.4SS*.Hα-helixtrans-57.5-51.2175.8173.9178.7-100.6159.3-6.4111.2D371 V372 K377 A378 E379D371-R375 PolarHBondContact O-N 3.46Å; V372-R375 PolarHBondContact O-N 3.02Å; R375-K377 VanDerWaalsContact C-N 3.31Å; R375-K377 PolarHBondContact O-N 2.82Å; R375-A378 WeakPolarHBondContact O-CB 3.43Å; R375-A378 PolarHBondContact O-N 2.92Å; R375-A378 VanDerWaalsContact O-N 3.14Å; R375-E379 WeakPolarHBondContact CD-OE1 3.44Å; R375-E379 HydrophobicContact CG-CG 4.41Å; R375-E379 WeakPolarHBondContact CG-OE1 3.43Å; R375-E379 IonicContact NE-OE1 2.7Å; R375-E379 PolarHBondContact O-N 3.44Å
376L84.5Confident76.8Confident0 Ų078.1 Ų78.10%039%0.386CS..Hα-helixtrans-66.6-29-179.9-69.4175.7000113.3A354 L357 L358 V372 L380 I427A354-L376 HydrophobicContact CB-CD2 3.92Å; L357-L376 HydrophobicContact CB-CD1 4.09Å; L357-L376 HydrophobicContact CB-CD2 4.31Å; L357-L376 HydrophobicContact CD1-CD2 3.98Å; L358-L376 HydrophobicContact CD2-CD1 3.54Å; L358-L376 HydrophobicContact CG-CD1 3.62Å; V372-L376 HydrophobicContact CG1-CD1 3.81Å; V372-L376 HydrophobicContact CG1-CG 4.25Å; V372-L376 WeakPolarHBondContact O-CB 3.45Å; V372-L376 WeakPolarHBondContact O-CG 3.41Å; V372-L376 PolarHBondContact O-N 3.06Å; L376-L380 WeakPolarHBondContact O-CB 3.38Å; L376-L380 PolarHBondContact O-N 3.47Å; L376-I427 HydrophobicContact CB-CD1 4.03Å; L376-I427 HydrophobicContact CB-CG1 4.11Å; L376-I427 HydrophobicContact CB-CG2 4.3Å
377K79.4Confident78.2Confident67 Ų6772.8 Ų72.829%0.29135%0.351SS..Hα-helixtrans-65.7-39171.2-84.2-179.5177.3-162.50112.5L373 K374 R375 N381 I427 K428 G430L373-K377 VanDerWaalsContact O-CB 3.32Å; L373-K377 WeakPolarHBondContact O-CB 3.29Å; L373-K377 VanDerWaalsContact O-CG 3.26Å; L373-K377 WeakPolarHBondContact O-CG 3.34Å; L373-K377 PolarHBondContact O-N 3.43Å; K374-K377 PolarHBondContact O-N 3.34Å; R375-K377 VanDerWaalsContact C-N 3.31Å; R375-K377 PolarHBondContact O-N 2.82Å; K377-N381 PolarHBondContact O-N 3.17Å; K377-I427 HydrophobicContact CB-CG2 4.2Å; K377-I427 WeakPolarHBondContact CE-O 3.35Å; K377-I427 HydrophobicContact CG-CG2 3.47Å; K377-I427 VanDerWaalsContact CG-CG2 3.47Å; K377-K428 WeakPolarHBondContact CE-O 3.49Å; K377-K428 PolarHBondContact NZ-O 2.79Å; K377-G430 PolarHBondContact NZ-O 3.35Å
378A78.2Confident79.2Confident50 Ų5068.4 Ų68.441%0.41333%0.333SS..Hα-helixtrans-68.1-53.6174.500000110.8K374 R375 L380 N381 D382K374-A378 PolarHBondContact O-N 3.45Å; K374-A378 VanDerWaalsContact O-N 3.14Å; R375-A378 WeakPolarHBondContact O-CB 3.43Å; R375-A378 PolarHBondContact O-N 2.92Å; R375-A378 VanDerWaalsContact O-N 3.14Å; A378-L380 PolarHBondContact O-N 3.14Å; A378-N381 WeakPolarHBondContact O-CA 3.47Å; A378-N381 WeakPolarHBondContact O-CB 3.43Å; A378-N381 PolarHBondContact O-N 3.15Å; A378-D382 PolarHBondContact O-N 3.13Å
379E85.2Confident80.1Confident52 Ų5266.2 Ų66.224%0.24333%0.329CS..Hα-helixtrans-57.5-35.2178.2-66.9176-158.600112.7W350 R375 N381 D382 I383W350-E379 HydrophobicContact CZ2-CB 4.03Å; W350-E379 PolarHBondContact NE1-OE2 2.88Å; R375-E379 WeakPolarHBondContact CD-OE1 3.44Å; R375-E379 HydrophobicContact CG-CG 4.41Å; R375-E379 WeakPolarHBondContact CG-OE1 3.43Å; R375-E379 IonicContact NE-OE1 2.7Å; R375-E379 PolarHBondContact O-N 3.44Å; E379-N381 VanDerWaalsContact C-N 3.34Å; E379-D382 PolarHBondContact O-N 3.48Å; E379-I383 WeakPolarHBondContact O-CB 3.3Å; E379-I383 WeakPolarHBondContact O-CG2 3.35Å; E379-I383 PolarHBondContact O-N 2.94Å
380L85.4Confident81.6Confident1 Ų162.7 Ų62.71%0.00531%0.313CS..Hα-helixtrans-64.9-35.5174.2176.363.7000112.7W350 L376 A378 I383 R384 F420 S424 I427 K428W350-L380 HydrophobicContact CH2-CB 4.14Å; W350-L380 HydrophobicContact CH2-CD1 3.86Å; W350-L380 HydrophobicContact CZ2-CB 4.34Å; W350-L380 HydrophobicContact CZ3-CD1 4.4Å; L376-L380 WeakPolarHBondContact O-CB 3.38Å; L376-L380 PolarHBondContact O-N 3.47Å; A378-L380 PolarHBondContact O-N 3.14Å; L380-I383 HydrophobicContact CD1-CG2 4.5Å; L380-R384 VanDerWaalsContact O-CB 3.25Å; L380-R384 WeakPolarHBondContact O-CB 3.4Å; L380-R384 PolarHBondContact O-N 3.14Å; L380-F420 HydrophobicContact CD1-CE2 3.53Å; L380-F420 HydrophobicContact CD1-CZ 3.5Å; L380-F420 VanDerWaalsContact CD1-CZ 3.5Å; L380-S424 WeakPolarHBondContact CD1-OG 3.44Å; L380-I427 HydrophobicContact CB-CD1 4.17Å; L380-I427 HydrophobicContact CB-CG2 4.31Å; L380-I427 HydrophobicContact CD2-CB 3.92Å; L380-I427 HydrophobicContact CD2-CD1 4.2Å; L380-I427 HydrophobicContact CD2-CG2 3.73Å; L380-K428 HydrophobicContact CD2-CG 4.24Å
381N80.9Confident82.6Confident98 Ų9864.5 Ų64.552%0.52432%0.317SS..Hα-helixtrans-71.6-38175.4-71.8-13.4000110.8K377 A378 E379 P385K377-N381 PolarHBondContact O-N 3.17Å; A378-N381 WeakPolarHBondContact O-CA 3.47Å; A378-N381 WeakPolarHBondContact O-CB 3.43Å; A378-N381 PolarHBondContact O-N 3.15Å; E379-N381 VanDerWaalsContact C-N 3.34Å; N381-P385 WeakPolarHBondContact O-CD 3.36Å
382D80.9Confident83.1Confident115 Ų11563.3 Ų63.362%0.61531%0.311SS*.Hα-helixtrans-72.5-38.4-179.7-59.6-20.6000112.9A378 E379A378-D382 PolarHBondContact O-N 3.13Å; E379-D382 PolarHBondContact O-N 3.48Å
383I88.8Confident83.5Confident9 Ų964.9 Ų64.95%0.04632%0.316CS..Hα-helixtrans-76.9-26.8-179.4-156.774.6000111.9I347 W350 E379 L380 K386 V387 F420I347-I383 HydrophobicContact CG1-CD1 4.4Å; I347-I383 HydrophobicContact CG1-CG1 4.39Å; W350-I383 HydrophobicContact CB-CD1 4.07Å; W350-I383 HydrophobicContact CB-CG1 4.35Å; W350-I383 HydrophobicContact CD2-CB 4.2Å; W350-I383 HydrophobicContact CD2-CG1 4Å; W350-I383 HydrophobicContact CD2-CG2 4Å; W350-I383 HydrophobicContact CE3-CB 4.31Å; W350-I383 HydrophobicContact CE3-CG1 4.02Å; W350-I383 HydrophobicContact CE3-CG2 3.74Å; W350-I383 HydrophobicContact CG-CD1 4.11Å; W350-I383 HydrophobicContact CG-CG1 4.12Å; W350-I383 HydrophobicContact CH2-CG2 3.89Å; W350-I383 HydrophobicContact CZ2-CG2 4.13Å; W350-I383 HydrophobicContact CZ3-CG2 3.7Å; E379-I383 WeakPolarHBondContact O-CB 3.3Å; E379-I383 WeakPolarHBondContact O-CG2 3.35Å; E379-I383 PolarHBondContact O-N 2.94Å; L380-I383 HydrophobicContact CD1-CG2 4.5Å; I383-K386 HydrophobicContact CD1-CD 4.24Å; I383-K386 WeakPolarHBondContact O-CA 3.31Å; I383-K386 VanDerWaalsContact O-CB 3.29Å; I383-K386 WeakPolarHBondContact O-CB 3.49Å; I383-K386 PolarHBondContact O-N 2.58Å; I383-V387 PolarHBondContact O-N 3.46Å; I383-F420 HydrophobicContact CG2-CE2 3.63Å; I383-F420 HydrophobicContact CG2-CZ 4.15Å
384R85.7Confident84.1Confident111 Ų11163.4 Ų63.442%0.41931%0.309SS..Hα-helixtrans-62.7-44.8-172.5-173.1163.9-170.4-154.20.7113.8L380 K386 V387 D388 F420L380-R384 VanDerWaalsContact O-CB 3.25Å; L380-R384 WeakPolarHBondContact O-CB 3.4Å; L380-R384 PolarHBondContact O-N 3.14Å; R384-K386 PolarHBondContact O-N 3.14Å; R384-V387 WeakPolarHBondContact O-CB 3.38Å; R384-V387 PolarHBondContact O-N 2.85Å; R384-D388 PolarHBondContact O-N 3.49Å; R384-F420 HydrophobicContact CB-CE1 4.33Å; R384-F420 HydrophobicContact CB-CZ 3.86Å; R384-F420 HydrophobicContact CG-CE1 3.91Å; R384-F420 HydrophobicContact CG-CZ 3.95Å
385P85.5Confident84.5Confident83 Ų8359.8 Ų59.854%0.53930%0.302SS..Hα-helixtrans-54.7-34168.9-27.335000113.4N381 S389N381-P385 WeakPolarHBondContact O-CD 3.36Å; P385-S389 WeakPolarHBondContact O-CB 3.26Å; P385-S389 PolarHBondContact O-N 3.1Å
386K84.6Confident84.6Confident91 Ų9156.3 Ų56.340%0.39630%0.296SS..Hα-helixtrans-69.4-38.9174-55.9-166.5-171.7-177.70112H346 I347 I383 R384 T390H346-K386 PolarHBondContact NE2-NZ 2.99Å; I347-K386 HydrophobicContact CD1-CB 4.37Å; I383-K386 HydrophobicContact CD1-CD 4.24Å; I383-K386 WeakPolarHBondContact O-CA 3.31Å; I383-K386 VanDerWaalsContact O-CB 3.29Å; I383-K386 WeakPolarHBondContact O-CB 3.49Å; I383-K386 PolarHBondContact O-N 2.58Å; R384-K386 PolarHBondContact O-N 3.14Å; K386-T390 VanDerWaalsContact O-CB 3.3Å; K386-T390 WeakPolarHBondContact O-CB 3.46Å; K386-T390 PolarHBondContact O-N 2.94Å; K386-T390 PolarHBondContact O-OG1 2.97Å
387V88.6Confident84.5Confident1 Ų156.9 Ų56.91%0.00630%0.299CS..Hα-helixtrans-63.6-47.5174.5-173.30000110.8I347 I383 R384 S389 T390 R391 F420I347-V387 HydrophobicContact CD1-CB 4.49Å; I347-V387 HydrophobicContact CD1-CG2 4.07Å; I347-V387 HydrophobicContact CG1-CG2 4.32Å; I347-V387 HydrophobicContact CG2-CG2 3.79Å; I383-V387 PolarHBondContact O-N 3.46Å; R384-V387 WeakPolarHBondContact O-CB 3.38Å; R384-V387 PolarHBondContact O-N 2.85Å; V387-S389 PolarHBondContact O-N 3.22Å; V387-T390 PolarHBondContact O-N 3.01Å; V387-R391 WeakPolarHBondContact O-CB 3.36Å; V387-R391 PolarHBondContact O-N 2.87Å; V387-F420 HydrophobicContact CB-CD1 4.23Å; V387-F420 HydrophobicContact CB-CE1 4.25Å; V387-F420 HydrophobicContact CG1-CB 4.46Å; V387-F420 HydrophobicContact CG1-CD1 3.87Å; V387-F420 HydrophobicContact CG1-CE1 4.35Å; V387-F420 HydrophobicContact CG1-CG 4.11Å; V387-F420 HydrophobicContact CG2-CD1 4.03Å; V387-F420 HydrophobicContact CG2-CD2 3.8Å; V387-F420 HydrophobicContact CG2-CE1 4.04Å; V387-F420 HydrophobicContact CG2-CE2 3.82Å; V387-F420 HydrophobicContact CG2-CG 3.91Å; V387-F420 HydrophobicContact CG2-CZ 3.93Å
388D85.5Confident84.7Confident61 Ų6155.3 Ų55.333%0.32629%0.293SS..Hα-helixtrans-62.2-44.6178.3-65.4-39000110.5R384 T390 R391 D392R384-D388 PolarHBondContact O-N 3.49Å; D388-T390 PolarHBondContact O-N 3.49Å; D388-R391 WeakPolarHBondContact O-CB 3.44Å; D388-R391 PolarHBondContact O-N 3.28Å; D388-D392 VanDerWaalsContact O-CG 3.24Å; D388-D392 PolarHBondContact O-N 3.42Å
389S85.8Confident84.6Confident57 Ų5756 Ų5640%0.39930%0.298SS..Hα-helixtrans-61-41.6173.1-177.10000113.1P385 V387 R391 D392 Q393P385-S389 WeakPolarHBondContact O-CB 3.26Å; P385-S389 PolarHBondContact O-N 3.1Å; V387-S389 PolarHBondContact O-N 3.22Å; S389-R391 VanDerWaalsContact C-N 3.31Å; S389-R391 PolarHBondContact O-N 3.29Å; S389-D392 PolarHBondContact O-N 2.92Å; S389-Q393 WeakPolarHBondContact O-CB 3.15Å; S389-Q393 WeakPolarHBondContact O-CG 3.4Å; S389-Q393 PolarHBondContact O-N 3.44Å
390T88.5Confident84.1Confident0 Ų058.4 Ų58.40%031%0.313CS..Hα-helixtrans-66.2-35.2177.2-54.70000111.3F340 N343 V344 I347 K386 V387 D388 A394 I413 L416F340-T390 HydrophobicContact CD2-CG2 3.96Å; F340-T390 HydrophobicContact CE2-CG2 3.82Å; N343-T390 HydrophobicContact CB-CG2 4.01Å; N343-T390 WeakPolarHBondContact CB-OG1 3.26Å; V344-T390 HydrophobicContact CG2-CG2 3.9Å; I347-T390 HydrophobicContact CD1-CG2 4.31Å; I347-T390 VanDerWaalsContact CD1-OG1 3.23Å; I347-T390 WeakPolarHBondContact CD1-OG1 3.35Å; K386-T390 VanDerWaalsContact O-CB 3.3Å; K386-T390 WeakPolarHBondContact O-CB 3.46Å; K386-T390 PolarHBondContact O-N 2.94Å; K386-T390 PolarHBondContact O-OG1 2.97Å; V387-T390 PolarHBondContact O-N 3.01Å; D388-T390 PolarHBondContact O-N 3.49Å; T390-A394 WeakPolarHBondContact O-CB 3.36Å; T390-A394 PolarHBondContact O-N 3.28Å; T390-I413 HydrophobicContact CG2-CD1 4.31Å; T390-L416 HydrophobicContact CG2-CD2 4.28Å
391R86.1Confident83.7Confident114 Ų11460.6 Ų60.643%0.4332%0.321SS..Hα-helixtrans-68.9-39.6174.4-171.5-158.669.1174.6-1.2111.8V387 D388 S389 A394 A395 I413V387-R391 WeakPolarHBondContact O-CB 3.36Å; V387-R391 PolarHBondContact O-N 2.87Å; D388-R391 WeakPolarHBondContact O-CB 3.44Å; D388-R391 PolarHBondContact O-N 3.28Å; S389-R391 VanDerWaalsContact C-N 3.31Å; S389-R391 PolarHBondContact O-N 3.29Å; R391-A394 WeakPolarHBondContact O-CB 3.45Å; R391-A394 PolarHBondContact O-N 3.03Å; R391-A395 PolarHBondContact O-N 3.39Å; R391-I413 HydrophobicContact CB-CD1 4.09Å; R391-I413 HydrophobicContact CB-CG1 4.38Å; R391-I413 HydrophobicContact CG-CD1 4.49Å; R391-I413 HydrophobicContact CG-CG1 4.28Å
392D85.7Confident83.5Confident74 Ų7457.3 Ų57.340%0.39631%0.31SS..Hα-helixtrans-75.6-32.6178.9-62.6-7.8000111.1D388 S389 A395 N396D388-D392 VanDerWaalsContact O-CG 3.24Å; D388-D392 PolarHBondContact O-N 3.42Å; S389-D392 PolarHBondContact O-N 2.92Å; D392-A395 PolarHBondContact O-N 2.85Å; D392-N396 WeakPolarHBondContact O-CB 3.35Å; D392-N396 PolarHBondContact O-N 3.49Å; D392-N396 PolarHBondContact O-ND2 3.16Å
393Q85.5Confident83.2Confident57 Ų5757.4 Ų57.427%0.26631%0.311SS..Hα-helixtrans-60.8-46.5165.1-76.5179.3-1.400111.4N343 S389 A395 N396 L397N343-Q393 PolarHBondContact ND2-OE1 3.48Å; S389-Q393 WeakPolarHBondContact O-CB 3.15Å; S389-Q393 WeakPolarHBondContact O-CG 3.4Å; S389-Q393 PolarHBondContact O-N 3.44Å; Q393-A395 PolarHBondContact O-N 3.4Å; Q393-N396 PolarHBondContact O-N 2.86Å; Q393-L397 WeakPolarHBondContact O-CB 3.24Å; Q393-L397 WeakPolarHBondContact O-CG 3.19Å; Q393-L397 PolarHBondContact O-N 3.48Å
394A85.4Confident82.5Confident0 Ų060 Ų600%032%0.323CS..Hα-helixtrans-58.6-47.4175.300000111.6F340 T390 R391 N396 L397 M398 V409 I413F340-A394 HydrophobicContact CD2-CB 4.43Å; F340-A394 HydrophobicContact CE2-CB 3.77Å; F340-A394 HydrophobicContact CZ-CB 4.36Å; T390-A394 WeakPolarHBondContact O-CB 3.36Å; T390-A394 PolarHBondContact O-N 3.28Å; R391-A394 WeakPolarHBondContact O-CB 3.45Å; R391-A394 PolarHBondContact O-N 3.03Å; A394-N396 VanDerWaalsContact C-N 3.34Å; A394-N396 PolarHBondContact O-N 3.15Å; A394-L397 PolarHBondContact O-N 3Å; A394-M398 HydrophobicContact CB-CE 4.33Å; A394-M398 WeakPolarHBondContact O-CB 3.45Å; A394-M398 WeakPolarHBondContact O-CG 3.49Å; A394-M398 PolarHBondContact O-N 2.8Å; A394-V409 HydrophobicContact CB-CG1 3.49Å; A394-V409 VanDerWaalsContact CB-CG1 3.49Å; A394-I413 HydrophobicContact CB-CB 4.02Å; A394-I413 HydrophobicContact CB-CD1 4.37Å; A394-I413 HydrophobicContact CB-CG1 3.83Å; A394-I413 HydrophobicContact CB-CG2 4.18Å
395A84.5Confident82.2Confident48 Ų4854.7 Ų54.740%0.39730%0.303SS..Hα-helixtrans-57.8-45.3177.500000112R391 D392 Q393 M398 A399R391-A395 PolarHBondContact O-N 3.39Å; D392-A395 PolarHBondContact O-N 2.85Å; Q393-A395 PolarHBondContact O-N 3.4Å; A395-M398 PolarHBondContact O-N 3.28Å; A395-A399 VanDerWaalsContact O-CB 3.29Å; A395-A399 WeakPolarHBondContact O-CB 3.38Å; A395-A399 PolarHBondContact O-N 3.25Å
396N81.5Confident82.1Confident93 Ų9355.7 Ų55.750%0.49730%0.296SS..Hα-helixtrans-64.6-40.7175.9-78.4-54.1000113D392 Q393 A394 A399 N400D392-N396 WeakPolarHBondContact O-CB 3.35Å; D392-N396 PolarHBondContact O-N 3.49Å; D392-N396 PolarHBondContact O-ND2 3.16Å; Q393-N396 PolarHBondContact O-N 2.86Å; A394-N396 VanDerWaalsContact C-N 3.34Å; A394-N396 PolarHBondContact O-N 3.15Å; N396-A399 PolarHBondContact O-N 2.97Å; N396-N400 VanDerWaalsContact O-CB 3.31Å; N396-N400 WeakPolarHBondContact O-CB 3.42Å; N396-N400 PolarHBondContact O-N 3.4Å; N396-N400 PolarHBondContact O-ND2 3.4Å
397L83Confident81.8Confident12 Ų1258.4 Ų58.46%0.06331%0.307CS..Hα-helixtrans-62.1-44.8174.5-79.5176.4000111.8H336 F340 Q393 A394 R401 C405 V409H336-L397 HydrophobicContact CB-CD2 4.05Å; F340-L397 HydrophobicContact CB-CD1 3.7Å; F340-L397 HydrophobicContact CD1-CD1 4.31Å; F340-L397 HydrophobicContact CD2-CD1 4.31Å; F340-L397 HydrophobicContact CG-CD1 3.84Å; Q393-L397 WeakPolarHBondContact O-CB 3.24Å; Q393-L397 WeakPolarHBondContact O-CG 3.19Å; Q393-L397 PolarHBondContact O-N 3.48Å; A394-L397 PolarHBondContact O-N 3Å; L397-R401 HydrophobicContact CD2-CG 3.87Å; L397-R401 WeakPolarHBondContact O-CB 3.45Å; L397-R401 PolarHBondContact O-N 3.02Å; L397-C405 PolarHBondContact O-SG 3.15Å; L397-V409 HydrophobicContact CB-CG2 4.25Å; L397-V409 HydrophobicContact CD1-CG2 4.07Å
398M83.8Confident81.4Confident34 Ų3462.3 Ų62.317%0.16733%0.328CS..Hα-helixtrans-70.5-30.5179.5-67-172-68.100113.5A394 A395 R406 V409 E410A394-M398 HydrophobicContact CB-CE 4.33Å; A394-M398 WeakPolarHBondContact O-CB 3.45Å; A394-M398 WeakPolarHBondContact O-CG 3.49Å; A394-M398 PolarHBondContact O-N 2.8Å; A395-M398 PolarHBondContact O-N 3.28Å; M398-R406 HydrophobicContact CB-CB 4.34Å; M398-R406 HydrophobicContact CB-CG 4.12Å; M398-R406 HydrophobicContact CG-CB 4.3Å; M398-R406 HydrophobicContact CG-CG 4.03Å; M398-R406 PolarHBondContact O-NE 2.78Å; M398-R406 PolarHBondContact O-NH2 2.83Å; M398-R406 HydrophobicContact SD-CG 4.23Å; M398-V409 HydrophobicContact CG-CB 4.05Å; M398-V409 HydrophobicContact CG-CG1 3.77Å; M398-V409 HydrophobicContact SD-CG1 4.16Å; M398-E410 HydrophobicContact SD-CB 3.64Å; M398-E410 HydrophobicContact SD-CG 4.03Å
399A76.2Confident81.6Confident64 Ų6459.4 Ų59.453%0.52931%0.312SS..Hα-helixtrans-79.9-46.7177.400000112.4A395 N396A395-A399 VanDerWaalsContact O-CB 3.29Å; A395-A399 WeakPolarHBondContact O-CB 3.38Å; A395-A399 PolarHBondContact O-N 3.25Å; N396-A399 PolarHBondContact O-N 2.97Å
400N73.9Confident81.7Confident104 Ų10461.2 Ų61.256%0.55632%0.315SS*.Hα-helixtrans-106.7-8.1-161.7-57.1-35.2000114.8N396N396-N400 VanDerWaalsContact O-CB 3.31Å; N396-N400 WeakPolarHBondContact O-CB 3.42Å; N396-N400 PolarHBondContact O-N 3.4Å; N396-N400 PolarHBondContact O-ND2 3.4Å
401R77.5Confident81.5Confident47 Ų4765.2 Ų65.218%0.17734%0.34CS..SBendtrans-116.511.7-174.6-49.3-58.4-169.5-173.910.2114.6M259 E332 H336 L397 C405M259-R401 HydrophobicContact CB-CB 4.38Å; M259-R401 WeakPolarHBondContact CB-O 3.23Å; M259-R401 PolarHBondContact N-O 3.42Å; E332-R401 IonicContact OE1-CZ 3.12Å; E332-R401 IonicContact OE1-NH1 2.66Å; E332-R401 PolarHBondContact OE1-NH1 2.88Å; E332-R401 IonicContact OE1-NH2 2.68Å; E332-R401 PolarHBondContact OE1-NH2 2.9Å; H336-R401 PolarHBondContact CE1-NH2 3.47Å; H336-R401 VanDerWaalsContact CE1-NH2 3.25Å; H336-R401 PolarHBondContact ND1-NH2 3.26Å; L397-R401 HydrophobicContact CD2-CG 3.87Å; L397-R401 WeakPolarHBondContact O-CB 3.45Å; L397-R401 PolarHBondContact O-N 3.02Å; R401-C405 HydrophobicContact CB-CB 3.79Å
402G76.3Confident81.5Confident28 Ų2863.2 Ų63.229%0.28934%0.336SS..Hα-helixtrans82.6170.2172.200000115.8H404 C405 R406G402-H404 VanDerWaalsContact C-N 3.28Å; G402-H404 PolarHBondContact O-N 3.11Å; G402-C405 WeakPolarHBondContact O-CB 3.49Å; G402-C405 PolarHBondContact O-N 2.92Å; G402-C405 VanDerWaalsContact O-N 3.12Å; G402-R406 PolarHBondContact O-N 2.9Å
403D74.1Confident81.8Confident118 Ų11860.1 Ų60.163%0.63132%0.319SS*.Hα-helixtrans-57.7-32.2-171-84.60.1000115R406 K407D403-R406 PolarHBondContact O-N 3.22Å; D403-K407 WeakPolarHBondContact O-CG 3.37Å; D403-K407 PolarHBondContact O-N 2.94Å; D403-K407 VanDerWaalsContact O-N 3.11Å
404H75.2Confident81.7Confident63 Ų6360.6 Ų60.629%0.29233%0.329SS..Hα-helixtrans-68.2-43178.9-177.661.8000111.5G402 R406 K407 L408G402-H404 VanDerWaalsContact C-N 3.28Å; G402-H404 PolarHBondContact O-N 3.11Å; H404-R406 VanDerWaalsContact C-N 3.31Å; H404-R406 PolarHBondContact O-N 2.81Å; H404-K407 PolarHBondContact O-N 3.39Å; H404-L408 PolarHBondContact O-N 3.03Å
405C80Confident81.8Confident0 Ų064.9 Ų64.90%035%0.349CS..Hα-helixtrans-59.7-43.9173.5-172.70000110.8M259 L397 R401 G402 K407 L408 V409M259-C405 HydrophobicContact CE-CB 3.92Å; M259-C405 HydrophobicContact SD-CB 4.45Å; L397-C405 PolarHBondContact O-SG 3.15Å; R401-C405 HydrophobicContact CB-CB 3.79Å; G402-C405 WeakPolarHBondContact O-CB 3.49Å; G402-C405 PolarHBondContact O-N 2.92Å; G402-C405 VanDerWaalsContact O-N 3.12Å; C405-K407 PolarHBondContact O-N 2.76Å; C405-L408 PolarHBondContact O-N 3.04Å; C405-L408 VanDerWaalsContact O-N 3.15Å; C405-V409 WeakPolarHBondContact O-CB 3.41Å; C405-V409 WeakPolarHBondContact O-CG2 3.25Å; C405-V409 PolarHBondContact O-N 3.09Å
406R81.9Confident82Confident103 Ų10362.8 Ų62.839%0.38933%0.331SS..Hα-helixtrans-57.2-45.2177.4-173.3178-64.8-131.23.1113M398 G402 D403 H404 L408 V409 E410M398-R406 HydrophobicContact CB-CB 4.34Å; M398-R406 HydrophobicContact CB-CG 4.12Å; M398-R406 HydrophobicContact CG-CB 4.3Å; M398-R406 HydrophobicContact CG-CG 4.03Å; M398-R406 PolarHBondContact O-NE 2.78Å; M398-R406 PolarHBondContact O-NH2 2.83Å; M398-R406 HydrophobicContact SD-CG 4.23Å; G402-R406 PolarHBondContact O-N 2.9Å; D403-R406 PolarHBondContact O-N 3.22Å; H404-R406 VanDerWaalsContact C-N 3.31Å; H404-R406 PolarHBondContact O-N 2.81Å; R406-L408 PolarHBondContact O-N 3.5Å; R406-V409 PolarHBondContact O-N 3.4Å; R406-E410 HydrophobicContact CG-CB 4.48Å; R406-E410 WeakPolarHBondContact CG-OE2 3.22Å; R406-E410 VanDerWaalsContact O-CB 3.24Å; R406-E410 WeakPolarHBondContact O-CB 3.26Å; R406-E410 PolarHBondContact O-N 2.91Å
407K78.4Confident82.3Confident148 Ų14860.9 Ų60.964%0.64332%0.321SS*.Hα-helixtrans-62.3-25.1178.9-73.2169.3-176.3170.30114.4D403 H404 C405D403-K407 WeakPolarHBondContact O-CG 3.37Å; D403-K407 PolarHBondContact O-N 2.94Å; D403-K407 VanDerWaalsContact O-N 3.11Å; H404-K407 PolarHBondContact O-N 3.39Å; C405-K407 PolarHBondContact O-N 2.76Å
408L81.2Confident82.2Confident83 Ų8366.9 Ų66.944%0.43535%0.348SS..Hα-helixtrans-86.8-42.5176.5-67.4171.2000112.1M259 H404 C405 R406M259-L408 HydrophobicContact CE-CD1 4.3Å; H404-L408 PolarHBondContact O-N 3.03Å; C405-L408 PolarHBondContact O-N 3.04Å; C405-L408 VanDerWaalsContact O-N 3.15Å; R406-L408 PolarHBondContact O-N 3.5Å
409V89.2Confident82.4Confident0 Ų070.4 Ų70.40%036%0.36CS..Hα-helixtrans-80.7-42.9-170.7170.30000113M337 F340 A394 L397 M398 C405 R406 Q412 I413M337-V409 HydrophobicContact SD-CG2 4.26Å; F340-V409 HydrophobicContact CD1-CG2 4.11Å; F340-V409 HydrophobicContact CE1-CB 4.21Å; F340-V409 HydrophobicContact CE1-CG1 4.03Å; F340-V409 HydrophobicContact CE1-CG2 3.87Å; F340-V409 HydrophobicContact CE2-CG1 4.21Å; F340-V409 HydrophobicContact CZ-CB 4.38Å; F340-V409 HydrophobicContact CZ-CG1 3.75Å; F340-V409 HydrophobicContact CZ-CG2 4.44Å; A394-V409 HydrophobicContact CB-CG1 3.49Å; A394-V409 VanDerWaalsContact CB-CG1 3.49Å; L397-V409 HydrophobicContact CB-CG2 4.25Å; L397-V409 HydrophobicContact CD1-CG2 4.07Å; M398-V409 HydrophobicContact CG-CB 4.05Å; M398-V409 HydrophobicContact CG-CG1 3.77Å; M398-V409 HydrophobicContact SD-CG1 4.16Å; C405-V409 WeakPolarHBondContact O-CB 3.41Å; C405-V409 WeakPolarHBondContact O-CG2 3.25Å; C405-V409 PolarHBondContact O-N 3.09Å; R406-V409 PolarHBondContact O-N 3.4Å; V409-Q412 PolarHBondContact O-N 2.71Å; V409-I413 WeakPolarHBondContact O-CG2 3.23Å; V409-I413 PolarHBondContact O-N 3.17Å; V409-I413 VanDerWaalsContact O-N 3.1Å
410E87.1Confident83Confident96 Ų9668 Ų6845%0.44934%0.337SS..Hα-helixtrans-59.2-41.2-172.6-169.4170-168.700114.2M398 R406 I413 S414M398-E410 HydrophobicContact SD-CB 3.64Å; M398-E410 HydrophobicContact SD-CG 4.03Å; R406-E410 HydrophobicContact CG-CB 4.48Å; R406-E410 WeakPolarHBondContact CG-OE2 3.22Å; R406-E410 VanDerWaalsContact O-CB 3.24Å; R406-E410 WeakPolarHBondContact O-CB 3.26Å; R406-E410 PolarHBondContact O-N 2.91Å; E410-I413 WeakPolarHBondContact O-CG2 3.37Å; E410-S414 WeakPolarHBondContact O-CB 3.35Å; E410-S414 PolarHBondContact O-N 3.34Å; E410-S414 PolarHBondContact O-OG 2.64Å
411P85.3Confident83.4Confident83 Ų8365.9 Ų65.954%0.53934%0.335SS..Hα-helixtrans-68-41.9176.4-19.533.5000112.7S414 E415P411-S414 PolarHBondContact O-N 3.31Å; P411-E415 PolarHBondContact O-N 2.89Å; P411-E415 VanDerWaalsContact O-N 3.14Å
412Q86.5Confident83.5Confident73 Ų7366.4 Ų66.434%0.34135%0.349SS..Hα-helixtrans-65.1-46.9-177.1-66.7-171.75.300111.6F340 V409 S414 E415 L416F340-Q412 HydrophobicContact CE1-CB 4.45Å; F340-Q412 VanDerWaalsContact CE1-OE1 3.22Å; F340-Q412 HydrophobicContact CZ-CB 4.34Å; V409-Q412 PolarHBondContact O-N 2.71Å; Q412-S414 VanDerWaalsContact C-N 3.31Å; Q412-S414 PolarHBondContact O-N 3.11Å; Q412-E415 PolarHBondContact O-N 2.87Å; Q412-L416 WeakPolarHBondContact O-CB 3.16Å; Q412-L416 PolarHBondContact O-N 3.09Å
413I91.1Very high83.8Confident8 Ų865.1 Ų65.14%0.04134%0.336CS..Hα-helixtrans-68.7-31.8-179.1-166.556.8000112.1T390 R391 A394 V409 E410 L416 N417T390-I413 HydrophobicContact CG2-CD1 4.31Å; R391-I413 HydrophobicContact CB-CD1 4.09Å; R391-I413 HydrophobicContact CB-CG1 4.38Å; R391-I413 HydrophobicContact CG-CD1 4.49Å; R391-I413 HydrophobicContact CG-CG1 4.28Å; A394-I413 HydrophobicContact CB-CB 4.02Å; A394-I413 HydrophobicContact CB-CD1 4.37Å; A394-I413 HydrophobicContact CB-CG1 3.83Å; A394-I413 HydrophobicContact CB-CG2 4.18Å; V409-I413 WeakPolarHBondContact O-CG2 3.23Å; V409-I413 PolarHBondContact O-N 3.17Å; V409-I413 VanDerWaalsContact O-N 3.1Å; E410-I413 WeakPolarHBondContact O-CG2 3.37Å; I413-L416 HydrophobicContact CD1-CD2 4.22Å; I413-N417 WeakPolarHBondContact O-CB 3.29Å; I413-N417 VanDerWaalsContact O-CG 3.29Å; I413-N417 PolarHBondContact O-N 3.32Å; I413-N417 PolarHBondContact O-ND2 3.02Å
414S84.3Confident84.2Confident68 Ų6860 Ų6048%0.47631%0.309SS..Hα-helixtrans-65.5-46.8175.8-61.50000111.9E410 P411 Q412 H418E410-S414 WeakPolarHBondContact O-CB 3.35Å; E410-S414 PolarHBondContact O-N 3.34Å; E410-S414 PolarHBondContact O-OG 2.64Å; P411-S414 PolarHBondContact O-N 3.31Å; Q412-S414 VanDerWaalsContact C-N 3.31Å; Q412-S414 PolarHBondContact O-N 3.11Å; S414-H418 PolarHBondContact O-N 2.9Å; S414-H418 VanDerWaalsContact O-N 3.13Å
415E86.3Confident84.1Confident89 Ų8963.4 Ų63.442%0.41633%0.325SS..Hα-helixtrans-63.9-43.6175.9179.864.7-174.300111.7P411 Q412 N417 H418 R419P411-E415 PolarHBondContact O-N 2.89Å; P411-E415 VanDerWaalsContact O-N 3.14Å; Q412-E415 PolarHBondContact O-N 2.87Å; E415-N417 PolarHBondContact O-N 3.5Å; E415-H418 PolarHBondContact O-N 3.36Å; E415-R419 WeakPolarHBondContact O-CG 3.3Å; E415-R419 PolarHBondContact O-N 2.92Å; E415-R419 VanDerWaalsContact O-N 3.09Å; E415-R419 IonicContact OE1-CZ 3.13Å; E415-R419 IonicContact OE1-NE 3.28Å; E415-R419 PolarHBondContact OE1-NE 3.25Å; E415-R419 IonicContact OE1-NH2 2.65Å; E415-R419 PolarHBondContact OE1-NH2 3.39Å
416L88.9Confident83.7Confident4 Ų467 Ų672%0.02134%0.338CS..Hα-helixtrans-60.3-47.1178.8-167.171.6000111.7V344 I347 T348 I351 T390 Q412 I413 H418 R419 F420V344-L416 HydrophobicContact CG2-CD2 4.31Å; I347-L416 HydrophobicContact CB-CD1 4.09Å; I347-L416 HydrophobicContact CB-CD2 4.29Å; I347-L416 HydrophobicContact CD1-CD2 4.05Å; I347-L416 HydrophobicContact CG2-CD1 3.7Å; I347-L416 HydrophobicContact CG2-CD2 4.11Å; I347-L416 HydrophobicContact CG2-CG 4.06Å; T348-L416 WeakPolarHBondContact OG1-CD1 3.26Å; I351-L416 HydrophobicContact CD1-CD1 4.13Å; T390-L416 HydrophobicContact CG2-CD2 4.28Å; Q412-L416 WeakPolarHBondContact O-CB 3.16Å; Q412-L416 PolarHBondContact O-N 3.09Å; I413-L416 HydrophobicContact CD1-CD2 4.22Å; L416-H418 PolarHBondContact O-N 3.39Å; L416-R419 PolarHBondContact O-N 3.08Å; L416-F420 VanDerWaalsContact O-CB 3.27Å; L416-F420 WeakPolarHBondContact O-CB 3.39Å; L416-F420 PolarHBondContact O-N 3.24Å
417N87.2Confident83.3Confident54 Ų5462.1 Ų62.129%0.28932%0.32SS..Hα-helixtrans-62.1-40.9177.7-79.5-43.1000112.3I413 E415 F420 A421I413-N417 WeakPolarHBondContact O-CB 3.29Å; I413-N417 VanDerWaalsContact O-CG 3.29Å; I413-N417 PolarHBondContact O-N 3.32Å; I413-N417 PolarHBondContact O-ND2 3.02Å; E415-N417 PolarHBondContact O-N 3.5Å; N417-F420 PolarHBondContact O-N 3.4Å; N417-A421 WeakPolarHBondContact O-CB 3.41Å; N417-A421 PolarHBondContact O-N 3.36Å
418H82.9Confident82.8Confident138 Ų13859.8 Ų59.864%0.63931%0.31SS*.Hα-helixtrans-62.5-49.1178.7-172.970.1000111.6S414 E415 L416 A421 A422S414-H418 PolarHBondContact O-N 2.9Å; S414-H418 VanDerWaalsContact O-N 3.13Å; E415-H418 PolarHBondContact O-N 3.36Å; L416-H418 PolarHBondContact O-N 3.39Å; H418-A421 PolarHBondContact O-N 3.05Å; H418-A422 PolarHBondContact O-N 2.86Å
419R86.1Confident81.3Confident107 Ų10760.4 Ų60.440%0.40432%0.317SS..Hα-helixtrans-63.5-42176.5-65.1-175.5-173.9-168.54.9112.3I351 E415 L416 A421 A422 I423I351-R419 HydrophobicContact CD1-CB 4.08Å; I351-R419 HydrophobicContact CG2-CB 4.16Å; E415-R419 WeakPolarHBondContact O-CG 3.3Å; E415-R419 PolarHBondContact O-N 2.92Å; E415-R419 VanDerWaalsContact O-N 3.09Å; E415-R419 IonicContact OE1-CZ 3.13Å; E415-R419 IonicContact OE1-NE 3.28Å; E415-R419 PolarHBondContact OE1-NE 3.25Å; E415-R419 IonicContact OE1-NH2 2.65Å; E415-R419 PolarHBondContact OE1-NH2 3.39Å; L416-R419 PolarHBondContact O-N 3.08Å; R419-A421 VanDerWaalsContact C-N 3.34Å; R419-A421 PolarHBondContact O-N 3.3Å; R419-A422 PolarHBondContact O-N 3.35Å; R419-I423 PolarHBondContact O-N 3.14Å; R419-I423 VanDerWaalsContact O-N 3.12Å
420F89.1Confident79.1Confident13 Ų1361.9 Ų61.96%0.05733%0.333CS..Hα-helixtrans-64.6-36.8-179.7-174.7-109.9000113W350 I351 L380 I383 R384 V387 L416 N417 I423 S424W350-F420 HydrophobicContact CH2-CE2 4.45Å; W350-F420 HydrophobicContact CZ3-CD2 4.08Å; W350-F420 AromaticContact CZ3-CE2 3.82Å; W350-F420 HydrophobicContact CZ3-CE2 3.82Å; I351-F420 HydrophobicContact CD1-CB 4.09Å; I351-F420 HydrophobicContact CD1-CD2 4.45Å; L380-F420 HydrophobicContact CD1-CE2 3.53Å; L380-F420 HydrophobicContact CD1-CZ 3.5Å; L380-F420 VanDerWaalsContact CD1-CZ 3.5Å; I383-F420 HydrophobicContact CG2-CE2 3.63Å; I383-F420 HydrophobicContact CG2-CZ 4.15Å; R384-F420 HydrophobicContact CB-CE1 4.33Å; R384-F420 HydrophobicContact CB-CZ 3.86Å; R384-F420 HydrophobicContact CG-CE1 3.91Å; R384-F420 HydrophobicContact CG-CZ 3.95Å; V387-F420 HydrophobicContact CB-CD1 4.23Å; V387-F420 HydrophobicContact CB-CE1 4.25Å; V387-F420 HydrophobicContact CG1-CB 4.46Å; V387-F420 HydrophobicContact CG1-CD1 3.87Å; V387-F420 HydrophobicContact CG1-CE1 4.35Å; V387-F420 HydrophobicContact CG1-CG 4.11Å; V387-F420 HydrophobicContact CG2-CD1 4.03Å; V387-F420 HydrophobicContact CG2-CD2 3.8Å; V387-F420 HydrophobicContact CG2-CE1 4.04Å; V387-F420 HydrophobicContact CG2-CE2 3.82Å; V387-F420 HydrophobicContact CG2-CG 3.91Å; V387-F420 HydrophobicContact CG2-CZ 3.93Å; L416-F420 VanDerWaalsContact O-CB 3.27Å; L416-F420 WeakPolarHBondContact O-CB 3.39Å; L416-F420 PolarHBondContact O-N 3.24Å; N417-F420 PolarHBondContact O-N 3.4Å; F420-I423 HydrophobicContact CD2-CG2 4.17Å; F420-I423 VanDerWaalsContact O-CG2 3.31Å; F420-I423 WeakPolarHBondContact O-CG2 3.34Å; F420-S424 WeakPolarHBondContact O-CB 3.14Å; F420-S424 PolarHBondContact O-N 2.71Å; F420-S424 PolarHBondContact O-OG 2.87Å
421A83.3Confident76.4Confident61 Ų6167.4 Ų67.450%0.50436%0.355SS..Hα-helixtrans-65.1-41.4174.800000112.2N417 H418 R419 H425N417-A421 WeakPolarHBondContact O-CB 3.41Å; N417-A421 PolarHBondContact O-N 3.36Å; H418-A421 PolarHBondContact O-N 3.05Å; R419-A421 VanDerWaalsContact C-N 3.34Å; R419-A421 PolarHBondContact O-N 3.3Å; A421-H425 PolarHBondContact O-N 3.49Å
422A78.7Confident73.8Confident58 Ų5866.8 Ų66.848%0.47936%0.357SS..Hα-helixtrans-63.4-51.4178.900000112.3H418 R419 S424 H425 R426H418-A422 PolarHBondContact O-N 2.86Å; R419-A422 PolarHBondContact O-N 3.35Å; A422-S424 PolarHBondContact O-N 2.87Å; A422-H425 PolarHBondContact O-N 3.49Å; A422-R426 PolarHBondContact O-N 3.25Å
423I82.2Confident71.1Confident1 Ų168.9 Ų68.91%0.00538%0.38CS..Hα-helixtrans-63.2-41.4178.4-166.781.1000111.4W350 I351 A354 D355 L358 R419 F420 H425 R426 I427W350-I423 HydrophobicContact CH2-CG1 4.49Å; W350-I423 HydrophobicContact CH2-CG2 4.41Å; W350-I423 HydrophobicContact CZ3-CG2 3.94Å; I351-I423 HydrophobicContact CG1-CG2 4.37Å; A354-I423 HydrophobicContact CB-CD1 3.85Å; A354-I423 HydrophobicContact CB-CG1 3.84Å; D355-I423 HydrophobicContact CB-CD1 3.97Å; D355-I423 VanDerWaalsContact CG-CD1 3.46Å; D355-I423 WeakPolarHBondContact OD1-CD1 3.34Å; L358-I423 HydrophobicContact CD1-CD1 3.52Å; L358-I423 HydrophobicContact CD1-CG1 4.38Å; R419-I423 PolarHBondContact O-N 3.14Å; R419-I423 VanDerWaalsContact O-N 3.12Å; F420-I423 HydrophobicContact CD2-CG2 4.17Å; F420-I423 VanDerWaalsContact O-CG2 3.31Å; F420-I423 WeakPolarHBondContact O-CG2 3.34Å; I423-H425 PolarHBondContact O-N 2.67Å; I423-R426 PolarHBondContact O-N 3.43Å; I423-I427 HydrophobicContact CG1-CD1 3.89Å; I423-I427 WeakPolarHBondContact O-CG1 3.45Å; I423-I427 PolarHBondContact O-N 2.88Å; I423-I427 VanDerWaalsContact O-N 3.15Å
424S83.3Confident68.4Low10 Ų1072.1 Ų72.17%0.0740%0.396CS..Hα-helixtrans-54.9-38.9176.5-71.90000112.8L380 F420 A422 K428L380-S424 WeakPolarHBondContact CD1-OG 3.44Å; F420-S424 WeakPolarHBondContact O-CB 3.14Å; F420-S424 PolarHBondContact O-N 2.71Å; F420-S424 PolarHBondContact O-OG 2.87Å; A422-S424 PolarHBondContact O-N 2.87Å; S424-K428 WeakPolarHBondContact O-CG 3.32Å; S424-K428 PolarHBondContact O-N 3.34Å
425H72.5Confident66.2Low135 Ų13573.1 Ų73.163%0.62540%0.401SS*.Hα-helixtrans-72.7-42.8-179.6-176-93.8000112A421 A422 I423 I427 K428A421-H425 PolarHBondContact O-N 3.49Å; A422-H425 PolarHBondContact O-N 3.49Å; I423-H425 PolarHBondContact O-N 2.67Å; H425-I427 VanDerWaalsContact C-N 3.28Å; H425-I427 PolarHBondContact O-N 3.31Å; H425-K428 PolarHBondContact O-N 3.35Å
426R71.2Confident63.9Low76 Ų7676 Ų7629%0.28742%0.418SS..Hα-helixtrans-56.8-42.2175.6-65.1-176.273.9-174.85.4111.7D355 L358 D359 E362 A422 I423D355-R426 IonicContact OD1-CZ 2.69Å; D355-R426 IonicContact OD1-NH1 2.61Å; D355-R426 PolarHBondContact OD1-NH1 3.29Å; L358-R426 HydrophobicContact CD1-CB 3.63Å; L358-R426 HydrophobicContact CD1-CG 4.34Å; D359-R426 IonicContact OD1-CZ 3.49Å; D359-R426 VanDerWaalsContact OD1-CZ 3.24Å; D359-R426 IonicContact OD1-NH1 3.98Å; D359-R426 PolarHBondContact OD1-NH1 3.47Å; D359-R426 IonicContact OD1-NH2 2.62Å; D359-R426 PolarHBondContact OD1-NH2 3.31Å; E362-R426 IonicContact OE1-NH2 2.59Å; E362-R426 PolarHBondContact OE1-NH2 2.93Å; A422-R426 PolarHBondContact O-N 3.25Å; I423-R426 PolarHBondContact O-N 3.43Å
427I75.1Confident62.2Low0 Ų083.2 Ų83.20%045%0.45CS..Hα-helixtrans-70.8-39.2-175.7-68.2169.2000112.2W350 L358 L373 L376 K377 L380 I423 H425 T429W350-I427 HydrophobicContact CH2-CD1 4Å; W350-I427 HydrophobicContact CZ2-CD1 4.38Å; L358-I427 HydrophobicContact CD1-CG1 4.07Å; L358-I427 HydrophobicContact CD2-CG1 4.33Å; L373-I427 WeakPolarHBondContact CD2-O 3.42Å; L376-I427 HydrophobicContact CB-CD1 4.03Å; L376-I427 HydrophobicContact CB-CG1 4.11Å; L376-I427 HydrophobicContact CB-CG2 4.3Å; K377-I427 HydrophobicContact CB-CG2 4.2Å; K377-I427 WeakPolarHBondContact CE-O 3.35Å; K377-I427 HydrophobicContact CG-CG2 3.47Å; K377-I427 VanDerWaalsContact CG-CG2 3.47Å; L380-I427 HydrophobicContact CB-CD1 4.17Å; L380-I427 HydrophobicContact CB-CG2 4.31Å; L380-I427 HydrophobicContact CD2-CB 3.92Å; L380-I427 HydrophobicContact CD2-CD1 4.2Å; L380-I427 HydrophobicContact CD2-CG2 3.73Å; I423-I427 HydrophobicContact CG1-CD1 3.89Å; I423-I427 WeakPolarHBondContact O-CG1 3.45Å; I423-I427 PolarHBondContact O-N 2.88Å; I423-I427 VanDerWaalsContact O-N 3.15Å; H425-I427 VanDerWaalsContact C-N 3.28Å; H425-I427 PolarHBondContact O-N 3.31Å; I427-T429 PolarHBondContact O-N 2.72Å
428K67.5Low60.6Low99 Ų9983.7 Ų83.743%0.4345%0.45SS..Hα-helixtrans-71.5-31.4-167.6-79.5172.6179.71720115.2K377 L380 S424 H425 G430K377-K428 WeakPolarHBondContact CE-O 3.49Å; K377-K428 PolarHBondContact NZ-O 2.79Å; L380-K428 HydrophobicContact CD2-CG 4.24Å; S424-K428 WeakPolarHBondContact O-CG 3.32Å; S424-K428 PolarHBondContact O-N 3.34Å; H425-K428 PolarHBondContact O-N 3.35Å; K428-G430 PolarHBondContact O-N 3.19Å
429T49.6Very low59.3Low95 Ų9578.1 Ų78.158%0.58343%0.425SS*.THydrogen-bonded Turntrans-76.5-11.9-164.251.40000116.6I427 K431I427-T429 PolarHBondContact O-N 2.72Å; T429-K431 PolarHBondContact O-N 3.38Å
430G42.4Very low58.1Low32 Ų3279.5 Ų79.533%0.3344%0.436SS..  trans-69.9119.7176.100000113.6K377 K428K377-G430 PolarHBondContact NZ-O 3.35Å; K428-G430 PolarHBondContact O-N 3.19Å
431K30.8Very low57.3Low212 Ų21282.9 Ų82.992%0.92245%0.452SS*.  trans-107.8141.2177.4-75.6-178.6174179.70112T429T429-K431 PolarHBondContact O-N 3.38Å
432A30.3Very low57.3Low70 Ų7080 Ų8058%0.57943%0.428SS*.  trans-141.1163.8173.600000110.6
433S29.2Very low57.1Low117 Ų11779.2 Ų79.282%0.81842%0.416SS*.  trans-114.3161.2-172.9-167.10000112.8
434I35.4Very low56.9Low76 Ų7681.3 Ų81.339%0.3943%0.43SS..  trans-103119.9-157.1-67.7171.8000112.8E438I434-E438 WeakPolarHBondContact CG1-OE1 3.32Å; I434-E438 HydrophobicContact CG2-CB 4Å; I434-E438 HydrophobicContact CG2-CG 3.94Å; I434-E438 VanDerWaalsContact CG2-OE2 3.27Å; I434-E438 WeakPolarHBondContact CG2-OE2 3.49Å
435P37.9Very low56.8Low88 Ų8882.5 Ų82.557%0.57144%0.436SS*.  trans-87.5156.8169.7-8.828.2000113.1K437 E438P435-K437 PolarHBondContact O-N 2.91Å; P435-E438 PolarHBondContact O-N 2.72Å
436L38.3Very low57.3Low150 Ų15076 Ų7679%0.78541%0.406SS*.THydrogen-bonded Turntrans-48.2-23.7179.2-160.373.3000115.4E438 L439L436-E438 PolarHBondContact O-N 3.5Å; L436-L439 PolarHBondContact O-N 2.88Å
437K53.3Low57.6Low156 Ų15677.1 Ų77.168%0.67842%0.415SS*.Hα-helixtrans-56.4-26174.5-138.8177.7-173.3-176.30113.3P435 L439 E440 Q441P435-K437 PolarHBondContact O-N 2.91Å; K437-L439 VanDerWaalsContact C-N 3.27Å; K437-L439 PolarHBondContact O-N 3.4Å; K437-E440 PolarHBondContact O-N 3.31Å; K437-Q441 VanDerWaalsContact O-CB 3.26Å; K437-Q441 WeakPolarHBondContact O-CB 3.31Å; K437-Q441 PolarHBondContact O-N 3.44Å
438E54.5Low57.6Low63 Ų6383 Ų8329%0.29444%0.44SS..Hα-helixtrans-63.6-28.2177.9-88.8-166.3-165.800114.2I434 P435 L436 F442 R486I434-E438 WeakPolarHBondContact CG1-OE1 3.32Å; I434-E438 HydrophobicContact CG2-CB 4Å; I434-E438 HydrophobicContact CG2-CG 3.94Å; I434-E438 VanDerWaalsContact CG2-OE2 3.27Å; I434-E438 WeakPolarHBondContact CG2-OE2 3.49Å; P435-E438 PolarHBondContact O-N 2.72Å; L436-E438 PolarHBondContact O-N 3.5Å; E438-F442 VanDerWaalsContact O-CB 3.24Å; E438-F442 WeakPolarHBondContact O-CB 3.4Å; E438-F442 PolarHBondContact O-N 3.5Å; E438-R486 PolarHBondContact O-NH2 3.22Å
439L55Low58.2Low22 Ų2279.1 Ų79.112%0.11542%0.424CS..Hα-helixtrans-78.9-37.5179.3-179.957.8000112.2L436 K437 N443 I494 K499 I503L436-L439 PolarHBondContact O-N 2.88Å; K437-L439 VanDerWaalsContact C-N 3.27Å; K437-L439 PolarHBondContact O-N 3.4Å; L439-N443 WeakPolarHBondContact O-CB 3.19Å; L439-N443 PolarHBondContact O-N 3.06Å; L439-N443 VanDerWaalsContact O-N 3.07Å; L439-N443 PolarHBondContact O-ND2 2.93Å; L439-I494 HydrophobicContact CB-CD1 4.38Å; L439-I494 HydrophobicContact CD1-CD1 3.65Å; L439-I494 HydrophobicContact CD2-CD1 3.69Å; L439-I494 HydrophobicContact CG-CD1 4.1Å; L439-K499 HydrophobicContact CD2-CD 3.86Å; L439-I503 HydrophobicContact CD1-CD1 3.81Å; L439-I503 HydrophobicContact CD1-CG1 4.1Å
440E61.2Low59.7Low135 Ų13575.1 Ų75.163%0.63140%0.399SS*.Hα-helixtrans-65.9-43.4170.7-65177.1159.300110.1K437 N443 S444K437-E440 PolarHBondContact O-N 3.31Å; E440-N443 PolarHBondContact O-N 3.3Å; E440-S444 PolarHBondContact O-N 3.38Å
441Q72.3Confident61.4Low85 Ų8580 Ų8040%0.39741%0.413SS..Hα-helixtrans-61.7-47.2175.7-169.164.950.300111.2K437 N443 S444 D445K437-Q441 VanDerWaalsContact O-CB 3.26Å; K437-Q441 WeakPolarHBondContact O-CB 3.31Å; K437-Q441 PolarHBondContact O-N 3.44Å; Q441-N443 VanDerWaalsContact C-N 3.33Å; Q441-N443 PolarHBondContact O-N 3.41Å; Q441-S444 CarbonylContact O-C 3.52Å; Q441-S444 WeakPolarHBondContact O-CB 3.41Å; Q441-S444 PolarHBondContact O-N 3.44Å; Q441-S444 VanDerWaalsContact O-N 3.08Å; Q441-D445 WeakPolarHBondContact CG-OD2 3.3Å; Q441-D445 PolarHBondContact NE2-OD1 2.82Å; Q441-D445 WeakPolarHBondContact O-CB 3.39Å; Q441-D445 PolarHBondContact O-N 3.02Å
442F81.9Confident63.4Low0 Ų073.1 Ų73.10%039%0.39CS..Hα-helixtrans-57.2-45175.6172.8-101.9000112.3E438 S444 D445 I446 L483 R486 L490 I503 Q507E438-F442 VanDerWaalsContact O-CB 3.24Å; E438-F442 WeakPolarHBondContact O-CB 3.4Å; E438-F442 PolarHBondContact O-N 3.5Å; F442-S444 VanDerWaalsContact C-N 3.32Å; F442-S444 PolarHBondContact O-N 3.08Å; F442-D445 PolarHBondContact O-N 3.41Å; F442-I446 HydrophobicContact CE1-CD1 4.16Å; F442-I446 HydrophobicContact CE2-CD1 3.97Å; F442-I446 HydrophobicContact CE2-CG1 4.47Å; F442-I446 HydrophobicContact CZ-CD1 3.51Å; F442-I446 HydrophobicContact CZ-CG1 4.41Å; F442-I446 WeakPolarHBondContact O-CB 3.4Å; F442-I446 PolarHBondContact O-N 2.96Å; F442-L483 HydrophobicContact CD2-CD2 3.82Å; F442-L483 HydrophobicContact CE2-CD2 3.99Å; F442-L483 WeakPolarHBondContact CE2-O 3.27Å; F442-R486 HydrophobicContact CD2-CG 4.39Å; F442-L490 HydrophobicContact CB-CD1 3.46Å; F442-L490 VanDerWaalsContact CB-CD1 3.46Å; F442-L490 HydrophobicContact CD1-CD1 4.02Å; F442-L490 HydrophobicContact CD2-CD1 3.86Å; F442-L490 HydrophobicContact CG-CD1 3.49Å; F442-L490 VanDerWaalsContact CG-CD1 3.49Å; F442-I503 HydrophobicContact CD1-CG1 4.3Å; F442-I503 HydrophobicContact CE1-CB 4.2Å; F442-I503 HydrophobicContact CE1-CG1 3.93Å; F442-I503 HydrophobicContact CE1-CG2 3.71Å; F442-I503 HydrophobicContact CZ-CG2 3.94Å; F442-Q507 HydrophobicContact CZ-CG 4.38Å
443N76.2Confident65.7Low41 Ų4169.8 Ų69.822%0.21936%0.363CS..Hα-helixtrans-62.4-37.3175.5-84.6-64.3000112.6L439 E440 Q441 Q447 K506L439-N443 WeakPolarHBondContact O-CB 3.19Å; L439-N443 PolarHBondContact O-N 3.06Å; L439-N443 VanDerWaalsContact O-N 3.07Å; L439-N443 PolarHBondContact O-ND2 2.93Å; E440-N443 PolarHBondContact O-N 3.3Å; Q441-N443 VanDerWaalsContact C-N 3.33Å; Q441-N443 PolarHBondContact O-N 3.41Å; N443-Q447 WeakPolarHBondContact O-CB 3.48Å; N443-Q447 PolarHBondContact O-N 3.28Å; N443-K506 PolarHBondContact OD1-NZ 3.38Å
444S76.1Confident68Low45 Ų4567.3 Ų67.332%0.31534%0.338SS..Hα-helixtrans-70.3-43174.8-172.30000112.4E440 Q441 F442 Q447 K448E440-S444 PolarHBondContact O-N 3.38Å; Q441-S444 CarbonylContact O-C 3.52Å; Q441-S444 WeakPolarHBondContact O-CB 3.41Å; Q441-S444 PolarHBondContact O-N 3.44Å; Q441-S444 VanDerWaalsContact O-N 3.08Å; F442-S444 VanDerWaalsContact C-N 3.32Å; F442-S444 PolarHBondContact O-N 3.08Å; S444-Q447 PolarHBondContact O-N 3.28Å; S444-K448 WeakPolarHBondContact O-CB 3.49Å; S444-K448 VanDerWaalsContact O-CG 3.29Å; S444-K448 WeakPolarHBondContact O-CG 3.36Å; S444-K448 PolarHBondContact O-N 2.94Å; S444-K448 WeakPolarHBondContact OG-CE 3.32Å
445D81.5Confident70Confident35 Ų3565.8 Ų65.819%0.18734%0.337CS..Hα-helixtrans-66-43.9-177.8-62.2-21.7000111Q441 F442 Q447 K448 L449 L483 R486Q441-D445 WeakPolarHBondContact CG-OD2 3.3Å; Q441-D445 PolarHBondContact NE2-OD1 2.82Å; Q441-D445 WeakPolarHBondContact O-CB 3.39Å; Q441-D445 PolarHBondContact O-N 3.02Å; F442-D445 PolarHBondContact O-N 3.41Å; D445-Q447 VanDerWaalsContact C-N 3.33Å; D445-Q447 PolarHBondContact O-N 2.89Å; D445-K448 PolarHBondContact O-N 3.45Å; D445-L449 PolarHBondContact O-N 3.23Å; D445-L483 HydrophobicContact CB-CD1 4.29Å; D445-L483 HydrophobicContact CB-CD2 3.72Å; D445-R486 IonicContact OD2-CZ 3.56Å; D445-R486 IonicContact OD2-NH1 2.67Å; D445-R486 PolarHBondContact OD2-NH1 2.99Å; D445-R486 IonicContact OD2-NH2 2.82Å
446I82.9Confident71.8Confident0 Ų062.9 Ų62.90%032%0.316CS..Hα-helixtrans-64.8-38176.5-120.7-178.9000111.5F442 L449 L450 L483 K506 L510F442-I446 HydrophobicContact CE1-CD1 4.16Å; F442-I446 HydrophobicContact CE2-CD1 3.97Å; F442-I446 HydrophobicContact CE2-CG1 4.47Å; F442-I446 HydrophobicContact CZ-CD1 3.51Å; F442-I446 HydrophobicContact CZ-CG1 4.41Å; F442-I446 WeakPolarHBondContact O-CB 3.4Å; F442-I446 PolarHBondContact O-N 2.96Å; I446-L449 PolarHBondContact O-N 2.9Å; I446-L450 HydrophobicContact CG2-CD1 4.23Å; I446-L450 WeakPolarHBondContact O-CB 3.38Å; I446-L450 WeakPolarHBondContact O-CG 3.39Å; I446-L450 PolarHBondContact O-N 3.23Å; I446-L483 HydrophobicContact CG1-CD1 4.49Å; I446-K506 HydrophobicContact CD1-CB 4.03Å; I446-K506 HydrophobicContact CG2-CB 4.14Å; I446-K506 HydrophobicContact CG2-CD 3.98Å; I446-K506 HydrophobicContact CG2-CG 4.48Å; I446-L510 HydrophobicContact CD1-CB 4.49Å; I446-L510 HydrophobicContact CD1-CD2 4.21Å; I446-L510 HydrophobicContact CG1-CD2 3.92Å
447Q78.8Confident73.7Confident99 Ų9957.4 Ų57.446%0.46329%0.287SS..Hα-helixtrans-68.8-42.8179.5-152.975.13400111N443 S444 D445 L449 L450 E451N443-Q447 WeakPolarHBondContact O-CB 3.48Å; N443-Q447 PolarHBondContact O-N 3.28Å; S444-Q447 PolarHBondContact O-N 3.28Å; D445-Q447 VanDerWaalsContact C-N 3.33Å; D445-Q447 PolarHBondContact O-N 2.89Å; Q447-L449 PolarHBondContact O-N 3.46Å; Q447-L450 PolarHBondContact O-N 2.83Å; Q447-E451 PolarHBondContact O-N 2.92Å; Q447-E451 VanDerWaalsContact O-N 3.08Å
448K75.5Confident74.8Confident124 Ų12457.2 Ų57.254%0.53929%0.288SS..Hα-helixtrans-64.5-22.7174.7-76.3172.5-179.8169.10114.2S444 D445 P452S444-K448 WeakPolarHBondContact O-CB 3.49Å; S444-K448 VanDerWaalsContact O-CG 3.29Å; S444-K448 WeakPolarHBondContact O-CG 3.36Å; S444-K448 PolarHBondContact O-N 2.94Å; S444-K448 WeakPolarHBondContact OG-CE 3.32Å; D445-K448 PolarHBondContact O-N 3.45Å; K448-P452 WeakPolarHBondContact O-CD 2.77Å; K448-P452 VanDerWaalsContact O-CG 3.28Å; K448-P452 WeakPolarHBondContact O-CG 3.35Å
449L79.9Confident75.6Confident17 Ų1758 Ų589%0.08929%0.292CS..Hα-helixtrans-90.2-33.3174.7-167.360.9000111.7D445 I446 Q447 P452 L453 T479 V480 L483 L510D445-L449 PolarHBondContact O-N 3.23Å; I446-L449 PolarHBondContact O-N 2.9Å; Q447-L449 PolarHBondContact O-N 3.46Å; L449-P452 WeakPolarHBondContact O-CD 3.39Å; L449-P452 WeakPolarHBondContact O-CG 3.47Å; L449-L453 HydrophobicContact CG-CD1 4.09Å; L449-L453 WeakPolarHBondContact O-CB 2.9Å; L449-L453 WeakPolarHBondContact O-CD1 3.44Å; L449-L453 WeakPolarHBondContact O-CG 3.28Å; L449-L453 PolarHBondContact O-N 2.72Å; L449-T479 HydrophobicContact CD2-CG2 4.29Å; L449-V480 HydrophobicContact CD2-CG2 3.7Å; L449-L483 HydrophobicContact CB-CD1 4.25Å; L449-L483 HydrophobicContact CD2-CD1 3.6Å; L449-L510 HydrophobicContact CB-CD1 4.45Å; L449-L510 HydrophobicContact CD2-CD1 4.04Å; L449-L510 HydrophobicContact CD2-CD2 4.42Å; L449-L510 HydrophobicContact CG-CD1 4.17Å
450L80Confident76.7Confident11 Ų1157.9 Ų57.96%0.05830%0.296CS..Hα-helixtrans-64.9-42174.2-79168.3000112.7I446 Q447 L453 E454 L509 L510 K513I446-L450 HydrophobicContact CG2-CD1 4.23Å; I446-L450 WeakPolarHBondContact O-CB 3.38Å; I446-L450 WeakPolarHBondContact O-CG 3.39Å; I446-L450 PolarHBondContact O-N 3.23Å; Q447-L450 PolarHBondContact O-N 2.83Å; L450-L453 PolarHBondContact O-N 3.04Å; L450-E454 VanDerWaalsContact O-CB 3.27Å; L450-E454 WeakPolarHBondContact O-CB 3.43Å; L450-E454 PolarHBondContact O-N 3.22Å; L450-L509 HydrophobicContact CD1-CD2 3.95Å; L450-L509 HydrophobicContact CD1-CG 4.39Å; L450-L509 HydrophobicContact CD2-CD2 4.42Å; L450-L509 HydrophobicContact CD2-CG 4.09Å; L450-L510 HydrophobicContact CD2-CB 4.42Å; L450-L510 HydrophobicContact CD2-CD1 4.09Å; L450-L510 HydrophobicContact CG-CD1 4.22Å; L450-K513 HydrophobicContact CD2-CB 4.4Å; L450-K513 HydrophobicContact CD2-CG 4.2Å
451E78Confident77.5Confident135 Ų13553.7 Ų53.763%0.63128%0.28SS*.Hα-helixtrans-53.9-54.8177.7-81.7-177.614500114.2Q447 E454 A455Q447-E451 PolarHBondContact O-N 2.92Å; Q447-E451 VanDerWaalsContact O-N 3.08Å; E451-E454 PolarHBondContact O-N 3.5Å; E451-A455 WeakPolarHBondContact O-CB 3.29Å; E451-A455 PolarHBondContact O-N 3.2Å
452P73.6Confident77.6Confident66 Ų6653.7 Ų53.743%0.42928%0.283SS..Hα-helixtrans-70.1-32.1178.326-33.7000113.1K448 L449 A455 E456K448-P452 WeakPolarHBondContact O-CD 2.77Å; K448-P452 VanDerWaalsContact O-CG 3.28Å; K448-P452 WeakPolarHBondContact O-CG 3.35Å; L449-P452 WeakPolarHBondContact O-CD 3.39Å; L449-P452 WeakPolarHBondContact O-CG 3.47Å; P452-A455 PolarHBondContact O-N 3.3Å; P452-E456 WeakPolarHBondContact O-CB 3.34Å; P452-E456 PolarHBondContact O-N 2.67Å
453L77.6Confident77.4Confident1 Ų153.7 Ų53.71%0.00528%0.283CS..Hα-helixtrans-62.1-45.8172.3-73.6172.1000111L449 L450 E456 I457 V480 L510 L517L449-L453 HydrophobicContact CG-CD1 4.09Å; L449-L453 WeakPolarHBondContact O-CB 2.9Å; L449-L453 WeakPolarHBondContact O-CD1 3.44Å; L449-L453 WeakPolarHBondContact O-CG 3.28Å; L449-L453 PolarHBondContact O-N 2.72Å; L450-L453 PolarHBondContact O-N 3.04Å; L453-E456 PolarHBondContact O-N 3.14Å; L453-I457 WeakPolarHBondContact O-CD1 3.41Å; L453-I457 WeakPolarHBondContact O-CG1 3.44Å; L453-I457 PolarHBondContact O-N 3.37Å; L453-V480 HydrophobicContact CD1-CG2 4.49Å; L453-L510 HydrophobicContact CD1-CD1 3.49Å; L453-L510 VanDerWaalsContact CD1-CD1 3.49Å; L453-L517 HydrophobicContact CD2-CD2 3.4Å
454E78.6Confident77.5Confident64 Ų6453.9 Ų53.930%0.29928%0.281SS..Hα-helixtrans-62.8-44.4177.4-163.772.8-137.500111.2L450 E451 E456 I457 Q458 K513L450-E454 VanDerWaalsContact O-CB 3.27Å; L450-E454 WeakPolarHBondContact O-CB 3.43Å; L450-E454 PolarHBondContact O-N 3.22Å; E451-E454 PolarHBondContact O-N 3.5Å; E454-E456 VanDerWaalsContact C-N 3.33Å; E454-E456 PolarHBondContact O-N 3.44Å; E454-I457 PolarHBondContact O-N 2.9Å; E454-Q458 WeakPolarHBondContact O-CG 3.33Å; E454-Q458 PolarHBondContact O-N 2.87Å; E454-K513 IonicContact OE1-NZ 3.83Å; E454-K513 PolarHBondContact OE1-NZ 3.2Å; E454-K513 VanDerWaalsContact OE2-CD 3.29Å; E454-K513 WeakPolarHBondContact OE2-CD 3.42Å; E454-K513 WeakPolarHBondContact OE2-CE 3.36Å; E454-K513 IonicContact OE2-NZ 3.4Å; E454-K513 PolarHBondContact OE2-NZ 3.15Å
455A76.2Confident77.4Confident45 Ų4555.3 Ų55.337%0.37228%0.283SS..Hα-helixtrans-63.6-35.1177.200000113.1E451 P452 Q459E451-A455 WeakPolarHBondContact O-CB 3.29Å; E451-A455 PolarHBondContact O-N 3.2Å; P452-A455 PolarHBondContact O-N 3.3Å; A455-Q459 WeakPolarHBondContact O-CG 3.49Å; A455-Q459 PolarHBondContact O-NE2 2.84Å
456E77Confident77Confident27 Ų2758.6 Ų58.613%0.12630%0.297CS..Hα-helixtrans-78.1-31.4176.2-155.4-170.2140.100112.6P452 L453 E454 Q459 L517 R521 R524P452-E456 WeakPolarHBondContact O-CB 3.34Å; P452-E456 PolarHBondContact O-N 2.67Å; L453-E456 PolarHBondContact O-N 3.14Å; E454-E456 VanDerWaalsContact C-N 3.33Å; E454-E456 PolarHBondContact O-N 3.44Å; E456-Q459 WeakPolarHBondContact O-CB 3.42Å; E456-Q459 PolarHBondContact O-N 3.34Å; E456-L517 HydrophobicContact CB-CD1 3.83Å; E456-L517 HydrophobicContact CB-CD2 4.16Å; E456-L517 HydrophobicContact CG-CD1 3.78Å; E456-L517 HydrophobicContact CG-CD2 4.46Å; E456-R521 IonicContact OE1-CZ 3.93Å; E456-R521 IonicContact OE1-NE 2.72Å; E456-R521 PolarHBondContact OE1-NE 2.95Å; E456-R521 IonicContact OE1-NH2 3.94Å; E456-R521 PolarHBondContact OE1-NH2 3.33Å; E456-R521 IonicContact OE2-CZ 3.47Å; E456-R521 IonicContact OE2-NE 3.14Å; E456-R521 IonicContact OE2-NH2 2.87Å; E456-R521 PolarHBondContact OE2-NH2 3.5Å; E456-R524 IonicContact OE1-CZ 3.78Å; E456-R524 IonicContact OE1-NH2 2.63Å; E456-R524 PolarHBondContact OE1-NH2 2.93Å
457I77.6Confident76.8Confident34 Ų3459.6 Ų59.617%0.17430%0.303CS..Hα-helixtrans-65.1-40.9172-69.3161.8000110.6L453 E454 Q459 G460 K513 L517 L520L453-I457 WeakPolarHBondContact O-CD1 3.41Å; L453-I457 WeakPolarHBondContact O-CG1 3.44Å; L453-I457 PolarHBondContact O-N 3.37Å; E454-I457 PolarHBondContact O-N 2.9Å; I457-Q459 PolarHBondContact O-N 3.23Å; I457-G460 PolarHBondContact O-N 2.92Å; I457-K513 HydrophobicContact CD1-CB 3.89Å; I457-K513 HydrophobicContact CD1-CD 3.58Å; I457-K513 HydrophobicContact CD1-CG 4.34Å; I457-K513 WeakPolarHBondContact CD1-O 3.38Å; I457-L517 HydrophobicContact CD1-CB 4.44Å; I457-L517 HydrophobicContact CG1-CB 3.98Å; I457-L517 HydrophobicContact CG1-CD1 4.07Å; I457-L520 HydrophobicContact CB-CD1 4.38Å; I457-L520 HydrophobicContact CG1-CD1 4.42Å; I457-L520 HydrophobicContact CG2-CD1 4.2Å
458Q76.4Confident76.7Confident152 Ų15255.6 Ų55.671%0.7128%0.284SS*.THydrogen-bonded Turntrans-63.1-18.8176.7-73.9178.913.500113.9E454 G460E454-Q458 WeakPolarHBondContact O-CG 3.33Å; E454-Q458 PolarHBondContact O-N 2.87Å; Q458-G460 VanDerWaalsContact C-N 3.33Å
459Q71.1Confident76.3Confident79 Ų7954.1 Ų54.137%0.36928%0.282SS..THydrogen-bonded Turntrans-80.3-14176-67.9161.39.200113A455 E456 I457A455-Q459 WeakPolarHBondContact O-CG 3.49Å; A455-Q459 PolarHBondContact O-NE2 2.84Å; E456-Q459 WeakPolarHBondContact O-CB 3.42Å; E456-Q459 PolarHBondContact O-N 3.34Å; I457-Q459 PolarHBondContact O-N 3.23Å
460G78.4Confident75.2Confident20 Ų2063.1 Ų63.121%0.20632%0.32CS..THydrogen-bonded Turntrans58.4-136.6177.200000113.8I457 Q458 R524I457-G460 PolarHBondContact O-N 2.92Å; Q458-G460 VanDerWaalsContact C-N 3.33Å; G460-R524 PolarHBondContact O-NH1 3.34Å
461V77.1Confident73.6Confident47 Ų4769.5 Ų69.529%0.28535%0.354SS..THydrogen-bonded Turntrans-94.712.5-172.1-151.20000113.1L520 Q523 R524V461-L520 HydrophobicContact CG2-CD2 4.01Å; V461-Q523 HydrophobicContact CG1-CB 3.73Å; V461-R524 HydrophobicContact CG1-CG 4.09Å
462N74.4Confident72.1Confident86 Ų8667.4 Ų67.446%0.4635%0.346SS..  trans-73128.4178-72.9-30.8000111.4R524 M599N462-R524 WeakPolarHBondContact O-CD 3.44Å; N462-M599 HydrophobicContact CB-CG 4.44Å
463L77.6Confident70.8Confident0 Ų069.7 Ų69.70%035%0.354CS..  trans-82.6136.9-172.7-51.1172.9000112.4F468 R524 K527 A528 I531 G596 A597 A600L463-F468 HydrophobicContact CB-CE2 4.4Å; L463-F468 HydrophobicContact CD1-CZ 4.22Å; L463-R524 HydrophobicContact CD2-CB 3.62Å; L463-R524 HydrophobicContact CD2-CG 3.93Å; L463-R524 WeakPolarHBondContact CD2-O 3.44Å; L463-K527 HydrophobicContact CD1-CB 4.02Å; L463-K527 HydrophobicContact CD2-CB 4.13Å; L463-A528 HydrophobicContact CD1-CB 4.43Å; L463-A528 HydrophobicContact CD2-CB 4.28Å; L463-I531 HydrophobicContact CD1-CD1 3.72Å; L463-I531 HydrophobicContact CD1-CG1 4.34Å; L463-G596 PolarHBondContact N-O 2.67Å; L463-A597 HydrophobicContact CB-CB 4.09Å; L463-A597 HydrophobicContact CD1-CB 4.23Å; L463-A600 PolarHBondContact O-N 3.06Å
464K78.6Confident69.7Low44 Ų4473.3 Ų73.319%0.19137%0.371CS..  trans-104.1163.2171.7-58.4176.4-173.11720110.6E466 D467 F468K464-E466 HydrophobicContact CB-CB 4.3Å; K464-E466 PolarHBondContact O-N 2.99Å; K464-E466 VanDerWaalsContact O-N 3.15Å; K464-D467 PolarHBondContact N-OD2 3.32Å; K464-D467 PolarHBondContact O-N 3.46Å; K464-F468 WeakPolarHBondContact O-CD2 3.47Å
465E74.6Confident68.4Low75 Ų7575.5 Ų75.535%0.3539%0.385SS..G310 helixtrans-55.6-31.4171.9174.4157-144.600111.7F468 W535 K539 A600E465-F468 PolarHBondContact O-N 2.91Å; E465-W535 HydrophobicContact CB-CH2 4.35Å; E465-W535 HydrophobicContact CB-CZ2 3.93Å; E465-W535 HydrophobicContact CG-CZ2 3.74Å; E465-K539 WeakPolarHBondContact OE1-CE 3.41Å; E465-K539 IonicContact OE1-NZ 2.65Å; E465-K539 PolarHBondContact OE1-NZ 3.04Å; E465-K539 IonicContact OE2-NZ 3.97Å; E465-K539 PolarHBondContact OE2-NZ 3.47Å; E465-A600 HydrophobicContact CB-CB 4.26Å; E465-A600 VanDerWaalsContact N-CB 3.29Å
466E73.3Confident67.5Low104 Ų10475.8 Ų75.849%0.48638%0.38SS..G310 helixtrans-61.9-37.6174.4-63.5167.5-169.300113.9K464 F468 N469 M472K464-E466 HydrophobicContact CB-CB 4.3Å; K464-E466 PolarHBondContact O-N 2.99Å; K464-E466 VanDerWaalsContact O-N 3.15Å; E466-F468 PolarHBondContact O-N 3.34Å; E466-N469 PolarHBondContact O-N 3.39Å; E466-N469 VanDerWaalsContact O-N 3.07Å; E466-M472 HydrophobicContact CB-CE 3.87Å; E466-M472 HydrophobicContact CB-SD 4.31Å; E466-M472 WeakPolarHBondContact O-CG 3.46Å
467D77.9Confident67.2Low22 Ų2277.7 Ų77.712%0.11839%0.389CS..G310 helixtrans-69.1-15.5-176.2-63.7-69.8000112.4K464 R524 A528K464-D467 PolarHBondContact N-OD2 3.32Å; K464-D467 PolarHBondContact O-N 3.46Å; D467-R524 IonicContact OD1-CZ 3.17Å; D467-R524 IonicContact OD1-NE 2.76Å; D467-R524 PolarHBondContact OD1-NE 2.92Å; D467-R524 IonicContact OD1-NH2 2.7Å; D467-R524 IonicContact OD2-NE 2.68Å; D467-R524 PolarHBondContact OD2-NE 3.41Å; D467-A528 HydrophobicContact CB-CB 4.35Å
468F78Confident66.9Low15 Ų1578.2 Ų78.27%0.06640%0.403CS..G310 helixtrans-85.8-11.8174.2-64.6-83000113.6L463 K464 E465 E466 K470 A528 I531 W535 Y536 A597 A600L463-F468 HydrophobicContact CB-CE2 4.4Å; L463-F468 HydrophobicContact CD1-CZ 4.22Å; K464-F468 WeakPolarHBondContact O-CD2 3.47Å; E465-F468 PolarHBondContact O-N 2.91Å; E466-F468 PolarHBondContact O-N 3.34Å; F468-K470 PolarHBondContact O-N 3.45Å; F468-A528 HydrophobicContact CD1-CB 3.99Å; F468-A528 HydrophobicContact CE1-CB 3.93Å; F468-A528 WeakPolarHBondContact CE1-O 3.39Å; F468-A528 HydrophobicContact CG-CB 4.47Å; F468-A528 HydrophobicContact CZ-CB 4.36Å; F468-I531 HydrophobicContact CE1-CG1 3.95Å; F468-I531 HydrophobicContact CZ-CD1 4.13Å; F468-I531 HydrophobicContact CZ-CG1 4.03Å; F468-W535 HydrophobicContact CD1-CB 3.97Å; F468-W535 AromaticContact CD1-CD1 3.59Å; F468-W535 AromaticContact CD1-CG 3.82Å; F468-W535 HydrophobicContact CD1-CG 3.82Å; F468-W535 AromaticContact CD2-CD1 3.67Å; F468-W535 HydrophobicContact CD2-CD2 4Å; F468-W535 AromaticContact CD2-CE2 3.98Å; F468-W535 AromaticContact CD2-CG 3.86Å; F468-W535 HydrophobicContact CD2-CG 3.86Å; F468-W535 AromaticContact CD2-NE1 3.7Å; F468-W535 HydrophobicContact CE1-CB 3.59Å; F468-W535 AromaticContact CE1-CG 3.8Å; F468-W535 HydrophobicContact CE1-CG 3.8Å; F468-W535 HydrophobicContact CE2-CB 4.35Å; F468-W535 AromaticContact CE2-CD2 3.87Å; F468-W535 HydrophobicContact CE2-CD2 3.87Å; F468-W535 HydrophobicContact CE2-CE3 4.29Å; F468-W535 AromaticContact CE2-CG 3.84Å; F468-W535 HydrophobicContact CE2-CG 3.84Å; F468-W535 HydrophobicContact CG-CB 4.48Å; F468-W535 AromaticContact CG-CD1 3.37Å; F468-W535 HydrophobicContact CG-CD2 4.45Å; F468-W535 AromaticContact CG-CG 3.85Å; F468-W535 HydrophobicContact CG-CG 3.85Å; F468-W535 AromaticContact CG-NE1 3.73Å; F468-W535 HydrophobicContact CZ-CB 3.81Å; F468-W535 HydrophobicContact CZ-CD2 4.2Å; F468-W535 AromaticContact CZ-CG 3.8Å; F468-W535 HydrophobicContact CZ-CG 3.8Å; F468-Y536 PolarHBondContact O-OH 3.34Å; F468-Y536 VanDerWaalsContact O-OH 3.1Å; F468-A597 HydrophobicContact CE2-CB 4.35Å; F468-A597 HydrophobicContact CZ-CB 4.22Å; F468-A600 HydrophobicContact CE2-CB 4.29Å
469N66.6Low66.7Low93 Ų9374 Ų7450%0.49739%0.387SS..  trans-80.6119.7177.9-75-35.6000110.6E466 D471 M472E466-N469 PolarHBondContact O-N 3.39Å; E466-N469 VanDerWaalsContact O-N 3.07Å; N469-D471 PolarHBondContact O-N 3.38Å; N469-D471 VanDerWaalsContact O-N 3.16Å; N469-M472 HydrophobicContact CB-CG 4.12Å; N469-M472 HydrophobicContact CB-SD 4.48Å; N469-M472 WeakPolarHBondContact O-CG 3.27Å; N469-M472 PolarHBondContact O-N 3.1Å
470K55.8Low67.1Low205 Ų20570.4 Ų70.489%0.89137%0.371SS*.THydrogen-bonded Turntrans-64.3-20.9-176.8-151178.5-175.5-175.70113.7F468F468-K470 PolarHBondContact O-N 3.45Å
471D48.4Very low67.1Low145 Ų14576.1 Ų76.178%0.77539%0.39SS*.THydrogen-bonded Turntrans-104.424.9-171.9-55.9-33.2000113.2N469 N473N469-D471 PolarHBondContact O-N 3.38Å; N469-D471 VanDerWaalsContact O-N 3.16Å; D471-N473 PolarHBondContact O-N 3.48Å
472M45Very low66.9Low91 Ų9180.2 Ų80.245%0.44841%0.406SS..  trans-67.397.5175.8-72.6-67.1-76.700111E466 N469E466-M472 HydrophobicContact CB-CE 3.87Å; E466-M472 HydrophobicContact CB-SD 4.31Å; E466-M472 WeakPolarHBondContact O-CG 3.46Å; N469-M472 HydrophobicContact CB-CG 4.12Å; N469-M472 HydrophobicContact CB-SD 4.48Å; N469-M472 WeakPolarHBondContact O-CG 3.27Å; N469-M472 PolarHBondContact O-N 3.1Å
473N47.6Very low67.1Low114 Ų11476.7 Ų76.761%0.6139%0.387SS*.  trans-52.5141170.7-79.8-10.6000111.3D471 D475D471-N473 PolarHBondContact O-N 3.48Å; N473-D475 HydrophobicContact CB-CB 4.48Å; N473-D475 WeakPolarHBondContact CB-OD1 3.45Å; N473-D475 PolarHBondContact ND2-OD1 2.72Å; N473-D475 PolarHBondContact O-N 3.05Å
474E53.4Low67.4Low77 Ų7777.9 Ų77.936%0.3639%0.394SS..  trans-78.747.9169.5-54.1-159.9146.700110.7N476 E477 K518 R525E474-N476 PolarHBondContact O-N 3.26Å; E474-N476 VanDerWaalsContact O-N 3.08Å; E474-E477 HydrophobicContact CB-CB 4.13Å; E474-E477 VanDerWaalsContact O-CB 3.28Å; E474-E477 WeakPolarHBondContact O-CB 3.28Å; E474-E477 PolarHBondContact O-N 3.26Å; E474-K518 IonicContact OE2-NZ 3.41Å; E474-K518 PolarHBondContact OE2-NZ 2.94Å; E474-R525 IonicContact OE1-CZ 3.37Å; E474-R525 IonicContact OE1-NH1 3.64Å; E474-R525 IonicContact OE1-NH2 3.47Å; E474-R525 PolarHBondContact OE1-NH2 3.25Å; E474-R525 VanDerWaalsContact OE1-NH2 3.08Å
475D51.7Low67.4Low111 Ų11181.7 Ų81.759%0.59441%0.412SS*.Hα-helixtrans-55.6-32.2-171.1-75.8-26.2000113.3N473 E477 T479N473-D475 HydrophobicContact CB-CB 4.48Å; N473-D475 WeakPolarHBondContact CB-OD1 3.45Å; N473-D475 PolarHBondContact ND2-OD1 2.72Å; N473-D475 PolarHBondContact O-N 3.05Å; D475-E477 VanDerWaalsContact C-N 3.34Å; D475-E477 PolarHBondContact O-N 3.47Å; D475-T479 PolarHBondContact O-OG1 2.99Å
476N58.3Low67.6Low51 Ų5181.5 Ų81.527%0.27341%0.408SS..Hα-helixtrans-70.4-25.4174.4-74.9-7000113.3E474 G478 T479 V480E474-N476 PolarHBondContact O-N 3.26Å; E474-N476 VanDerWaalsContact O-N 3.08Å; N476-G478 VanDerWaalsContact C-N 3.34Å; N476-T479 PolarHBondContact O-N 3.43Å; N476-V480 WeakPolarHBondContact O-CB 3.39Å; N476-V480 VanDerWaalsContact O-CG2 3.28Å; N476-V480 WeakPolarHBondContact O-CG2 3.36Å; N476-V480 PolarHBondContact O-N 3.3Å
477E69.9Low67.8Low67 Ų6776.5 Ų76.531%0.31339%0.385SS..Hα-helixtrans-66.5-38.5179.5-165.7-179.9-103.800110.8E474 D475 K481 K518E474-E477 HydrophobicContact CB-CB 4.13Å; E474-E477 VanDerWaalsContact O-CB 3.28Å; E474-E477 WeakPolarHBondContact O-CB 3.28Å; E474-E477 PolarHBondContact O-N 3.26Å; D475-E477 VanDerWaalsContact C-N 3.34Å; D475-E477 PolarHBondContact O-N 3.47Å; E477-K481 WeakPolarHBondContact O-CB 3.37Å; E477-K481 PolarHBondContact O-N 3.47Å; E477-K518 IonicContact OE1-NZ 3.43Å; E477-K518 PolarHBondContact OE1-NZ 3.09Å
478G71.3Confident67.8Low44 Ų4479.1 Ų79.145%0.45440%0.399SS..Hα-helixtrans-58.9-49.3171.300000112.2N476 K481 E482N476-G478 VanDerWaalsContact C-N 3.34Å; G478-K481 PolarHBondContact O-N 3.25Å; G478-E482 PolarHBondContact O-N 2.97Å
479T71.9Confident67.3Low63 Ų6381 Ų8139%0.38741%0.409SS..Hα-helixtrans-66.9-40.5-178.5-39.40000112.7L449 D475 N476 L483L449-T479 HydrophobicContact CD2-CG2 4.29Å; D475-T479 PolarHBondContact O-OG1 2.99Å; N476-T479 PolarHBondContact O-N 3.43Å; T479-L483 WeakPolarHBondContact O-CB 3.18Å; T479-L483 PolarHBondContact O-N 2.96Å
480V79.4Confident67.5Low4 Ų477.1 Ų77.12%0.02439%0.388CS..Hα-helixtrans-63.1-46.5173.3167.50000110.1L449 L453 N476 L483 L484 L510 H514L449-V480 HydrophobicContact CD2-CG2 3.7Å; L453-V480 HydrophobicContact CD1-CG2 4.49Å; N476-V480 WeakPolarHBondContact O-CB 3.39Å; N476-V480 VanDerWaalsContact O-CG2 3.28Å; N476-V480 WeakPolarHBondContact O-CG2 3.36Å; N476-V480 PolarHBondContact O-N 3.3Å; V480-L483 PolarHBondContact O-N 3.41Å; V480-L484 HydrophobicContact CG1-CD1 3.59Å; V480-L484 HydrophobicContact CG1-CG 4.17Å; V480-L484 WeakPolarHBondContact O-CB 3.44Å; V480-L484 WeakPolarHBondContact O-CG 3.22Å; V480-L484 PolarHBondContact O-N 3.33Å; V480-L510 HydrophobicContact CG1-CD2 4.19Å; V480-L510 HydrophobicContact CG1-CG 4.29Å; V480-L510 HydrophobicContact CG2-CD1 4.4Å; V480-L510 HydrophobicContact CG2-CG 4.49Å; V480-H514 HydrophobicContact CG1-CB 4.19Å; V480-H514 HydrophobicContact CG2-CB 4.34Å
481K78.1Confident68.1Low140 Ų14069.2 Ų69.261%0.60936%0.355SS*.Hα-helixtrans-65.9-39.5-179.5-165.6173.1-168.5168.90112.3E477 G478 Q485E477-K481 WeakPolarHBondContact O-CB 3.37Å; E477-K481 PolarHBondContact O-N 3.47Å; G478-K481 PolarHBondContact O-N 3.25Å; K481-Q485 WeakPolarHBondContact O-CB 3.44Å; K481-Q485 PolarHBondContact O-N 3.03Å
482E73.5Confident68.8Low133 Ų13369.4 Ų69.462%0.62135%0.351SS*.Hα-helixtrans-62.1-45.7170.1-84.6-155.4142.500111.9G478 Q485 R486G478-E482 PolarHBondContact O-N 2.97Å; E482-Q485 PolarHBondContact O-N 3.48Å; E482-R486 WeakPolarHBondContact O-CB 3.39Å; E482-R486 PolarHBondContact O-N 3.33Å
483L79.4Confident69.7Low12 Ų1272.4 Ų72.46%0.06336%0.357CS..Hα-helixtrans-67.2-41.1179-86166.6000112.4F442 D445 I446 L449 T479 V480 R486 G487 L510F442-L483 HydrophobicContact CD2-CD2 3.82Å; F442-L483 HydrophobicContact CE2-CD2 3.99Å; F442-L483 WeakPolarHBondContact CE2-O 3.27Å; D445-L483 HydrophobicContact CB-CD1 4.29Å; D445-L483 HydrophobicContact CB-CD2 3.72Å; I446-L483 HydrophobicContact CG1-CD1 4.49Å; L449-L483 HydrophobicContact CB-CD1 4.25Å; L449-L483 HydrophobicContact CD2-CD1 3.6Å; T479-L483 WeakPolarHBondContact O-CB 3.18Å; T479-L483 PolarHBondContact O-N 2.96Å; V480-L483 PolarHBondContact O-N 3.41Å; L483-R486 PolarHBondContact O-N 3.3Å; L483-G487 PolarHBondContact O-N 3.48Å; L483-L510 HydrophobicContact CB-CD2 4.14Å
484L83.2Confident70.1Confident26 Ų2668.3 Ų68.314%0.13634%0.335CS..Hα-helixtrans-58.7-51.3172.6-69.8166.8000110.3V480 R486 G487 D488 Q507 L510 Q511V480-L484 HydrophobicContact CG1-CD1 3.59Å; V480-L484 HydrophobicContact CG1-CG 4.17Å; V480-L484 WeakPolarHBondContact O-CB 3.44Å; V480-L484 WeakPolarHBondContact O-CG 3.22Å; V480-L484 PolarHBondContact O-N 3.33Å; L484-R486 VanDerWaalsContact C-N 3.33Å; L484-R486 PolarHBondContact O-N 2.98Å; L484-G487 CarbonylContact O-C 3.52Å; L484-G487 WeakPolarHBondContact O-CA 3.21Å; L484-G487 PolarHBondContact O-N 3.39Å; L484-G487 VanDerWaalsContact O-N 3.1Å; L484-D488 PolarHBondContact O-N 3.04Å; L484-Q507 HydrophobicContact CD2-CB 3.85Å; L484-Q507 HydrophobicContact CD2-CG 4.13Å; L484-Q507 PolarHBondContact O-NE2 3.35Å; L484-L510 HydrophobicContact CD2-CD2 4.4Å; L484-L510 HydrophobicContact CG-CD2 4.34Å; L484-Q511 HydrophobicContact CD2-CB 4.46Å
485Q77.9Confident70.2Confident123 Ų12370.9 Ų70.958%0.57536%0.357SS*.Hα-helixtrans-67.2-31.7-179.2-167.4171.658.700112.9K481 E482 D488 N489K481-Q485 WeakPolarHBondContact O-CB 3.44Å; K481-Q485 PolarHBondContact O-N 3.03Å; E482-Q485 PolarHBondContact O-N 3.48Å; Q485-D488 PolarHBondContact O-N 2.88Å; Q485-N489 WeakPolarHBondContact O-CB 3.45Å; Q485-N489 PolarHBondContact O-N 3.5Å; Q485-N489 PolarHBondContact O-ND2 3.09Å
486R79.4Confident70.4Confident71 Ų7168.8 Ų68.827%0.26835%0.345SS..Hα-helixtrans-71.6-35.3172.3-175.7170.6166.4-145-13.3111.3E438 F442 D445 E482 L483 L484 N489 L490E438-R486 PolarHBondContact O-NH2 3.22Å; F442-R486 HydrophobicContact CD2-CG 4.39Å; D445-R486 IonicContact OD2-CZ 3.56Å; D445-R486 IonicContact OD2-NH1 2.67Å; D445-R486 PolarHBondContact OD2-NH1 2.99Å; D445-R486 IonicContact OD2-NH2 2.82Å; E482-R486 WeakPolarHBondContact O-CB 3.39Å; E482-R486 PolarHBondContact O-N 3.33Å; L483-R486 PolarHBondContact O-N 3.3Å; L484-R486 VanDerWaalsContact C-N 3.33Å; L484-R486 PolarHBondContact O-N 2.98Å; R486-N489 PolarHBondContact O-N 2.84Å; R486-L490 HydrophobicContact CG-CD1 4.19Å; R486-L490 WeakPolarHBondContact O-CB 3.31Å; R486-L490 VanDerWaalsContact O-CG 3.28Å; R486-L490 WeakPolarHBondContact O-CG 3.25Å; R486-L490 PolarHBondContact O-N 3.2Å
487G77.7Confident70.7Confident0 Ų073.8 Ų73.80%037%0.367CS..Hα-helixtrans-60.4-47.9168.700000111.7L483 L484 N489 L490 Q491L483-G487 PolarHBondContact O-N 3.48Å; L484-G487 CarbonylContact O-C 3.52Å; L484-G487 WeakPolarHBondContact O-CA 3.21Å; L484-G487 PolarHBondContact O-N 3.39Å; L484-G487 VanDerWaalsContact O-N 3.1Å; G487-N489 PolarHBondContact O-N 2.7Å; G487-L490 CarbonylContact O-C 3.52Å; G487-L490 PolarHBondContact O-N 2.93Å; G487-Q491 WeakPolarHBondContact O-CG 3.2Å; G487-Q491 PolarHBondContact O-N 3.49Å
488D76.7Confident70.6Confident76 Ų7679.7 Ų79.741%0.40639%0.386SS..Hα-helixtrans-61.8-44176.4-62.5-31.1000111.7L484 Q485 L490 Q491 Q492 Q507L484-D488 PolarHBondContact O-N 3.04Å; Q485-D488 PolarHBondContact O-N 2.88Å; D488-L490 VanDerWaalsContact C-N 3.34Å; D488-L490 PolarHBondContact O-N 2.92Å; D488-Q491 PolarHBondContact O-N 3.33Å; D488-Q492 WeakPolarHBondContact O-CG 3.49Å; D488-Q492 PolarHBondContact O-N 3.49Å; D488-Q507 VanDerWaalsContact N-NE2 3.19Å; D488-Q507 PolarHBondContact OD1-NE2 3.47Å
489N67.2Low70.5Confident54 Ų5481.8 Ų81.829%0.28938%0.383SS..Hα-helixtrans-63.6-37.7174.9-85.6-82.5000112.3Q485 R486 G487 R493Q485-N489 WeakPolarHBondContact O-CB 3.45Å; Q485-N489 PolarHBondContact O-N 3.5Å; Q485-N489 PolarHBondContact O-ND2 3.09Å; R486-N489 PolarHBondContact O-N 2.84Å; G487-N489 PolarHBondContact O-N 2.7Å; N489-R493 WeakPolarHBondContact O-CB 3.48Å; N489-R493 VanDerWaalsContact O-CD 3.31Å; N489-R493 WeakPolarHBondContact O-CD 3.36Å; N489-R493 WeakPolarHBondContact O-CG 3.36Å; N489-R493 PolarHBondContact O-N 2.72Å; N489-R493 VanDerWaalsContact O-N 3.13Å; N489-R493 PolarHBondContact OD1-NH2 3.49Å
490L71Confident70.5Confident12 Ų1282.4 Ų82.46%0.06338%0.378CS..Hα-helixtrans-70.1-40.7174.8-78.3166000111.5F442 R486 G487 D488 Q492 R493 I494 I503F442-L490 HydrophobicContact CB-CD1 3.46Å; F442-L490 VanDerWaalsContact CB-CD1 3.46Å; F442-L490 HydrophobicContact CD1-CD1 4.02Å; F442-L490 HydrophobicContact CD2-CD1 3.86Å; F442-L490 HydrophobicContact CG-CD1 3.49Å; F442-L490 VanDerWaalsContact CG-CD1 3.49Å; R486-L490 HydrophobicContact CG-CD1 4.19Å; R486-L490 WeakPolarHBondContact O-CB 3.31Å; R486-L490 VanDerWaalsContact O-CG 3.28Å; R486-L490 WeakPolarHBondContact O-CG 3.25Å; R486-L490 PolarHBondContact O-N 3.2Å; G487-L490 CarbonylContact O-C 3.52Å; G487-L490 PolarHBondContact O-N 2.93Å; D488-L490 VanDerWaalsContact C-N 3.34Å; D488-L490 PolarHBondContact O-N 2.92Å; L490-Q492 VanDerWaalsContact C-N 3.3Å; L490-Q492 PolarHBondContact O-N 3.19Å; L490-R493 PolarHBondContact O-N 2.87Å; L490-I494 HydrophobicContact CB-CD1 4.06Å; L490-I494 HydrophobicContact CD2-CD1 3.96Å; L490-I494 WeakPolarHBondContact O-CB 3.46Å; L490-I494 WeakPolarHBondContact O-CG1 3.26Å; L490-I494 PolarHBondContact O-N 3.19Å; L490-I503 HydrophobicContact CB-CD1 4.07Å
491Q68.3Low70.1Confident40 Ų4086.1 Ų86.119%0.18740%0.395CS..Hα-helixtrans-57.7-42172.4-77.1-161.738.200111.8G487 D488 R500 I503G487-Q491 WeakPolarHBondContact O-CG 3.2Å; G487-Q491 PolarHBondContact O-N 3.49Å; D488-Q491 PolarHBondContact O-N 3.33Å; Q491-R500 HydrophobicContact CB-CG 3.89Å; Q491-R500 HydrophobicContact CG-CG 4.03Å; Q491-R500 WeakPolarHBondContact O-CD 3.39Å; Q491-R500 WeakPolarHBondContact O-CG 3.4Å; Q491-R500 PolarHBondContact O-NH1 2.85Å; Q491-I503 HydrophobicContact CG-CB 4.11Å; Q491-I503 HydrophobicContact CG-CG2 3.65Å
492Q64.5Low70Confident149 Ų14983.7 Ų83.770%0.69639%0.386SS*.Hα-helixtrans-68.3-34.4177.6-71.9177.411.900112.6D488 L490D488-Q492 WeakPolarHBondContact O-CG 3.49Å; D488-Q492 PolarHBondContact O-N 3.49Å; L490-Q492 VanDerWaalsContact C-N 3.3Å; L490-Q492 PolarHBondContact O-N 3.19Å
493R62.8Low70.3Confident153 Ų15377.5 Ų77.558%0.57736%0.357SS*.Hα-helixtrans-94.2-19.9-171.4-66.4169.4-165-177.35.7114.7N489 L490N489-R493 WeakPolarHBondContact O-CB 3.48Å; N489-R493 VanDerWaalsContact O-CD 3.31Å; N489-R493 WeakPolarHBondContact O-CD 3.36Å; N489-R493 WeakPolarHBondContact O-CG 3.36Å; N489-R493 PolarHBondContact O-N 2.72Å; N489-R493 VanDerWaalsContact O-N 3.13Å; N489-R493 PolarHBondContact OD1-NH2 3.49Å; L490-R493 PolarHBondContact O-N 2.87Å
494I57Low70.4Confident28 Ų2880.5 Ų80.514%0.14437%0.37CS..  trans-91.7123.9178.2-69.7162.3000109.6L439 L490 D496 K499 R500 I503L439-I494 HydrophobicContact CB-CD1 4.38Å; L439-I494 HydrophobicContact CD1-CD1 3.65Å; L439-I494 HydrophobicContact CD2-CD1 3.69Å; L439-I494 HydrophobicContact CG-CD1 4.1Å; L490-I494 HydrophobicContact CB-CD1 4.06Å; L490-I494 HydrophobicContact CD2-CD1 3.96Å; L490-I494 WeakPolarHBondContact O-CB 3.46Å; L490-I494 WeakPolarHBondContact O-CG1 3.26Å; L490-I494 PolarHBondContact O-N 3.19Å; I494-D496 HydrophobicContact CG2-CB 3.93Å; I494-K499 HydrophobicContact CG2-CB 4.15Å; I494-R500 PolarHBondContact O-NH1 2.79Å; I494-R500 PolarHBondContact O-NH2 3.41Å; I494-I503 HydrophobicContact CD1-CD1 3.73Å
495T54.3Low70.3Confident132 Ų13283.9 Ų83.981%0.8139%0.387SS*.  trans-77.9-25.6178.238.50000114E497 R500T495-E497 PolarHBondContact O-N 3.31Å; T495-E497 VanDerWaalsContact O-N 3.16Å; T495-R500 PolarHBondContact O-NH2 3.29Å
496D56.8Low70.5Confident66 Ų6680.6 Ų80.635%0.35337%0.371SS..  trans-67.9105.5178.9-176.4-22.1000111I494 R498 K499 R500I494-D496 HydrophobicContact CG2-CB 3.93Å; D496-R498 VanDerWaalsContact C-N 3.31Å; D496-R498 PolarHBondContact O-N 2.95Å; D496-R498 PolarHBondContact OD1-N 3.41Å; D496-K499 HydrophobicContact CB-CB 4.15Å; D496-K499 HydrophobicContact CB-CD 4.11Å; D496-K499 HydrophobicContact CB-CG 4.22Å; D496-K499 PolarHBondContact O-N 2.95Å; D496-K499 PolarHBondContact OD1-N 3.32Å; D496-K499 VanDerWaalsContact OD2-CD 3.23Å; D496-K499 WeakPolarHBondContact OD2-CD 3.33Å; D496-K499 WeakPolarHBondContact OD2-CE 3.42Å; D496-K499 WeakPolarHBondContact OD2-CG 3.45Å; D496-K499 IonicContact OD2-NZ 3.08Å; D496-R500 PolarHBondContact O-N 3.45Å
497E65.3Low70.8Confident156 Ų15677.8 Ų77.873%0.72936%0.361SS*.Hα-helixtrans-64.3-32.6-173.4-161.8160.8-134.700113.1T495 R500 E501T495-E497 PolarHBondContact O-N 3.31Å; T495-E497 VanDerWaalsContact O-N 3.16Å; E497-R500 VanDerWaalsContact O-CB 3.31Å; E497-R500 WeakPolarHBondContact O-CB 3.31Å; E497-R500 PolarHBondContact O-N 2.92Å; E497-E501 PolarHBondContact O-N 2.97Å
498R67.4Low71.1Confident192 Ų19283.5 Ų83.573%0.72539%0.387SS*.Hα-helixtrans-67.1-43.1175.2-177.4179.6177.5161.75.5111.1D496 R500 E501 E502D496-R498 VanDerWaalsContact C-N 3.31Å; D496-R498 PolarHBondContact O-N 2.95Å; D496-R498 PolarHBondContact OD1-N 3.41Å; R498-R500 VanDerWaalsContact C-N 3.3Å; R498-E501 PolarHBondContact O-N 3.44Å; R498-E502 IonicContact NE-OE1 2.8Å; R498-E502 PolarHBondContact O-N 3.28Å
499K68.9Low71.6Confident87 Ų8783.8 Ų83.838%0.37839%0.388SS..Hα-helixtrans-68.2-31.9174.9-66.2-178.3-173.7179.20111.9L439 I494 D496 E502 I503L439-K499 HydrophobicContact CD2-CD 3.86Å; I494-K499 HydrophobicContact CG2-CB 4.15Å; D496-K499 HydrophobicContact CB-CB 4.15Å; D496-K499 HydrophobicContact CB-CD 4.11Å; D496-K499 HydrophobicContact CB-CG 4.22Å; D496-K499 PolarHBondContact O-N 2.95Å; D496-K499 PolarHBondContact OD1-N 3.32Å; D496-K499 VanDerWaalsContact OD2-CD 3.23Å; D496-K499 WeakPolarHBondContact OD2-CD 3.33Å; D496-K499 WeakPolarHBondContact OD2-CE 3.42Å; D496-K499 WeakPolarHBondContact OD2-CG 3.45Å; D496-K499 IonicContact OD2-NZ 3.08Å; K499-E502 PolarHBondContact O-N 2.96Å; K499-I503 WeakPolarHBondContact O-CD1 3.34Å; K499-I503 VanDerWaalsContact O-CG1 3.22Å; K499-I503 WeakPolarHBondContact O-CG1 3.4Å; K499-I503 PolarHBondContact O-N 3.37Å
500R70.9Confident72.5Confident76 Ų7681.2 Ų81.229%0.28738%0.375SS..Hα-helixtrans-60.2-45.9172.8-139.7-170.9-58.2-110.78.4111.2Q491 I494 T495 D496 E497 R498 I503 K504Q491-R500 HydrophobicContact CB-CG 3.89Å; Q491-R500 HydrophobicContact CG-CG 4.03Å; Q491-R500 WeakPolarHBondContact O-CD 3.39Å; Q491-R500 WeakPolarHBondContact O-CG 3.4Å; Q491-R500 PolarHBondContact O-NH1 2.85Å; I494-R500 PolarHBondContact O-NH1 2.79Å; I494-R500 PolarHBondContact O-NH2 3.41Å; T495-R500 PolarHBondContact O-NH2 3.29Å; D496-R500 PolarHBondContact O-N 3.45Å; E497-R500 VanDerWaalsContact O-CB 3.31Å; E497-R500 WeakPolarHBondContact O-CB 3.31Å; E497-R500 PolarHBondContact O-N 2.92Å; R498-R500 VanDerWaalsContact C-N 3.3Å; R500-I503 PolarHBondContact O-N 2.88Å; R500-K504 PolarHBondContact O-N 2.94Å; R500-K504 VanDerWaalsContact O-N 3.1Å
501E72.3Confident73.2Confident83 Ų8384 Ų8439%0.38839%0.388SS..Hα-helixtrans-72.1-36.1177.9-160.862.7-154.900112.5E497 R498 I503 K504 I505E497-E501 PolarHBondContact O-N 2.97Å; R498-E501 PolarHBondContact O-N 3.44Å; E501-I503 VanDerWaalsContact C-N 3.32Å; E501-I503 PolarHBondContact O-N 2.77Å; E501-K504 WeakPolarHBondContact O-CB 3.4Å; E501-K504 PolarHBondContact O-N 2.91Å; E501-K504 IonicContact OE1-NZ 3.03Å; E501-K504 PolarHBondContact OE1-NZ 3.06Å; E501-K504 IonicContact OE2-NZ 2.73Å; E501-K504 PolarHBondContact OE2-NZ 3.32Å; E501-I505 HydrophobicContact CG-CD1 4.24Å; E501-I505 WeakPolarHBondContact O-CG1 3.39Å; E501-I505 PolarHBondContact O-N 3.39Å
502E75.7Confident73.9Confident89 Ų8986.5 Ų86.542%0.41641%0.405SS..Hα-helixtrans-59.7-39.9171.7-77.2176.1-169.100112.6R498 K499 K506R498-E502 IonicContact NE-OE1 2.8Å; R498-E502 PolarHBondContact O-N 3.28Å; K499-E502 PolarHBondContact O-N 2.96Å; E502-K506 WeakPolarHBondContact O-CG 3.32Å; E502-K506 PolarHBondContact O-N 2.88Å
503I80.7Confident74.9Confident2 Ų281.7 Ų81.71%0.0138%0.382CS..Hα-helixtrans-63.3-46.5173.3-68.2159.6000110.4L439 F442 L490 Q491 I494 K499 R500 E501 K506 Q507L439-I503 HydrophobicContact CD1-CD1 3.81Å; L439-I503 HydrophobicContact CD1-CG1 4.1Å; F442-I503 HydrophobicContact CD1-CG1 4.3Å; F442-I503 HydrophobicContact CE1-CB 4.2Å; F442-I503 HydrophobicContact CE1-CG1 3.93Å; F442-I503 HydrophobicContact CE1-CG2 3.71Å; F442-I503 HydrophobicContact CZ-CG2 3.94Å; L490-I503 HydrophobicContact CB-CD1 4.07Å; Q491-I503 HydrophobicContact CG-CB 4.11Å; Q491-I503 HydrophobicContact CG-CG2 3.65Å; I494-I503 HydrophobicContact CD1-CD1 3.73Å; K499-I503 WeakPolarHBondContact O-CD1 3.34Å; K499-I503 VanDerWaalsContact O-CG1 3.22Å; K499-I503 WeakPolarHBondContact O-CG1 3.4Å; K499-I503 PolarHBondContact O-N 3.37Å; R500-I503 PolarHBondContact O-N 2.88Å; E501-I503 VanDerWaalsContact C-N 3.32Å; E501-I503 PolarHBondContact O-N 2.77Å; I503-K506 PolarHBondContact O-N 3.11Å; I503-Q507 HydrophobicContact CG2-CG 4.39Å; I503-Q507 WeakPolarHBondContact O-CG 3.47Å; I503-Q507 PolarHBondContact O-N 3Å; I503-Q507 PolarHBondContact O-OE1 2.76Å
504K80.5Confident75.9Confident75 Ų7575.3 Ų75.333%0.32636%0.359SS..Hα-helixtrans-61.7-45.8-177.8-174.3166.5151.4-120.40113R500 E501 K506 Q507 Q508R500-K504 PolarHBondContact O-N 2.94Å; R500-K504 VanDerWaalsContact O-N 3.1Å; E501-K504 WeakPolarHBondContact O-CB 3.4Å; E501-K504 PolarHBondContact O-N 2.91Å; E501-K504 IonicContact OE1-NZ 3.03Å; E501-K504 PolarHBondContact OE1-NZ 3.06Å; E501-K504 IonicContact OE2-NZ 2.73Å; E501-K504 PolarHBondContact OE2-NZ 3.32Å; K504-K506 VanDerWaalsContact C-N 3.31Å; K504-K506 PolarHBondContact O-N 2.63Å; K504-Q507 PolarHBondContact O-N 3.15Å; K504-Q508 PolarHBondContact O-N 2.97Å
505I80.8Confident77.1Confident97 Ų9777.6 Ų77.650%0.49737%0.371SS..Hα-helixtrans-59.5-43.5175.1-68.8166.8000110.4E501 Q508 L509E501-I505 HydrophobicContact CG-CD1 4.24Å; E501-I505 WeakPolarHBondContact O-CG1 3.39Å; E501-I505 PolarHBondContact O-N 3.39Å; I505-Q508 PolarHBondContact O-N 3.44Å; I505-L509 WeakPolarHBondContact O-CB 3.48Å; I505-L509 PolarHBondContact O-N 3.13Å
506K82.1Confident78.4Confident55 Ų5573.2 Ų73.224%0.23935%0.348CS..Hα-helixtrans-69.3-36179.4-71.5-176.6180-164.20113.3N443 I446 E502 I503 K504 L509 L510N443-K506 PolarHBondContact OD1-NZ 3.38Å; I446-K506 HydrophobicContact CD1-CB 4.03Å; I446-K506 HydrophobicContact CG2-CB 4.14Å; I446-K506 HydrophobicContact CG2-CD 3.98Å; I446-K506 HydrophobicContact CG2-CG 4.48Å; E502-K506 WeakPolarHBondContact O-CG 3.32Å; E502-K506 PolarHBondContact O-N 2.88Å; I503-K506 PolarHBondContact O-N 3.11Å; K504-K506 VanDerWaalsContact C-N 3.31Å; K504-K506 PolarHBondContact O-N 2.63Å; K506-L509 PolarHBondContact O-N 2.7Å; K506-L510 WeakPolarHBondContact O-CB 3.39Å; K506-L510 PolarHBondContact O-N 2.92Å
507Q86.8Confident79.6Confident12 Ų1270.2 Ų70.26%0.05633%0.332CS..Hα-helixtrans-64.7-44.5172.5-73.7171.4-75.600111.8F442 L484 D488 I503 K504 L509 L510 Q511F442-Q507 HydrophobicContact CZ-CG 4.38Å; L484-Q507 HydrophobicContact CD2-CB 3.85Å; L484-Q507 HydrophobicContact CD2-CG 4.13Å; L484-Q507 PolarHBondContact O-NE2 3.35Å; D488-Q507 VanDerWaalsContact N-NE2 3.19Å; D488-Q507 PolarHBondContact OD1-NE2 3.47Å; I503-Q507 HydrophobicContact CG2-CG 4.39Å; I503-Q507 WeakPolarHBondContact O-CG 3.47Å; I503-Q507 PolarHBondContact O-N 3Å; I503-Q507 PolarHBondContact O-OE1 2.76Å; K504-Q507 PolarHBondContact O-N 3.15Å; Q507-L509 VanDerWaalsContact C-N 3.32Å; Q507-L509 PolarHBondContact O-N 2.94Å; Q507-L510 PolarHBondContact O-N 2.86Å; Q507-Q511 WeakPolarHBondContact O-CB 3.28Å; Q507-Q511 PolarHBondContact O-N 2.85Å
508Q83.5Confident80.3Confident120 Ų12066 Ų6656%0.56131%0.312SS*.Hα-helixtrans-61.4-41.1175.9-74.8-177.1-23.500111.8K504 I505 Q511 T512K504-Q508 PolarHBondContact O-N 2.97Å; I505-Q508 PolarHBondContact O-N 3.44Å; Q508-Q511 PolarHBondContact O-N 3.42Å; Q508-T512 WeakPolarHBondContact O-CB 3.47Å; Q508-T512 PolarHBondContact O-N 3.24Å; Q508-T512 PolarHBondContact O-OG1 2.88Å
509L86.7Confident80.8Confident81 Ų8161.7 Ų61.742%0.42430%0.303SS..Hα-helixtrans-61.8-47.3174.6-175.962.7000111.8L450 I505 K506 Q507 T512 K513L450-L509 HydrophobicContact CD1-CD2 3.95Å; L450-L509 HydrophobicContact CD1-CG 4.39Å; L450-L509 HydrophobicContact CD2-CD2 4.42Å; L450-L509 HydrophobicContact CD2-CG 4.09Å; I505-L509 WeakPolarHBondContact O-CB 3.48Å; I505-L509 PolarHBondContact O-N 3.13Å; K506-L509 PolarHBondContact O-N 2.7Å; Q507-L509 VanDerWaalsContact C-N 3.32Å; Q507-L509 PolarHBondContact O-N 2.94Å; L509-T512 PolarHBondContact O-N 2.95Å; L509-K513 HydrophobicContact CD1-CG 4.36Å; L509-K513 VanDerWaalsContact O-CG 3.32Å; L509-K513 WeakPolarHBondContact O-CG 3.28Å; L509-K513 PolarHBondContact O-N 2.84Å
510L87.3Confident81.3Confident0 Ų058.9 Ų58.90%029%0.292CS..Hα-helixtrans-60.2-47.1177.3-176.969.5000112I446 L449 L450 L453 V480 L483 L484 K506 Q507 T512 K513 H514I446-L510 HydrophobicContact CD1-CB 4.49Å; I446-L510 HydrophobicContact CD1-CD2 4.21Å; I446-L510 HydrophobicContact CG1-CD2 3.92Å; L449-L510 HydrophobicContact CB-CD1 4.45Å; L449-L510 HydrophobicContact CD2-CD1 4.04Å; L449-L510 HydrophobicContact CD2-CD2 4.42Å; L449-L510 HydrophobicContact CG-CD1 4.17Å; L450-L510 HydrophobicContact CD2-CB 4.42Å; L450-L510 HydrophobicContact CD2-CD1 4.09Å; L450-L510 HydrophobicContact CG-CD1 4.22Å; L453-L510 HydrophobicContact CD1-CD1 3.49Å; L453-L510 VanDerWaalsContact CD1-CD1 3.49Å; V480-L510 HydrophobicContact CG1-CD2 4.19Å; V480-L510 HydrophobicContact CG1-CG 4.29Å; V480-L510 HydrophobicContact CG2-CD1 4.4Å; V480-L510 HydrophobicContact CG2-CG 4.49Å; L483-L510 HydrophobicContact CB-CD2 4.14Å; L484-L510 HydrophobicContact CD2-CD2 4.4Å; L484-L510 HydrophobicContact CG-CD2 4.34Å; K506-L510 WeakPolarHBondContact O-CB 3.39Å; K506-L510 PolarHBondContact O-N 2.92Å; Q507-L510 PolarHBondContact O-N 2.86Å; L510-T512 PolarHBondContact O-N 2.96Å; L510-K513 PolarHBondContact O-N 3.24Å; L510-H514 VanDerWaalsContact O-CB 3.27Å; L510-H514 WeakPolarHBondContact O-CB 3.38Å; L510-H514 PolarHBondContact O-N 3.43Å
511Q85.2Confident81.9Confident72 Ų7258.1 Ų58.134%0.33629%0.289SS..Hα-helixtrans-60.9-44.5178.2-174.27066.200111.5L484 Q507 Q508 H514 N515L484-Q511 HydrophobicContact CD2-CB 4.46Å; Q507-Q511 WeakPolarHBondContact O-CB 3.28Å; Q507-Q511 PolarHBondContact O-N 2.85Å; Q508-Q511 PolarHBondContact O-N 3.42Å; Q511-H514 PolarHBondContact O-N 3.12Å; Q511-N515 PolarHBondContact NE2-OD1 3Å; Q511-N515 WeakPolarHBondContact O-CB 3.49Å; Q511-N515 PolarHBondContact O-N 3.49Å; Q511-N515 PolarHBondContact O-OD1 3.32Å
512T82.6Confident82Confident91 Ų9156.9 Ų56.956%0.55829%0.29SS*.Hα-helixtrans-63.5-44.8-179.2-54.40000111.1Q508 L509 L510 A516Q508-T512 WeakPolarHBondContact O-CB 3.47Å; Q508-T512 PolarHBondContact O-N 3.24Å; Q508-T512 PolarHBondContact O-OG1 2.88Å; L509-T512 PolarHBondContact O-N 2.95Å; L510-T512 PolarHBondContact O-N 2.96Å; T512-A516 PolarHBondContact O-N 3.39Å; T512-A516 VanDerWaalsContact O-N 3.11Å
513K85Confident82.2Confident49 Ų4957.5 Ų57.521%0.21329%0.292CS..Hα-helixtrans-67.2-41.8177.2-66.9-72.8174.3168.70111.9L450 E454 I457 L509 L510 N515 A516 L517L450-K513 HydrophobicContact CD2-CB 4.4Å; L450-K513 HydrophobicContact CD2-CG 4.2Å; E454-K513 IonicContact OE1-NZ 3.83Å; E454-K513 PolarHBondContact OE1-NZ 3.2Å; E454-K513 VanDerWaalsContact OE2-CD 3.29Å; E454-K513 WeakPolarHBondContact OE2-CD 3.42Å; E454-K513 WeakPolarHBondContact OE2-CE 3.36Å; E454-K513 IonicContact OE2-NZ 3.4Å; E454-K513 PolarHBondContact OE2-NZ 3.15Å; I457-K513 HydrophobicContact CD1-CB 3.89Å; I457-K513 HydrophobicContact CD1-CD 3.58Å; I457-K513 HydrophobicContact CD1-CG 4.34Å; I457-K513 WeakPolarHBondContact CD1-O 3.38Å; L509-K513 HydrophobicContact CD1-CG 4.36Å; L509-K513 VanDerWaalsContact O-CG 3.32Å; L509-K513 WeakPolarHBondContact O-CG 3.28Å; L509-K513 PolarHBondContact O-N 2.84Å; L510-K513 PolarHBondContact O-N 3.24Å; K513-N515 PolarHBondContact O-N 3.06Å; K513-A516 PolarHBondContact O-N 3.47Å; K513-L517 WeakPolarHBondContact O-CB 3.3Å; K513-L517 PolarHBondContact O-N 2.98Å
514H84Confident82.2Confident18 Ų1857.6 Ų57.68%0.08329%0.293CS..Hα-helixtrans-61.8-43.4176.6-178.565.2000112.4V480 L510 Q511 L517 K518V480-H514 HydrophobicContact CG1-CB 4.19Å; V480-H514 HydrophobicContact CG2-CB 4.34Å; L510-H514 VanDerWaalsContact O-CB 3.27Å; L510-H514 WeakPolarHBondContact O-CB 3.38Å; L510-H514 PolarHBondContact O-N 3.43Å; Q511-H514 PolarHBondContact O-N 3.12Å; H514-L517 PolarHBondContact O-N 3.4Å; H514-K518 PolarHBondContact O-N 3.41Å
515N82.6Confident81.9Confident76 Ų7658.5 Ų58.541%0.40629%0.294SS..Hα-helixtrans-61.8-50.5176.6-69.33.7000111.4Q511 K513 L517 K518 D519Q511-N515 PolarHBondContact NE2-OD1 3Å; Q511-N515 WeakPolarHBondContact O-CB 3.49Å; Q511-N515 PolarHBondContact O-N 3.49Å; Q511-N515 PolarHBondContact O-OD1 3.32Å; K513-N515 PolarHBondContact O-N 3.06Å; N515-L517 PolarHBondContact O-N 3.37Å; N515-K518 WeakPolarHBondContact O-CA 3.28Å; N515-K518 WeakPolarHBondContact O-CB 3.49Å; N515-K518 PolarHBondContact O-N 3.3Å; N515-D519 PolarHBondContact O-N 2.83Å
516A81Confident81.7Confident40 Ų4060.7 Ų60.733%0.33130%0.3SS..Hα-helixtrans-57-37.2177.500000112.5T512 K513 L520T512-A516 PolarHBondContact O-N 3.39Å; T512-A516 VanDerWaalsContact O-N 3.11Å; K513-A516 PolarHBondContact O-N 3.47Å; A516-L520 WeakPolarHBondContact O-CG 3.46Å; A516-L520 PolarHBondContact O-N 2.99Å; A516-L520 VanDerWaalsContact O-N 3.12Å
517L82.4Confident81.5Confident3 Ų362.5 Ų62.52%0.01631%0.308CS..Hα-helixtrans-72.1-34.1175.3-171.962.2000113.1L453 E456 I457 K513 H514 N515 D519 L520 R521L453-L517 HydrophobicContact CD2-CD2 3.4Å; E456-L517 HydrophobicContact CB-CD1 3.83Å; E456-L517 HydrophobicContact CB-CD2 4.16Å; E456-L517 HydrophobicContact CG-CD1 3.78Å; E456-L517 HydrophobicContact CG-CD2 4.46Å; I457-L517 HydrophobicContact CD1-CB 4.44Å; I457-L517 HydrophobicContact CG1-CB 3.98Å; I457-L517 HydrophobicContact CG1-CD1 4.07Å; K513-L517 WeakPolarHBondContact O-CB 3.3Å; K513-L517 PolarHBondContact O-N 2.98Å; H514-L517 PolarHBondContact O-N 3.4Å; N515-L517 PolarHBondContact O-N 3.37Å; L517-D519 VanDerWaalsContact C-N 3.3Å; L517-D519 PolarHBondContact O-N 3.15Å; L517-L520 PolarHBondContact O-N 3.09Å; L517-R521 HydrophobicContact CD1-CG 4.42Å; L517-R521 HydrophobicContact CG-CG 4.34Å; L517-R521 WeakPolarHBondContact O-CB 3.36Å; L517-R521 VanDerWaalsContact O-CG 3.29Å; L517-R521 WeakPolarHBondContact O-CG 3.45Å; L517-R521 PolarHBondContact O-N 2.76Å
518K79.3Confident81.2Confident69 Ų6962.1 Ų62.130%0.331%0.307SS..Hα-helixtrans-63.6-37.9175.4-167.1163-167.5157.90111.5E474 E477 H514 N515 S522E474-K518 IonicContact OE2-NZ 3.41Å; E474-K518 PolarHBondContact OE2-NZ 2.94Å; E477-K518 IonicContact OE1-NZ 3.43Å; E477-K518 PolarHBondContact OE1-NZ 3.09Å; H514-K518 PolarHBondContact O-N 3.41Å; N515-K518 WeakPolarHBondContact O-CA 3.28Å; N515-K518 WeakPolarHBondContact O-CB 3.49Å; N515-K518 PolarHBondContact O-N 3.3Å; K518-S522 PolarHBondContact O-N 3.34Å; K518-S522 PolarHBondContact O-OG 2.85Å
519D78.3Confident80.9Confident100 Ų10062.8 Ų62.854%0.53531%0.313SS..Hα-helixtrans-67.3-48.9174.3-63.7-28.9000111.4N515 L517 R521 S522 Q523N515-D519 PolarHBondContact O-N 2.83Å; L517-D519 VanDerWaalsContact C-N 3.3Å; L517-D519 PolarHBondContact O-N 3.15Å; D519-R521 PolarHBondContact O-N 3.48Å; D519-S522 WeakPolarHBondContact O-CB 3.39Å; D519-S522 PolarHBondContact O-N 3.04Å; D519-S522 VanDerWaalsContact O-N 3.1Å; D519-Q523 WeakPolarHBondContact O-CG 3.48Å; D519-Q523 PolarHBondContact O-N 3.33Å
520L80.6Confident80.5Confident29 Ų2965 Ų6515%0.15232%0.321CS..Hα-helixtrans-58.1-45.2175.7-73.6172.2000112.3I457 V461 A516 L517 S522 Q523 R524I457-L520 HydrophobicContact CB-CD1 4.38Å; I457-L520 HydrophobicContact CG1-CD1 4.42Å; I457-L520 HydrophobicContact CG2-CD1 4.2Å; V461-L520 HydrophobicContact CG2-CD2 4.01Å; A516-L520 WeakPolarHBondContact O-CG 3.46Å; A516-L520 PolarHBondContact O-N 2.99Å; A516-L520 VanDerWaalsContact O-N 3.12Å; L517-L520 PolarHBondContact O-N 3.09Å; L520-S522 VanDerWaalsContact C-N 3.28Å; L520-S522 PolarHBondContact O-N 3.35Å; L520-Q523 PolarHBondContact O-N 3.44Å; L520-R524 WeakPolarHBondContact O-CG 3.12Å; L520-R524 PolarHBondContact O-N 2.86Å
521R82Confident80.4Confident59 Ų5965.7 Ų65.722%0.22333%0.325CS..Hα-helixtrans-63.3-31.4175.8-74.9173.4174.3-162-0112.7E456 L517 D519 R525E456-R521 IonicContact OE1-CZ 3.93Å; E456-R521 IonicContact OE1-NE 2.72Å; E456-R521 PolarHBondContact OE1-NE 2.95Å; E456-R521 IonicContact OE1-NH2 3.94Å; E456-R521 PolarHBondContact OE1-NH2 3.33Å; E456-R521 IonicContact OE2-CZ 3.47Å; E456-R521 IonicContact OE2-NE 3.14Å; E456-R521 IonicContact OE2-NH2 2.87Å; E456-R521 PolarHBondContact OE2-NH2 3.5Å; L517-R521 HydrophobicContact CD1-CG 4.42Å; L517-R521 HydrophobicContact CG-CG 4.34Å; L517-R521 WeakPolarHBondContact O-CB 3.36Å; L517-R521 VanDerWaalsContact O-CG 3.29Å; L517-R521 WeakPolarHBondContact O-CG 3.45Å; L517-R521 PolarHBondContact O-N 2.76Å; D519-R521 PolarHBondContact O-N 3.48Å; R521-R525 WeakPolarHBondContact O-CB 3.29Å; R521-R525 WeakPolarHBondContact O-CG 3.28Å; R521-R525 PolarHBondContact O-N 3.5Å
522S74.7Confident80.2Confident57 Ų5764.2 Ų64.240%0.39932%0.323SS..Hα-helixtrans-72.5-40.2174.1-63.30000112K518 D519 L520 R525 K526K518-S522 PolarHBondContact O-N 3.34Å; K518-S522 PolarHBondContact O-OG 2.85Å; D519-S522 WeakPolarHBondContact O-CB 3.39Å; D519-S522 PolarHBondContact O-N 3.04Å; D519-S522 VanDerWaalsContact O-N 3.1Å; L520-S522 VanDerWaalsContact C-N 3.28Å; L520-S522 PolarHBondContact O-N 3.35Å; S522-R525 PolarHBondContact O-N 3.37Å; S522-K526 PolarHBondContact O-N 2.92Å
523Q79.5Confident80Confident102 Ų10266.7 Ų66.748%0.47733%0.328SS..Hα-helixtrans-62.7-43.2172.9-66.3175.918.500111.6V461 D519 L520 K526 K527V461-Q523 HydrophobicContact CG1-CB 3.73Å; D519-Q523 WeakPolarHBondContact O-CG 3.48Å; D519-Q523 PolarHBondContact O-N 3.33Å; L520-Q523 PolarHBondContact O-N 3.44Å; Q523-K526 PolarHBondContact O-N 2.56Å; Q523-K527 PolarHBondContact O-N 3.14Å; Q523-K527 VanDerWaalsContact O-N 3.15Å
524R81Confident80Confident4 Ų468.5 Ų68.52%0.01534%0.337CS..Hα-helixtrans-60.5-48.1173.4-69.8-157.6-56-108.86.1112.2E456 G460 V461 N462 L463 D467 L520 K526 K527 A528E456-R524 IonicContact OE1-CZ 3.78Å; E456-R524 IonicContact OE1-NH2 2.63Å; E456-R524 PolarHBondContact OE1-NH2 2.93Å; G460-R524 PolarHBondContact O-NH1 3.34Å; V461-R524 HydrophobicContact CG1-CG 4.09Å; N462-R524 WeakPolarHBondContact O-CD 3.44Å; L463-R524 HydrophobicContact CD2-CB 3.62Å; L463-R524 HydrophobicContact CD2-CG 3.93Å; L463-R524 WeakPolarHBondContact CD2-O 3.44Å; D467-R524 IonicContact OD1-CZ 3.17Å; D467-R524 IonicContact OD1-NE 2.76Å; D467-R524 PolarHBondContact OD1-NE 2.92Å; D467-R524 IonicContact OD1-NH2 2.7Å; D467-R524 IonicContact OD2-NE 2.68Å; D467-R524 PolarHBondContact OD2-NE 3.41Å; L520-R524 WeakPolarHBondContact O-CG 3.12Å; L520-R524 PolarHBondContact O-N 2.86Å; R524-K526 VanDerWaalsContact C-N 3.28Å; R524-K526 PolarHBondContact O-N 2.92Å; R524-K527 PolarHBondContact O-N 3.32Å; R524-A528 VanDerWaalsContact O-CB 3.28Å; R524-A528 WeakPolarHBondContact O-CB 3.21Å; R524-A528 PolarHBondContact O-N 3.2Å
525R75.1Confident80.1Confident94 Ų9467.9 Ų67.936%0.35533%0.334SS..Hα-helixtrans-57.8-36.9175.8-80.4-171.8-79.9-159.5-0.5113.1E474 R521 S522 L529E474-R525 IonicContact OE1-CZ 3.37Å; E474-R525 IonicContact OE1-NH1 3.64Å; E474-R525 IonicContact OE1-NH2 3.47Å; E474-R525 PolarHBondContact OE1-NH2 3.25Å; E474-R525 VanDerWaalsContact OE1-NH2 3.08Å; R521-R525 WeakPolarHBondContact O-CB 3.29Å; R521-R525 WeakPolarHBondContact O-CG 3.28Å; R521-R525 PolarHBondContact O-N 3.5Å; S522-R525 PolarHBondContact O-N 3.37Å; R525-L529 PolarHBondContact O-N 3.47Å; R525-L529 VanDerWaalsContact O-N 3.08Å
526K77.1Confident80.2Confident143 Ų14370.2 Ų70.262%0.62234%0.338SS*.Hα-helixtrans-65.3-52.7176.8-168.3-176.5174.7-1690111.7S522 Q523 R524 A528 L529 E530S522-K526 PolarHBondContact O-N 2.92Å; Q523-K526 PolarHBondContact O-N 2.56Å; R524-K526 VanDerWaalsContact C-N 3.28Å; R524-K526 PolarHBondContact O-N 2.92Å; K526-A528 PolarHBondContact O-N 2.93Å; K526-L529 WeakPolarHBondContact O-CB 3.23Å; K526-L529 PolarHBondContact O-N 2.84Å; K526-E530 WeakPolarHBondContact CE-OE1 3.41Å; K526-E530 WeakPolarHBondContact O-CG 3.33Å; K526-E530 PolarHBondContact O-N 2.95Å
527K77.1Confident80.4Confident94 Ų9472.3 Ų72.341%0.40934%0.341SS..Hα-helixtrans-60.8-42175.6-75.7-162.3171.8-159.20112.6L463 Q523 R524 L529 E530 I531L463-K527 HydrophobicContact CD1-CB 4.02Å; L463-K527 HydrophobicContact CD2-CB 4.13Å; Q523-K527 PolarHBondContact O-N 3.14Å; Q523-K527 VanDerWaalsContact O-N 3.15Å; R524-K527 PolarHBondContact O-N 3.32Å; K527-L529 VanDerWaalsContact C-N 3.27Å; K527-L529 PolarHBondContact O-N 3.05Å; K527-E530 WeakPolarHBondContact O-CB 3.42Å; K527-E530 PolarHBondContact O-N 3.06Å; K527-E530 VanDerWaalsContact O-N 3.1Å; K527-I531 PolarHBondContact O-N 3.32Å
528A79.5Confident80.8Confident4 Ų472.2 Ų72.23%0.03334%0.34CS..Hα-helixtrans-59.9-36.8177.200000112.2L463 D467 F468 R524 K526 S532L463-A528 HydrophobicContact CD1-CB 4.43Å; L463-A528 HydrophobicContact CD2-CB 4.28Å; D467-A528 HydrophobicContact CB-CB 4.35Å; F468-A528 HydrophobicContact CD1-CB 3.99Å; F468-A528 HydrophobicContact CE1-CB 3.93Å; F468-A528 WeakPolarHBondContact CE1-O 3.39Å; F468-A528 HydrophobicContact CG-CB 4.47Å; F468-A528 HydrophobicContact CZ-CB 4.36Å; R524-A528 VanDerWaalsContact O-CB 3.28Å; R524-A528 WeakPolarHBondContact O-CB 3.21Å; R524-A528 PolarHBondContact O-N 3.2Å; K526-A528 PolarHBondContact O-N 2.93Å; A528-S532 VanDerWaalsContact O-CA 3.3Å; A528-S532 WeakPolarHBondContact O-CA 3.5Å; A528-S532 VanDerWaalsContact O-CB 3.24Å; A528-S532 WeakPolarHBondContact O-CB 3.4Å; A528-S532 PolarHBondContact O-N 2.7Å
529L77.8Confident81.2Confident133 Ų13370.7 Ų70.770%0.69633%0.334SS*.Hα-helixtrans-63.2-45.1173.1-117.294.2000111.9R525 K526 K527 I531 S532R525-L529 PolarHBondContact O-N 3.47Å; R525-L529 VanDerWaalsContact O-N 3.08Å; K526-L529 WeakPolarHBondContact O-CB 3.23Å; K526-L529 PolarHBondContact O-N 2.84Å; K527-L529 VanDerWaalsContact C-N 3.27Å; K527-L529 PolarHBondContact O-N 3.05Å; L529-I531 VanDerWaalsContact C-N 3.34Å; L529-I531 PolarHBondContact O-N 2.82Å; L529-S532 WeakPolarHBondContact O-CB 3.45Å; L529-S532 PolarHBondContact O-N 3.25Å; L529-S532 PolarHBondContact O-OG 2.98Å
530E79Confident81.5Confident127 Ų12774.6 Ų74.659%0.59334%0.341SS*.Hα-helixtrans-60.2-39.9-176.9-70.3160.7-177.400111.9K526 K527K526-E530 WeakPolarHBondContact CE-OE1 3.41Å; K526-E530 WeakPolarHBondContact O-CG 3.33Å; K526-E530 PolarHBondContact O-N 2.95Å; K527-E530 WeakPolarHBondContact O-CB 3.42Å; K527-E530 PolarHBondContact O-N 3.06Å; K527-E530 VanDerWaalsContact O-N 3.1Å
531I84.2Confident81.8Confident16 Ų1676.4 Ų76.48%0.08235%0.349CS..Hα-helixtrans-102.72.817969.9178.5000115.3L463 F468 K527 L529 H533 Q534 W535 L592 D595 A597L463-I531 HydrophobicContact CD1-CD1 3.72Å; L463-I531 HydrophobicContact CD1-CG1 4.34Å; F468-I531 HydrophobicContact CE1-CG1 3.95Å; F468-I531 HydrophobicContact CZ-CD1 4.13Å; F468-I531 HydrophobicContact CZ-CG1 4.03Å; K527-I531 PolarHBondContact O-N 3.32Å; L529-I531 VanDerWaalsContact C-N 3.34Å; L529-I531 PolarHBondContact O-N 2.82Å; I531-H533 VanDerWaalsContact C-N 3.28Å; I531-H533 PolarHBondContact O-N 3.12Å; I531-H533 VanDerWaalsContact O-N 3.1Å; I531-Q534 WeakPolarHBondContact O-CB 3.23Å; I531-Q534 PolarHBondContact O-N 3.3Å; I531-W535 PolarHBondContact O-N 3.01Å; I531-W535 VanDerWaalsContact O-N 3.11Å; I531-L592 HydrophobicContact CD1-CD2 4.11Å; I531-D595 HydrophobicContact CD1-CB 3.98Å; I531-D595 HydrophobicContact CG2-CB 4.01Å; I531-A597 HydrophobicContact CD1-CB 3.95Å
532S80.9Confident82.1Confident41 Ų4173.6 Ų73.629%0.28734%0.338SS..Hα-helixtrans-48.7-42.1-174.555.90000114.8A528 L529 Q534 W535 Y536A528-S532 VanDerWaalsContact O-CA 3.3Å; A528-S532 WeakPolarHBondContact O-CA 3.5Å; A528-S532 VanDerWaalsContact O-CB 3.24Å; A528-S532 WeakPolarHBondContact O-CB 3.4Å; A528-S532 PolarHBondContact O-N 2.7Å; L529-S532 WeakPolarHBondContact O-CB 3.45Å; L529-S532 PolarHBondContact O-N 3.25Å; L529-S532 PolarHBondContact O-OG 2.98Å; S532-Q534 PolarHBondContact O-N 3.08Å; S532-W535 PolarHBondContact O-N 3.38Å; S532-Y536 WeakPolarHBondContact O-CD2 3.27Å; S532-Y536 PolarHBondContact O-N 2.92Å
533H78.5Confident82.7Confident142 Ų14274.4 Ų74.466%0.65734%0.338SS*.Hα-helixtrans-61.9-42.7178.2177.959.3000112.5I531 Q537I531-H533 VanDerWaalsContact C-N 3.28Å; I531-H533 PolarHBondContact O-N 3.12Å; I531-H533 VanDerWaalsContact O-N 3.1Å; H533-Q537 WeakPolarHBondContact O-CB 3.49Å; H533-Q537 PolarHBondContact O-N 3.02Å; H533-Q537 VanDerWaalsContact O-N 3.12Å
534Q84.6Confident83Confident88 Ų8873.9 Ų73.941%0.41134%0.338SS..Hα-helixtrans-67.5-42.8179-57.1-169.539.200110.8I531 S532 Q537 Y538 L592I531-Q534 WeakPolarHBondContact O-CB 3.23Å; I531-Q534 PolarHBondContact O-N 3.3Å; S532-Q534 PolarHBondContact O-N 3.08Å; Q534-Q537 PolarHBondContact O-N 3.41Å; Q534-Y538 PolarHBondContact O-N 3.4Å; Q534-L592 HydrophobicContact CB-CD2 3.8Å; Q534-L592 HydrophobicContact CB-CG 4.49Å
535W86.3Confident83.3Confident5 Ų573.9 Ų73.92%0.01934%0.339CS..Hα-helixtrans-58.6-50.9176.6171.2-106.9000112.3E465 F468 I531 S532 Q537 Y538 K539 L592 A600 V601E465-W535 HydrophobicContact CB-CH2 4.35Å; E465-W535 HydrophobicContact CB-CZ2 3.93Å; E465-W535 HydrophobicContact CG-CZ2 3.74Å; F468-W535 HydrophobicContact CD1-CB 3.97Å; F468-W535 AromaticContact CD1-CD1 3.59Å; F468-W535 AromaticContact CD1-CG 3.82Å; F468-W535 HydrophobicContact CD1-CG 3.82Å; F468-W535 AromaticContact CD2-CD1 3.67Å; F468-W535 HydrophobicContact CD2-CD2 4Å; F468-W535 AromaticContact CD2-CE2 3.98Å; F468-W535 AromaticContact CD2-CG 3.86Å; F468-W535 HydrophobicContact CD2-CG 3.86Å; F468-W535 AromaticContact CD2-NE1 3.7Å; F468-W535 HydrophobicContact CE1-CB 3.59Å; F468-W535 AromaticContact CE1-CG 3.8Å; F468-W535 HydrophobicContact CE1-CG 3.8Å; F468-W535 HydrophobicContact CE2-CB 4.35Å; F468-W535 AromaticContact CE2-CD2 3.87Å; F468-W535 HydrophobicContact CE2-CD2 3.87Å; F468-W535 HydrophobicContact CE2-CE3 4.29Å; F468-W535 AromaticContact CE2-CG 3.84Å; F468-W535 HydrophobicContact CE2-CG 3.84Å; F468-W535 HydrophobicContact CG-CB 4.48Å; F468-W535 AromaticContact CG-CD1 3.37Å; F468-W535 HydrophobicContact CG-CD2 4.45Å; F468-W535 AromaticContact CG-CG 3.85Å; F468-W535 HydrophobicContact CG-CG 3.85Å; F468-W535 AromaticContact CG-NE1 3.73Å; F468-W535 HydrophobicContact CZ-CB 3.81Å; F468-W535 HydrophobicContact CZ-CD2 4.2Å; F468-W535 AromaticContact CZ-CG 3.8Å; F468-W535 HydrophobicContact CZ-CG 3.8Å; I531-W535 PolarHBondContact O-N 3.01Å; I531-W535 VanDerWaalsContact O-N 3.11Å; S532-W535 PolarHBondContact O-N 3.38Å; W535-Q537 VanDerWaalsContact C-N 3.27Å; W535-Q537 PolarHBondContact O-N 3.43Å; W535-Y538 AromaticContact CE3-CD1 3.96Å; W535-Y538 HydrophobicContact CE3-CD1 3.96Å; W535-Y538 HydrophobicContact CE3-CE1 4.48Å; W535-Y538 HydrophobicContact CH2-CD1 4.39Å; W535-Y538 HydrophobicContact CH2-CE1 4.28Å; W535-Y538 AromaticContact CZ3-CD1 3.71Å; W535-Y538 HydrophobicContact CZ3-CD1 3.71Å; W535-Y538 AromaticContact CZ3-CE1 3.78Å; W535-Y538 HydrophobicContact CZ3-CE1 3.78Å; W535-Y538 PolarHBondContact O-N 3.07Å; W535-K539 HydrophobicContact CH2-CD 4.43Å; W535-K539 HydrophobicContact CZ2-CD 4.1Å; W535-K539 WeakPolarHBondContact O-CB 3.3Å; W535-K539 PolarHBondContact O-N 2.71Å; W535-L592 HydrophobicContact CB-CD2 4.39Å; W535-L592 HydrophobicContact CE3-CD1 4.25Å; W535-A600 HydrophobicContact CE3-CB 4.16Å; W535-A600 HydrophobicContact CH2-CB 3.65Å; W535-A600 VanDerWaalsContact CH2-O 3.31Å; W535-A600 WeakPolarHBondContact CH2-O 3.4Å; W535-A600 HydrophobicContact CZ2-CB 4.28Å; W535-A600 HydrophobicContact CZ3-CB 3.56Å; W535-V601 HydrophobicContact CE3-CG2 4.32Å; W535-V601 HydrophobicContact CZ3-CG2 3.84Å
536Y86.3Confident83.8Confident125 Ų12570.2 Ų70.249%0.4933%0.326SS..Hα-helixtrans-65-30.4178.3-73.1-57.9000113F468 S532 R540F468-Y536 PolarHBondContact O-OH 3.34Å; F468-Y536 VanDerWaalsContact O-OH 3.1Å; S532-Y536 WeakPolarHBondContact O-CD2 3.27Å; S532-Y536 PolarHBondContact O-N 2.92Å; Y536-R540 VanDerWaalsContact O-CB 3.29Å; Y536-R540 WeakPolarHBondContact O-CB 3.36Å; Y536-R540 PolarHBondContact O-N 2.87Å
537Q83.3Confident84.3Confident83 Ų8369.8 Ų69.839%0.38832%0.324SS..Hα-helixtrans-68.1-48.4173.7-170.3178.613.800111.4H533 Q534 W535 Q541H533-Q537 WeakPolarHBondContact O-CB 3.49Å; H533-Q537 PolarHBondContact O-N 3.02Å; H533-Q537 VanDerWaalsContact O-N 3.12Å; Q534-Q537 PolarHBondContact O-N 3.41Å; W535-Q537 VanDerWaalsContact C-N 3.27Å; W535-Q537 PolarHBondContact O-N 3.43Å; Q537-Q541 WeakPolarHBondContact O-CG 3.42Å; Q537-Q541 PolarHBondContact O-N 2.95Å; Q537-Q541 VanDerWaalsContact O-N 3.08Å
538Y91.1Very high84.6Confident1 Ų166.7 Ų66.70%0.00431%0.314CS..Hα-helixtrans-57.8-52.1175.3163.4-107.5000111.8Q534 W535 R540 Q541 A542 V585 Q588 A589 L592 V601Q534-Y538 PolarHBondContact O-N 3.4Å; W535-Y538 AromaticContact CE3-CD1 3.96Å; W535-Y538 HydrophobicContact CE3-CD1 3.96Å; W535-Y538 HydrophobicContact CE3-CE1 4.48Å; W535-Y538 HydrophobicContact CH2-CD1 4.39Å; W535-Y538 HydrophobicContact CH2-CE1 4.28Å; W535-Y538 AromaticContact CZ3-CD1 3.71Å; W535-Y538 HydrophobicContact CZ3-CD1 3.71Å; W535-Y538 AromaticContact CZ3-CE1 3.78Å; W535-Y538 HydrophobicContact CZ3-CE1 3.78Å; W535-Y538 PolarHBondContact O-N 3.07Å; Y538-R540 VanDerWaalsContact C-N 3.33Å; Y538-R540 PolarHBondContact O-N 3.47Å; Y538-Q541 PolarHBondContact O-N 2.87Å; Y538-A542 HydrophobicContact CE2-CB 4.42Å; Y538-A542 WeakPolarHBondContact O-CB 3.35Å; Y538-A542 PolarHBondContact O-N 2.8Å; Y538-V585 HydrophobicContact CD2-CG1 3.95Å; Y538-V585 HydrophobicContact CE2-CG1 3.58Å; Y538-Q588 HydrophobicContact CD2-CB 4.1Å; Y538-A589 HydrophobicContact CD2-CB 4.35Å; Y538-A589 HydrophobicContact CE2-CB 3.66Å; Y538-L592 HydrophobicContact CD1-CD1 3.86Å; Y538-L592 HydrophobicContact CG-CD1 3.67Å; Y538-V601 HydrophobicContact CD1-CG2 4.46Å; Y538-V601 HydrophobicContact CE1-CB 4.32Å; Y538-V601 HydrophobicContact CE1-CG1 4.15Å; Y538-V601 HydrophobicContact CE1-CG2 4.11Å; Y538-V601 PolarHBondContact OH-O 3.33Å; Y538-V601 VanDerWaalsContact OH-O 3.13Å
539K88.2Confident84.8Confident37 Ų3766.6 Ų66.616%0.16131%0.313CS..Hα-helixtrans-57.7-46.9-177.6-173.172.6-171.7-160.30111.2E465 W535 Q541 A542 D543 T604E465-K539 WeakPolarHBondContact OE1-CE 3.41Å; E465-K539 IonicContact OE1-NZ 2.65Å; E465-K539 PolarHBondContact OE1-NZ 3.04Å; E465-K539 IonicContact OE2-NZ 3.97Å; E465-K539 PolarHBondContact OE2-NZ 3.47Å; W535-K539 HydrophobicContact CH2-CD 4.43Å; W535-K539 HydrophobicContact CZ2-CD 4.1Å; W535-K539 WeakPolarHBondContact O-CB 3.3Å; W535-K539 PolarHBondContact O-N 2.71Å; K539-Q541 PolarHBondContact O-N 3.16Å; K539-A542 PolarHBondContact O-N 3.14Å; K539-D543 WeakPolarHBondContact O-CB 3.27Å; K539-D543 VanDerWaalsContact O-CG 3.31Å; K539-D543 PolarHBondContact O-N 2.93Å; K539-T604 PolarHBondContact NZ-OG1 3.31Å
540R84.7Confident85Confident183 Ų18362.9 Ų62.969%0.69129%0.294SS*.Hα-helixtrans-60.2-45.8177.5-171.8176.4-171.7161.44.9112.3Y536 Y538 A542 D543 D544Y536-R540 VanDerWaalsContact O-CB 3.29Å; Y536-R540 WeakPolarHBondContact O-CB 3.36Å; Y536-R540 PolarHBondContact O-N 2.87Å; Y538-R540 VanDerWaalsContact C-N 3.33Å; Y538-R540 PolarHBondContact O-N 3.47Å; R540-A542 VanDerWaalsContact C-N 3.35Å; R540-D543 PolarHBondContact O-N 2.96Å; R540-D544 VanDerWaalsContact O-CB 3.32Å; R540-D544 WeakPolarHBondContact O-CB 3.44Å; R540-D544 PolarHBondContact O-N 2.63Å
541Q87.3Confident85.1Confident67 Ų6759.9 Ų59.931%0.31328%0.282SS..Hα-helixtrans-66.2-36.6178-69.1-176.114.300112.4Q537 Y538 K539 L545 V585Q537-Q541 WeakPolarHBondContact O-CG 3.42Å; Q537-Q541 PolarHBondContact O-N 2.95Å; Q537-Q541 VanDerWaalsContact O-N 3.08Å; Y538-Q541 PolarHBondContact O-N 2.87Å; K539-Q541 PolarHBondContact O-N 3.16Å; Q541-L545 WeakPolarHBondContact O-CB 3.45Å; Q541-L545 PolarHBondContact O-N 3.03Å; Q541-V585 HydrophobicContact CB-CG2 3.67Å
542A87.9Confident84.9Confident0 Ų059.2 Ų59.20%028%0.279CS..Hα-helixtrans-66.3-46176.100000112.1Y538 K539 R540 L545 L546 V585 T604 L608Y538-A542 HydrophobicContact CE2-CB 4.42Å; Y538-A542 WeakPolarHBondContact O-CB 3.35Å; Y538-A542 PolarHBondContact O-N 2.8Å; K539-A542 PolarHBondContact O-N 3.14Å; R540-A542 VanDerWaalsContact C-N 3.35Å; A542-L545 PolarHBondContact O-N 2.89Å; A542-L546 PolarHBondContact O-N 2.99Å; A542-V585 HydrophobicContact CB-CG1 3.98Å; A542-T604 HydrophobicContact CB-CG2 3.79Å; A542-L608 HydrophobicContact CB-CD1 3.69Å; A542-L608 WeakPolarHBondContact O-CD1 3.39Å
543D87.5Confident84.9Confident73 Ų7359.2 Ų59.239%0.3927%0.274SS..Hα-helixtrans-66.5-40.9178.2-68.6-20000111.7K539 R540 L545 L546 K547K539-D543 WeakPolarHBondContact O-CB 3.27Å; K539-D543 VanDerWaalsContact O-CG 3.31Å; K539-D543 PolarHBondContact O-N 2.93Å; R540-D543 PolarHBondContact O-N 2.96Å; D543-L545 VanDerWaalsContact C-N 3.29Å; D543-L545 PolarHBondContact O-N 2.9Å; D543-L546 PolarHBondContact O-N 2.95Å; D543-K547 WeakPolarHBondContact O-CB 3.25Å; D543-K547 PolarHBondContact O-N 3.42Å
544D85.7Confident84.9Confident91 Ų9158.6 Ų58.649%0.48727%0.269SS..Hα-helixtrans-62.1-36172.7-79.2-29.9000111.6R540 C548R540-D544 VanDerWaalsContact O-CB 3.32Å; R540-D544 WeakPolarHBondContact O-CB 3.44Å; R540-D544 PolarHBondContact O-N 2.63Å; D544-C548 VanDerWaalsContact O-CB 3.29Å; D544-C548 WeakPolarHBondContact O-CB 3.36Å; D544-C548 PolarHBondContact O-N 3.33Å
545L86.4Confident84.5Confident4 Ų458.6 Ų58.62%0.02127%0.268CS..Hα-helixtrans-69-44.7174.4-126.186.1000112.5Q541 A542 D543 K547 C548 L549 E581 L582 L608Q541-L545 WeakPolarHBondContact O-CB 3.45Å; Q541-L545 PolarHBondContact O-N 3.03Å; A542-L545 PolarHBondContact O-N 2.89Å; D543-L545 VanDerWaalsContact C-N 3.29Å; D543-L545 PolarHBondContact O-N 2.9Å; L545-K547 VanDerWaalsContact C-N 3.33Å; L545-K547 PolarHBondContact O-N 3.17Å; L545-C548 PolarHBondContact O-N 3.33Å; L545-L549 WeakPolarHBondContact O-CG 3.38Å; L545-L549 PolarHBondContact O-N 3.33Å; L545-E581 HydrophobicContact CD1-CB 3.6Å; L545-L582 HydrophobicContact CD2-CB 3.72Å; L545-L582 HydrophobicContact CD2-CD1 4.14Å; L545-L608 HydrophobicContact CB-CD1 4.11Å; L545-L608 HydrophobicContact CD2-CD2 3.89Å
546L86.8Confident83.9Confident17 Ų1759.3 Ų59.39%0.08927%0.272CS..Hα-helixtrans-56.9-48176.2-87.5160.2000111A542 D543 C548 L549 D550 Q607 L608 R611A542-L546 PolarHBondContact O-N 2.99Å; D543-L546 PolarHBondContact O-N 2.95Å; L546-C548 PolarHBondContact O-N 3.46Å; L546-L549 WeakPolarHBondContact O-CB 3.43Å; L546-L549 PolarHBondContact O-N 3.34Å; L546-D550 PolarHBondContact O-N 3.5Å; L546-Q607 HydrophobicContact CD2-CG 4.2Å; L546-L608 HydrophobicContact CD1-CD1 4.34Å; L546-L608 HydrophobicContact CD2-CB 4.49Å; L546-L608 HydrophobicContact CD2-CG 4.46Å; L546-L608 HydrophobicContact CG-CB 4.35Å; L546-L608 HydrophobicContact CG-CD1 4.13Å; L546-L608 HydrophobicContact CG-CG 4.01Å; L546-R611 HydrophobicContact CD2-CB 4.09Å; L546-R611 HydrophobicContact CD2-CG 4.26Å
547K86.7Confident83.2Confident134 Ų13457.7 Ų57.758%0.58328%0.284SS*.Hα-helixtrans-62-42.7175.9-175.4177.7177.7-177.70112.4D543 L545 L549 D550 D551D543-K547 WeakPolarHBondContact O-CB 3.25Å; D543-K547 PolarHBondContact O-N 3.42Å; L545-K547 VanDerWaalsContact C-N 3.33Å; L545-K547 PolarHBondContact O-N 3.17Å; K547-L549 VanDerWaalsContact C-N 3.3Å; K547-L549 PolarHBondContact O-N 3.26Å; K547-D550 PolarHBondContact O-N 3.36Å; K547-D551 PolarHBondContact O-N 2.85Å
548C83.8Confident82.7Confident30 Ų3057.9 Ų57.920%0.20330%0.295CS..Hα-helixtrans-64-34.8176.7-171.60000112.5D544 L545 L546 D551 I552 K578D544-C548 VanDerWaalsContact O-CB 3.29Å; D544-C548 WeakPolarHBondContact O-CB 3.36Å; D544-C548 PolarHBondContact O-N 3.33Å; L545-C548 PolarHBondContact O-N 3.33Å; L546-C548 PolarHBondContact O-N 3.46Å; C548-D551 PolarHBondContact O-N 2.87Å; C548-I552 WeakPolarHBondContact O-CG1 3.49Å; C548-I552 PolarHBondContact O-N 3.01Å; C548-K578 HydrophobicContact CB-CD 4.34Å; C548-K578 VanDerWaalsContact SG-CD 3.56Å; C548-K578 WeakPolarHBondContact SG-CE 3.34Å
549L84.6Confident81.7Confident1 Ų159.1 Ų59.11%0.00530%0.301CS..Hα-helixtrans-64.5-49.6173.9-74.5169.8000110.5L545 L546 K547 D551 I552 E553 R611 W612 I615L545-L549 WeakPolarHBondContact O-CG 3.38Å; L545-L549 PolarHBondContact O-N 3.33Å; L546-L549 WeakPolarHBondContact O-CB 3.43Å; L546-L549 PolarHBondContact O-N 3.34Å; K547-L549 VanDerWaalsContact C-N 3.3Å; K547-L549 PolarHBondContact O-N 3.26Å; L549-D551 PolarHBondContact O-N 3.11Å; L549-I552 PolarHBondContact O-N 2.96Å; L549-I552 VanDerWaalsContact O-N 3.07Å; L549-E553 PolarHBondContact O-N 3.04Å; L549-R611 HydrophobicContact CB-CG 4.49Å; L549-R611 HydrophobicContact CD1-CB 4.32Å; L549-W612 HydrophobicContact CD1-CB 4.49Å; L549-W612 HydrophobicContact CD1-CE3 4.24Å; L549-W612 HydrophobicContact CD2-CE3 3.61Å; L549-W612 HydrophobicContact CD2-CZ3 3.87Å; L549-W612 HydrophobicContact CG-CE3 4.46Å; L549-I615 VanDerWaalsContact C-CD1 3.42Å; L549-I615 HydrophobicContact CB-CD1 3.67Å; L549-I615 HydrophobicContact CD2-CD1 3.92Å; L549-I615 HydrophobicContact CG-CD1 4.39Å; L549-I615 WeakPolarHBondContact O-CD1 3.48Å
550D82.1Confident80.1Confident55 Ų5560.8 Ų60.829%0.29432%0.316SS..Hα-helixtrans-59.7-33.2176.3-68.4-25.9000112.5L546 K547 E553 K554 R611L546-D550 PolarHBondContact O-N 3.5Å; K547-D550 PolarHBondContact O-N 3.36Å; D550-E553 PolarHBondContact O-N 3.04Å; D550-K554 WeakPolarHBondContact O-CG 3.44Å; D550-K554 PolarHBondContact O-N 2.91Å; D550-R611 IonicContact OD1-CZ 2.69Å; D550-R611 VanDerWaalsContact OD1-CZ 3.28Å; D550-R611 IonicContact OD1-NE 2.63Å; D550-R611 PolarHBondContact OD1-NE 2.9Å; D550-R611 IonicContact OD1-NH2 2.74Å; D550-R611 PolarHBondContact OD1-NH2 3.07Å
551D81.4Confident78.1Confident64 Ų6459 Ų5934%0.34232%0.316SS..Hα-helixtrans-73.3-34.4174.2-73.2-20.8000113.2K547 C548 L549 E553 K554 K555K547-D551 PolarHBondContact O-N 2.85Å; C548-D551 PolarHBondContact O-N 2.87Å; L549-D551 PolarHBondContact O-N 3.11Å; D551-E553 VanDerWaalsContact C-N 3.35Å; D551-K554 PolarHBondContact O-N 2.86Å; D551-K554 IonicContact OD1-NZ 3.67Å; D551-K554 PolarHBondContact OD1-NZ 3.37Å; D551-K555 WeakPolarHBondContact O-CG 3.16Å; D551-K555 PolarHBondContact O-N 3.01Å
552I79.9Confident76.4Confident3 Ų362 Ų622%0.01534%0.341CS..Hα-helixtrans-64.9-39.6170-72.7167.6000110.7C548 L549 K555 L556 I571 L575 K578 I615C548-I552 WeakPolarHBondContact O-CG1 3.49Å; C548-I552 PolarHBondContact O-N 3.01Å; L549-I552 PolarHBondContact O-N 2.96Å; L549-I552 VanDerWaalsContact O-N 3.07Å; I552-K555 PolarHBondContact O-N 3.32Å; I552-L556 HydrophobicContact CG2-CD1 4.02Å; I552-L556 WeakPolarHBondContact O-CB 3.4Å; I552-L556 PolarHBondContact O-N 3.24Å; I552-I571 HydrophobicContact CG2-CG2 4.15Å; I552-L575 HydrophobicContact CD1-CD1 4.49Å; I552-L575 HydrophobicContact CG2-CD1 4.17Å; I552-K578 HydrophobicContact CD1-CG 4.23Å; I552-I615 HydrophobicContact CG2-CG2 3.98Å
553E79Confident74.7Confident41 Ų4167.6 Ų67.619%0.19236%0.362CS..Hα-helixtrans-62.1-41.9174.3-177.4168.1-123.100111.8L549 D550 D551 L556 A557 R611 I615 K618L549-E553 PolarHBondContact O-N 3.04Å; D550-E553 PolarHBondContact O-N 3.04Å; D551-E553 VanDerWaalsContact C-N 3.35Å; E553-L556 WeakPolarHBondContact O-CB 3.39Å; E553-L556 PolarHBondContact O-N 2.89Å; E553-A557 PolarHBondContact O-N 3.3Å; E553-R611 IonicContact OE2-CZ 3.63Å; E553-R611 IonicContact OE2-NH1 3.97Å; E553-R611 IonicContact OE2-NH2 2.89Å; E553-R611 PolarHBondContact OE2-NH2 3.33Å; E553-I615 HydrophobicContact CB-CD1 3.95Å; E553-I615 HydrophobicContact CB-CG1 4.42Å; E553-K618 IonicContact OE1-NZ 3.27Å; E553-K618 PolarHBondContact OE1-NZ 2.89Å
554K79.2Confident73.5Confident129 Ų12967.1 Ų67.156%0.56136%0.36SS*.Hα-helixtrans-62.9-44172.4-68.6167-155.4156.60112.3D550 D551 L556 A557 S558D550-K554 WeakPolarHBondContact O-CG 3.44Å; D550-K554 PolarHBondContact O-N 2.91Å; D551-K554 PolarHBondContact O-N 2.86Å; D551-K554 IonicContact OD1-NZ 3.67Å; D551-K554 PolarHBondContact OD1-NZ 3.37Å; K554-L556 VanDerWaalsContact C-N 3.31Å; K554-L556 PolarHBondContact O-N 3.13Å; K554-A557 PolarHBondContact O-N 2.87Å; K554-S558 WeakPolarHBondContact O-CB 3.29Å; K554-S558 PolarHBondContact O-N 3.17Å; K554-S558 VanDerWaalsContact O-N 3.08Å; K554-S558 PolarHBondContact O-OG 3.29Å
555K76.3Confident72.7Confident88 Ų8867.6 Ų67.638%0.38336%0.359SS..Hα-helixtrans-57.2-46.3175.2-74.7-178.7-173.3-177.60110.8D551 I552 S558 I571 E574D551-K555 WeakPolarHBondContact O-CG 3.16Å; D551-K555 PolarHBondContact O-N 3.01Å; I552-K555 PolarHBondContact O-N 3.32Å; K555-S558 PolarHBondContact O-N 2.9Å; K555-S558 VanDerWaalsContact O-N 3.13Å; K555-S558 PolarHBondContact O-OG 2.95Å; K555-I571 HydrophobicContact CB-CD1 4.31Å; K555-E574 IonicContact NZ-OE1 3.27Å; K555-E574 PolarHBondContact NZ-OE1 3.1Å; K555-E574 IonicContact NZ-OE2 3.33Å; K555-E574 PolarHBondContact NZ-OE2 3.36Å
556L73.4Confident71.9Confident20 Ų2077.3 Ų77.311%0.10540%0.395CS..Hα-helixtrans-59.8-44.7176.4-85.7158.4000113I552 E553 K554 S558 L559 I571 I615 F619 F622I552-L556 HydrophobicContact CG2-CD1 4.02Å; I552-L556 WeakPolarHBondContact O-CB 3.4Å; I552-L556 PolarHBondContact O-N 3.24Å; E553-L556 WeakPolarHBondContact O-CB 3.39Å; E553-L556 PolarHBondContact O-N 2.89Å; K554-L556 VanDerWaalsContact C-N 3.31Å; K554-L556 PolarHBondContact O-N 3.13Å; L556-S558 PolarHBondContact O-N 3.37Å; L556-L559 HydrophobicContact CD2-CD1 4.17Å; L556-L559 PolarHBondContact O-N 2.97Å; L556-I571 HydrophobicContact CG-CG2 4.33Å; L556-I615 HydrophobicContact CD1-CG2 4.28Å; L556-F619 HydrophobicContact CD1-CD2 3.89Å; L556-F619 HydrophobicContact CD2-CD2 3.63Å; L556-F619 HydrophobicContact CD2-CE2 3.85Å; L556-F619 HydrophobicContact CG-CD2 4.25Å; L556-F622 HydrophobicContact CD2-CD2 4.22Å; L556-F622 HydrophobicContact CD2-CE2 3.75Å; L556-F622 HydrophobicContact CD2-CZ 3.93Å
557A73Confident71.1Confident90 Ų9081 Ų8174%0.74441%0.411SS*.Hα-helixtrans-66.4-19.1176.500000113.7E553 K554E553-A557 PolarHBondContact O-N 3.3Å; K554-A557 PolarHBondContact O-N 2.87Å
558S72.4Confident70.5Confident87 Ų8775.4 Ų75.461%0.60839%0.387SS*.THydrogen-bonded Turntrans-94-0.5-178.475.70000115.3K554 K555 L556 P560K554-S558 WeakPolarHBondContact O-CB 3.29Å; K554-S558 PolarHBondContact O-N 3.17Å; K554-S558 VanDerWaalsContact O-N 3.08Å; K554-S558 PolarHBondContact O-OG 3.29Å; K555-S558 PolarHBondContact O-N 2.9Å; K555-S558 VanDerWaalsContact O-N 3.13Å; K555-S558 PolarHBondContact O-OG 2.95Å; L556-S558 PolarHBondContact O-N 3.37Å; S558-P560 WeakPolarHBondContact O-CD 3.36Å
559L70Confident70Confident27 Ų2779.2 Ų79.214%0.14140%0.4CS..  trans-68.8120.7-179.5-73171.1000110.9L556 K567 I568 I571 F622L556-L559 HydrophobicContact CD2-CD1 4.17Å; L556-L559 PolarHBondContact O-N 2.97Å; L559-K567 HydrophobicContact CD2-CB 3.71Å; L559-K567 HydrophobicContact CD2-CD 4.12Å; L559-I568 HydrophobicContact CD1-CG1 4.1Å; L559-I571 HydrophobicContact CD1-CD1 4.06Å; L559-I571 HydrophobicContact CD2-CD1 4.2Å; L559-I571 HydrophobicContact CG-CD1 4.34Å; L559-F622 HydrophobicContact CD1-CE1 4.17Å
560P54.3Low69.5Low73 Ų7385 Ų8547%0.47443%0.427SS..  trans-71.1155.6178.930.1-35.2000111.8S558 P562 R563S558-P560 WeakPolarHBondContact O-CD 3.36Å; P560-P562 CarbonylContact O-C 3.06Å; P560-R563 WeakPolarHBondContact O-CA 3.36Å
561E41.8Very low69.4Low145 Ų14582.9 Ų82.968%0.67842%0.415SS*.SBendtrans-114.5126.2-177.4-161.9134.3-115.900109R563E561-R563 IonicContact OE1-CZ 2.73Å; E561-R563 IonicContact OE1-NE 2.74Å; E561-R563 PolarHBondContact OE1-NE 3.26Å; E561-R563 IonicContact OE1-NH2 2.65Å; E561-R563 PolarHBondContact OE1-NH2 2.76Å
562P51.3Low69.3Low131 Ų13182.3 Ų82.385%0.85141%0.412SS*.SBendcis-74.8151.64.332.4-35.8000114P560P560-P562 CarbonylContact O-C 3.06Å
563R53.8Low69.2Low117 Ų11791.6 Ų91.644%0.44245%0.447SS..  trans-87132.9-153.2-55.4178.4-173.5-167.9-1114.2P560 E561 E565 I568P560-R563 WeakPolarHBondContact O-CA 3.36Å; E561-R563 IonicContact OE1-CZ 2.73Å; E561-R563 IonicContact OE1-NE 2.74Å; E561-R563 PolarHBondContact OE1-NE 3.26Å; E561-R563 IonicContact OE1-NH2 2.65Å; E561-R563 PolarHBondContact OE1-NH2 2.76Å; R563-E565 PolarHBondContact O-N 3.36Å; R563-I568 HydrophobicContact CB-CD1 4.1Å
564D62.1Low69.2Low63 Ų6392.7 Ų92.734%0.33745%0.452SS..  trans-76.2105.3178.6-178.6-5.5000112R566 K567 I568D564-R566 PolarHBondContact O-N 3.36Å; D564-R566 VanDerWaalsContact O-N 3.16Å; D564-R566 WeakPolarHBondContact OD1-CB 3.44Å; D564-R566 PolarHBondContact OD1-N 3.21Å; D564-K567 HydrophobicContact CB-CB 4.42Å; D564-K567 HydrophobicContact CB-CD 4.34Å; D564-K567 HydrophobicContact CB-CG 4.39Å; D564-K567 PolarHBondContact O-N 3.13Å; D564-K567 WeakPolarHBondContact OD2-CG 3.25Å; D564-I568 PolarHBondContact O-N 3.36Å
565E67.4Low69.4Low100 Ų10086.7 Ų86.747%0.46743%0.426SS..Hα-helixtrans-52.8-33.9177.2-82.5-154.9168.300114R563 I568 K569R563-E565 PolarHBondContact O-N 3.36Å; E565-I568 PolarHBondContact O-N 3Å; E565-K569 WeakPolarHBondContact O-CG 3.37Å; E565-K569 PolarHBondContact O-N 2.72Å; E565-K569 IonicContact OE2-NZ 3.73Å; E565-K569 PolarHBondContact OE2-NZ 2.95Å
566R70.2Confident69.5Low209 Ų20987 Ų8779%0.78943%0.429SS*.Hα-helixtrans-68.2-43.5-175.5-68.3-175.4174.2-171.1-0.7110.3D564 I568 K569 E570D564-R566 PolarHBondContact O-N 3.36Å; D564-R566 VanDerWaalsContact O-N 3.16Å; D564-R566 WeakPolarHBondContact OD1-CB 3.44Å; D564-R566 PolarHBondContact OD1-N 3.21Å; R566-I568 VanDerWaalsContact C-N 3.34Å; R566-I568 PolarHBondContact O-N 3.45Å; R566-K569 PolarHBondContact O-N 2.96Å; R566-E570 WeakPolarHBondContact O-CB 3.46Å; R566-E570 PolarHBondContact O-N 2.83Å
567K70.6Confident69.7Low95 Ų9592.4 Ų92.441%0.41345%0.452SS..Hα-helixtrans-65.1-36.7175.1-69.5-177.6-177.7-175.40112.3L559 D564 E570 I571L559-K567 HydrophobicContact CD2-CB 3.71Å; L559-K567 HydrophobicContact CD2-CD 4.12Å; D564-K567 HydrophobicContact CB-CB 4.42Å; D564-K567 HydrophobicContact CB-CD 4.34Å; D564-K567 HydrophobicContact CB-CG 4.39Å; D564-K567 PolarHBondContact O-N 3.13Å; D564-K567 WeakPolarHBondContact OD2-CG 3.25Å; K567-E570 PolarHBondContact O-N 2.81Å; K567-I571 VanDerWaalsContact O-CG1 3.31Å; K567-I571 WeakPolarHBondContact O-CG1 3Å; K567-I571 PolarHBondContact O-N 3.43Å
568I74.9Confident70.2Confident15 Ų1590.3 Ų90.38%0.07743%0.426CS..Hα-helixtrans-63.6-44.7174.3-65.6169.3000110.4L559 R563 D564 E565 R566 E570 I571 D572 F619 F622L559-I568 HydrophobicContact CD1-CG1 4.1Å; R563-I568 HydrophobicContact CB-CD1 4.1Å; D564-I568 PolarHBondContact O-N 3.36Å; E565-I568 PolarHBondContact O-N 3Å; R566-I568 VanDerWaalsContact C-N 3.34Å; R566-I568 PolarHBondContact O-N 3.45Å; I568-E570 VanDerWaalsContact C-N 3.3Å; I568-E570 PolarHBondContact O-N 2.91Å; I568-I571 PolarHBondContact O-N 2.89Å; I568-D572 WeakPolarHBondContact O-CB 3.32Å; I568-D572 PolarHBondContact O-N 3.48Å; I568-F619 HydrophobicContact CG2-CZ 4.15Å; I568-F622 HydrophobicContact CD1-CD1 3.97Å; I568-F622 HydrophobicContact CG1-CD1 4.35Å; I568-F622 HydrophobicContact CG2-CB 4.32Å
569K72.8Confident70.7Confident111 Ų11189.5 Ų89.548%0.48341%0.411SS..Hα-helixtrans-65.9-29.8175.4-74.3169178.9155.40113E565 R566 R573E565-K569 WeakPolarHBondContact O-CG 3.37Å; E565-K569 PolarHBondContact O-N 2.72Å; E565-K569 IonicContact OE2-NZ 3.73Å; E565-K569 PolarHBondContact OE2-NZ 2.95Å; R566-K569 PolarHBondContact O-N 2.96Å; K569-R573 WeakPolarHBondContact O-CG 3.39Å; K569-R573 PolarHBondContact O-N 3.44Å
570E73.9Confident71.1Confident122 Ų12294.6 Ų94.657%0.5744%0.435SS*.Hα-helixtrans-71-46173.9-172.7169.4-159.600111.8R566 K567 I568 D572 R573 E574R566-E570 WeakPolarHBondContact O-CB 3.46Å; R566-E570 PolarHBondContact O-N 2.83Å; K567-E570 PolarHBondContact O-N 2.81Å; I568-E570 VanDerWaalsContact C-N 3.3Å; I568-E570 PolarHBondContact O-N 2.91Å; E570-D572 VanDerWaalsContact C-N 3.32Å; E570-D572 PolarHBondContact O-N 3.45Å; E570-R573 WeakPolarHBondContact O-CB 3.26Å; E570-R573 PolarHBondContact O-N 3.32Å; E570-E574 PolarHBondContact O-N 3.35Å
571I78.9Confident72.4Confident10 Ų1094 Ų945%0.05143%0.425CS..Hα-helixtrans-64.1-37.1174.6-62.9163.7000110.9I552 K555 L556 L559 K567 I568 R573 E574 L575 F619I552-I571 HydrophobicContact CG2-CG2 4.15Å; K555-I571 HydrophobicContact CB-CD1 4.31Å; L556-I571 HydrophobicContact CG-CG2 4.33Å; L559-I571 HydrophobicContact CD1-CD1 4.06Å; L559-I571 HydrophobicContact CD2-CD1 4.2Å; L559-I571 HydrophobicContact CG-CD1 4.34Å; K567-I571 VanDerWaalsContact O-CG1 3.31Å; K567-I571 WeakPolarHBondContact O-CG1 3Å; K567-I571 PolarHBondContact O-N 3.43Å; I568-I571 PolarHBondContact O-N 2.89Å; I571-R573 VanDerWaalsContact C-N 3.3Å; I571-R573 PolarHBondContact O-N 3.38Å; I571-E574 PolarHBondContact O-N 3.19Å; I571-L575 VanDerWaalsContact O-CB 3.32Å; I571-L575 WeakPolarHBondContact O-CB 3.1Å; I571-L575 PolarHBondContact O-N 2.83Å; I571-F619 HydrophobicContact CB-CE2 3.93Å; I571-F619 HydrophobicContact CB-CZ 4.3Å; I571-F619 HydrophobicContact CG2-CD2 4.06Å; I571-F619 HydrophobicContact CG2-CE2 3.43Å; I571-F619 VanDerWaalsContact CG2-CE2 3.43Å; I571-F619 HydrophobicContact CG2-CZ 4.13Å
572D79.9Confident74.4Confident52 Ų5287.5 Ų87.528%0.27840%0.395SS..Hα-helixtrans-61.2-38174.8-169.758.2000112.1I568 E570 Q576 F619 R623I568-D572 WeakPolarHBondContact O-CB 3.32Å; I568-D572 PolarHBondContact O-N 3.48Å; E570-D572 VanDerWaalsContact C-N 3.32Å; E570-D572 PolarHBondContact O-N 3.45Å; D572-Q576 WeakPolarHBondContact O-CB 3.41Å; D572-Q576 PolarHBondContact O-N 3.07Å; D572-F619 HydrophobicContact CB-CE1 3.72Å; D572-F619 HydrophobicContact CB-CZ 3.8Å; D572-F619 VanDerWaalsContact OD1-CE1 3.28Å; D572-F619 WeakPolarHBondContact OD1-CE1 3.46Å; D572-R623 IonicContact OD1-CZ 3.69Å; D572-R623 IonicContact OD1-NE 2.79Å; D572-R623 PolarHBondContact OD1-NE 3.41Å; D572-R623 IonicContact OD1-NH2 2.79Å; D572-R623 PolarHBondContact OD1-NH2 3.06Å
573R78.2Confident76Confident198 Ų19884.1 Ų84.175%0.74737%0.37SS*.Hα-helixtrans-70.5-41.8173.7-74.1174.4175.6-176.9-2112.8K569 E570 I571 L575 Q576 K577K569-R573 WeakPolarHBondContact O-CG 3.39Å; K569-R573 PolarHBondContact O-N 3.44Å; E570-R573 WeakPolarHBondContact O-CB 3.26Å; E570-R573 PolarHBondContact O-N 3.32Å; I571-R573 VanDerWaalsContact C-N 3.3Å; I571-R573 PolarHBondContact O-N 3.38Å; R573-L575 VanDerWaalsContact C-N 3.35Å; R573-Q576 PolarHBondContact O-N 2.94Å; R573-K577 WeakPolarHBondContact O-CB 3.49Å; R573-K577 PolarHBondContact O-N 3.35Å
574E79.1Confident77.3Confident65 Ų6580.1 Ų80.130%0.30436%0.362SS..Hα-helixtrans-60.8-45.2173.2-75.1-168.4157.300111.1K555 E570 I571 K577 K578K555-E574 IonicContact NZ-OE1 3.27Å; K555-E574 PolarHBondContact NZ-OE1 3.1Å; K555-E574 IonicContact NZ-OE2 3.33Å; K555-E574 PolarHBondContact NZ-OE2 3.36Å; E570-E574 PolarHBondContact O-N 3.35Å; I571-E574 PolarHBondContact O-N 3.19Å; E574-K577 PolarHBondContact O-N 2.83Å; E574-K578 WeakPolarHBondContact O-CB 3.43Å; E574-K578 VanDerWaalsContact O-CG 3.28Å; E574-K578 WeakPolarHBondContact O-CG 3.2Å; E574-K578 PolarHBondContact O-N 3.26Å
575L82.3Confident78.4Confident3 Ų377.4 Ų77.42%0.01635%0.348CS..Hα-helixtrans-60.6-47.1176.3-158.983000110.5I552 I571 R573 K577 K578 K579 W612 I615 F619I552-L575 HydrophobicContact CD1-CD1 4.49Å; I552-L575 HydrophobicContact CG2-CD1 4.17Å; I571-L575 VanDerWaalsContact O-CB 3.32Å; I571-L575 WeakPolarHBondContact O-CB 3.1Å; I571-L575 PolarHBondContact O-N 2.83Å; R573-L575 VanDerWaalsContact C-N 3.35Å; L575-K577 PolarHBondContact O-N 3.13Å; L575-K578 PolarHBondContact O-N 3.01Å; L575-K579 PolarHBondContact O-N 2.89Å; L575-K579 VanDerWaalsContact O-N 3.09Å; L575-W612 HydrophobicContact CD1-CH2 4.43Å; L575-W612 HydrophobicContact CG-CH2 4.22Å; L575-W612 HydrophobicContact CG-CZ2 4.35Å; L575-W612 WeakPolarHBondContact O-CH2 3.47Å; L575-I615 HydrophobicContact CD1-CG2 3.82Å; L575-F619 HydrophobicContact CD2-CB 4.21Å; L575-F619 HydrophobicContact CD2-CD1 4.04Å; L575-F619 HydrophobicContact CD2-CG 4.13Å
576Q78.8Confident79.2Confident95 Ų9575.3 Ų75.344%0.44434%0.335SS..Hα-helixtrans-62.7-40.7179.4-16668.211.400112.2D572 R573 K579D572-Q576 WeakPolarHBondContact O-CB 3.41Å; D572-Q576 PolarHBondContact O-N 3.07Å; R573-Q576 PolarHBondContact O-N 2.94Å; Q576-K579 VanDerWaalsContact O-CB 3.31Å; Q576-K579 WeakPolarHBondContact O-CB 3.31Å; Q576-K579 PolarHBondContact O-N 3.04Å
577K78.6Confident79.9Confident133 Ų13372.6 Ų72.658%0.57833%0.325SS*.Hα-helixtrans-62.7-44.1173.9-178.5178.7175.2-178.80112R573 E574 L575 K579 E580 E581R573-K577 WeakPolarHBondContact O-CB 3.49Å; R573-K577 PolarHBondContact O-N 3.35Å; E574-K577 PolarHBondContact O-N 2.83Å; L575-K577 PolarHBondContact O-N 3.13Å; K577-K579 PolarHBondContact O-N 3.47Å; K577-E580 PolarHBondContact O-N 3.28Å; K577-E580 VanDerWaalsContact O-N 3.11Å; K577-E581 PolarHBondContact O-N 3.19Å
578K82.1Confident80.5Confident45 Ų4570.7 Ų70.720%0.19632%0.318CS..Hα-helixtrans-66.9-18.9179.7-68.1-72.8160.4-176.80113.3C548 I552 E574 L575 E581 L582 W612C548-K578 HydrophobicContact CB-CD 4.34Å; C548-K578 VanDerWaalsContact SG-CD 3.56Å; C548-K578 WeakPolarHBondContact SG-CE 3.34Å; I552-K578 HydrophobicContact CD1-CG 4.23Å; E574-K578 WeakPolarHBondContact O-CB 3.43Å; E574-K578 VanDerWaalsContact O-CG 3.28Å; E574-K578 WeakPolarHBondContact O-CG 3.2Å; E574-K578 PolarHBondContact O-N 3.26Å; L575-K578 PolarHBondContact O-N 3.01Å; K578-E581 WeakPolarHBondContact CD-OE2 3.25Å; K578-E581 WeakPolarHBondContact CE-OE1 3.41Å; K578-E581 WeakPolarHBondContact CE-OE2 3.42Å; K578-E581 VanDerWaalsContact NZ-CD 3.28Å; K578-E581 IonicContact NZ-OE1 2.95Å; K578-E581 PolarHBondContact NZ-OE1 3.22Å; K578-E581 VanDerWaalsContact NZ-OE1 3.13Å; K578-E581 IonicContact NZ-OE2 2.74Å; K578-E581 PolarHBondContact NZ-OE2 2.89Å; K578-L582 WeakPolarHBondContact O-CB 3.45Å; K578-L582 PolarHBondContact O-N 2.88Å; K578-W612 HydrophobicContact CB-CH2 4.23Å; K578-W612 HydrophobicContact CB-CZ3 3.96Å
579K83Confident80.9Confident70 Ų7070 Ų7030%0.30431%0.314SS..Hα-helixtrans-68.6-32.6172.1-165.3167.8-175.2155.80112.7L575 Q576 K577 N583 W612 E616L575-K579 PolarHBondContact O-N 2.89Å; L575-K579 VanDerWaalsContact O-N 3.09Å; Q576-K579 VanDerWaalsContact O-CB 3.31Å; Q576-K579 WeakPolarHBondContact O-CB 3.31Å; Q576-K579 PolarHBondContact O-N 3.04Å; K577-K579 PolarHBondContact O-N 3.47Å; K579-N583 VanDerWaalsContact O-CG 3.26Å; K579-N583 PolarHBondContact O-N 3.04Å; K579-N583 VanDerWaalsContact O-N 3.14Å; K579-N583 PolarHBondContact O-ND2 3.22Å; K579-W612 HydrophobicContact CB-CH2 3.72Å; K579-W612 HydrophobicContact CB-CZ2 3.74Å; K579-W612 HydrophobicContact CD-CZ2 4.16Å; K579-W612 HydrophobicContact CG-CH2 4.35Å; K579-W612 HydrophobicContact CG-CZ2 3.91Å; K579-E616 IonicContact NZ-OE1 2.73Å; K579-E616 PolarHBondContact NZ-OE1 2.96Å; K579-E616 VanDerWaalsContact NZ-OE1 3.16Å
580E79.9Confident81.4Confident135 Ų13568.4 Ų68.463%0.63131%0.309SS*.Hα-helixtrans-72.5-42.2175.4-64.1177.7177.100111.1K577 N583 A584K577-E580 PolarHBondContact O-N 3.28Å; K577-E580 VanDerWaalsContact O-N 3.11Å; E580-N583 PolarHBondContact O-N 3.45Å; E580-A584 PolarHBondContact O-N 3.47Å
581E81Confident81.8Confident60 Ų6063.7 Ų63.728%0.2829%0.293SS..Hα-helixtrans-61.9-41.6173.3-61.5177.6-150.900111.3L545 K577 K578 N583 A584 V585L545-E581 HydrophobicContact CD1-CB 3.6Å; K577-E581 PolarHBondContact O-N 3.19Å; K578-E581 WeakPolarHBondContact CD-OE2 3.25Å; K578-E581 WeakPolarHBondContact CE-OE1 3.41Å; K578-E581 WeakPolarHBondContact CE-OE2 3.42Å; K578-E581 VanDerWaalsContact NZ-CD 3.28Å; K578-E581 IonicContact NZ-OE1 2.95Å; K578-E581 PolarHBondContact NZ-OE1 3.22Å; K578-E581 VanDerWaalsContact NZ-OE1 3.13Å; K578-E581 IonicContact NZ-OE2 2.74Å; K578-E581 PolarHBondContact NZ-OE2 2.89Å; E581-N583 VanDerWaalsContact C-N 3.33Å; E581-N583 PolarHBondContact O-N 3.4Å; E581-A584 WeakPolarHBondContact O-CB 3.39Å; E581-A584 PolarHBondContact O-N 3.49Å; E581-A584 VanDerWaalsContact O-N 3.12Å; E581-V585 WeakPolarHBondContact O-CG2 3.38Å; E581-V585 PolarHBondContact O-N 3.11Å
582L83.6Confident82Confident9 Ų963.3 Ų63.35%0.04729%0.291CS..Hα-helixtrans-55.8-44.5171.2172.764.5000112.5L545 K578 A584 V585 R586 L608 W612L545-L582 HydrophobicContact CD2-CB 3.72Å; L545-L582 HydrophobicContact CD2-CD1 4.14Å; K578-L582 WeakPolarHBondContact O-CB 3.45Å; K578-L582 PolarHBondContact O-N 2.88Å; L582-A584 VanDerWaalsContact C-N 3.31Å; L582-A584 PolarHBondContact O-N 3.1Å; L582-V585 PolarHBondContact O-N 3.4Å; L582-R586 WeakPolarHBondContact O-CG 3.37Å; L582-R586 PolarHBondContact O-N 3.09Å; L582-L608 HydrophobicContact CD1-CD2 3.2Å; L582-W612 HydrophobicContact CD2-CB 4.3Å; L582-W612 HydrophobicContact CD2-CD2 3.52Å; L582-W612 HydrophobicContact CD2-CE3 3.75Å; L582-W612 HydrophobicContact CD2-CG 3.71Å; L582-W612 HydrophobicContact CD2-CZ3 4.41Å
583N84.3Confident82.1Confident60 Ų6063.3 Ų63.332%0.32130%0.295SS..Hα-helixtrans-68.7-30.6178.5-71-26000112K579 E580 E581 R587K579-N583 VanDerWaalsContact O-CG 3.26Å; K579-N583 PolarHBondContact O-N 3.04Å; K579-N583 VanDerWaalsContact O-N 3.14Å; K579-N583 PolarHBondContact O-ND2 3.22Å; E580-N583 PolarHBondContact O-N 3.45Å; E581-N583 VanDerWaalsContact C-N 3.33Å; E581-N583 PolarHBondContact O-N 3.4Å; N583-R587 PolarHBondContact O-N 3.34Å; N583-R587 VanDerWaalsContact O-N 3.16Å
584A81.1Confident82.1Confident33 Ų3361.6 Ų61.627%0.27330%0.296SS..Hα-helixtrans-69-46.517300000112E580 E581 L582 R586 R587 Q588E580-A584 PolarHBondContact O-N 3.47Å; E581-A584 WeakPolarHBondContact O-CB 3.39Å; E581-A584 PolarHBondContact O-N 3.49Å; E581-A584 VanDerWaalsContact O-N 3.12Å; L582-A584 VanDerWaalsContact C-N 3.31Å; L582-A584 PolarHBondContact O-N 3.1Å; A584-R586 VanDerWaalsContact C-N 3.27Å; A584-R586 PolarHBondContact O-N 3.4Å; A584-R587 PolarHBondContact O-N 2.89Å; A584-R587 VanDerWaalsContact O-N 3.12Å; A584-Q588 PolarHBondContact O-N 2.95Å
585V85.3Confident82Confident5 Ų561.8 Ų61.83%0.0330%0.299CS..Hα-helixtrans-59.5-37.9174.2172.60000111.2Y538 Q541 A542 E581 L582 Q588 A589 L608Y538-V585 HydrophobicContact CD2-CG1 3.95Å; Y538-V585 HydrophobicContact CE2-CG1 3.58Å; Q541-V585 HydrophobicContact CB-CG2 3.67Å; A542-V585 HydrophobicContact CB-CG1 3.98Å; E581-V585 WeakPolarHBondContact O-CG2 3.38Å; E581-V585 PolarHBondContact O-N 3.11Å; L582-V585 PolarHBondContact O-N 3.4Å; V585-Q588 PolarHBondContact O-N 3.4Å; V585-A589 WeakPolarHBondContact O-CB 3.36Å; V585-A589 PolarHBondContact O-N 2.92Å; V585-L608 HydrophobicContact CG1-CD1 4.49Å
586R84.3Confident81.9Confident56 Ų5662.3 Ų62.321%0.21131%0.305CS..Hα-helixtrans-64.9-37.6173.7-80.1-174.7169-154.5-2.4114.1L582 A584 A589 E590 S609L582-R586 WeakPolarHBondContact O-CG 3.37Å; L582-R586 PolarHBondContact O-N 3.09Å; A584-R586 VanDerWaalsContact C-N 3.27Å; A584-R586 PolarHBondContact O-N 3.4Å; R586-A589 WeakPolarHBondContact O-CB 3.48Å; R586-A589 PolarHBondContact O-N 3.14Å; R586-E590 WeakPolarHBondContact O-CG 3.44Å; R586-E590 PolarHBondContact O-N 3.49Å; R586-S609 PolarHBondContact NH2-OG 3.14Å
587R84.5Confident82.1Confident152 Ų15257.8 Ų57.857%0.57428%0.283SS*.Hα-helixtrans-70-36.2175.1-72.5-175.7-122.6101.1-1.1112.4N583 A584 A589 E590 G591N583-R587 PolarHBondContact O-N 3.34Å; N583-R587 VanDerWaalsContact O-N 3.16Å; A584-R587 PolarHBondContact O-N 2.89Å; A584-R587 VanDerWaalsContact O-N 3.12Å; R587-A589 VanDerWaalsContact C-N 3.35Å; R587-E590 PolarHBondContact O-N 2.7Å; R587-G591 PolarHBondContact O-N 2.71Å
588Q83.1Confident82.3Confident55 Ų5552.9 Ų52.926%0.25727%0.268SS..Hα-helixtrans-65.9-38.7171.5-72.4-168.5-26.600112Y538 A584 V585 L592Y538-Q588 HydrophobicContact CD2-CB 4.1Å; A584-Q588 PolarHBondContact O-N 2.95Å; V585-Q588 PolarHBondContact O-N 3.4Å; Q588-L592 WeakPolarHBondContact O-CB 3.13Å; Q588-L592 WeakPolarHBondContact O-CG 3.39Å; Q588-L592 PolarHBondContact O-N 3.03Å
589A84.2Confident82.1Confident1 Ų155.2 Ų55.21%0.00828%0.281CS..Hα-helixtrans-58.4-48.9170.900000112Y538 V585 R586 R587 L592 S593 V601 Q605Y538-A589 HydrophobicContact CD2-CB 4.35Å; Y538-A589 HydrophobicContact CE2-CB 3.66Å; V585-A589 WeakPolarHBondContact O-CB 3.36Å; V585-A589 PolarHBondContact O-N 2.92Å; R586-A589 WeakPolarHBondContact O-CB 3.48Å; R586-A589 PolarHBondContact O-N 3.14Å; R587-A589 VanDerWaalsContact C-N 3.35Å; A589-L592 PolarHBondContact O-N 3.42Å; A589-S593 VanDerWaalsContact O-CB 3.32Å; A589-S593 WeakPolarHBondContact O-CB 3.48Å; A589-S593 PolarHBondContact O-N 3.45Å; A589-V601 VanDerWaalsContact CA-CG1 3.5Å; A589-V601 HydrophobicContact CB-CG1 3.25Å; A589-Q605 HydrophobicContact CB-CG 4.4Å
590E83.3Confident82Confident77 Ų7752 Ų5236%0.3627%0.267SS..Hα-helixtrans-57.9-50.6177.9-75.2160.8-169.300111.5R586 R587 L592 S593 E594R586-E590 WeakPolarHBondContact O-CG 3.44Å; R586-E590 PolarHBondContact O-N 3.49Å; R587-E590 PolarHBondContact O-N 2.7Å; E590-L592 PolarHBondContact O-N 3.38Å; E590-S593 WeakPolarHBondContact O-CA 3.45Å; E590-S593 WeakPolarHBondContact O-CB 3.45Å; E590-S593 PolarHBondContact O-N 3.03Å; E590-E594 PolarHBondContact O-N 3.46Å
591G82.4Confident82.3Confident24 Ų2445.6 Ų45.625%0.24724%0.237CC..Hα-helixtrans-63.2-42.5178.100000114.1R587 S593 E594 D595R587-G591 PolarHBondContact O-N 2.71Å; G591-S593 PolarHBondContact O-N 3.03Å; G591-E594 PolarHBondContact O-N 2.96Å; G591-D595 PolarHBondContact O-N 3.13Å
592L82.9Confident82.5Confident2 Ų247.3 Ų47.31%0.0125%0.245CC..Hα-helixtrans-63.6-28172.7-77.3167.1000112.5I531 Q534 W535 Y538 Q588 A589 E590 G596 A597 V601I531-L592 HydrophobicContact CD1-CD2 4.11Å; Q534-L592 HydrophobicContact CB-CD2 3.8Å; Q534-L592 HydrophobicContact CB-CG 4.49Å; W535-L592 HydrophobicContact CB-CD2 4.39Å; W535-L592 HydrophobicContact CE3-CD1 4.25Å; Y538-L592 HydrophobicContact CD1-CD1 3.86Å; Y538-L592 HydrophobicContact CG-CD1 3.67Å; Q588-L592 WeakPolarHBondContact O-CB 3.13Å; Q588-L592 WeakPolarHBondContact O-CG 3.39Å; Q588-L592 PolarHBondContact O-N 3.03Å; A589-L592 PolarHBondContact O-N 3.42Å; E590-L592 PolarHBondContact O-N 3.38Å; L592-G596 PolarHBondContact O-N 2.95Å; L592-A597 WeakPolarHBondContact O-CA 3.48Å; L592-A597 VanDerWaalsContact O-CB 3.32Å; L592-A597 WeakPolarHBondContact O-CB 3.49Å; L592-A597 PolarHBondContact O-N 3.07Å; L592-V601 HydrophobicContact CB-CG2 3.62Å; L592-V601 HydrophobicContact CD1-CG2 4.31Å
593S81.8Confident82.5Confident52 Ų5250.4 Ų50.436%0.36427%0.266SS..Iπ-helixtrans-69.7-41.8174.7-157.90000111.3A589 E590 G591 G596 A598A589-S593 VanDerWaalsContact O-CB 3.32Å; A589-S593 WeakPolarHBondContact O-CB 3.48Å; A589-S593 PolarHBondContact O-N 3.45Å; E590-S593 WeakPolarHBondContact O-CA 3.45Å; E590-S593 WeakPolarHBondContact O-CB 3.45Å; E590-S593 PolarHBondContact O-N 3.03Å; G591-S593 PolarHBondContact O-N 3.03Å; S593-G596 PolarHBondContact O-N 3.42Å; S593-A598 WeakPolarHBondContact OG-CA 3.49Å; S593-A598 WeakPolarHBondContact OG-CB 3.43Å
594E77.5Confident82.4Confident161 Ų16147.8 Ų47.875%0.75225%0.252SS*.Iπ-helixtrans-65.3-41.5174.8-68.9172.417800112E590 G591 G596E590-E594 PolarHBondContact O-N 3.46Å; G591-E594 PolarHBondContact O-N 2.96Å; E594-G596 PolarHBondContact O-N 3.07Å
595D78.6Confident82.5Confident70 Ų7048.6 Ų48.637%0.37425%0.25SC..Iπ-helixtrans-68.1-1.1174.4-75.6-21.8000113.8I531 G591I531-D595 HydrophobicContact CD1-CB 3.98Å; I531-D595 HydrophobicContact CG2-CB 4.01Å; G591-D595 PolarHBondContact O-N 3.13Å
596G79.3Confident82.4Confident13 Ų1353.4 Ų53.413%0.13427%0.274CS..Iπ-helixtrans99.310.2172.500000115.8L463 L592 S593 E594L463-G596 PolarHBondContact N-O 2.67Å; L592-G596 PolarHBondContact O-N 2.95Å; S593-G596 PolarHBondContact O-N 3.42Å; E594-G596 PolarHBondContact O-N 3.07Å
597A83.3Confident82.5Confident0 Ų056.2 Ų56.20%029%0.29CS..Iπ-helixtrans-99.222.9175.700000114.6L463 F468 I531 L592 M599 A600 V601L463-A597 HydrophobicContact CB-CB 4.09Å; L463-A597 HydrophobicContact CD1-CB 4.23Å; F468-A597 HydrophobicContact CE2-CB 4.35Å; F468-A597 HydrophobicContact CZ-CB 4.22Å; I531-A597 HydrophobicContact CD1-CB 3.95Å; L592-A597 WeakPolarHBondContact O-CA 3.48Å; L592-A597 VanDerWaalsContact O-CB 3.32Å; L592-A597 WeakPolarHBondContact O-CB 3.49Å; L592-A597 PolarHBondContact O-N 3.07Å; A597-M599 VanDerWaalsContact C-N 3.29Å; A597-M599 PolarHBondContact O-N 3.33Å; A597-A600 HydrophobicContact CB-CB 4.33Å; A597-A600 WeakPolarHBondContact O-CB 3.23Å; A597-A600 PolarHBondContact O-N 3.22Å; A597-V601 WeakPolarHBondContact O-CG2 3.43Å; A597-V601 PolarHBondContact O-N 2.97Å; A597-V601 VanDerWaalsContact O-N 3.08Å
598A82.2Confident82.5Confident31 Ų3149.1 Ų49.126%0.25626%0.264SS..Hα-helixtrans-46.3-49.2178.400000113.2S593 A600 V601 E602S593-A598 WeakPolarHBondContact OG-CA 3.49Å; S593-A598 WeakPolarHBondContact OG-CB 3.43Å; A598-A600 VanDerWaalsContact C-N 3.28Å; A598-A600 PolarHBondContact O-N 3.43Å; A598-V601 PolarHBondContact O-N 2.87Å; A598-E602 WeakPolarHBondContact O-CB 3.4Å; A598-E602 PolarHBondContact O-N 2.67Å
599M79.5Confident82.5Confident94 Ų9447.5 Ų47.546%0.46326%0.258SS..Hα-helixtrans-66-25.5-178.9-68.5-99.273.900113.8N462 A597 P603N462-M599 HydrophobicContact CB-CG 4.44Å; A597-M599 VanDerWaalsContact C-N 3.29Å; A597-M599 PolarHBondContact O-N 3.33Å; M599-P603 WeakPolarHBondContact O-CD 3.12Å
600A80.6Confident82.5Confident1 Ų153.5 Ų53.51%0.00828%0.284CS..Hα-helixtrans-78.8-40.7174.200000111.9L463 E465 F468 W535 A597 A598L463-A600 PolarHBondContact O-N 3.06Å; E465-A600 HydrophobicContact CB-CB 4.26Å; E465-A600 VanDerWaalsContact N-CB 3.29Å; F468-A600 HydrophobicContact CE2-CB 4.29Å; W535-A600 HydrophobicContact CE3-CB 4.16Å; W535-A600 HydrophobicContact CH2-CB 3.65Å; W535-A600 VanDerWaalsContact CH2-O 3.31Å; W535-A600 WeakPolarHBondContact CH2-O 3.4Å; W535-A600 HydrophobicContact CZ2-CB 4.28Å; W535-A600 HydrophobicContact CZ3-CB 3.56Å; A597-A600 HydrophobicContact CB-CB 4.33Å; A597-A600 WeakPolarHBondContact O-CB 3.23Å; A597-A600 PolarHBondContact O-N 3.22Å; A598-A600 VanDerWaalsContact C-N 3.28Å; A598-A600 PolarHBondContact O-N 3.43Å
601V86.5Confident82.6Confident1 Ų152.9 Ų52.91%0.00628%0.278CS..Hα-helixtrans-72.8-46.1-173.3169.20000112.5W535 Y538 A589 L592 A597 A598 T604 Q605W535-V601 HydrophobicContact CE3-CG2 4.32Å; W535-V601 HydrophobicContact CZ3-CG2 3.84Å; Y538-V601 HydrophobicContact CD1-CG2 4.46Å; Y538-V601 HydrophobicContact CE1-CB 4.32Å; Y538-V601 HydrophobicContact CE1-CG1 4.15Å; Y538-V601 HydrophobicContact CE1-CG2 4.11Å; Y538-V601 PolarHBondContact OH-O 3.33Å; Y538-V601 VanDerWaalsContact OH-O 3.13Å; A589-V601 VanDerWaalsContact CA-CG1 3.5Å; A589-V601 HydrophobicContact CB-CG1 3.25Å; L592-V601 HydrophobicContact CB-CG2 3.62Å; L592-V601 HydrophobicContact CD1-CG2 4.31Å; A597-V601 WeakPolarHBondContact O-CG2 3.43Å; A597-V601 PolarHBondContact O-N 2.97Å; A597-V601 VanDerWaalsContact O-N 3.08Å; A598-V601 PolarHBondContact O-N 2.87Å; V601-T604 PolarHBondContact O-N 3.11Å; V601-Q605 PolarHBondContact O-N 3.07Å; V601-Q605 VanDerWaalsContact O-N 3.14Å
602E83.3Confident82.8Confident96 Ų9652.4 Ų52.445%0.44927%0.269SS..Hα-helixtrans-57.3-44.1-165.8-169.1178.6-152.300114.6A598 T604 Q605 I606A598-E602 WeakPolarHBondContact O-CB 3.4Å; A598-E602 PolarHBondContact O-N 2.67Å; E602-T604 PolarHBondContact O-N 3.11Å; E602-Q605 PolarHBondContact O-N 3.38Å; E602-I606 HydrophobicContact CG-CD1 3.87Å; E602-I606 HydrophobicContact CG-CG1 4.44Å; E602-I606 VanDerWaalsContact O-CG1 3.32Å; E602-I606 WeakPolarHBondContact O-CG1 3.31Å; E602-I606 PolarHBondContact O-N 3.02Å
603P84.9Confident82.8Confident74 Ų7456 Ų5648%0.48128%0.283SS..Hα-helixtrans-61.6-42.7-179.4-22.534.2000112.8M599 I606 Q607M599-P603 WeakPolarHBondContact O-CD 3.12Å; P603-I606 PolarHBondContact O-N 2.6Å; P603-Q607 PolarHBondContact O-N 3.43Å
604T82.6Confident82.9Confident5 Ų556.5 Ų56.53%0.03128%0.279CS..Hα-helixtrans-67.4-41.9179-50.20000110K539 A542 V601 E602 I606 Q607 L608K539-T604 PolarHBondContact NZ-OG1 3.31Å; A542-T604 HydrophobicContact CB-CG2 3.79Å; V601-T604 PolarHBondContact O-N 3.11Å; E602-T604 PolarHBondContact O-N 3.11Å; T604-I606 PolarHBondContact O-N 2.84Å; T604-Q607 PolarHBondContact O-N 2.87Å; T604-L608 WeakPolarHBondContact O-CB 3.38Å; T604-L608 PolarHBondContact O-N 3.04Å
605Q83.5Confident83Confident50 Ų5048.9 Ų48.923%0.23424%0.244CC..Hα-helixtrans-63.7-38.2178.1-161.4-17422.200112.4A589 V601 E602 S609A589-Q605 HydrophobicContact CB-CG 4.4Å; V601-Q605 PolarHBondContact O-N 3.07Å; V601-Q605 VanDerWaalsContact O-N 3.14Å; E602-Q605 PolarHBondContact O-N 3.38Å; Q605-S609 WeakPolarHBondContact O-CB 3.45Å; Q605-S609 PolarHBondContact O-N 3.31Å; Q605-S609 PolarHBondContact O-OG 3.38Å
606I82.8Confident83Confident106 Ų10648.2 Ų48.254%0.54424%0.239SC..Hα-helixtrans-65.7-49.4174.1-70.5167.9000110.9E602 P603 T604 L608 S609 K610E602-I606 HydrophobicContact CG-CD1 3.87Å; E602-I606 HydrophobicContact CG-CG1 4.44Å; E602-I606 VanDerWaalsContact O-CG1 3.32Å; E602-I606 WeakPolarHBondContact O-CG1 3.31Å; E602-I606 PolarHBondContact O-N 3.02Å; P603-I606 PolarHBondContact O-N 2.6Å; T604-I606 PolarHBondContact O-N 2.84Å; I606-L608 VanDerWaalsContact C-N 3.35Å; I606-L608 PolarHBondContact O-N 3.45Å; I606-S609 PolarHBondContact O-N 3.28Å; I606-K610 WeakPolarHBondContact O-CB 3.42Å; I606-K610 PolarHBondContact O-N 3.3Å
607Q85.7Confident82.8Confident115 Ų11550.9 Ų50.954%0.53726%0.255SS..Hα-helixtrans-58.8-47.3179.4-179.1-178.7-6.500111.4L546 P603 T604 K610 R611L546-Q607 HydrophobicContact CD2-CG 4.2Å; P603-Q607 PolarHBondContact O-N 3.43Å; T604-Q607 PolarHBondContact O-N 2.87Å; Q607-K610 WeakPolarHBondContact O-CB 3.14Å; Q607-K610 PolarHBondContact O-N 2.86Å; Q607-R611 PolarHBondContact O-N 3.32Å
608L84.5Confident82.2Confident4 Ų456.1 Ų56.12%0.02128%0.278CS..Hα-helixtrans-68.9-38.4-176.9-158.5158.7000111.1A542 L545 L546 L582 V585 T604 I606 K610 R611 W612A542-L608 HydrophobicContact CB-CD1 3.69Å; A542-L608 WeakPolarHBondContact O-CD1 3.39Å; L545-L608 HydrophobicContact CB-CD1 4.11Å; L545-L608 HydrophobicContact CD2-CD2 3.89Å; L546-L608 HydrophobicContact CD1-CD1 4.34Å; L546-L608 HydrophobicContact CD2-CB 4.49Å; L546-L608 HydrophobicContact CD2-CG 4.46Å; L546-L608 HydrophobicContact CG-CB 4.35Å; L546-L608 HydrophobicContact CG-CD1 4.13Å; L546-L608 HydrophobicContact CG-CG 4.01Å; L582-L608 HydrophobicContact CD1-CD2 3.2Å; V585-L608 HydrophobicContact CG1-CD1 4.49Å; T604-L608 WeakPolarHBondContact O-CB 3.38Å; T604-L608 PolarHBondContact O-N 3.04Å; I606-L608 VanDerWaalsContact C-N 3.35Å; I606-L608 PolarHBondContact O-N 3.45Å; L608-K610 PolarHBondContact O-N 3.42Å; L608-R611 PolarHBondContact O-N 3.05Å; L608-W612 WeakPolarHBondContact O-CB 3.43Å; L608-W612 PolarHBondContact O-N 3.41Å
609S83.1Confident81.9Confident21 Ų2154.7 Ų54.715%0.14727%0.266CS..Hα-helixtrans-66.1-34.1171.3-60.30000113.3R586 Q605 I606 R613R586-S609 PolarHBondContact NH2-OG 3.14Å; Q605-S609 WeakPolarHBondContact O-CB 3.45Å; Q605-S609 PolarHBondContact O-N 3.31Å; Q605-S609 PolarHBondContact O-OG 3.38Å; I606-S609 PolarHBondContact O-N 3.28Å; S609-R613 WeakPolarHBondContact O-CB 3.34Å; S609-R613 PolarHBondContact O-N 2.9Å
610K83.8Confident81.3Confident127 Ų12752 Ų5255%0.55226%0.258SS*.Hα-helixtrans-66.4-50.8173.2-176.3-171.3177.4-166.50110.6I606 Q607 L608 W612 R613 E614I606-K610 WeakPolarHBondContact O-CB 3.42Å; I606-K610 PolarHBondContact O-N 3.3Å; Q607-K610 WeakPolarHBondContact O-CB 3.14Å; Q607-K610 PolarHBondContact O-N 2.86Å; L608-K610 PolarHBondContact O-N 3.42Å; K610-W612 PolarHBondContact O-N 3.39Å; K610-R613 PolarHBondContact O-N 3.17Å; K610-R613 VanDerWaalsContact O-N 3.14Å; K610-E614 WeakPolarHBondContact CE-OE1 3.47Å; K610-E614 IonicContact NZ-OE1 2.7Å; K610-E614 WeakPolarHBondContact O-CG 3.47Å; K610-E614 PolarHBondContact O-N 3.36Å
611R84.8Confident80.5Confident63 Ų6358.4 Ų58.424%0.23829%0.288CS..Hα-helixtrans-63.5-39.6-177.7-153.672.1176123.57.1112.3L546 L549 D550 E553 Q607 L608 E614 I615L546-R611 HydrophobicContact CD2-CB 4.09Å; L546-R611 HydrophobicContact CD2-CG 4.26Å; L549-R611 HydrophobicContact CB-CG 4.49Å; L549-R611 HydrophobicContact CD1-CB 4.32Å; D550-R611 IonicContact OD1-CZ 2.69Å; D550-R611 VanDerWaalsContact OD1-CZ 3.28Å; D550-R611 IonicContact OD1-NE 2.63Å; D550-R611 PolarHBondContact OD1-NE 2.9Å; D550-R611 IonicContact OD1-NH2 2.74Å; D550-R611 PolarHBondContact OD1-NH2 3.07Å; E553-R611 IonicContact OE2-CZ 3.63Å; E553-R611 IonicContact OE2-NH1 3.97Å; E553-R611 IonicContact OE2-NH2 2.89Å; E553-R611 PolarHBondContact OE2-NH2 3.33Å; Q607-R611 PolarHBondContact O-N 3.32Å; L608-R611 PolarHBondContact O-N 3.05Å; R611-E614 IonicContact CZ-OE2 2.79Å; R611-E614 IonicContact NH1-OE2 3.31Å; R611-E614 PolarHBondContact NH1-OE2 3.46Å; R611-E614 PolarHBondContact O-N 3.08Å; R611-I615 PolarHBondContact O-N 3.31Å
612W88.2Confident79.4Confident14 Ų1459.7 Ų59.75%0.05329%0.294CS..Hα-helixtrans-56.2-50.8170.8-176.2-86.9000111.9L549 L575 K578 K579 L582 L608 K610 E614 I615 E616L549-W612 HydrophobicContact CD1-CB 4.49Å; L549-W612 HydrophobicContact CD1-CE3 4.24Å; L549-W612 HydrophobicContact CD2-CE3 3.61Å; L549-W612 HydrophobicContact CD2-CZ3 3.87Å; L549-W612 HydrophobicContact CG-CE3 4.46Å; L575-W612 HydrophobicContact CD1-CH2 4.43Å; L575-W612 HydrophobicContact CG-CH2 4.22Å; L575-W612 HydrophobicContact CG-CZ2 4.35Å; L575-W612 WeakPolarHBondContact O-CH2 3.47Å; K578-W612 HydrophobicContact CB-CH2 4.23Å; K578-W612 HydrophobicContact CB-CZ3 3.96Å; K579-W612 HydrophobicContact CB-CH2 3.72Å; K579-W612 HydrophobicContact CB-CZ2 3.74Å; K579-W612 HydrophobicContact CD-CZ2 4.16Å; K579-W612 HydrophobicContact CG-CH2 4.35Å; K579-W612 HydrophobicContact CG-CZ2 3.91Å; L582-W612 HydrophobicContact CD2-CB 4.3Å; L582-W612 HydrophobicContact CD2-CD2 3.52Å; L582-W612 HydrophobicContact CD2-CE3 3.75Å; L582-W612 HydrophobicContact CD2-CG 3.71Å; L582-W612 HydrophobicContact CD2-CZ3 4.41Å; L608-W612 WeakPolarHBondContact O-CB 3.43Å; L608-W612 PolarHBondContact O-N 3.41Å; K610-W612 PolarHBondContact O-N 3.39Å; W612-E614 VanDerWaalsContact C-N 3.29Å; W612-E614 PolarHBondContact O-N 3.44Å; W612-I615 PolarHBondContact O-N 3.09Å; W612-E616 VanDerWaalsContact NE1-CD 3.33Å; W612-E616 PolarHBondContact NE1-OE2 3.17Å; W612-E616 WeakPolarHBondContact O-CB 3.47Å; W612-E616 PolarHBondContact O-N 2.93Å
613R82.7Confident78.4Confident77 Ų7759.3 Ų59.329%0.29129%0.288SS..Hα-helixtrans-62.5-34.4-178.4-161.6-170.3-72.7106.9-13.2112.2S609 K610 S617 D750S609-R613 WeakPolarHBondContact O-CB 3.34Å; S609-R613 PolarHBondContact O-N 2.9Å; K610-R613 PolarHBondContact O-N 3.17Å; K610-R613 VanDerWaalsContact O-N 3.14Å; R613-S617 VanDerWaalsContact O-CB 3.24Å; R613-S617 WeakPolarHBondContact O-CB 3.48Å; R613-S617 PolarHBondContact O-N 3.48Å; R613-D750 IonicContact CZ-OD1 3.54Å; R613-D750 IonicContact CZ-OD2 3.73Å; R613-D750 IonicContact NE-OD1 2.76Å; R613-D750 IonicContact NH2-OD1 3.54Å; R613-D750 PolarHBondContact NH2-OD1 2.97Å; R613-D750 IonicContact NH2-OD2 2.75Å; R613-D750 PolarHBondContact NH2-OD2 2.72Å
614E83.4Confident76.6Confident63 Ų6365.9 Ų65.929%0.29430%0.303SS..Hα-helixtrans-64.3-46.7174.9-72.3169.6-171.900112K610 R611 W612 S617 K618K610-E614 WeakPolarHBondContact CE-OE1 3.47Å; K610-E614 IonicContact NZ-OE1 2.7Å; K610-E614 WeakPolarHBondContact O-CG 3.47Å; K610-E614 PolarHBondContact O-N 3.36Å; R611-E614 IonicContact CZ-OE2 2.79Å; R611-E614 IonicContact NH1-OE2 3.31Å; R611-E614 PolarHBondContact NH1-OE2 3.46Å; R611-E614 PolarHBondContact O-N 3.08Å; W612-E614 VanDerWaalsContact C-N 3.29Å; W612-E614 PolarHBondContact O-N 3.44Å; E614-S617 PolarHBondContact O-N 2.91Å; E614-K618 WeakPolarHBondContact O-CG 3.48Å; E614-K618 PolarHBondContact O-N 3.47Å
615I79.4Confident75.1Confident2 Ų271.8 Ų71.81%0.0133%0.334CS..Hα-helixtrans-72.1-42.5178.6-63.7-172.9000111.6L549 I552 E553 L556 L575 R611 W612 S617 K618 F619L549-I615 VanDerWaalsContact C-CD1 3.42Å; L549-I615 HydrophobicContact CB-CD1 3.67Å; L549-I615 HydrophobicContact CD2-CD1 3.92Å; L549-I615 HydrophobicContact CG-CD1 4.39Å; L549-I615 WeakPolarHBondContact O-CD1 3.48Å; I552-I615 HydrophobicContact CG2-CG2 3.98Å; E553-I615 HydrophobicContact CB-CD1 3.95Å; E553-I615 HydrophobicContact CB-CG1 4.42Å; L556-I615 HydrophobicContact CD1-CG2 4.28Å; L575-I615 HydrophobicContact CD1-CG2 3.82Å; R611-I615 PolarHBondContact O-N 3.31Å; W612-I615 PolarHBondContact O-N 3.09Å; I615-S617 PolarHBondContact O-N 3Å; I615-K618 PolarHBondContact O-N 3.37Å; I615-K618 VanDerWaalsContact O-N 3.15Å; I615-F619 WeakPolarHBondContact O-CB 3.29Å; I615-F619 PolarHBondContact O-N 2.74Å
616E79.3Confident73.1Confident56 Ų5672.9 Ų72.926%0.26234%0.342SS..Hα-helixtrans-62.3-32.2176.9-163.3169.3-144.400110.8K579 W612 A620K579-E616 IonicContact NZ-OE1 2.73Å; K579-E616 PolarHBondContact NZ-OE1 2.96Å; K579-E616 VanDerWaalsContact NZ-OE1 3.16Å; W612-E616 VanDerWaalsContact NE1-CD 3.33Å; W612-E616 PolarHBondContact NE1-OE2 3.17Å; W612-E616 WeakPolarHBondContact O-CB 3.47Å; W612-E616 PolarHBondContact O-N 2.93Å; E616-A620 VanDerWaalsContact O-CB 3.26Å; E616-A620 WeakPolarHBondContact O-CB 3.4Å; E616-A620 PolarHBondContact O-N 3.15Å
617S74.4Confident70.8Confident68 Ų6876.5 Ų76.548%0.47635%0.353SS..Hα-helixtrans-66.7-49170.5-170.50000112.7R613 E614 I615 F619 A620R613-S617 VanDerWaalsContact O-CB 3.24Å; R613-S617 WeakPolarHBondContact O-CB 3.48Å; R613-S617 PolarHBondContact O-N 3.48Å; E614-S617 PolarHBondContact O-N 2.91Å; I615-S617 PolarHBondContact O-N 3Å; S617-F619 VanDerWaalsContact C-N 3.28Å; S617-F619 PolarHBondContact O-N 3.25Å; S617-A620 PolarHBondContact O-N 3.33Å
618K71.4Confident68.1Low110 Ų11075.2 Ų75.248%0.47836%0.363SS..Hα-helixtrans-59.5-39.7175.1-72.4179.7179.5-175.80111.7E553 E614 I615 F622E553-K618 IonicContact OE1-NZ 3.27Å; E553-K618 PolarHBondContact OE1-NZ 2.89Å; E614-K618 WeakPolarHBondContact O-CG 3.48Å; E614-K618 PolarHBondContact O-N 3.47Å; I615-K618 PolarHBondContact O-N 3.37Å; I615-K618 VanDerWaalsContact O-N 3.15Å; K618-F622 VanDerWaalsContact O-CD2 3.3Å; K618-F622 WeakPolarHBondContact O-CD2 3.43Å; K618-F622 WeakPolarHBondContact O-CE2 3.49Å
619F76.5Confident65.4Low2 Ų283.5 Ų83.51%0.00940%0.401CS..Hα-helixtrans-74.9-30.2179.1-153.7-97.9000113.4L556 I568 I571 D572 L575 I615 S617 Q621 F622 R623L556-F619 HydrophobicContact CD1-CD2 3.89Å; L556-F619 HydrophobicContact CD2-CD2 3.63Å; L556-F619 HydrophobicContact CD2-CE2 3.85Å; L556-F619 HydrophobicContact CG-CD2 4.25Å; I568-F619 HydrophobicContact CG2-CZ 4.15Å; I571-F619 HydrophobicContact CB-CE2 3.93Å; I571-F619 HydrophobicContact CB-CZ 4.3Å; I571-F619 HydrophobicContact CG2-CD2 4.06Å; I571-F619 HydrophobicContact CG2-CE2 3.43Å; I571-F619 VanDerWaalsContact CG2-CE2 3.43Å; I571-F619 HydrophobicContact CG2-CZ 4.13Å; D572-F619 HydrophobicContact CB-CE1 3.72Å; D572-F619 HydrophobicContact CB-CZ 3.8Å; D572-F619 VanDerWaalsContact OD1-CE1 3.28Å; D572-F619 WeakPolarHBondContact OD1-CE1 3.46Å; L575-F619 HydrophobicContact CD2-CB 4.21Å; L575-F619 HydrophobicContact CD2-CD1 4.04Å; L575-F619 HydrophobicContact CD2-CG 4.13Å; I615-F619 WeakPolarHBondContact O-CB 3.29Å; I615-F619 PolarHBondContact O-N 2.74Å; S617-F619 VanDerWaalsContact C-N 3.28Å; S617-F619 PolarHBondContact O-N 3.25Å; F619-Q621 PolarHBondContact O-N 2.89Å; F619-F622 WeakPolarHBondContact O-CB 3.39Å; F619-F622 PolarHBondContact O-N 3.11Å; F619-R623 HydrophobicContact CD1-CG 4.05Å; F619-R623 HydrophobicContact CE1-CG 4.1Å; F619-R623 PolarHBondContact O-N 3.25Å; F619-R623 VanDerWaalsContact O-N 3.1Å
620A65.6Low62.7Low37 Ų3790 Ų9031%0.30643%0.433SS..Hα-helixtrans-60.3-28.6177.400000113.1E616 S617 F622 R623 R624E616-A620 VanDerWaalsContact O-CB 3.26Å; E616-A620 WeakPolarHBondContact O-CB 3.4Å; E616-A620 PolarHBondContact O-N 3.15Å; S617-A620 PolarHBondContact O-N 3.33Å; A620-F622 VanDerWaalsContact C-N 3.3Å; A620-F622 PolarHBondContact O-N 3.39Å; A620-R623 PolarHBondContact O-N 2.9Å; A620-R624 WeakPolarHBondContact O-CG 3.49Å; A620-R624 PolarHBondContact O-N 3.37Å; A620-R624 VanDerWaalsContact O-N 3.1Å
621Q63.7Low59.9Low136 Ų13691.5 Ų91.564%0.63644%0.441SS*.Hα-helixtrans-62.4-36.4171.9-64.1-174.3-3.200112.1F619F619-Q621 PolarHBondContact O-N 2.89Å
622F63.2Low57.2Low27 Ų2793.9 Ų93.912%0.11846%0.463CS..Hα-helixtrans-75.1-40.2176.1-61.2-100.2000111.8L556 L559 I568 K618 F619 A620 R624 L625L556-F622 HydrophobicContact CD2-CD2 4.22Å; L556-F622 HydrophobicContact CD2-CE2 3.75Å; L556-F622 HydrophobicContact CD2-CZ 3.93Å; L559-F622 HydrophobicContact CD1-CE1 4.17Å; I568-F622 HydrophobicContact CD1-CD1 3.97Å; I568-F622 HydrophobicContact CG1-CD1 4.35Å; I568-F622 HydrophobicContact CG2-CB 4.32Å; K618-F622 VanDerWaalsContact O-CD2 3.3Å; K618-F622 WeakPolarHBondContact O-CD2 3.43Å; K618-F622 WeakPolarHBondContact O-CE2 3.49Å; F619-F622 WeakPolarHBondContact O-CB 3.39Å; F619-F622 PolarHBondContact O-N 3.11Å; A620-F622 VanDerWaalsContact C-N 3.3Å; A620-F622 PolarHBondContact O-N 3.39Å; F622-R624 VanDerWaalsContact C-N 3.27Å; F622-R624 PolarHBondContact O-N 2.82Å; F622-L625 PolarHBondContact O-N 3.45Å
623R62.6Low54.1Low89 Ų8999.9 Ų99.934%0.33650%0.501SS..Hα-helixtrans-60.8-33.6175.3-75.6-173.7174.7172.3-3.1112.8D572 F619 A620 L625D572-R623 IonicContact OD1-CZ 3.69Å; D572-R623 IonicContact OD1-NE 2.79Å; D572-R623 PolarHBondContact OD1-NE 3.41Å; D572-R623 IonicContact OD1-NH2 2.79Å; D572-R623 PolarHBondContact OD1-NH2 3.06Å; F619-R623 HydrophobicContact CD1-CG 4.05Å; F619-R623 HydrophobicContact CE1-CG 4.1Å; F619-R623 PolarHBondContact O-N 3.25Å; F619-R623 VanDerWaalsContact O-N 3.1Å; A620-R623 PolarHBondContact O-N 2.9Å; R623-L625 PolarHBondContact O-N 2.92Å
624R48.5Very low51.4Low212 Ų212105.9 Ų105.980%0.852%0.524SS*.Hα-helixtrans-67.9-28177.7-77177.2178.9-176.1-1.7114.2A620 F622A620-R624 WeakPolarHBondContact O-CG 3.49Å; A620-R624 PolarHBondContact O-N 3.37Å; A620-R624 VanDerWaalsContact O-N 3.1Å; F622-R624 VanDerWaalsContact C-N 3.27Å; F622-R624 PolarHBondContact O-N 2.82Å
625L49.9Very low48.5Very low129 Ų129109.3 Ų109.368%0.67554%0.54SS*.Hα-helixtrans-79.3-28.4-178.1-81.6160.6000113.7F622 R623F622-L625 PolarHBondContact O-N 3.45Å; R623-L625 PolarHBondContact O-N 2.92Å
626N41.2Very low46.1Very low73 Ų73118.2 Ų118.239%0.3958%0.581SS.*SBendtrans-96.8-1.2-170.8-78.25.8000115.7
627F35.2Very low43.6Very low181 Ų181122.7 Ų122.779%0.79461%0.613SS**  trans-104.32.2-175.3-98.1-82.3000115.5Q629F627-Q629 VanDerWaalsContact C-N 3.3Å; F627-Q629 PolarHBondContact O-N 3.01Å; F627-Q629 VanDerWaalsContact O-N 3.12Å
628A28Very low41.4Very low88 Ų88127.5 Ų127.573%0.72763%0.63SS**  trans-87.351.3-177.800000113.7
629Q28.6Very low39.1Very low178 Ų178131.5 Ų131.583%0.83265%0.652SS**  trans-159.396.9171.2-111.8171.138.200112.2F627F627-Q629 VanDerWaalsContact C-N 3.3Å; F627-Q629 PolarHBondContact O-N 3.01Å; F627-Q629 VanDerWaalsContact O-N 3.12Å
630I27.3Very low36.7Very low158 Ų158135.4 Ų135.481%0.8168%0.676SS**  trans-177.9125.8147.5-96.5152.1000109.4
631H25.1Very low34.9Very low158 Ų158142.3 Ų142.373%0.73170%0.704SS**  trans26.2118.3162.2-64.8-69.3000121
632T26.3Very low33.1Very low113 Ų113141.4 Ų141.469%0.69371%0.708SS**  76.3116.251.172.70000117.3
633V24.7Very low31.2Very low141 Ų141148.8 Ų148.886%0.85574%0.743SS**  trans124.2100.6140.5-178.10000114.3
634R25.4Very low29.2Very low202 Ų202151.4 Ų151.476%0.76276%0.764SS**  -167128.7117.2-168.6160.2-174.8142.421.8111.9
635E23.4Very low28.1Very low136 Ų136148.2 Ų148.264%0.63676%0.76SS**  trans27.2112.3154.7-62.2148.1-159.700118
636E28.1Very low27.2Very low189 Ų189147.7 Ų147.788%0.88376%0.764SS**  44.495.873.3-69.7-168.6161.200115.2
637T26Very low26.6Very low150 Ų150151.4 Ų151.492%0.9278%0.783SS**  trans-132.5123.8142.7-68.50000108.1
638M29.5Very low26.4Very low168 Ų168152.2 Ų152.283%0.82879%0.789SS**  trans-100.1127.6-166.4162.7-174.1161.800109.8V640M638-V640 HydrophobicContact CE-CG2 4.34Å
639M23.6Very low26.5Very low194 Ų194154.1 Ų154.196%0.95679%0.786SS**  trans-144128.8154.6-153.3167.7-175.300112
640V25.9Very low27.2Very low85 Ų85150.2 Ų150.252%0.51578%0.778SS.*  trans-94.9131.8-170.5171.60000110.3M638M638-V640 HydrophobicContact CE-CG2 4.34Å
641M26Very low28.4Very low182 Ų182147.2 Ų147.290%0.89776%0.758SS**  trans-142.795.1151.1-75.7-80.981.200108.8
642T27Very low30.2Very low116 Ų116143.2 Ų143.271%0.71274%0.744SS**  trans-83.9120.3158.736.60000108.9
643E22.8Very low32.3Very low183 Ų183138.5 Ų138.586%0.85572%0.715SS**  trans168.5144.6164.5-100165.6-147.500106.4
644D21.8Very low34.6Very low143 Ų143135.2 Ų135.277%0.76570%0.698SS**  cis-161.4160.1-23.6-147.2-15.3000108.4
645M23.9Very low37Very low145 Ų145129 Ų12971%0.71468%0.684SS**  trans55.7130.3162.4-79.9-73.8-69.100122L647M645-L647 PolarHBondContact O-N 2.95Å
646P32.5Very low39.9Very low119 Ų119122.7 Ų122.777%0.77365%0.654SS**  trans-79.1109.617332.8-32.5000111.7
647L26.9Very low42.4Very low151 Ų151116.4 Ų116.479%0.79163%0.626SS**  trans-98.5121.7165.2-84.5154.5000109.4M645 I649M645-L647 PolarHBondContact O-N 2.95Å; L647-I649 VanDerWaalsContact C-N 3.27Å; L647-I649 PolarHBondContact O-N 3.36Å
648E31.1Very low45Very low197 Ų197113.3 Ų113.392%0.92161%0.607SS**  trans-63.885.4172.3-68.3178.6122.300110.1S650E648-S650 PolarHBondContact O-N 3.4Å
649I30Very low47.7Very low129 Ų129108.6 Ų108.666%0.66258%0.583SS**  trans-68.2103.5167.7-59.8175.8000106.4L647 Y651L647-I649 VanDerWaalsContact C-N 3.27Å; L647-I649 PolarHBondContact O-N 3.36Å; I649-Y651 WeakPolarHBondContact O-CD2 3.46Å; I649-Y651 PolarHBondContact O-N 2.82Å
650S43.6Very low50.7Low96 Ų9699.4 Ų99.467%0.67154%0.538SS*.  trans-61.3102.5174.848.30000109.1E648 V652E648-S650 PolarHBondContact O-N 3.4Å; S650-V652 PolarHBondContact O-N 3.5Å
651Y52.6Low53.6Low95 Ų9598.2 Ų98.237%0.37353%0.53SS..  trans-60.9102.3179.7-74.6-84.2000109.5I649 K714 A717 S721I649-Y651 WeakPolarHBondContact O-CD2 3.46Å; I649-Y651 PolarHBondContact O-N 2.82Å; Y651-K714 HydrophobicContact CE1-CD 4.34Å; Y651-K714 HydrophobicContact CE1-CG 4.38Å; Y651-A717 HydrophobicContact CD2-CB 3.73Å; Y651-A717 HydrophobicContact CE2-CB 4.07Å; Y651-A717 HydrophobicContact CG-CB 4.4Å; Y651-S721 WeakPolarHBondContact O-CB 3.47Å; Y651-S721 PolarHBondContact O-OG 3.35Å
652V62.4Low56.4Low73 Ų7395.7 Ų95.744%0.44252%0.516SS..  trans-69.9127.3177.8-168.70000107.8S650 S654 T655 Y656S650-V652 PolarHBondContact O-N 3.5Å; V652-S654 VanDerWaalsContact CG1-OG 3.31Å; V652-S654 WeakPolarHBondContact CG1-OG 3.48Å; V652-S654 PolarHBondContact O-N 3.19Å; V652-T655 PolarHBondContact O-N 2.96Å; V652-T655 VanDerWaalsContact O-N 3.14Å; V652-T655 PolarHBondContact O-OG1 3.4Å; V652-Y656 PolarHBondContact O-N 3.47Å
653P71.1Confident59.4Low14 Ų1490.6 Ų90.69%0.09149%0.485CS..Hα-helixtrans-52.9-33.2-178-29.735.9000113.7L657 A722 E726 L730P653-L657 WeakPolarHBondContact O-CB 3.28Å; P653-L657 PolarHBondContact O-N 2.93Å; P653-A722 HydrophobicContact CB-CB 4.04Å; P653-A722 VanDerWaalsContact CG-CA 3.49Å; P653-A722 HydrophobicContact CG-CB 3.65Å; P653-E726 HydrophobicContact CB-CB 4.3Å; P653-L730 HydrophobicContact CB-CD1 4.02Å
654S74Confident62.5Low72 Ų7282.6 Ų82.650%0.50345%0.449SS..Hα-helixtrans-67.4-39.5-179.557.90000114.1V652 L657 T658V652-S654 VanDerWaalsContact CG1-OG 3.31Å; V652-S654 WeakPolarHBondContact CG1-OG 3.48Å; V652-S654 PolarHBondContact O-N 3.19Å; S654-L657 PolarHBondContact O-N 2.64Å; S654-T658 PolarHBondContact O-N 3.33Å; S654-T658 PolarHBondContact O-OG1 3.03Å
655T75.2Confident65.5Low73 Ų7381.2 Ų81.245%0.44844%0.438SS..Hα-helixtrans-72.4-36.8179.751.50000111.7V652 L657 T658 E659V652-T655 PolarHBondContact O-N 2.96Å; V652-T655 VanDerWaalsContact O-N 3.14Å; V652-T655 PolarHBondContact O-OG1 3.4Å; T655-L657 VanDerWaalsContact C-N 3.33Å; T655-T658 WeakPolarHBondContact CA-OG1 3.35Å; T655-T658 PolarHBondContact O-N 2.8Å; T655-T658 PolarHBondContact O-OG1 2.76Å; T655-T658 VanDerWaalsContact O-OG1 3.05Å; T655-E659 PolarHBondContact O-N 3.07Å
656Y84.1Confident68.6Low2 Ų275 Ų751%0.00841%0.41CS..Hα-helixtrans-66.2-36.6173-177.3-119.3000111.9V652 E659 I660 I711 K714 K715 A718 L730 L734V652-Y656 PolarHBondContact O-N 3.47Å; Y656-E659 PolarHBondContact O-N 3.23Å; Y656-I660 HydrophobicContact CD1-CD1 3.88Å; Y656-I660 HydrophobicContact CE1-CD1 3.6Å; Y656-I660 HydrophobicContact CE2-CD1 4.42Å; Y656-I660 HydrophobicContact CG-CD1 4.39Å; Y656-I660 WeakPolarHBondContact O-CG1 3.35Å; Y656-I660 PolarHBondContact O-N 2.89Å; Y656-I711 HydrophobicContact CE2-CB 4.44Å; Y656-I711 HydrophobicContact CE2-CG2 3.9Å; Y656-I711 WeakPolarHBondContact CE2-O 3.37Å; Y656-I711 WeakPolarHBondContact OH-CG2 3.27Å; Y656-I711 PolarHBondContact OH-O 3.39Å; Y656-K714 HydrophobicContact CD2-CB 4.11Å; Y656-K714 HydrophobicContact CD2-CD 4.46Å; Y656-K714 HydrophobicContact CE2-CB 3.7Å; Y656-K715 VanDerWaalsContact OH-CA 3.27Å; Y656-K715 WeakPolarHBondContact OH-CA 3.37Å; Y656-K715 WeakPolarHBondContact OH-CB 3.34Å; Y656-K715 PolarHBondContact OH-N 3.35Å; Y656-A718 HydrophobicContact CD1-CB 3.26Å; Y656-A718 HydrophobicContact CD2-CB 4.22Å; Y656-A718 HydrophobicContact CE1-CB 3.76Å; Y656-A718 HydrophobicContact CG-CB 3.53Å; Y656-L730 HydrophobicContact CD1-CD1 4.16Å; Y656-L730 HydrophobicContact CD1-CD2 3.63Å; Y656-L730 HydrophobicContact CD1-CG 4.5Å; Y656-L730 HydrophobicContact CE1-CD2 4.2Å; Y656-L734 HydrophobicContact CE1-CD1 4.19Å
657L80.8Confident71.4Confident57 Ų5769.3 Ų69.330%0.29837%0.373SS..Hα-helixtrans-65.7-36173.9-150.8153.3000111.8P653 S654 T655 I660 T661 L730P653-L657 WeakPolarHBondContact O-CB 3.28Å; P653-L657 PolarHBondContact O-N 2.93Å; S654-L657 PolarHBondContact O-N 2.64Å; T655-L657 VanDerWaalsContact C-N 3.33Å; L657-I660 PolarHBondContact O-N 3.49Å; L657-T661 HydrophobicContact CD2-CG2 4.39Å; L657-T661 PolarHBondContact O-N 3.03Å; L657-T661 PolarHBondContact O-OG1 2.96Å; L657-T661 VanDerWaalsContact O-OG1 3.13Å; L657-L730 HydrophobicContact CB-CD2 3.71Å; L657-L730 HydrophobicContact CD1-CD2 3.87Å; L657-L730 HydrophobicContact CD1-CG 4.26Å; L657-L730 HydrophobicContact CG-CD2 3.84Å
658T81.1Confident74.3Confident86 Ų8665.2 Ų65.253%0.52835%0.352SS..Hα-helixtrans-70.3-33.8171.223.30000113.9S654 T655 T661 H662S654-T658 PolarHBondContact O-N 3.33Å; S654-T658 PolarHBondContact O-OG1 3.03Å; T655-T658 WeakPolarHBondContact CA-OG1 3.35Å; T655-T658 PolarHBondContact O-N 2.8Å; T655-T658 PolarHBondContact O-OG1 2.76Å; T655-T658 VanDerWaalsContact O-OG1 3.05Å; T658-T661 WeakPolarHBondContact CA-OG1 3.47Å; T658-T661 PolarHBondContact O-OG1 3.28Å; T658-H662 VanDerWaalsContact O-CB 3.27Å; T658-H662 WeakPolarHBondContact O-CB 3.36Å; T658-H662 PolarHBondContact O-N 2.83Å
659E85.1Confident76.9Confident69 Ų6961.5 Ų61.532%0.32233%0.334SS..Hα-helixtrans-61.2-44.9170.5-72-175.6-168.500111.2T655 Y656 H662 V663 I711 K714T655-E659 PolarHBondContact O-N 3.07Å; Y656-E659 PolarHBondContact O-N 3.23Å; E659-H662 PolarHBondContact O-N 2.9Å; E659-V663 PolarHBondContact O-N 3.33Å; E659-I711 HydrophobicContact CB-CD1 4.41Å; E659-I711 HydrophobicContact CB-CG1 4.49Å; E659-K714 IonicContact OE1-NZ 3.84Å; E659-K714 PolarHBondContact OE1-NZ 2.82Å; E659-K714 WeakPolarHBondContact OE2-CD 3.36Å; E659-K714 IonicContact OE2-NZ 3.77Å; E659-K714 PolarHBondContact OE2-NZ 2.85Å
660I87.5Confident79.8Confident1 Ų155.6 Ų55.61%0.00530%0.304CS..Hα-helixtrans-60.4-48.5177.1-69.3159.1000111.7Y656 L657 H662 V663 S664 I711 L730 A733 L734 L737Y656-I660 HydrophobicContact CD1-CD1 3.88Å; Y656-I660 HydrophobicContact CE1-CD1 3.6Å; Y656-I660 HydrophobicContact CE2-CD1 4.42Å; Y656-I660 HydrophobicContact CG-CD1 4.39Å; Y656-I660 WeakPolarHBondContact O-CG1 3.35Å; Y656-I660 PolarHBondContact O-N 2.89Å; L657-I660 PolarHBondContact O-N 3.49Å; I660-H662 PolarHBondContact O-N 3.01Å; I660-V663 PolarHBondContact O-N 2.78Å; I660-S664 WeakPolarHBondContact O-CB 3.47Å; I660-S664 PolarHBondContact O-N 3.03Å; I660-S664 PolarHBondContact O-OG 3.14Å; I660-I711 HydrophobicContact CG1-CD1 4.38Å; I660-I711 HydrophobicContact CG1-CG2 3.84Å; I660-L730 HydrophobicContact CD1-CD2 3.97Å; I660-A733 HydrophobicContact CG2-CB 4Å; I660-L734 HydrophobicContact CD1-CD1 4.48Å; I660-L734 HydrophobicContact CD1-CD2 3.77Å; I660-L734 HydrophobicContact CD1-CG 3.74Å; I660-L734 HydrophobicContact CG1-CD2 3.98Å; I660-L734 HydrophobicContact CG1-CG 4.44Å; I660-L737 HydrophobicContact CG2-CB 4.23Å; I660-L737 HydrophobicContact CG2-CD2 4.23Å
661T85.9Confident82.1Confident59 Ų5952.5 Ų52.536%0.36228%0.279SS..Hα-helixtrans-66.5-37178.744.90000111.9L657 T658 V663 S664 Q665L657-T661 HydrophobicContact CD2-CG2 4.39Å; L657-T661 PolarHBondContact O-N 3.03Å; L657-T661 PolarHBondContact O-OG1 2.96Å; L657-T661 VanDerWaalsContact O-OG1 3.13Å; T658-T661 WeakPolarHBondContact CA-OG1 3.47Å; T658-T661 PolarHBondContact O-OG1 3.28Å; T661-V663 VanDerWaalsContact C-N 3.35Å; T661-V663 PolarHBondContact O-N 3.46Å; T661-S664 WeakPolarHBondContact O-CB 3.41Å; T661-S664 PolarHBondContact O-N 2.96Å; T661-Q665 WeakPolarHBondContact O-CB 3.34Å; T661-Q665 PolarHBondContact O-N 3.14Å
662H85.2Confident83.7Confident129 Ų12954.7 Ų54.760%0.59729%0.293SS*.Hα-helixtrans-65.1-35.5177.3-163.5-63.1000113T658 E659 I660 A666T658-H662 VanDerWaalsContact O-CB 3.27Å; T658-H662 WeakPolarHBondContact O-CB 3.36Å; T658-H662 PolarHBondContact O-N 2.83Å; E659-H662 PolarHBondContact O-N 2.9Å; I660-H662 PolarHBondContact O-N 3.01Å; H662-A666 PolarHBondContact O-N 3.35Å
663V89.4Confident84.9Confident9 Ų955.4 Ų55.46%0.05529%0.293CS..Hα-helixtrans-74.5-37.9172.7178.90000111.2E659 I660 T661 Q665 A666 L667 R707 I708 I711 L737E659-V663 PolarHBondContact O-N 3.33Å; I660-V663 PolarHBondContact O-N 2.78Å; T661-V663 VanDerWaalsContact C-N 3.35Å; T661-V663 PolarHBondContact O-N 3.46Å; V663-Q665 VanDerWaalsContact C-N 3.26Å; V663-Q665 PolarHBondContact O-N 3.06Å; V663-A666 PolarHBondContact O-N 3.48Å; V663-A666 VanDerWaalsContact O-N 3.15Å; V663-L667 WeakPolarHBondContact O-CG 3.36Å; V663-L667 PolarHBondContact O-N 3.44Å; V663-R707 HydrophobicContact CG1-CB 4.49Å; V663-R707 HydrophobicContact CG2-CB 3.89Å; V663-I708 HydrophobicContact CG1-CD1 4.29Å; V663-I708 HydrophobicContact CG1-CG1 3.65Å; V663-I711 HydrophobicContact CB-CD1 3.89Å; V663-I711 HydrophobicContact CG1-CD1 4.49Å; V663-I711 HydrophobicContact CG2-CD1 3.51Å; V663-L737 HydrophobicContact CB-CD1 4.26Å; V663-L737 HydrophobicContact CG1-CD1 3.9Å
664S87.2Confident85.7Confident15 Ų1554.7 Ų54.711%0.10529%0.289CS..Hα-helixtrans-59.1-38.5172.8-52.90000111.7I660 T661 L667 L668 L737I660-S664 WeakPolarHBondContact O-CB 3.47Å; I660-S664 PolarHBondContact O-N 3.03Å; I660-S664 PolarHBondContact O-OG 3.14Å; T661-S664 WeakPolarHBondContact O-CB 3.41Å; T661-S664 PolarHBondContact O-N 2.96Å; S664-L667 PolarHBondContact O-N 3.29Å; S664-L668 WeakPolarHBondContact O-CG 3.49Å; S664-L668 PolarHBondContact O-N 2.92Å; S664-L737 WeakPolarHBondContact OG-CD1 2.75Å
665Q86.3Confident86.3Confident114 Ų11454.8 Ų54.853%0.53328%0.284SS..Hα-helixtrans-60-47.8173.5-135.68221.900111.5T661 V663 L667 L668 E669T661-Q665 WeakPolarHBondContact O-CB 3.34Å; T661-Q665 PolarHBondContact O-N 3.14Å; V663-Q665 VanDerWaalsContact C-N 3.26Å; V663-Q665 PolarHBondContact O-N 3.06Å; Q665-L667 VanDerWaalsContact C-N 3.31Å; Q665-L667 PolarHBondContact O-N 2.96Å; Q665-L668 WeakPolarHBondContact O-CB 3.46Å; Q665-L668 PolarHBondContact O-N 3.02Å; Q665-L668 VanDerWaalsContact O-N 3.13Å; Q665-E669 PolarHBondContact O-N 3Å
666A87.3Confident86.6Confident14 Ų1452.5 Ų52.512%0.11627%0.272CS..Hα-helixtrans-64-34.3177.300000112.5H662 V663 E669 V670H662-A666 PolarHBondContact O-N 3.35Å; V663-A666 PolarHBondContact O-N 3.48Å; V663-A666 VanDerWaalsContact O-N 3.15Å; A666-E669 PolarHBondContact O-N 2.86Å; A666-V670 WeakPolarHBondContact O-CG2 3.31Å; A666-V670 PolarHBondContact O-N 3.06Å
667L91.8Very high86.3Confident1 Ų157.3 Ų57.31%0.00530%0.304CS..Hα-helixtrans-67.9-35.4172.9-65-172.7000112.6V663 S664 Q665 V670 E671 I708 L737 Q740 W741V663-L667 WeakPolarHBondContact O-CG 3.36Å; V663-L667 PolarHBondContact O-N 3.44Å; S664-L667 PolarHBondContact O-N 3.29Å; Q665-L667 VanDerWaalsContact C-N 3.31Å; Q665-L667 PolarHBondContact O-N 2.96Å; L667-V670 PolarHBondContact O-N 3.26Å; L667-E671 WeakPolarHBondContact O-CB 3.44Å; L667-E671 PolarHBondContact O-N 3.01Å; L667-I708 HydrophobicContact CD1-CD1 4.11Å; L667-I708 HydrophobicContact CD2-CD1 4.32Å; L667-L737 HydrophobicContact CD1-CD1 3.7Å; L667-Q740 HydrophobicContact CD1-CB 4.1Å; L667-W741 HydrophobicContact CD1-CB 3.9Å; L667-W741 HydrophobicContact CD1-CE3 4.27Å; L667-W741 HydrophobicContact CD2-CE3 3.58Å; L667-W741 HydrophobicContact CD2-CZ3 3.94Å
668L87.7Confident86Confident65 Ų6558.5 Ų58.534%0.3431%0.31SS..Hα-helixtrans-66.2-36.4172.7-74164.6000112S664 Q665 E671 Q672S664-L668 WeakPolarHBondContact O-CG 3.49Å; S664-L668 PolarHBondContact O-N 2.92Å; Q665-L668 WeakPolarHBondContact O-CB 3.46Å; Q665-L668 PolarHBondContact O-N 3.02Å; Q665-L668 VanDerWaalsContact O-N 3.13Å; L668-E671 PolarHBondContact O-N 2.7Å; L668-Q672 WeakPolarHBondContact O-CG 3.39Å; L668-Q672 PolarHBondContact O-N 2.67Å
669E87.4Confident85.9Confident118 Ų11854.9 Ų54.955%0.55129%0.288SS*.Hα-helixtrans-62.6-45171.5-69.6170.3-174.800111.2Q665 A666 E671 Q672 L673Q665-E669 PolarHBondContact O-N 3Å; A666-E669 PolarHBondContact O-N 2.86Å; E669-E671 VanDerWaalsContact C-N 3.32Å; E669-E671 PolarHBondContact O-N 2.88Å; E669-Q672 WeakPolarHBondContact O-CB 3.48Å; E669-Q672 PolarHBondContact O-N 3.49Å; E669-L673 WeakPolarHBondContact O-CG 3.4Å; E669-L673 PolarHBondContact O-N 3.39Å
670V90.5Very high85.5Confident6 Ų654.2 Ų54.24%0.03629%0.29CS..Hα-helixtrans-64.9-35.1174-179.90000111.9A666 L667 Q672 L673 L674 I697 L701 V744A666-V670 WeakPolarHBondContact O-CG2 3.31Å; A666-V670 PolarHBondContact O-N 3.06Å; L667-V670 PolarHBondContact O-N 3.26Å; V670-Q672 VanDerWaalsContact C-N 3.35Å; V670-L673 PolarHBondContact O-N 3.1Å; V670-L674 HydrophobicContact CG1-CD1 4.21Å; V670-L674 WeakPolarHBondContact O-CB 3.43Å; V670-L674 WeakPolarHBondContact O-CG 3.42Å; V670-L674 PolarHBondContact O-N 3.47Å; V670-I697 HydrophobicContact CG1-CG2 4Å; V670-L701 HydrophobicContact CG1-CD2 3.91Å; V670-L701 HydrophobicContact CG1-CG 4.03Å; V670-V744 HydrophobicContact CB-CG1 4.03Å; V670-V744 HydrophobicContact CG1-CG1 3.52Å
671E91Very high85Confident30 Ų3055.7 Ų55.714%0.1430%0.302CS..Hα-helixtrans-64.4-38.9173.1-158.9-173.8136.800111.9L667 L668 E669 L674 N675 K743 V744 M747L667-E671 WeakPolarHBondContact O-CB 3.44Å; L667-E671 PolarHBondContact O-N 3.01Å; L668-E671 PolarHBondContact O-N 2.7Å; E669-E671 VanDerWaalsContact C-N 3.32Å; E669-E671 PolarHBondContact O-N 2.88Å; E671-L674 PolarHBondContact O-N 3.47Å; E671-N675 PolarHBondContact O-N 3.41Å; E671-N675 PolarHBondContact O-ND2 2.65Å; E671-K743 WeakPolarHBondContact OE1-CE 3.36Å; E671-K743 IonicContact OE1-NZ 3.76Å; E671-K743 PolarHBondContact OE1-NZ 2.93Å; E671-K743 WeakPolarHBondContact OE2-CE 3.39Å; E671-K743 IonicContact OE2-NZ 3.97Å; E671-K743 PolarHBondContact OE2-NZ 3.5Å; E671-V744 HydrophobicContact CB-CG2 3.93Å; E671-V744 HydrophobicContact CG-CG2 4.21Å; E671-M747 HydrophobicContact CG-CE 3.66Å; E671-M747 HydrophobicContact CG-SD 3.87Å
672Q86.8Confident84.7Confident142 Ų14256.7 Ų56.766%0.66430%0.302SS*.Hα-helixtrans-64.9-43.2173.7-72.9177.311.500111.5L668 E669 V670 L674 N675 A676L668-Q672 WeakPolarHBondContact O-CG 3.39Å; L668-Q672 PolarHBondContact O-N 2.67Å; E669-Q672 WeakPolarHBondContact O-CB 3.48Å; E669-Q672 PolarHBondContact O-N 3.49Å; V670-Q672 VanDerWaalsContact C-N 3.35Å; Q672-L674 VanDerWaalsContact C-N 3.34Å; Q672-L674 PolarHBondContact O-N 2.94Å; Q672-N675 CarbonylContact O-C 3.56Å; Q672-N675 WeakPolarHBondContact O-CA 3.41Å; Q672-N675 PolarHBondContact O-N 3.09Å; Q672-N675 VanDerWaalsContact O-N 3.08Å; Q672-A676 PolarHBondContact O-N 2.93Å
673L87.6Confident84.6Confident87 Ų8752 Ų5246%0.45528%0.281SS..Hα-helixtrans-61.5-39.6174.9-68.2172.2000112.3E669 V670 N675 A676 I697E669-L673 WeakPolarHBondContact O-CG 3.4Å; E669-L673 PolarHBondContact O-N 3.39Å; V670-L673 PolarHBondContact O-N 3.1Å; L673-N675 PolarHBondContact O-N 3.48Å; L673-A676 WeakPolarHBondContact O-CB 3.5Å; L673-A676 PolarHBondContact O-N 2.86Å; L673-A676 VanDerWaalsContact O-N 3.14Å; L673-I697 HydrophobicContact CB-CD1 3.87Å; L673-I697 HydrophobicContact CB-CG1 3.87Å; L673-I697 HydrophobicContact CD1-CG1 4.44Å
674L88.6Confident84.4Confident0 Ų052.1 Ų52.10%028%0.281CS..Hα-helixtrans-68.7-15.3174.6-77.7167.9000114.7V670 E671 Q672 I697 V744 M747 Y748 R751V670-L674 HydrophobicContact CG1-CD1 4.21Å; V670-L674 WeakPolarHBondContact O-CB 3.43Å; V670-L674 WeakPolarHBondContact O-CG 3.42Å; V670-L674 PolarHBondContact O-N 3.47Å; E671-L674 PolarHBondContact O-N 3.47Å; Q672-L674 VanDerWaalsContact C-N 3.34Å; Q672-L674 PolarHBondContact O-N 2.94Å; L674-I697 HydrophobicContact CD1-CG2 4.49Å; L674-I697 HydrophobicContact CD2-CD1 4Å; L674-I697 HydrophobicContact CD2-CG2 3.89Å; L674-I697 HydrophobicContact CG-CD1 4.16Å; L674-I697 HydrophobicContact CG-CG2 4.03Å; L674-V744 HydrophobicContact CD1-CG1 3.65Å; L674-V744 WeakPolarHBondContact CD1-O 2.98Å; L674-M747 HydrophobicContact CB-CE 4.23Å; L674-M747 HydrophobicContact CD1-CB 3.94Å; L674-Y748 HydrophobicContact CD2-CD2 4.14Å; L674-R751 HydrophobicContact CD2-CB 4.41Å; L674-R751 HydrophobicContact CD2-CG 4.13Å; L674-R751 PolarHBondContact O-NE 3.43Å
675N86.2Confident84Confident73 Ų7354.1 Ų54.139%0.3929%0.289SS..THydrogen-bonded Turntrans-106.64.4174.4-69.1-37.1000112.5E671 Q672 L673 C680 M747E671-N675 PolarHBondContact O-N 3.41Å; E671-N675 PolarHBondContact O-ND2 2.65Å; Q672-N675 CarbonylContact O-C 3.56Å; Q672-N675 WeakPolarHBondContact O-CA 3.41Å; Q672-N675 PolarHBondContact O-N 3.09Å; Q672-N675 VanDerWaalsContact O-N 3.08Å; L673-N675 PolarHBondContact O-N 3.48Å; N675-C680 VanDerWaalsContact C-SG 3.58Å; N675-C680 PolarHBondContact O-SG 3.41Å; N675-M747 WeakPolarHBondContact OD1-CE 3.3Å
676A81.6Confident83.7Confident25 Ų2552.9 Ų52.921%0.20729%0.286CS..SBendtrans-57.8147.9176.600000110.7Q672 L673 D678 L679 C680Q672-A676 PolarHBondContact O-N 2.93Å; L673-A676 WeakPolarHBondContact O-CB 3.5Å; L673-A676 PolarHBondContact O-N 2.86Å; L673-A676 VanDerWaalsContact O-N 3.14Å; A676-D678 PolarHBondContact O-N 3.4Å; A676-D678 VanDerWaalsContact O-N 3.13Å; A676-L679 PolarHBondContact O-N 3.15Å; A676-L679 VanDerWaalsContact O-N 3.08Å; A676-C680 PolarHBondContact O-N 3.45Å; A676-C680 PolarHBondContact O-SG 2.93Å
677P77Confident83.6Confident103 Ų10353.6 Ų53.667%0.66929%0.287SS*.Hα-helixtrans-50.4-41.9-177.6-2835.7000112.7L679 C680 A681P677-L679 PolarHBondContact O-N 3.01Å; P677-C680 CarbonylContact O-C 3.59Å; P677-C680 WeakPolarHBondContact O-CA 3.32Å; P677-C680 PolarHBondContact O-N 3.1Å; P677-A681 WeakPolarHBondContact O-CB 3.32Å; P677-A681 PolarHBondContact O-N 2.88Å
678D74.1Confident83.1Confident82 Ų8261.1 Ų61.144%0.43932%0.321SS..Hα-helixtrans-58-31.6-177-47.5-12000113.6A676 Q690A676-D678 PolarHBondContact O-N 3.4Å; A676-D678 VanDerWaalsContact O-N 3.13Å; D678-Q690 WeakPolarHBondContact O-CG 3.5Å
679L80.5Confident82.6Confident10 Ų1062.8 Ų62.85%0.05233%0.325CS..Hα-helixtrans-98.7-6176.4-63.9178.9000113.3A676 P677 Q690 L694 I697 R751A676-L679 PolarHBondContact O-N 3.15Å; A676-L679 VanDerWaalsContact O-N 3.08Å; P677-L679 PolarHBondContact O-N 3.01Å; L679-Q690 HydrophobicContact CD2-CB 4.02Å; L679-Q690 HydrophobicContact CD2-CG 4.32Å; L679-L694 HydrophobicContact CD1-CD2 4.25Å; L679-L694 HydrophobicContact CD1-CG 4.47Å; L679-L694 HydrophobicContact CD2-CD1 4.35Å; L679-L694 HydrophobicContact CD2-CD2 4.3Å; L679-L694 HydrophobicContact CD2-CG 3.84Å; L679-I697 HydrophobicContact CD1-CD1 3.44Å; L679-I697 VanDerWaalsContact CD1-CD1 3.44Å; L679-R751 WeakPolarHBondContact O-CD 3.39Å; L679-R751 PolarHBondContact O-NH1 3.05Å
680C75.9Confident82.5Confident55 Ų5557.8 Ų57.837%0.37230%0.301SS..Hα-helixtrans-103.6-11177.6-700000113.6N675 A676 P677 R751N675-C680 VanDerWaalsContact C-SG 3.58Å; N675-C680 PolarHBondContact O-SG 3.41Å; A676-C680 PolarHBondContact O-N 3.45Å; A676-C680 PolarHBondContact O-SG 2.93Å; P677-C680 CarbonylContact O-C 3.59Å; P677-C680 WeakPolarHBondContact O-CA 3.32Å; P677-C680 PolarHBondContact O-N 3.1Å; C680-R751 VanDerWaalsContact SG-CZ 3.6Å; C680-R751 PolarHBondContact SG-NH2 2.93Å
681A76.7Confident82.5Confident32 Ų3262.8 Ų62.826%0.26432%0.324SS..SBendtrans-63.6-175.1177.500000112.8P677 E685P677-A681 WeakPolarHBondContact O-CB 3.32Å; P677-A681 PolarHBondContact O-N 2.88Å; A681-E685 HydrophobicContact CB-CB 4.4Å
682K80.1Confident82.2Confident81 Ų8166.5 Ų66.535%0.35234%0.342SS..  trans-68.4157.9177.9-61.3177.1167-165.40111.9F684 E685 Q690 Q827 Q828 S829K682-F684 VanDerWaalsContact C-N 3.27Å; K682-F684 PolarHBondContact O-N 3.49Å; K682-F684 VanDerWaalsContact O-N 3.1Å; K682-E685 HydrophobicContact CB-CB 4.25Å; K682-E685 PolarHBondContact N-OE2 3.46Å; K682-E685 PolarHBondContact O-N 2.98Å; K682-Q690 PolarHBondContact O-NE2 3.36Å; K682-Q827 WeakPolarHBondContact CE-O 3.37Å; K682-Q827 PolarHBondContact NZ-O 3.17Å; K682-Q828 WeakPolarHBondContact CB-O 3.31Å; K682-S829 WeakPolarHBondContact CD-O 3.34Å; K682-S829 PolarHBondContact NZ-O 3.16Å
683D83.1Confident82.2Confident31 Ų3161.2 Ų61.217%0.16632%0.321CS..THydrogen-bonded Turntrans-63.3-22.4-165.1-85.5-53.7000115.8R754 S758 Q828D683-R754 VanDerWaalsContact CG-NH2 3.29Å; D683-R754 VanDerWaalsContact OD1-CD 3.32Å; D683-R754 WeakPolarHBondContact OD1-CD 3.28Å; D683-R754 WeakPolarHBondContact OD1-CG 3.2Å; D683-R754 IonicContact OD1-CZ 3.97Å; D683-R754 IonicContact OD1-NE 3.87Å; D683-R754 PolarHBondContact OD1-NE 2.94Å; D683-R754 IonicContact OD1-NH2 2.71Å; D683-R754 PolarHBondContact OD1-NH2 2.73Å; D683-R754 IonicContact OD2-CZ 2.98Å; D683-R754 IonicContact OD2-NE 3.08Å; D683-R754 PolarHBondContact OD2-NE 3.03Å; D683-R754 IonicContact OD2-NH2 3.62Å; D683-R754 PolarHBondContact OD2-NH2 2.8Å; D683-S758 WeakPolarHBondContact O-CB 3.28Å; D683-S758 PolarHBondContact O-OG 3.38Å; D683-Q828 HydrophobicContact CB-CB 4.25Å; D683-Q828 PolarHBondContact N-O 3.23Å
684F84.2Confident82.4Confident11 Ų1157.1 Ų57.15%0.04830%0.299CS..THydrogen-bonded Turntrans-115.96.4179.3-52.4-81.7000113.8K682 S758 K761 W762 I825 Q828K682-F684 VanDerWaalsContact C-N 3.27Å; K682-F684 PolarHBondContact O-N 3.49Å; K682-F684 VanDerWaalsContact O-N 3.1Å; F684-S758 VanDerWaalsContact CE1-O 3.31Å; F684-S758 WeakPolarHBondContact CE1-O 3.47Å; F684-K761 HydrophobicContact CE1-CB 4.04Å; F684-K761 HydrophobicContact CZ-CB 4.14Å; F684-K761 HydrophobicContact CZ-CD 4.39Å; F684-W762 HydrophobicContact CB-CE3 4.35Å; F684-W762 HydrophobicContact CD1-CB 4.2Å; F684-W762 HydrophobicContact CD1-CE3 4.06Å; F684-W762 HydrophobicContact CE1-CB 4.35Å; F684-W762 HydrophobicContact CG-CE3 4.42Å; F684-I825 HydrophobicContact CD1-CG1 4.42Å; F684-I825 HydrophobicContact CD2-CB 4.28Å; F684-I825 HydrophobicContact CD2-CG1 4.2Å; F684-I825 HydrophobicContact CD2-CG2 4.12Å; F684-I825 HydrophobicContact CE1-CG1 4Å; F684-I825 HydrophobicContact CE2-CB 4.25Å; F684-I825 HydrophobicContact CE2-CG1 3.79Å; F684-I825 HydrophobicContact CG-CG2 4.13Å; F684-I825 HydrophobicContact CZ-CG1 3.68Å; F684-Q828 HydrophobicContact CD2-CB 3.46Å; F684-Q828 VanDerWaalsContact CD2-CB 3.46Å; F684-Q828 HydrophobicContact CE2-CB 3.63Å; F684-Q828 HydrophobicContact CE2-CG 4.42Å; F684-Q828 PolarHBondContact N-O 2.79Å
685E80.8Confident82.4Confident57 Ų5763.6 Ų63.627%0.26633%0.327SS..THydrogen-bonded Turntrans-81.8120.3-175.6-169157.4-137.800110.9A681 K682 L687 Q690 S830A681-E685 HydrophobicContact CB-CB 4.4Å; K682-E685 HydrophobicContact CB-CB 4.25Å; K682-E685 PolarHBondContact N-OE2 3.46Å; K682-E685 PolarHBondContact O-N 2.98Å; E685-L687 PolarHBondContact O-N 3.44Å; E685-Q690 PolarHBondContact O-NE2 3.3Å; E685-S830 VanDerWaalsContact OE1-CA 3.22Å; E685-S830 WeakPolarHBondContact OE1-CA 3.44Å; E685-S830 WeakPolarHBondContact OE1-CB 3.11Å
686D80Confident82.4Confident88 Ų8864.1 Ų64.147%0.47133%0.33SS..THydrogen-bonded Turntrans53.141.2178.5-94.5-16.8000115.1F688 K689 Q690D686-F688 PolarHBondContact O-N 3.28Å; D686-K689 HydrophobicContact CB-CB 4.33Å; D686-K689 HydrophobicContact CB-CD 4.13Å; D686-K689 HydrophobicContact CB-CG 4.37Å; D686-K689 PolarHBondContact O-N 3.48Å; D686-K689 WeakPolarHBondContact OD2-CD 3.5Å; D686-K689 VanDerWaalsContact OD2-CE 3.31Å; D686-K689 WeakPolarHBondContact OD2-CE 3.41Å; D686-K689 IonicContact OD2-NZ 2.94Å; D686-K689 PolarHBondContact OD2-NZ 3.13Å; D686-Q690 PolarHBondContact O-N 3.03Å; D686-Q690 VanDerWaalsContact O-N 3.12Å
687L84.1Confident82.9Confident28 Ų2863.1 Ų63.115%0.14732%0.321CS..Hα-helixtrans-44.8-36.4-178.2-74.9172.6000114.7E685 Q690 E691 F755 V759 W762E685-L687 PolarHBondContact O-N 3.44Å; L687-Q690 WeakPolarHBondContact O-CB 3.36Å; L687-Q690 PolarHBondContact O-N 3.22Å; L687-E691 PolarHBondContact O-N 3.42Å; L687-F755 HydrophobicContact CB-CE2 4.34Å; L687-F755 HydrophobicContact CD2-CD2 3.95Å; L687-F755 HydrophobicContact CD2-CE2 3.93Å; L687-F755 VanDerWaalsContact O-CE2 3.28Å; L687-F755 WeakPolarHBondContact O-CE2 3.38Å; L687-V759 HydrophobicContact CD2-CG2 4.3Å; L687-W762 HydrophobicContact CD1-CB 4.37Å; L687-W762 HydrophobicContact CD1-CD2 4.48Å; L687-W762 HydrophobicContact CD1-CG 4.23Å
688F80.3Confident83.6Confident160 Ų16063.2 Ų63.270%0.70231%0.311SS*.Hα-helixtrans-64.1-41.4177-171.3-92.5000113D686 Q690 E691 E692D686-F688 PolarHBondContact O-N 3.28Å; F688-Q690 VanDerWaalsContact C-N 3.34Å; F688-E691 PolarHBondContact O-N 2.98Å; F688-E692 PolarHBondContact O-N 3.33Å
689K79.1Confident84.2Confident99 Ų9963.2 Ų63.243%0.4331%0.311SS..Hα-helixtrans-69.8-33.1173.7-62.5-178.1-171.1158.20111.5D686 E691 E692 S693D686-K689 HydrophobicContact CB-CB 4.33Å; D686-K689 HydrophobicContact CB-CD 4.13Å; D686-K689 HydrophobicContact CB-CG 4.37Å; D686-K689 PolarHBondContact O-N 3.48Å; D686-K689 WeakPolarHBondContact OD2-CD 3.5Å; D686-K689 VanDerWaalsContact OD2-CE 3.31Å; D686-K689 WeakPolarHBondContact OD2-CE 3.41Å; D686-K689 IonicContact OD2-NZ 2.94Å; D686-K689 PolarHBondContact OD2-NZ 3.13Å; K689-E691 VanDerWaalsContact C-N 3.34Å; K689-E692 PolarHBondContact O-N 3.4Å; K689-S693 WeakPolarHBondContact O-CB 3.44Å; K689-S693 PolarHBondContact O-N 3.17Å; K689-S693 PolarHBondContact O-OG 3.27Å; K689-S693 VanDerWaalsContact O-OG 3.05Å
690Q85.3Confident84.4Confident13 Ų1364.7 Ų64.76%0.06132%0.322CS..Hα-helixtrans-62.5-43.4173.2-59.8-166.12200111D678 L679 K682 E685 D686 L687 F688 L694 F755D678-Q690 WeakPolarHBondContact O-CG 3.5Å; L679-Q690 HydrophobicContact CD2-CB 4.02Å; L679-Q690 HydrophobicContact CD2-CG 4.32Å; K682-Q690 PolarHBondContact O-NE2 3.36Å; E685-Q690 PolarHBondContact O-NE2 3.3Å; D686-Q690 PolarHBondContact O-N 3.03Å; D686-Q690 VanDerWaalsContact O-N 3.12Å; L687-Q690 WeakPolarHBondContact O-CB 3.36Å; L687-Q690 PolarHBondContact O-N 3.22Å; F688-Q690 VanDerWaalsContact C-N 3.34Å; Q690-L694 VanDerWaalsContact O-CB 3.29Å; Q690-L694 WeakPolarHBondContact O-CB 3.44Å; Q690-L694 VanDerWaalsContact O-CG 3.26Å; Q690-L694 WeakPolarHBondContact O-CG 3.41Å; Q690-L694 PolarHBondContact O-N 3.07Å; Q690-F755 HydrophobicContact CB-CD2 3.76Å; Q690-F755 HydrophobicContact CB-CE2 4.03Å
691E89.3Confident85.1Confident111 Ų11162.5 Ų62.552%0.51931%0.307SS..Hα-helixtrans-61.3-47.3176-162.7172.2-17900111.9L687 F688 K689 L694 K695 F755L687-E691 PolarHBondContact O-N 3.42Å; F688-E691 PolarHBondContact O-N 2.98Å; K689-E691 VanDerWaalsContact C-N 3.34Å; E691-L694 PolarHBondContact O-N 2.97Å; E691-K695 VanDerWaalsContact O-CB 3.32Å; E691-K695 WeakPolarHBondContact O-CB 3.3Å; E691-K695 PolarHBondContact O-N 2.73Å; E691-F755 HydrophobicContact CB-CE1 4.21Å; E691-F755 HydrophobicContact CB-CE2 4.06Å; E691-F755 HydrophobicContact CB-CZ 3.51Å; E691-F755 HydrophobicContact CG-CE1 4.06Å; E691-F755 HydrophobicContact CG-CZ 3.77Å
692E85.7Confident85.6Confident108 Ų10867.4 Ų67.451%0.50533%0.325SS..Hα-helixtrans-63.8-46.6178.6-174.6170-152.100112.1F688 K689 K695 N696F688-E692 PolarHBondContact O-N 3.33Å; K689-E692 PolarHBondContact O-N 3.4Å; E692-K695 WeakPolarHBondContact O-CB 3.29Å; E692-K695 PolarHBondContact O-N 3Å; E692-N696 VanDerWaalsContact O-CG 3.27Å; E692-N696 PolarHBondContact O-N 2.88Å; E692-N696 PolarHBondContact O-ND2 3.34Å
693S86Confident85.7Confident31 Ų3169.5 Ų69.522%0.21734%0.335CS..Hα-helixtrans-61.3-45.4175.9-71.40000112.4K689 K695 N696 I697K689-S693 WeakPolarHBondContact O-CB 3.44Å; K689-S693 PolarHBondContact O-N 3.17Å; K689-S693 PolarHBondContact O-OG 3.27Å; K689-S693 VanDerWaalsContact O-OG 3.05Å; S693-K695 VanDerWaalsContact C-N 3.3Å; S693-K695 PolarHBondContact O-N 2.99Å; S693-N696 PolarHBondContact O-N 2.92Å; S693-I697 WeakPolarHBondContact O-CB 3.47Å; S693-I697 WeakPolarHBondContact O-CD1 3.44Å; S693-I697 VanDerWaalsContact O-CG1 3.25Å; S693-I697 WeakPolarHBondContact O-CG1 3.4Å; S693-I697 PolarHBondContact O-N 3.09Å
694L91.6Very high85.8Confident2 Ų268.3 Ų68.31%0.0133%0.329CS..Hα-helixtrans-63.3-35.8175.9-76.6168.7000112.3L679 Q690 E691 K698 Y748 R751 Q752 F755L679-L694 HydrophobicContact CD1-CD2 4.25Å; L679-L694 HydrophobicContact CD1-CG 4.47Å; L679-L694 HydrophobicContact CD2-CD1 4.35Å; L679-L694 HydrophobicContact CD2-CD2 4.3Å; L679-L694 HydrophobicContact CD2-CG 3.84Å; Q690-L694 VanDerWaalsContact O-CB 3.29Å; Q690-L694 WeakPolarHBondContact O-CB 3.44Å; Q690-L694 VanDerWaalsContact O-CG 3.26Å; Q690-L694 WeakPolarHBondContact O-CG 3.41Å; Q690-L694 PolarHBondContact O-N 3.07Å; E691-L694 PolarHBondContact O-N 2.97Å; L694-K698 WeakPolarHBondContact O-CB 3.31Å; L694-K698 PolarHBondContact O-N 3.04Å; L694-Y748 HydrophobicContact CB-CE2 4.38Å; L694-Y748 HydrophobicContact CD2-CD2 4Å; L694-Y748 HydrophobicContact CD2-CE2 3.82Å; L694-Y748 WeakPolarHBondContact O-CE2 3.43Å; L694-R751 HydrophobicContact CD2-CB 3.97Å; L694-Q752 HydrophobicContact CD2-CB 4.47Å; L694-F755 HydrophobicContact CD1-CB 3.55Å; L694-F755 HydrophobicContact CD1-CD1 3.94Å; L694-F755 HydrophobicContact CD1-CD2 4.35Å; L694-F755 HydrophobicContact CD1-CG 3.68Å
695K88.4Confident85.9Confident135 Ų13569.5 Ų69.559%0.58734%0.339SS*.Hα-helixtrans-66.3-48.6174.9-174.4-177.4175.3-170.30111.7E691 E692 S693 I697 K698 D699E691-K695 VanDerWaalsContact O-CB 3.32Å; E691-K695 WeakPolarHBondContact O-CB 3.3Å; E691-K695 PolarHBondContact O-N 2.73Å; E692-K695 WeakPolarHBondContact O-CB 3.29Å; E692-K695 PolarHBondContact O-N 3Å; S693-K695 VanDerWaalsContact C-N 3.3Å; S693-K695 PolarHBondContact O-N 2.99Å; K695-I697 VanDerWaalsContact C-N 3.3Å; K695-I697 PolarHBondContact O-N 3.36Å; K695-K698 WeakPolarHBondContact O-CB 3.14Å; K695-K698 PolarHBondContact O-N 3.08Å; K695-K698 VanDerWaalsContact O-N 3.11Å; K695-D699 PolarHBondContact O-N 2.91Å
696N87.1Confident86.1Confident84 Ų8468.5 Ų68.545%0.44934%0.344SS..Hα-helixtrans-61.9-38.5177.9-67.4-23.3000112E692 S693 D699 S700E692-N696 VanDerWaalsContact O-CG 3.27Å; E692-N696 PolarHBondContact O-N 2.88Å; E692-N696 PolarHBondContact O-ND2 3.34Å; S693-N696 PolarHBondContact O-N 2.92Å; N696-D699 PolarHBondContact O-N 3.41Å; N696-S700 WeakPolarHBondContact O-CB 3.2Å; N696-S700 PolarHBondContact O-N 3.49Å; N696-S700 PolarHBondContact O-OG 2.89Å
697I91.4Very high86.3Confident4 Ų469.1 Ų69.12%0.02134%0.34CS..Hα-helixtrans-65.8-40.9174-73167.2000111.3V670 L673 L674 L679 S693 K695 D699 S700 L701 Y748V670-I697 HydrophobicContact CG1-CG2 4Å; L673-I697 HydrophobicContact CB-CD1 3.87Å; L673-I697 HydrophobicContact CB-CG1 3.87Å; L673-I697 HydrophobicContact CD1-CG1 4.44Å; L674-I697 HydrophobicContact CD1-CG2 4.49Å; L674-I697 HydrophobicContact CD2-CD1 4Å; L674-I697 HydrophobicContact CD2-CG2 3.89Å; L674-I697 HydrophobicContact CG-CD1 4.16Å; L674-I697 HydrophobicContact CG-CG2 4.03Å; L679-I697 HydrophobicContact CD1-CD1 3.44Å; L679-I697 VanDerWaalsContact CD1-CD1 3.44Å; S693-I697 WeakPolarHBondContact O-CB 3.47Å; S693-I697 WeakPolarHBondContact O-CD1 3.44Å; S693-I697 VanDerWaalsContact O-CG1 3.25Å; S693-I697 WeakPolarHBondContact O-CG1 3.4Å; S693-I697 PolarHBondContact O-N 3.09Å; K695-I697 VanDerWaalsContact C-N 3.3Å; K695-I697 PolarHBondContact O-N 3.36Å; I697-D699 VanDerWaalsContact C-N 3.35Å; I697-D699 PolarHBondContact O-N 3.12Å; I697-S700 WeakPolarHBondContact O-CB 3.26Å; I697-S700 PolarHBondContact O-N 2.63Å; I697-L701 HydrophobicContact CG2-CD1 4.03Å; I697-L701 HydrophobicContact CG2-CG 4.41Å; I697-L701 WeakPolarHBondContact O-CB 3.41Å; I697-L701 WeakPolarHBondContact O-CG 3.21Å; I697-L701 PolarHBondContact O-N 3.22Å; I697-Y748 HydrophobicContact CG2-CD2 3.69Å; I697-Y748 HydrophobicContact CG2-CE2 4.3Å; I697-Y748 HydrophobicContact CG2-CG 4.39Å
698K92.4Very high86.5Confident105 Ų10568 Ų6846%0.45733%0.334SS..Hα-helixtrans-61.2-42.3176.8-172.4-173.2-177.2179.10112.2L694 K695 L701 Q702 Y748L694-K698 WeakPolarHBondContact O-CB 3.31Å; L694-K698 PolarHBondContact O-N 3.04Å; K695-K698 WeakPolarHBondContact O-CB 3.14Å; K695-K698 PolarHBondContact O-N 3.08Å; K695-K698 VanDerWaalsContact O-N 3.11Å; K698-L701 WeakPolarHBondContact O-CB 3.35Å; K698-L701 PolarHBondContact O-N 3.01Å; K698-Q702 PolarHBondContact O-N 3.35Å; K698-Y748 HydrophobicContact CB-CE2 4.24Å; K698-Y748 HydrophobicContact CG-CE1 4.41Å
699D85.4Confident86.7Confident82 Ų8265.1 Ų65.144%0.43933%0.326SS..Hα-helixtrans-68.1-39.7178.2-64-13.4000110.6K695 N696 I697 L701 Q702 Q703K695-D699 PolarHBondContact O-N 2.91Å; N696-D699 PolarHBondContact O-N 3.41Å; I697-D699 VanDerWaalsContact C-N 3.35Å; I697-D699 PolarHBondContact O-N 3.12Å; D699-L701 VanDerWaalsContact C-N 3.35Å; D699-L701 PolarHBondContact O-N 3.1Å; D699-Q702 PolarHBondContact O-N 3.21Å; D699-Q703 PolarHBondContact O-N 3.01Å
700S86.2Confident86.8Confident41 Ų4164.7 Ų64.729%0.28733%0.327SS..Hα-helixtrans-62.7-38173.1-55.90000112.7N696 I697 S704N696-S700 WeakPolarHBondContact O-CB 3.2Å; N696-S700 PolarHBondContact O-N 3.49Å; N696-S700 PolarHBondContact O-OG 2.89Å; I697-S700 WeakPolarHBondContact O-CB 3.26Å; I697-S700 PolarHBondContact O-N 2.63Å; S700-S704 WeakPolarHBondContact O-CB 3.36Å; S700-S704 PolarHBondContact O-N 3.15Å; S700-S704 PolarHBondContact O-OG 3.5Å
701L90.4Very high86.8Confident10 Ų1064.2 Ų64.25%0.05233%0.325CS..Hα-helixtrans-66.9-42.3172.8-76.9171.2000111.5V670 I697 K698 D699 Q703 S704 S705 W741 V744 Y748V670-L701 HydrophobicContact CG1-CD2 3.91Å; V670-L701 HydrophobicContact CG1-CG 4.03Å; I697-L701 HydrophobicContact CG2-CD1 4.03Å; I697-L701 HydrophobicContact CG2-CG 4.41Å; I697-L701 WeakPolarHBondContact O-CB 3.41Å; I697-L701 WeakPolarHBondContact O-CG 3.21Å; I697-L701 PolarHBondContact O-N 3.22Å; K698-L701 WeakPolarHBondContact O-CB 3.35Å; K698-L701 PolarHBondContact O-N 3.01Å; D699-L701 VanDerWaalsContact C-N 3.35Å; D699-L701 PolarHBondContact O-N 3.1Å; L701-Q703 VanDerWaalsContact C-N 3.35Å; L701-Q703 PolarHBondContact O-N 3.4Å; L701-S704 PolarHBondContact O-N 3.5Å; L701-S705 PolarHBondContact O-N 2.96Å; L701-W741 HydrophobicContact CB-CH2 4.42Å; L701-W741 HydrophobicContact CD2-CE3 4.35Å; L701-W741 HydrophobicContact CD2-CH2 4.1Å; L701-W741 HydrophobicContact CD2-CZ3 3.52Å; L701-W741 VanDerWaalsContact O-CH2 3.3Å; L701-W741 WeakPolarHBondContact O-CH2 3.38Å; L701-V744 HydrophobicContact CD2-CG1 3.88Å; L701-Y748 HydrophobicContact CD1-CD1 3.66Å; L701-Y748 HydrophobicContact CD1-CD2 4.11Å; L701-Y748 HydrophobicContact CD1-CE1 4.42Å; L701-Y748 HydrophobicContact CD1-CG 3.5Å; L701-Y748 VanDerWaalsContact CD1-CG 3.5Å
702Q86.4Confident86.6Confident135 Ų13561.6 Ų61.663%0.63131%0.313SS*.Hα-helixtrans-60.9-43.4175.1-79.5-171.2-41.300111.9K698 D699 S704 S705 G706K698-Q702 PolarHBondContact O-N 3.35Å; D699-Q702 PolarHBondContact O-N 3.21Å; Q702-S704 VanDerWaalsContact C-N 3.33Å; Q702-S704 PolarHBondContact O-N 2.94Å; Q702-S705 PolarHBondContact O-N 3.49Å; Q702-G706 PolarHBondContact O-N 3.34Å
703Q82.9Confident86.4Confident124 Ų12460.6 Ų60.658%0.57932%0.318SS*.Hα-helixtrans-63.5-39.6175.6-165.9-178.252.700112.1D699 L701 R707D699-Q703 PolarHBondContact O-N 3.01Å; L701-Q703 VanDerWaalsContact C-N 3.35Å; L701-Q703 PolarHBondContact O-N 3.4Å; Q703-R707 PolarHBondContact O-N 2.92Å
704S84.4Confident86.3Confident6 Ų661.2 Ų61.24%0.04232%0.316CS..Hα-helixtrans-65.8-41.6176-61.40000112.5S700 L701 Q702 G706 R707 I708S700-S704 WeakPolarHBondContact O-CB 3.36Å; S700-S704 PolarHBondContact O-N 3.15Å; S700-S704 PolarHBondContact O-OG 3.5Å; L701-S704 PolarHBondContact O-N 3.5Å; Q702-S704 VanDerWaalsContact C-N 3.33Å; Q702-S704 PolarHBondContact O-N 2.94Å; S704-G706 PolarHBondContact O-N 2.94Å; S704-R707 PolarHBondContact O-N 3.38Å; S704-R707 VanDerWaalsContact O-N 3.14Å; S704-I708 WeakPolarHBondContact O-CG1 3.42Å; S704-I708 PolarHBondContact O-N 3.21Å
705S87.5Confident85.8Confident37 Ų3764 Ų6426%0.25933%0.329SS..Hα-helixtrans-55-50.2176.7-167.60000111.2L701 Q702 R707 I708 D709L701-S705 PolarHBondContact O-N 2.96Å; Q702-S705 PolarHBondContact O-N 3.49Å; S705-R707 VanDerWaalsContact C-N 3.27Å; S705-R707 PolarHBondContact O-N 2.92Å; S705-I708 WeakPolarHBondContact O-CB 3.45Å; S705-I708 PolarHBondContact O-N 3.34Å; S705-D709 VanDerWaalsContact O-CG 3.31Å; S705-D709 PolarHBondContact O-N 3.35Å; S705-D709 VanDerWaalsContact O-OD2 3.13Å
706G83.2Confident85.3Confident35 Ų3562 Ų6236%0.36133%0.327SS..Hα-helixtrans-61.5-33.218000000113.4Q702 S704 I710Q702-G706 PolarHBondContact O-N 3.34Å; S704-G706 PolarHBondContact O-N 2.94Å; G706-I710 WeakPolarHBondContact O-CD1 3.08Å; G706-I710 VanDerWaalsContact O-CG1 3.26Å; G706-I710 WeakPolarHBondContact O-CG1 3.33Å; G706-I710 PolarHBondContact O-N 3.45Å
707R86.1Confident84.7Confident102 Ų10259.8 Ų59.839%0.38532%0.321SS..Hα-helixtrans-70.7-38.9173.5-68.1179.3176173.90.9112.2V663 Q703 S704 S705 I710 I711V663-R707 HydrophobicContact CG1-CB 4.49Å; V663-R707 HydrophobicContact CG2-CB 3.89Å; Q703-R707 PolarHBondContact O-N 2.92Å; S704-R707 PolarHBondContact O-N 3.38Å; S704-R707 VanDerWaalsContact O-N 3.14Å; S705-R707 VanDerWaalsContact C-N 3.27Å; S705-R707 PolarHBondContact O-N 2.92Å; R707-I710 PolarHBondContact O-N 3.1Å; R707-I711 WeakPolarHBondContact O-CG1 3.49Å; R707-I711 PolarHBondContact O-N 3.08Å
708I87.6Confident84Confident4 Ų459.6 Ų59.62%0.02132%0.32CS..Hα-helixtrans-65.8-42.1176.6-68.3166.4000111V663 L667 S704 S705 I710 I711 H712 W741V663-I708 HydrophobicContact CG1-CD1 4.29Å; V663-I708 HydrophobicContact CG1-CG1 3.65Å; L667-I708 HydrophobicContact CD1-CD1 4.11Å; L667-I708 HydrophobicContact CD2-CD1 4.32Å; S704-I708 WeakPolarHBondContact O-CG1 3.42Å; S704-I708 PolarHBondContact O-N 3.21Å; S705-I708 WeakPolarHBondContact O-CB 3.45Å; S705-I708 PolarHBondContact O-N 3.34Å; I708-I710 VanDerWaalsContact C-N 3.34Å; I708-I710 PolarHBondContact O-N 2.91Å; I708-I711 PolarHBondContact O-N 3.2Å; I708-H712 PolarHBondContact O-CD2 3.36Å; I708-H712 PolarHBondContact O-N 2.73Å; I708-W741 HydrophobicContact CD1-CB 3.96Å; I708-W741 HydrophobicContact CD1-CD2 3.33Å; I708-W741 HydrophobicContact CD1-CE3 3.39Å; I708-W741 HydrophobicContact CD1-CG 3.61Å; I708-W741 HydrophobicContact CD1-CZ3 4.03Å
709D83.9Confident83.2Confident99 Ų9956.1 Ų56.153%0.52931%0.306SS..Hα-helixtrans-61.9-41.5175.9-66.5-39.8000111.3S705 H712 S713S705-D709 VanDerWaalsContact O-CG 3.31Å; S705-D709 PolarHBondContact O-N 3.35Å; S705-D709 VanDerWaalsContact O-OD2 3.13Å; D709-H712 PolarHBondContact O-N 3.07Å; D709-S713 PolarHBondContact O-N 2.87Å
710I82.2Confident82.7Confident91 Ų9159 Ų5947%0.46732%0.317SS..Hα-helixtrans-61.9-45.9172.9-69.9165.3000111.1G706 R707 I708 S713 K714G706-I710 WeakPolarHBondContact O-CD1 3.08Å; G706-I710 VanDerWaalsContact O-CG1 3.26Å; G706-I710 WeakPolarHBondContact O-CG1 3.33Å; G706-I710 PolarHBondContact O-N 3.45Å; R707-I710 PolarHBondContact O-N 3.1Å; I708-I710 VanDerWaalsContact C-N 3.34Å; I708-I710 PolarHBondContact O-N 2.91Å; I710-S713 PolarHBondContact O-N 3.01Å; I710-S713 PolarHBondContact O-OG 3.26Å; I710-K714 HydrophobicContact CG2-CD 4.35Å; I710-K714 WeakPolarHBondContact O-CG 2.99Å; I710-K714 PolarHBondContact O-N 3.39Å; I710-K714 VanDerWaalsContact O-N 3.14Å
711I85.5Confident82.1Confident3 Ų360 Ų602%0.01532%0.324CS..Hα-helixtrans-57.9-51176.1-76.1175000110.6Y656 E659 I660 V663 R707 I708 S713 K714 K715 L734 L737Y656-I711 HydrophobicContact CE2-CB 4.44Å; Y656-I711 HydrophobicContact CE2-CG2 3.9Å; Y656-I711 WeakPolarHBondContact CE2-O 3.37Å; Y656-I711 WeakPolarHBondContact OH-CG2 3.27Å; Y656-I711 PolarHBondContact OH-O 3.39Å; E659-I711 HydrophobicContact CB-CD1 4.41Å; E659-I711 HydrophobicContact CB-CG1 4.49Å; I660-I711 HydrophobicContact CG1-CD1 4.38Å; I660-I711 HydrophobicContact CG1-CG2 3.84Å; V663-I711 HydrophobicContact CB-CD1 3.89Å; V663-I711 HydrophobicContact CG1-CD1 4.49Å; V663-I711 HydrophobicContact CG2-CD1 3.51Å; R707-I711 WeakPolarHBondContact O-CG1 3.49Å; R707-I711 PolarHBondContact O-N 3.08Å; I708-I711 PolarHBondContact O-N 3.2Å; I711-S713 VanDerWaalsContact C-N 3.28Å; I711-S713 PolarHBondContact O-N 2.6Å; I711-K714 PolarHBondContact O-N 3.3Å; I711-K715 PolarHBondContact O-N 3.15Å; I711-K715 VanDerWaalsContact O-N 3.08Å; I711-L734 HydrophobicContact CG2-CD2 3.61Å; I711-L737 HydrophobicContact CD1-CD2 4.19Å; I711-L737 HydrophobicContact CG2-CD2 4.17Å
712H85.1Confident81.4Confident55 Ų5559.8 Ų59.826%0.25532%0.324SS..Hα-helixtrans-61.4-34178.1-82.6-64000113.2I708 D709 K714 K715 D738I708-H712 PolarHBondContact O-CD2 3.36Å; I708-H712 PolarHBondContact O-N 2.73Å; D709-H712 PolarHBondContact O-N 3.07Å; H712-K714 VanDerWaalsContact C-N 3.33Å; H712-K714 PolarHBondContact O-N 2.86Å; H712-K715 WeakPolarHBondContact O-CB 3.34Å; H712-K715 PolarHBondContact O-N 2.96Å; H712-D738 IonicContact CD2-OD1 3.94Å; H712-D738 IonicContact CE1-OD1 2.63Å; H712-D738 PolarHBondContact CE1-OD1 3.41Å; H712-D738 IonicContact CE1-OD2 3.93Å; H712-D738 PolarHBondContact CE1-OD2 3.38Å; H712-D738 VanDerWaalsContact CE1-OD2 3.26Å; H712-D738 IonicContact NE2-OD1 3.31Å; H712-D738 PolarHBondContact NE2-OD1 3.47Å; H712-D738 IonicContact NE2-OD2 3.3Å
713S80.5Confident81Confident87 Ų8756.9 Ų56.961%0.60832%0.315SS*.Hα-helixtrans-64.1-35.9173.580.10000112.9D709 I710 I711D709-S713 PolarHBondContact O-N 2.87Å; I710-S713 PolarHBondContact O-N 3.01Å; I710-S713 PolarHBondContact O-OG 3.26Å; I711-S713 VanDerWaalsContact C-N 3.28Å; I711-S713 PolarHBondContact O-N 2.6Å
714K83.2Confident80.9Confident44 Ų4455.9 Ų55.919%0.19132%0.32CS..Hα-helixtrans-77.7-21.1178.2-68.8175.7-177.7176.80113.4Y651 Y656 E659 I710 I711 H712 T716 A717 A718Y651-K714 HydrophobicContact CE1-CD 4.34Å; Y651-K714 HydrophobicContact CE1-CG 4.38Å; Y656-K714 HydrophobicContact CD2-CB 4.11Å; Y656-K714 HydrophobicContact CD2-CD 4.46Å; Y656-K714 HydrophobicContact CE2-CB 3.7Å; E659-K714 IonicContact OE1-NZ 3.84Å; E659-K714 PolarHBondContact OE1-NZ 2.82Å; E659-K714 WeakPolarHBondContact OE2-CD 3.36Å; E659-K714 IonicContact OE2-NZ 3.77Å; E659-K714 PolarHBondContact OE2-NZ 2.85Å; I710-K714 HydrophobicContact CG2-CD 4.35Å; I710-K714 WeakPolarHBondContact O-CG 2.99Å; I710-K714 PolarHBondContact O-N 3.39Å; I710-K714 VanDerWaalsContact O-N 3.14Å; I711-K714 PolarHBondContact O-N 3.3Å; H712-K714 VanDerWaalsContact C-N 3.33Å; H712-K714 PolarHBondContact O-N 2.86Å; K714-T716 VanDerWaalsContact C-N 3.3Å; K714-T716 PolarHBondContact O-N 2.98Å; K714-T716 VanDerWaalsContact O-N 3.17Å; K714-A717 PolarHBondContact O-N 3.11Å; K714-A717 VanDerWaalsContact O-N 3.09Å; K714-A718 PolarHBondContact O-N 2.98Å
715K81.7Confident80.6Confident62 Ų6260.6 Ų60.627%0.2735%0.348SS..Hα-helixtrans-45.2-48.3-176.2-178.2174.5-177.5168.90114Y656 I711 H712 A717 L719 L734Y656-K715 VanDerWaalsContact OH-CA 3.27Å; Y656-K715 WeakPolarHBondContact OH-CA 3.37Å; Y656-K715 WeakPolarHBondContact OH-CB 3.34Å; Y656-K715 PolarHBondContact OH-N 3.35Å; I711-K715 PolarHBondContact O-N 3.15Å; I711-K715 VanDerWaalsContact O-N 3.08Å; H712-K715 WeakPolarHBondContact O-CB 3.34Å; H712-K715 PolarHBondContact O-N 2.96Å; K715-A717 PolarHBondContact O-N 3.18Å; K715-L719 HydrophobicContact CG-CD1 3.81Å; K715-L719 WeakPolarHBondContact O-CB 3.42Å; K715-L719 VanDerWaalsContact O-CG 3.31Å; K715-L719 WeakPolarHBondContact O-CG 3.47Å; K715-L719 PolarHBondContact O-N 3.49Å; K715-L734 HydrophobicContact CD-CD1 3.88Å; K715-L734 HydrophobicContact CG-CD1 3.77Å
716T78.7Confident80.2Confident91 Ų9162.4 Ų62.456%0.55835%0.352SS*.Hα-helixtrans-65.5-40.4-175.3-42.70000111.8K714 Q720K714-T716 VanDerWaalsContact C-N 3.3Å; K714-T716 PolarHBondContact O-N 2.98Å; K714-T716 VanDerWaalsContact O-N 3.17Å; T716-Q720 VanDerWaalsContact O-CG 3.32Å; T716-Q720 WeakPolarHBondContact O-CG 3.31Å; T716-Q720 PolarHBondContact O-N 3.42Å
717A74.5Confident80.1Confident38 Ų3865.9 Ų65.931%0.31435%0.354SS..Hα-helixtrans-70.8-47178.800000111.6Y651 K714 K715 L719 Q720 S721Y651-A717 HydrophobicContact CD2-CB 3.73Å; Y651-A717 HydrophobicContact CE2-CB 4.07Å; Y651-A717 HydrophobicContact CG-CB 4.4Å; K714-A717 PolarHBondContact O-N 3.11Å; K714-A717 VanDerWaalsContact O-N 3.09Å; K715-A717 PolarHBondContact O-N 3.18Å; A717-L719 PolarHBondContact O-N 3.39Å; A717-Q720 PolarHBondContact O-N 3.26Å; A717-S721 PolarHBondContact O-N 2.92Å; A717-S721 PolarHBondContact O-OG 2.99Å
718A77.1Confident79.9Confident0 Ų064.8 Ų64.80%036%0.359CS..Hα-helixtrans-68.7-30.3-179.200000113.6Y656 K714 S721 A722Y656-A718 HydrophobicContact CD1-CB 3.26Å; Y656-A718 HydrophobicContact CD2-CB 4.22Å; Y656-A718 HydrophobicContact CE1-CB 3.76Å; Y656-A718 HydrophobicContact CG-CB 3.53Å; K714-A718 PolarHBondContact O-N 2.98Å; A718-S721 PolarHBondContact O-OG 3.23Å; A718-S721 VanDerWaalsContact O-OG 3.11Å; A718-A722 WeakPolarHBondContact O-CB 3.36Å; A718-A722 PolarHBondContact O-N 2.99Å
719L74.9Confident79.7Confident32 Ų3270.7 Ų70.717%0.16838%0.384CS..Hα-helixtrans-71.5-36.2171.9-74.6172.2000111.8K715 A717 S721 A722 R727 L730K715-L719 HydrophobicContact CG-CD1 3.81Å; K715-L719 WeakPolarHBondContact O-CB 3.42Å; K715-L719 VanDerWaalsContact O-CG 3.31Å; K715-L719 WeakPolarHBondContact O-CG 3.47Å; K715-L719 PolarHBondContact O-N 3.49Å; A717-L719 PolarHBondContact O-N 3.39Å; L719-S721 VanDerWaalsContact C-N 3.35Å; L719-S721 PolarHBondContact O-N 3.3Å; L719-A722 PolarHBondContact O-N 2.97Å; L719-R727 HydrophobicContact CD2-CB 4.21Å; L719-R727 HydrophobicContact CD2-CG 4.07Å; L719-R727 VanDerWaalsContact O-CZ 3.29Å; L719-R727 PolarHBondContact O-NE 3.01Å; L719-R727 PolarHBondContact O-NH2 2.87Å; L719-L730 HydrophobicContact CD2-CB 4.21Å
720Q75.2Confident79.7Confident144 Ų14466 Ų6667%0.67336%0.359SS*.Hα-helixtrans-62.3-41.2179.5-78.6177.18.800112.2T716 A717 R727T716-Q720 VanDerWaalsContact O-CG 3.32Å; T716-Q720 WeakPolarHBondContact O-CG 3.31Å; T716-Q720 PolarHBondContact O-N 3.42Å; A717-Q720 PolarHBondContact O-N 3.26Å; Q720-R727 PolarHBondContact O-NH2 2.68Å
721S74.3Confident79.8Confident60 Ų6067 Ų6742%0.4236%0.362SS..Hα-helixtrans-76.5-18.6177.855.10000115.2Y651 A717 A718 L719Y651-S721 WeakPolarHBondContact O-CB 3.47Å; Y651-S721 PolarHBondContact O-OG 3.35Å; A717-S721 PolarHBondContact O-N 2.92Å; A717-S721 PolarHBondContact O-OG 2.99Å; A718-S721 PolarHBondContact O-OG 3.23Å; A718-S721 VanDerWaalsContact O-OG 3.11Å; L719-S721 VanDerWaalsContact C-N 3.35Å; L719-S721 PolarHBondContact O-N 3.3Å
722A74.1Confident79.8Confident6 Ų672.3 Ų72.35%0.0539%0.387CS..SBendtrans-76.3141.3-175.700000114.4P653 A718 L719 E726 R727 L730P653-A722 HydrophobicContact CB-CB 4.04Å; P653-A722 VanDerWaalsContact CG-CA 3.49Å; P653-A722 HydrophobicContact CG-CB 3.65Å; A718-A722 WeakPolarHBondContact O-CB 3.36Å; A718-A722 PolarHBondContact O-N 2.99Å; L719-A722 PolarHBondContact O-N 2.97Å; A722-E726 HydrophobicContact CB-CB 3.98Å; A722-R727 HydrophobicContact CB-CG 3.68Å; A722-R727 PolarHBondContact O-NE 3.05Å; A722-L730 HydrophobicContact CB-CD1 4.06Å
723T79Confident79.9Confident74 Ų7470.4 Ų70.445%0.45438%0.381SS..  trans-64.5160.5168.964.80000111V725 E726 R727T723-V725 VanDerWaalsContact C-N 3.26Å; T723-V725 PolarHBondContact O-N 3.25Å; T723-V725 VanDerWaalsContact O-N 3.15Å; T723-E726 VanDerWaalsContact CB-OE2 3.29Å; T723-E726 WeakPolarHBondContact CB-OE2 3.36Å; T723-E726 VanDerWaalsContact CG2-OE2 3.3Å; T723-E726 WeakPolarHBondContact CG2-OE2 3.44Å; T723-E726 PolarHBondContact N-OE2 3.16Å; T723-E726 PolarHBondContact O-N 3.02Å; T723-E726 VanDerWaalsContact OG1-CG 3.28Å; T723-E726 WeakPolarHBondContact OG1-CG 3.39Å; T723-E726 PolarHBondContact OG1-OE2 3.49Å; T723-R727 PolarHBondContact O-N 3.33Å
724P79.4Confident80.2Confident104 Ų10466.3 Ų66.368%0.67535%0.352SS*.Hα-helixtrans-55.9-36.3-176.1-2836.1000114.5V728P724-V728 WeakPolarHBondContact O-CG2 3.47Å; P724-V728 PolarHBondContact O-N 2.76Å
725V79.6Confident80.4Confident104 Ų10467.6 Ų67.663%0.6337%0.366SS*.Hα-helixtrans-73.4-38.5177.9-179.20000111.5T723 V728 K729T723-V725 VanDerWaalsContact C-N 3.26Å; T723-V725 PolarHBondContact O-N 3.25Å; T723-V725 VanDerWaalsContact O-N 3.15Å; V725-V728 PolarHBondContact O-N 2.9Å; V725-K729 PolarHBondContact O-N 3.47Å
726E79.1Confident80.6Confident75 Ų7570.9 Ų70.935%0.3538%0.383SS..Hα-helixtrans-69-35.8175.2-69.2166.9138.900112.1P653 A722 T723 V728 K729 L730P653-E726 HydrophobicContact CB-CB 4.3Å; A722-E726 HydrophobicContact CB-CB 3.98Å; T723-E726 VanDerWaalsContact CB-OE2 3.29Å; T723-E726 WeakPolarHBondContact CB-OE2 3.36Å; T723-E726 VanDerWaalsContact CG2-OE2 3.3Å; T723-E726 WeakPolarHBondContact CG2-OE2 3.44Å; T723-E726 PolarHBondContact N-OE2 3.16Å; T723-E726 PolarHBondContact O-N 3.02Å; T723-E726 VanDerWaalsContact OG1-CG 3.28Å; T723-E726 WeakPolarHBondContact OG1-CG 3.39Å; T723-E726 PolarHBondContact OG1-OE2 3.49Å; E726-V728 PolarHBondContact O-N 3.31Å; E726-K729 PolarHBondContact O-N 3.02Å; E726-L730 WeakPolarHBondContact O-CB 3.4Å; E726-L730 WeakPolarHBondContact O-CG 3.48Å; E726-L730 PolarHBondContact O-N 3.47Å
727R80.3Confident81.2Confident108 Ų10866.5 Ų66.541%0.40836%0.356SS..Hα-helixtrans-57.8-47.2173.3-76.1-175.2-175.9173.92.6111.7L719 Q720 A722 T723 L730 Q731L719-R727 HydrophobicContact CD2-CB 4.21Å; L719-R727 HydrophobicContact CD2-CG 4.07Å; L719-R727 VanDerWaalsContact O-CZ 3.29Å; L719-R727 PolarHBondContact O-NE 3.01Å; L719-R727 PolarHBondContact O-NH2 2.87Å; Q720-R727 PolarHBondContact O-NH2 2.68Å; A722-R727 HydrophobicContact CB-CG 3.68Å; A722-R727 PolarHBondContact O-NE 3.05Å; T723-R727 PolarHBondContact O-N 3.33Å; R727-L730 PolarHBondContact O-N 3.18Å; R727-Q731 WeakPolarHBondContact O-CB 3.36Å; R727-Q731 PolarHBondContact O-N 3.5Å
728V82.7Confident81.9Confident80 Ų8067 Ų6749%0.48535%0.353SS..Hα-helixtrans-59.8-50.6177.7174.80000110P724 V725 E726 L730 Q731 E732P724-V728 WeakPolarHBondContact O-CG2 3.47Å; P724-V728 PolarHBondContact O-N 2.76Å; V725-V728 PolarHBondContact O-N 2.9Å; E726-V728 PolarHBondContact O-N 3.31Å; V728-L730 PolarHBondContact O-N 3.32Å; V728-Q731 PolarHBondContact O-N 3.01Å; V728-E732 HydrophobicContact CG1-CG 4.39Å; V728-E732 WeakPolarHBondContact O-CB 3.12Å; V728-E732 WeakPolarHBondContact O-CG 3.28Å; V728-E732 PolarHBondContact O-N 3.42Å
729K82.7Confident82.4Confident127 Ų12773.7 Ų73.755%0.55238%0.383SS*.Hα-helixtrans-60.5-41.9177.9-72.9-173.6174.6-173.80113.8V725 E726 Q731 A733V725-K729 PolarHBondContact O-N 3.47Å; E726-K729 PolarHBondContact O-N 3.02Å; K729-Q731 VanDerWaalsContact C-N 3.34Å; K729-A733 VanDerWaalsContact O-CB 3.28Å; K729-A733 WeakPolarHBondContact O-CB 3.36Å; K729-A733 PolarHBondContact O-N 3.34Å
730L84.1Confident83.1Confident0 Ų074.1 Ų74.10%038%0.384CS..Hα-helixtrans-64.9-39.3176.1-82.6176000111.8P653 Y656 L657 I660 L719 A722 E726 R727 V728 A733 L734P653-L730 HydrophobicContact CB-CD1 4.02Å; Y656-L730 HydrophobicContact CD1-CD1 4.16Å; Y656-L730 HydrophobicContact CD1-CD2 3.63Å; Y656-L730 HydrophobicContact CD1-CG 4.5Å; Y656-L730 HydrophobicContact CE1-CD2 4.2Å; L657-L730 HydrophobicContact CB-CD2 3.71Å; L657-L730 HydrophobicContact CD1-CD2 3.87Å; L657-L730 HydrophobicContact CD1-CG 4.26Å; L657-L730 HydrophobicContact CG-CD2 3.84Å; I660-L730 HydrophobicContact CD1-CD2 3.97Å; L719-L730 HydrophobicContact CD2-CB 4.21Å; A722-L730 HydrophobicContact CB-CD1 4.06Å; E726-L730 WeakPolarHBondContact O-CB 3.4Å; E726-L730 WeakPolarHBondContact O-CG 3.48Å; E726-L730 PolarHBondContact O-N 3.47Å; R727-L730 PolarHBondContact O-N 3.18Å; V728-L730 PolarHBondContact O-N 3.32Å; L730-A733 PolarHBondContact O-N 3.31Å; L730-L734 WeakPolarHBondContact O-CB 3.27Å; L730-L734 VanDerWaalsContact O-CG 3.32Å; L730-L734 WeakPolarHBondContact O-CG 3.37Å; L730-L734 PolarHBondContact O-N 3.24Å
731Q84.1Confident83.9Confident112 Ų11269.4 Ų69.452%0.52336%0.36SS..Hα-helixtrans-74.2-34.9-179.4-167.8163.2-7.200111.8R727 V728 K729 S735R727-Q731 WeakPolarHBondContact O-CB 3.36Å; R727-Q731 PolarHBondContact O-N 3.5Å; V728-Q731 PolarHBondContact O-N 3.01Å; K729-Q731 VanDerWaalsContact C-N 3.34Å; Q731-S735 WeakPolarHBondContact O-CB 3.45Å; Q731-S735 PolarHBondContact O-N 2.93Å; Q731-S735 PolarHBondContact O-OG 3.02Å
732E86.1Confident84.6Confident115 Ų11573.5 Ų73.554%0.53737%0.372SS..Hα-helixtrans-63.6-48.4167.9-73.7173.8161.100111.5V728 L734 S735 Q736V728-E732 HydrophobicContact CG1-CG 4.39Å; V728-E732 WeakPolarHBondContact O-CB 3.12Å; V728-E732 WeakPolarHBondContact O-CG 3.28Å; V728-E732 PolarHBondContact O-N 3.42Å; E732-L734 PolarHBondContact O-N 2.97Å; E732-S735 PolarHBondContact O-N 2.65Å; E732-S735 VanDerWaalsContact O-N 3.16Å; E732-Q736 PolarHBondContact O-N 2.63Å
733A87Confident85.5Confident15 Ų1576.9 Ų76.912%0.12439%0.386CS..Hα-helixtrans-62.7-40.5178.900000112.5I660 K729 L730 Q736 L737I660-A733 HydrophobicContact CG2-CB 4Å; K729-A733 VanDerWaalsContact O-CB 3.28Å; K729-A733 WeakPolarHBondContact O-CB 3.36Å; K729-A733 PolarHBondContact O-N 3.34Å; L730-A733 PolarHBondContact O-N 3.31Å; A733-Q736 PolarHBondContact O-N 2.87Å; A733-L737 WeakPolarHBondContact O-CB 3.36Å; A733-L737 PolarHBondContact O-N 3.26Å
734L87.3Confident86.1Confident1 Ų173.4 Ų73.41%0.00536%0.364CS..Hα-helixtrans-63.5-42.8171.7-78.2167000112.1Y656 I660 I711 K715 L730 E732 Q736 L737 D738Y656-L734 HydrophobicContact CE1-CD1 4.19Å; I660-L734 HydrophobicContact CD1-CD1 4.48Å; I660-L734 HydrophobicContact CD1-CD2 3.77Å; I660-L734 HydrophobicContact CD1-CG 3.74Å; I660-L734 HydrophobicContact CG1-CD2 3.98Å; I660-L734 HydrophobicContact CG1-CG 4.44Å; I711-L734 HydrophobicContact CG2-CD2 3.61Å; K715-L734 HydrophobicContact CD-CD1 3.88Å; K715-L734 HydrophobicContact CG-CD1 3.77Å; L730-L734 WeakPolarHBondContact O-CB 3.27Å; L730-L734 VanDerWaalsContact O-CG 3.32Å; L730-L734 WeakPolarHBondContact O-CG 3.37Å; L730-L734 PolarHBondContact O-N 3.24Å; E732-L734 PolarHBondContact O-N 2.97Å; L734-Q736 VanDerWaalsContact C-N 3.28Å; L734-Q736 PolarHBondContact O-N 3.5Å; L734-L737 PolarHBondContact O-N 2.83Å; L734-D738 WeakPolarHBondContact O-CB 3.38Å; L734-D738 PolarHBondContact O-N 3.13Å
735S85.7Confident86.6Confident71 Ų7170.2 Ų70.250%0.49734%0.342SS..Hα-helixtrans-65-34178.2-55.30000111.7Q731 E732 F739Q731-S735 WeakPolarHBondContact O-CB 3.45Å; Q731-S735 PolarHBondContact O-N 2.93Å; Q731-S735 PolarHBondContact O-OG 3.02Å; E732-S735 PolarHBondContact O-N 2.65Å; E732-S735 VanDerWaalsContact O-N 3.16Å; S735-F739 VanDerWaalsContact O-CB 3.29Å; S735-F739 WeakPolarHBondContact O-CB 3.41Å; S735-F739 PolarHBondContact O-N 2.93Å
736Q87.5Confident87.2Confident131 Ų13170.3 Ų70.361%0.61233%0.334SS*.Hα-helixtrans-68.2-43.1170.9-76.7-174.9-12.500112.3E732 A733 L734 F739 Q740E732-Q736 PolarHBondContact O-N 2.63Å; A733-Q736 PolarHBondContact O-N 2.87Å; L734-Q736 VanDerWaalsContact C-N 3.28Å; L734-Q736 PolarHBondContact O-N 3.5Å; Q736-F739 PolarHBondContact O-N 3.22Å; Q736-Q740 WeakPolarHBondContact O-CB 3.2Å; Q736-Q740 WeakPolarHBondContact O-CG 3.35Å; Q736-Q740 PolarHBondContact O-N 3.43Å
737L89.8Confident87.8Confident0 Ų068.6 Ų68.60%033%0.326CS..Hα-helixtrans-60.9-46.4175.8175.967.3000111.3I660 V663 S664 L667 I711 A733 L734 Q740 W741I660-L737 HydrophobicContact CG2-CB 4.23Å; I660-L737 HydrophobicContact CG2-CD2 4.23Å; V663-L737 HydrophobicContact CB-CD1 4.26Å; V663-L737 HydrophobicContact CG1-CD1 3.9Å; S664-L737 WeakPolarHBondContact OG-CD1 2.75Å; L667-L737 HydrophobicContact CD1-CD1 3.7Å; I711-L737 HydrophobicContact CD1-CD2 4.19Å; I711-L737 HydrophobicContact CG2-CD2 4.17Å; A733-L737 WeakPolarHBondContact O-CB 3.36Å; A733-L737 PolarHBondContact O-N 3.26Å; L734-L737 PolarHBondContact O-N 2.83Å; L737-Q740 PolarHBondContact O-N 3.23Å; L737-W741 WeakPolarHBondContact O-CB 3.49Å; L737-W741 PolarHBondContact O-N 3.41Å
738D89.3Confident88.4Confident47 Ų4764.7 Ų64.725%0.25131%0.312SS..Hα-helixtrans-61.6-44.1177.5-72.9-29.1000111.4H712 L734 W741 E742H712-D738 IonicContact CD2-OD1 3.94Å; H712-D738 IonicContact CE1-OD1 2.63Å; H712-D738 PolarHBondContact CE1-OD1 3.41Å; H712-D738 IonicContact CE1-OD2 3.93Å; H712-D738 PolarHBondContact CE1-OD2 3.38Å; H712-D738 VanDerWaalsContact CE1-OD2 3.26Å; H712-D738 IonicContact NE2-OD1 3.31Å; H712-D738 PolarHBondContact NE2-OD1 3.47Å; H712-D738 IonicContact NE2-OD2 3.3Å; L734-D738 WeakPolarHBondContact O-CB 3.38Å; L734-D738 PolarHBondContact O-N 3.13Å; D738-W741 PolarHBondContact O-N 3.11Å; D738-E742 PolarHBondContact O-N 2.86Å
739F88Confident88.7Confident141 Ų14166.6 Ų66.662%0.61831%0.313SS*.Hα-helixtrans-63.5-42.4175.3177.7-98.9000112.6S735 Q736 K743S735-F739 VanDerWaalsContact O-CB 3.29Å; S735-F739 WeakPolarHBondContact O-CB 3.41Å; S735-F739 PolarHBondContact O-N 2.93Å; Q736-F739 PolarHBondContact O-N 3.22Å; F739-K743 WeakPolarHBondContact O-CB 3.28Å; F739-K743 PolarHBondContact O-N 3.16Å
740Q89.4Confident88.9Confident41 Ų4163.9 Ų63.919%0.19231%0.305CS..Hα-helixtrans-62.9-43.2173.8-77.1-176.2-7.500111.2L667 Q736 L737 K743 V744L667-Q740 HydrophobicContact CD1-CB 4.1Å; Q736-Q740 WeakPolarHBondContact O-CB 3.2Å; Q736-Q740 WeakPolarHBondContact O-CG 3.35Å; Q736-Q740 PolarHBondContact O-N 3.43Å; L737-Q740 PolarHBondContact O-N 3.23Å; Q740-K743 PolarHBondContact O-N 3.45Å; Q740-V744 WeakPolarHBondContact O-CB 3.33Å; Q740-V744 VanDerWaalsContact O-CG2 3.26Å; Q740-V744 WeakPolarHBondContact O-CG2 3.21Å; Q740-V744 PolarHBondContact O-N 3.24Å
741W92.4Very high89.1Confident45 Ų4566.5 Ų66.517%0.1732%0.315CS..Hα-helixtrans-61.2-46177.9177.5-122.9000112.6L667 L701 I708 L737 D738 N745L667-W741 HydrophobicContact CD1-CB 3.9Å; L667-W741 HydrophobicContact CD1-CE3 4.27Å; L667-W741 HydrophobicContact CD2-CE3 3.58Å; L667-W741 HydrophobicContact CD2-CZ3 3.94Å; L701-W741 HydrophobicContact CB-CH2 4.42Å; L701-W741 HydrophobicContact CD2-CE3 4.35Å; L701-W741 HydrophobicContact CD2-CH2 4.1Å; L701-W741 HydrophobicContact CD2-CZ3 3.52Å; L701-W741 VanDerWaalsContact O-CH2 3.3Å; L701-W741 WeakPolarHBondContact O-CH2 3.38Å; I708-W741 HydrophobicContact CD1-CB 3.96Å; I708-W741 HydrophobicContact CD1-CD2 3.33Å; I708-W741 HydrophobicContact CD1-CE3 3.39Å; I708-W741 HydrophobicContact CD1-CG 3.61Å; I708-W741 HydrophobicContact CD1-CZ3 4.03Å; L737-W741 WeakPolarHBondContact O-CB 3.49Å; L737-W741 PolarHBondContact O-N 3.41Å; D738-W741 PolarHBondContact O-N 3.11Å; W741-N745 WeakPolarHBondContact CH2-ND2 3.38Å; W741-N745 VanDerWaalsContact CZ2-ND2 3.26Å; W741-N745 WeakPolarHBondContact CZ2-ND2 3.45Å; W741-N745 VanDerWaalsContact CZ3-ND2 3.34Å; W741-N745 WeakPolarHBondContact CZ3-ND2 3.42Å; W741-N745 WeakPolarHBondContact O-CB 3.43Å; W741-N745 PolarHBondContact O-N 2.92Å; W741-N745 PolarHBondContact O-ND2 3.24Å
742E89.4Confident89.4Confident146 Ų14663.3 Ų63.368%0.68230%0.3SS*.Hα-helixtrans-63.8-42.5174-74.1-161.1142.900112.2D738 N745 K746D738-E742 PolarHBondContact O-N 2.86Å; E742-N745 PolarHBondContact O-N 3.08Å; E742-K746 VanDerWaalsContact O-CB 3.27Å; E742-K746 WeakPolarHBondContact O-CB 3.31Å; E742-K746 PolarHBondContact O-N 3.49Å
743K92.2Very high89.4Confident78 Ų7858.7 Ų58.734%0.33928%0.284SS..Hα-helixtrans-59.6-51.7178.1-179.1-168.4172.1-158.30111.5E671 F739 Q740 K746 M747E671-K743 WeakPolarHBondContact OE1-CE 3.36Å; E671-K743 IonicContact OE1-NZ 3.76Å; E671-K743 PolarHBondContact OE1-NZ 2.93Å; E671-K743 WeakPolarHBondContact OE2-CE 3.39Å; E671-K743 IonicContact OE2-NZ 3.97Å; E671-K743 PolarHBondContact OE2-NZ 3.5Å; F739-K743 WeakPolarHBondContact O-CB 3.28Å; F739-K743 PolarHBondContact O-N 3.16Å; Q740-K743 PolarHBondContact O-N 3.45Å; K743-K746 WeakPolarHBondContact O-CB 3.49Å; K743-K746 PolarHBondContact O-N 3.04Å; K743-M747 HydrophobicContact CG-SD 4.13Å; K743-M747 WeakPolarHBondContact O-CG 3.47Å; K743-M747 PolarHBondContact O-N 3.5Å
744V91.4Very high89.4Confident0 Ų062 Ų620%029%0.293CS..Hα-helixtrans-66.2-41.3-178.9178.60000110.8V670 E671 L674 L701 Q740 K746 M747 Y748V670-V744 HydrophobicContact CB-CG1 4.03Å; V670-V744 HydrophobicContact CG1-CG1 3.52Å; E671-V744 HydrophobicContact CB-CG2 3.93Å; E671-V744 HydrophobicContact CG-CG2 4.21Å; L674-V744 HydrophobicContact CD1-CG1 3.65Å; L674-V744 WeakPolarHBondContact CD1-O 2.98Å; L701-V744 HydrophobicContact CD2-CG1 3.88Å; Q740-V744 WeakPolarHBondContact O-CB 3.33Å; Q740-V744 VanDerWaalsContact O-CG2 3.26Å; Q740-V744 WeakPolarHBondContact O-CG2 3.21Å; Q740-V744 PolarHBondContact O-N 3.24Å; V744-K746 VanDerWaalsContact C-N 3.34Å; V744-K746 PolarHBondContact O-N 3.34Å; V744-M747 PolarHBondContact O-N 3.01Å; V744-Y748 PolarHBondContact O-N 3.08Å
745N90.7Very high89.4Confident38 Ų3862.5 Ų62.520%0.20330%0.295CS..Hα-helixtrans-63.2-37.5173.6-87.7-84.2000113.1W741 E742 K749W741-N745 WeakPolarHBondContact CH2-ND2 3.38Å; W741-N745 VanDerWaalsContact CZ2-ND2 3.26Å; W741-N745 WeakPolarHBondContact CZ2-ND2 3.45Å; W741-N745 VanDerWaalsContact CZ3-ND2 3.34Å; W741-N745 WeakPolarHBondContact CZ3-ND2 3.42Å; W741-N745 WeakPolarHBondContact O-CB 3.43Å; W741-N745 PolarHBondContact O-N 2.92Å; W741-N745 PolarHBondContact O-ND2 3.24Å; E742-N745 PolarHBondContact O-N 3.08Å; N745-K749 WeakPolarHBondContact O-CB 3.45Å; N745-K749 WeakPolarHBondContact O-CG 3.14Å; N745-K749 PolarHBondContact O-N 2.79Å
746K91.3Very high89.5Confident105 Ų10563.1 Ų63.146%0.45729%0.293SS..Hα-helixtrans-65-46.5174.7-179.2-173.3171.2-165.90110.5E742 K743 V744 Y748 K749 D750E742-K746 VanDerWaalsContact O-CB 3.27Å; E742-K746 WeakPolarHBondContact O-CB 3.31Å; E742-K746 PolarHBondContact O-N 3.49Å; K743-K746 WeakPolarHBondContact O-CB 3.49Å; K743-K746 PolarHBondContact O-N 3.04Å; V744-K746 VanDerWaalsContact C-N 3.34Å; V744-K746 PolarHBondContact O-N 3.34Å; K746-Y748 PolarHBondContact O-N 3.06Å; K746-K749 PolarHBondContact O-N 3.31Å; K746-D750 WeakPolarHBondContact O-CB 3.26Å; K746-D750 PolarHBondContact O-N 3.3Å
747M92.1Very high89.5Confident39 Ų3962 Ų6219%0.19228%0.283CS..Hα-helixtrans-58.9-45.4175.7-72.6172.659.800111.7E671 L674 N675 K743 V744 D750 R751E671-M747 HydrophobicContact CG-CE 3.66Å; E671-M747 HydrophobicContact CG-SD 3.87Å; L674-M747 HydrophobicContact CB-CE 4.23Å; L674-M747 HydrophobicContact CD1-CB 3.94Å; N675-M747 WeakPolarHBondContact OD1-CE 3.3Å; K743-M747 HydrophobicContact CG-SD 4.13Å; K743-M747 WeakPolarHBondContact O-CG 3.47Å; K743-M747 PolarHBondContact O-N 3.5Å; V744-M747 PolarHBondContact O-N 3.01Å; M747-D750 PolarHBondContact O-N 2.85Å; M747-R751 WeakPolarHBondContact O-CB 3.17Å; M747-R751 VanDerWaalsContact O-CG 3.3Å; M747-R751 WeakPolarHBondContact O-CG 3.41Å; M747-R751 PolarHBondContact O-N 3.38Å
748Y92.6Very high89.4Confident27 Ų2762.3 Ų62.311%0.10629%0.285CS..Hα-helixtrans-60.5-46.6175172.4-108.9000112.8L674 L694 I697 K698 L701 V744 K746 D750 R751 Q752L674-Y748 HydrophobicContact CD2-CD2 4.14Å; L694-Y748 HydrophobicContact CB-CE2 4.38Å; L694-Y748 HydrophobicContact CD2-CD2 4Å; L694-Y748 HydrophobicContact CD2-CE2 3.82Å; L694-Y748 WeakPolarHBondContact O-CE2 3.43Å; I697-Y748 HydrophobicContact CG2-CD2 3.69Å; I697-Y748 HydrophobicContact CG2-CE2 4.3Å; I697-Y748 HydrophobicContact CG2-CG 4.39Å; K698-Y748 HydrophobicContact CB-CE2 4.24Å; K698-Y748 HydrophobicContact CG-CE1 4.41Å; L701-Y748 HydrophobicContact CD1-CD1 3.66Å; L701-Y748 HydrophobicContact CD1-CD2 4.11Å; L701-Y748 HydrophobicContact CD1-CE1 4.42Å; L701-Y748 HydrophobicContact CD1-CG 3.5Å; L701-Y748 VanDerWaalsContact CD1-CG 3.5Å; V744-Y748 PolarHBondContact O-N 3.08Å; K746-Y748 PolarHBondContact O-N 3.06Å; Y748-D750 VanDerWaalsContact C-N 3.32Å; Y748-D750 PolarHBondContact O-N 2.9Å; Y748-R751 PolarHBondContact O-N 3.02Å; Y748-Q752 HydrophobicContact CE2-CB 4.38Å; Y748-Q752 WeakPolarHBondContact O-CB 3.48Å; Y748-Q752 PolarHBondContact O-N 3.11Å; Y748-Q752 PolarHBondContact OH-OE1 2.84Å
749K89.7Confident89.3Confident120 Ų12061.1 Ų61.152%0.52228%0.279SS..Hα-helixtrans-61.8-39.6176.1-75.7176.9-179.71790112.7N745 K746 G753N745-K749 WeakPolarHBondContact O-CB 3.45Å; N745-K749 WeakPolarHBondContact O-CG 3.14Å; N745-K749 PolarHBondContact O-N 2.79Å; K746-K749 PolarHBondContact O-N 3.31Å; K749-G753 PolarHBondContact O-N 2.62Å
750D87.2Confident89.1Confident70 Ų7059.6 Ų59.637%0.37427%0.274SS..Hα-helixtrans-70.5-36.9-179.8-69-15.6000111R613 K746 M747 Y748 R754R613-D750 IonicContact CZ-OD1 3.54Å; R613-D750 IonicContact CZ-OD2 3.73Å; R613-D750 IonicContact NE-OD1 2.76Å; R613-D750 IonicContact NH2-OD1 3.54Å; R613-D750 PolarHBondContact NH2-OD1 2.97Å; R613-D750 IonicContact NH2-OD2 2.75Å; R613-D750 PolarHBondContact NH2-OD2 2.72Å; K746-D750 WeakPolarHBondContact O-CB 3.26Å; K746-D750 PolarHBondContact O-N 3.3Å; M747-D750 PolarHBondContact O-N 2.85Å; Y748-D750 VanDerWaalsContact C-N 3.32Å; Y748-D750 PolarHBondContact O-N 2.9Å; D750-R754 WeakPolarHBondContact O-CB 3.28Å; D750-R754 PolarHBondContact O-N 3.23Å; D750-R754 VanDerWaalsContact O-N 3.16Å
751R87.9Confident89Confident54 Ų5461.3 Ų61.320%0.20428%0.281CS..Hα-helixtrans-68.3-51.9171.9-68.7-73.4-173.3-154.4-13.8112.6L674 L679 C680 L694 M747 Y748 G753 R754 F755L674-R751 HydrophobicContact CD2-CB 4.41Å; L674-R751 HydrophobicContact CD2-CG 4.13Å; L674-R751 PolarHBondContact O-NE 3.43Å; L679-R751 WeakPolarHBondContact O-CD 3.39Å; L679-R751 PolarHBondContact O-NH1 3.05Å; C680-R751 VanDerWaalsContact SG-CZ 3.6Å; C680-R751 PolarHBondContact SG-NH2 2.93Å; L694-R751 HydrophobicContact CD2-CB 3.97Å; M747-R751 WeakPolarHBondContact O-CB 3.17Å; M747-R751 VanDerWaalsContact O-CG 3.3Å; M747-R751 WeakPolarHBondContact O-CG 3.41Å; M747-R751 PolarHBondContact O-N 3.38Å; Y748-R751 PolarHBondContact O-N 3.02Å; R751-G753 VanDerWaalsContact C-N 3.31Å; R751-G753 PolarHBondContact O-N 2.81Å; R751-R754 WeakPolarHBondContact O-CA 3.09Å; R751-R754 WeakPolarHBondContact O-CB 3.49Å; R751-R754 PolarHBondContact O-N 3.39Å; R751-F755 PolarHBondContact O-N 3.38Å
752Q89.8Confident88.7Confident45 Ų4562.5 Ų62.521%0.2129%0.285CS..Hα-helixtrans-56.6-46.6176.7-177.271.757.600110.8L694 Y748 R754 F755 D756L694-Q752 HydrophobicContact CD2-CB 4.47Å; Y748-Q752 HydrophobicContact CE2-CB 4.38Å; Y748-Q752 WeakPolarHBondContact O-CB 3.48Å; Y748-Q752 PolarHBondContact O-N 3.11Å; Y748-Q752 PolarHBondContact OH-OE1 2.84Å; Q752-R754 PolarHBondContact O-N 2.76Å; Q752-F755 PolarHBondContact O-N 3.45Å; Q752-D756 PolarHBondContact NE2-OD1 3Å; Q752-D756 PolarHBondContact O-N 3.4Å
753G87.5Confident88.6Confident19 Ų1963.1 Ų63.120%0.19628%0.282CS..Hα-helixtrans-67.9-18177.500000114.1K749 R751 R757K749-G753 PolarHBondContact O-N 2.62Å; R751-G753 VanDerWaalsContact C-N 3.31Å; R751-G753 PolarHBondContact O-N 2.81Å; G753-R757 WeakPolarHBondContact O-CG 3.1Å; G753-R757 PolarHBondContact O-NH1 3.49Å
754R86Confident88.2Confident84 Ų8466.6 Ų66.632%0.31729%0.292SS..Hα-helixtrans-76.7-54170.2-167.5176.3-173-159.9-3.4109.6D683 D750 R751 Q752 D756 R757 S758D683-R754 VanDerWaalsContact CG-NH2 3.29Å; D683-R754 VanDerWaalsContact OD1-CD 3.32Å; D683-R754 WeakPolarHBondContact OD1-CD 3.28Å; D683-R754 WeakPolarHBondContact OD1-CG 3.2Å; D683-R754 IonicContact OD1-CZ 3.97Å; D683-R754 IonicContact OD1-NE 3.87Å; D683-R754 PolarHBondContact OD1-NE 2.94Å; D683-R754 IonicContact OD1-NH2 2.71Å; D683-R754 PolarHBondContact OD1-NH2 2.73Å; D683-R754 IonicContact OD2-CZ 2.98Å; D683-R754 IonicContact OD2-NE 3.08Å; D683-R754 PolarHBondContact OD2-NE 3.03Å; D683-R754 IonicContact OD2-NH2 3.62Å; D683-R754 PolarHBondContact OD2-NH2 2.8Å; D750-R754 WeakPolarHBondContact O-CB 3.28Å; D750-R754 PolarHBondContact O-N 3.23Å; D750-R754 VanDerWaalsContact O-N 3.16Å; R751-R754 WeakPolarHBondContact O-CA 3.09Å; R751-R754 WeakPolarHBondContact O-CB 3.49Å; R751-R754 PolarHBondContact O-N 3.39Å; Q752-R754 PolarHBondContact O-N 2.76Å; R754-D756 PolarHBondContact O-N 2.79Å; R754-R757 WeakPolarHBondContact O-CB 3.47Å; R754-R757 PolarHBondContact O-N 2.87Å; R754-S758 PolarHBondContact O-N 3.5Å; R754-S758 VanDerWaalsContact O-N 3.1Å; R754-S758 PolarHBondContact O-OG 2.85Å
755F87.8Confident88.2Confident11 Ų1166.7 Ų66.75%0.04829%0.293CS..Hα-helixtrans-51.5-48.5174.3172.2-100000113.2L687 Q690 E691 L694 R751 Q752 R757 S758 V759L687-F755 HydrophobicContact CB-CE2 4.34Å; L687-F755 HydrophobicContact CD2-CD2 3.95Å; L687-F755 HydrophobicContact CD2-CE2 3.93Å; L687-F755 VanDerWaalsContact O-CE2 3.28Å; L687-F755 WeakPolarHBondContact O-CE2 3.38Å; Q690-F755 HydrophobicContact CB-CD2 3.76Å; Q690-F755 HydrophobicContact CB-CE2 4.03Å; E691-F755 HydrophobicContact CB-CE1 4.21Å; E691-F755 HydrophobicContact CB-CE2 4.06Å; E691-F755 HydrophobicContact CB-CZ 3.51Å; E691-F755 HydrophobicContact CG-CE1 4.06Å; E691-F755 HydrophobicContact CG-CZ 3.77Å; L694-F755 HydrophobicContact CD1-CB 3.55Å; L694-F755 HydrophobicContact CD1-CD1 3.94Å; L694-F755 HydrophobicContact CD1-CD2 4.35Å; L694-F755 HydrophobicContact CD1-CG 3.68Å; R751-F755 PolarHBondContact O-N 3.38Å; Q752-F755 PolarHBondContact O-N 3.45Å; F755-R757 PolarHBondContact O-N 3.4Å; F755-S758 WeakPolarHBondContact O-CB 3.37Å; F755-S758 PolarHBondContact O-N 2.86Å; F755-S758 VanDerWaalsContact O-N 3.1Å; F755-V759 HydrophobicContact CD1-CG2 4.31Å; F755-V759 HydrophobicContact CD2-CG2 4.08Å; F755-V759 HydrophobicContact CE1-CG2 3.83Å; F755-V759 HydrophobicContact CE2-CG2 3.55Å; F755-V759 HydrophobicContact CG-CG2 4.42Å; F755-V759 HydrophobicContact CZ-CG2 3.41Å; F755-V759 VanDerWaalsContact CZ-CG2 3.41Å; F755-V759 WeakPolarHBondContact O-CG2 3.46Å; F755-V759 PolarHBondContact O-N 3.39Å
756D87Confident87.9Confident85 Ų8569.2 Ų69.246%0.45530%0.303SS..Hα-helixtrans-58.5-34.8179.5-65-13.6000112.2Q752 R754 E760Q752-D756 PolarHBondContact NE2-OD1 3Å; Q752-D756 PolarHBondContact O-N 3.4Å; R754-D756 PolarHBondContact O-N 2.79Å; D756-E760 PolarHBondContact O-N 3.14Å
757R88.3Confident87.6Confident108 Ų10870.5 Ų70.541%0.40831%0.306SS..Hα-helixtrans-73-41.5176.1-73-170.4-61.7-84.6-4.2111.7G753 R754 F755 E760 K761G753-R757 WeakPolarHBondContact O-CG 3.1Å; G753-R757 PolarHBondContact O-NH1 3.49Å; R754-R757 WeakPolarHBondContact O-CB 3.47Å; R754-R757 PolarHBondContact O-N 2.87Å; F755-R757 PolarHBondContact O-N 3.4Å; R757-E760 PolarHBondContact O-N 2.65Å; R757-K761 PolarHBondContact O-N 3.14Å
758S86.6Confident87.5Confident5 Ų570 Ų704%0.03531%0.305CS..Hα-helixtrans-61.5-46.4176-53.20000111.5D683 F684 R754 F755 E760 K761 W762D683-S758 WeakPolarHBondContact O-CB 3.28Å; D683-S758 PolarHBondContact O-OG 3.38Å; F684-S758 VanDerWaalsContact CE1-O 3.31Å; F684-S758 WeakPolarHBondContact CE1-O 3.47Å; R754-S758 PolarHBondContact O-N 3.5Å; R754-S758 VanDerWaalsContact O-N 3.1Å; R754-S758 PolarHBondContact O-OG 2.85Å; F755-S758 WeakPolarHBondContact O-CB 3.37Å; F755-S758 PolarHBondContact O-N 2.86Å; F755-S758 VanDerWaalsContact O-N 3.1Å; S758-E760 VanDerWaalsContact C-N 3.32Å; S758-E760 PolarHBondContact O-N 3.43Å; S758-K761 PolarHBondContact O-N 2.95Å; S758-W762 VanDerWaalsContact O-CB 3.29Å; S758-W762 WeakPolarHBondContact O-CB 3.46Å; S758-W762 PolarHBondContact O-N 2.76Å
759V87.4Confident87.4Confident22 Ų2269.6 Ų69.613%0.13330%0.304CS..Hα-helixtrans-60.8-40.21781720000111.8L687 F755 R763L687-V759 HydrophobicContact CD2-CG2 4.3Å; F755-V759 HydrophobicContact CD1-CG2 4.31Å; F755-V759 HydrophobicContact CD2-CG2 4.08Å; F755-V759 HydrophobicContact CE1-CG2 3.83Å; F755-V759 HydrophobicContact CE2-CG2 3.55Å; F755-V759 HydrophobicContact CG-CG2 4.42Å; F755-V759 HydrophobicContact CZ-CG2 3.41Å; F755-V759 VanDerWaalsContact CZ-CG2 3.41Å; F755-V759 WeakPolarHBondContact O-CG2 3.46Å; F755-V759 PolarHBondContact O-N 3.39Å; V759-R763 HydrophobicContact CG1-CG 4.45Å; V759-R763 WeakPolarHBondContact O-CB 3.15Å; V759-R763 VanDerWaalsContact O-CG 3.26Å; V759-R763 WeakPolarHBondContact O-CG 3.44Å; V759-R763 PolarHBondContact O-N 3.1Å
760E84.1Confident87.3Confident110 Ų11071 Ų7151%0.51431%0.31SS..Hα-helixtrans-70.7-43.6178.2-170.859.8-159.300112.3D756 R757 S758 W762 R763 R764D756-E760 PolarHBondContact O-N 3.14Å; R757-E760 PolarHBondContact O-N 2.65Å; S758-E760 VanDerWaalsContact C-N 3.32Å; S758-E760 PolarHBondContact O-N 3.43Å; E760-W762 VanDerWaalsContact C-N 3.34Å; E760-W762 PolarHBondContact O-N 2.83Å; E760-R763 PolarHBondContact O-N 3.17Å; E760-R764 WeakPolarHBondContact O-CB 3.22Å; E760-R764 PolarHBondContact O-N 3.47Å
761K86.9Confident87.2Confident76 Ų7670.4 Ų70.433%0.3331%0.306SS..Hα-helixtrans-58.3-45.9172.8-78.5-164.3179.4-166.90111.1F684 R757 S758 R764 F765 E824F684-K761 HydrophobicContact CE1-CB 4.04Å; F684-K761 HydrophobicContact CZ-CB 4.14Å; F684-K761 HydrophobicContact CZ-CD 4.39Å; R757-K761 PolarHBondContact O-N 3.14Å; S758-K761 PolarHBondContact O-N 2.95Å; K761-R764 PolarHBondContact O-N 2.77Å; K761-F765 WeakPolarHBondContact O-CB 3.42Å; K761-F765 PolarHBondContact O-N 3.29Å; K761-E824 IonicContact NZ-OE1 3.81Å; K761-E824 PolarHBondContact NZ-OE1 2.83Å; K761-E824 IonicContact NZ-OE2 3.23Å; K761-E824 PolarHBondContact NZ-OE2 3.2Å
762W87.4Confident87.5Confident71 Ų7168 Ų6827%0.26930%0.297SS..Hα-helixtrans-61.1-47.8177.9-177.7-95000112.6F684 L687 S758 E760 R764 F765 H766 I825 L837F684-W762 HydrophobicContact CB-CE3 4.35Å; F684-W762 HydrophobicContact CD1-CB 4.2Å; F684-W762 HydrophobicContact CD1-CE3 4.06Å; F684-W762 HydrophobicContact CE1-CB 4.35Å; F684-W762 HydrophobicContact CG-CE3 4.42Å; L687-W762 HydrophobicContact CD1-CB 4.37Å; L687-W762 HydrophobicContact CD1-CD2 4.48Å; L687-W762 HydrophobicContact CD1-CG 4.23Å; S758-W762 VanDerWaalsContact O-CB 3.29Å; S758-W762 WeakPolarHBondContact O-CB 3.46Å; S758-W762 PolarHBondContact O-N 2.76Å; E760-W762 VanDerWaalsContact C-N 3.34Å; E760-W762 PolarHBondContact O-N 2.83Å; W762-R764 VanDerWaalsContact C-N 3.32Å; W762-R764 PolarHBondContact O-N 3.33Å; W762-F765 PolarHBondContact O-N 3.45Å; W762-H766 VanDerWaalsContact O-CB 3.31Å; W762-H766 WeakPolarHBondContact O-CB 3.33Å; W762-H766 PolarHBondContact O-N 2.89Å; W762-I825 HydrophobicContact CE3-CG2 3.72Å; W762-I825 HydrophobicContact CZ3-CG2 3.52Å; W762-L837 HydrophobicContact CH2-CD1 4.07Å; W762-L837 HydrophobicContact CH2-CD2 4.35Å; W762-L837 HydrophobicContact CZ3-CD1 3.86Å
763R85.9Confident87.5Confident159 Ų15968.7 Ų68.760%0.630%0.302SS*.Hα-helixtrans-59.8-42176.5-77174.4-174.8172.14.7112V759 E760 H766 Y767V759-R763 HydrophobicContact CG1-CG 4.45Å; V759-R763 WeakPolarHBondContact O-CB 3.15Å; V759-R763 VanDerWaalsContact O-CG 3.26Å; V759-R763 WeakPolarHBondContact O-CG 3.44Å; V759-R763 PolarHBondContact O-N 3.1Å; E760-R763 PolarHBondContact O-N 3.17Å; R763-H766 PolarHBondContact O-N 2.86Å; R763-Y767 VanDerWaalsContact O-CB 3.32Å; R763-Y767 WeakPolarHBondContact O-CB 3.41Å; R763-Y767 PolarHBondContact O-N 3.18Å
764R84.6Confident87.6Confident150 Ų15072.9 Ų72.957%0.56632%0.317SS*.Hα-helixtrans-62.3-53.6179.1-167.875.5-159.9-168.72.2111.2E760 K761 W762 H766 Y767 D768E760-R764 WeakPolarHBondContact O-CB 3.22Å; E760-R764 PolarHBondContact O-N 3.47Å; K761-R764 PolarHBondContact O-N 2.77Å; W762-R764 VanDerWaalsContact C-N 3.32Å; W762-R764 PolarHBondContact O-N 3.33Å; R764-H766 VanDerWaalsContact C-N 3.33Å; R764-H766 PolarHBondContact O-N 2.86Å; R764-Y767 WeakPolarHBondContact O-CB 3.34Å; R764-Y767 PolarHBondContact O-N 3.37Å; R764-D768 IonicContact NE-OD2 3.54Å; R764-D768 PolarHBondContact O-N 3.33Å
765F90.7Very high88Confident3 Ų370.6 Ų70.61%0.01331%0.308CS..Hα-helixtrans-55.7-45.8176.3172.3-108.8000112.3K761 W762 Y767 D768 I769 L818 I825 L837 L841K761-F765 WeakPolarHBondContact O-CB 3.42Å; K761-F765 PolarHBondContact O-N 3.29Å; W762-F765 PolarHBondContact O-N 3.45Å; F765-Y767 VanDerWaalsContact C-N 3.33Å; F765-Y767 PolarHBondContact O-N 3.26Å; F765-D768 PolarHBondContact O-N 2.99Å; F765-I769 HydrophobicContact CD1-CD1 4.23Å; F765-I769 HydrophobicContact CE1-CD1 3.6Å; F765-I769 HydrophobicContact CE2-CD1 3.96Å; F765-I769 HydrophobicContact CE2-CG1 4.27Å; F765-I769 HydrophobicContact CZ-CD1 3.46Å; F765-I769 VanDerWaalsContact CZ-CD1 3.46Å; F765-I769 HydrophobicContact CZ-CG1 4.26Å; F765-I769 PolarHBondContact O-N 3.33Å; F765-L818 HydrophobicContact CD2-CD2 3.78Å; F765-L818 HydrophobicContact CE2-CD2 3.87Å; F765-I825 HydrophobicContact CB-CD1 3.5Å; F765-I825 VanDerWaalsContact CB-CD1 3.5Å; F765-I825 HydrophobicContact CD1-CD1 3.56Å; F765-I825 HydrophobicContact CD2-CD1 4.1Å; F765-I825 HydrophobicContact CE1-CD1 4.23Å; F765-I825 HydrophobicContact CG-CD1 3.46Å; F765-I825 VanDerWaalsContact CG-CD1 3.46Å; F765-L837 HydrophobicContact CE1-CD2 3.9Å; F765-L837 HydrophobicContact CZ-CD2 4.45Å; F765-L841 HydrophobicContact CE2-CD1 3.86Å; F765-L841 HydrophobicContact CZ-CD1 3.84Å
766H84.6Confident88.2Confident91 Ų9170.1 Ų70.142%0.42131%0.306SS..Hα-helixtrans-71-26.5-178.7-153.2-46.7000113.4W762 R763 R764 K770W762-H766 VanDerWaalsContact O-CB 3.31Å; W762-H766 WeakPolarHBondContact O-CB 3.33Å; W762-H766 PolarHBondContact O-N 2.89Å; R763-H766 PolarHBondContact O-N 2.86Å; R764-H766 VanDerWaalsContact C-N 3.33Å; R764-H766 PolarHBondContact O-N 2.86Å; H766-K770 PolarHBondContact O-N 2.94Å
767Y85.7Confident88.3Confident131 Ų13168.5 Ų68.551%0.51430%0.299SS..Hα-helixtrans-72.2-46.5170.5175.3-97.7000111.5R763 R764 F765 I769 K770 I771R763-Y767 VanDerWaalsContact O-CB 3.32Å; R763-Y767 WeakPolarHBondContact O-CB 3.41Å; R763-Y767 PolarHBondContact O-N 3.18Å; R764-Y767 WeakPolarHBondContact O-CB 3.34Å; R764-Y767 PolarHBondContact O-N 3.37Å; F765-Y767 VanDerWaalsContact C-N 3.33Å; F765-Y767 PolarHBondContact O-N 3.26Å; Y767-I769 PolarHBondContact O-N 3.1Å; Y767-K770 WeakPolarHBondContact O-CB 3.11Å; Y767-K770 PolarHBondContact O-N 2.77Å; Y767-K770 VanDerWaalsContact O-N 3.11Å; Y767-I771 HydrophobicContact CD1-CD1 4.04Å; Y767-I771 HydrophobicContact CE1-CD1 3.4Å; Y767-I771 HydrophobicContact CE2-CD1 3.93Å; Y767-I771 PolarHBondContact O-N 2.99Å; Y767-I771 WeakPolarHBondContact OH-CD1 3.27Å
768D89.2Confident88.2Confident30 Ų3068.1 Ų68.116%0.1630%0.302CS..Hα-helixtrans-65.7-39.1179.6-67.1-28.6000111R764 F765 K770 I771 F772 L818R764-D768 IonicContact NE-OD2 3.54Å; R764-D768 PolarHBondContact O-N 3.33Å; F765-D768 PolarHBondContact O-N 2.99Å; D768-K770 VanDerWaalsContact C-N 3.31Å; D768-K770 PolarHBondContact O-N 3.4Å; D768-I771 PolarHBondContact O-N 3.04Å; D768-F772 VanDerWaalsContact O-CB 3.32Å; D768-F772 WeakPolarHBondContact O-CB 3.39Å; D768-F772 PolarHBondContact O-N 3.08Å; D768-L818 HydrophobicContact CB-CD2 4.06Å; D768-L818 HydrophobicContact CB-CG 4.2Å
769I90.5Very high88.2Confident18 Ų1868.1 Ų68.19%0.09230%0.302CS..Hα-helixtrans-54.5-47.9169.4-81.7-171.4000110.6F765 Y767 F772 N773 L818 L844F765-I769 HydrophobicContact CD1-CD1 4.23Å; F765-I769 HydrophobicContact CE1-CD1 3.6Å; F765-I769 HydrophobicContact CE2-CD1 3.96Å; F765-I769 HydrophobicContact CE2-CG1 4.27Å; F765-I769 HydrophobicContact CZ-CD1 3.46Å; F765-I769 VanDerWaalsContact CZ-CD1 3.46Å; F765-I769 HydrophobicContact CZ-CG1 4.26Å; F765-I769 PolarHBondContact O-N 3.33Å; Y767-I769 PolarHBondContact O-N 3.1Å; I769-F772 PolarHBondContact O-N 3.35Å; I769-N773 WeakPolarHBondContact O-CB 3.48Å; I769-N773 PolarHBondContact O-N 3.32Å; I769-L818 HydrophobicContact CB-CD2 4.36Å; I769-L818 HydrophobicContact CG1-CD2 3.47Å; I769-L818 VanDerWaalsContact CG1-CD2 3.47Å; I769-L844 HydrophobicContact CG1-CD1 4.35Å; I769-L844 HydrophobicContact CG2-CD1 4.2Å
770K87.6Confident88.4Confident149 Ų14969.1 Ų69.165%0.64831%0.306SS*.Hα-helixtrans-64.6-45.4-174.8-174.5-179178.7-178.40111.2H766 Y767 D768 Q774H766-K770 PolarHBondContact O-N 2.94Å; Y767-K770 WeakPolarHBondContact O-CB 3.11Å; Y767-K770 PolarHBondContact O-N 2.77Å; Y767-K770 VanDerWaalsContact O-N 3.11Å; D768-K770 VanDerWaalsContact C-N 3.31Å; D768-K770 PolarHBondContact O-N 3.4Å; K770-Q774 WeakPolarHBondContact O-CB 3.22Å; K770-Q774 PolarHBondContact O-N 3.49Å
771I86.2Confident88.2Confident58 Ų5868.8 Ų68.830%0.29730%0.304SS..Hα-helixtrans-66.5-41.4178.4-70.5-177.5000111.4Y767 D768 Q774 W775Y767-I771 HydrophobicContact CD1-CD1 4.04Å; Y767-I771 HydrophobicContact CE1-CD1 3.4Å; Y767-I771 HydrophobicContact CE2-CD1 3.93Å; Y767-I771 PolarHBondContact O-N 2.99Å; Y767-I771 WeakPolarHBondContact OH-CD1 3.27Å; D768-I771 PolarHBondContact O-N 3.04Å; I771-Q774 PolarHBondContact O-N 3.21Å; I771-W775 PolarHBondContact O-N 2.88Å; I771-W775 VanDerWaalsContact O-N 3.07Å
772F93.4Very high87.6Confident3 Ų366.3 Ų66.31%0.01329%0.293CS..Hα-helixtrans-66.9-42179.6-175.5-121.8000112.1D768 I769 W775 L776 R811 V814 V815 L818 L844 W848D768-F772 VanDerWaalsContact O-CB 3.32Å; D768-F772 WeakPolarHBondContact O-CB 3.39Å; D768-F772 PolarHBondContact O-N 3.08Å; I769-F772 PolarHBondContact O-N 3.35Å; F772-W775 HydrophobicContact CE2-CE3 4.24Å; F772-W775 PolarHBondContact O-N 3.05Å; F772-L776 HydrophobicContact CD1-CD1 3.96Å; F772-L776 HydrophobicContact CE1-CD1 3.5Å; F772-L776 VanDerWaalsContact CE1-CD1 3.5Å; F772-L776 HydrophobicContact CE1-CG 4.14Å; F772-L776 HydrophobicContact CE2-CD1 4.41Å; F772-L776 HydrophobicContact CE2-CD2 4.45Å; F772-L776 HydrophobicContact CE2-CG 4.15Å; F772-L776 HydrophobicContact CZ-CD1 3.74Å; F772-L776 HydrophobicContact CZ-CD2 4.1Å; F772-L776 HydrophobicContact CZ-CG 3.9Å; F772-L776 WeakPolarHBondContact O-CG 3.38Å; F772-L776 PolarHBondContact O-N 3.28Å; F772-R811 HydrophobicContact CE2-CB 4.28Å; F772-V814 HydrophobicContact CB-CG1 4.47Å; F772-V815 HydrophobicContact CD2-CG2 4.34Å; F772-V815 HydrophobicContact CE1-CG2 3.77Å; F772-V815 HydrophobicContact CE2-CG2 3.54Å; F772-V815 HydrophobicContact CZ-CG2 3.19Å; F772-L818 HydrophobicContact CB-CD1 3.72Å; F772-L818 HydrophobicContact CD1-CD1 3.9Å; F772-L818 HydrophobicContact CG-CD1 3.98Å; F772-L844 HydrophobicContact CD1-CB 4.43Å; F772-L844 HydrophobicContact CD1-CD2 4.35Å; F772-L844 HydrophobicContact CE1-CB 4.28Å; F772-W848 HydrophobicContact CE1-CB 4.42Å; F772-W848 HydrophobicContact CE2-CD2 4.42Å; F772-W848 AromaticContact CE2-CE3 3.67Å; F772-W848 HydrophobicContact CE2-CE3 3.67Å; F772-W848 HydrophobicContact CE2-CZ3 4.05Å; F772-W848 HydrophobicContact CZ-CB 3.9Å; F772-W848 AromaticContact CZ-CD2 3.93Å; F772-W848 HydrophobicContact CZ-CD2 3.93Å; F772-W848 AromaticContact CZ-CE3 3.57Å; F772-W848 HydrophobicContact CZ-CE3 3.57Å; F772-W848 HydrophobicContact CZ-CG 4.09Å; F772-W848 HydrophobicContact CZ-CZ3 4.38Å
773N90.5Very high87.2Confident59 Ų5963 Ų6332%0.31628%0.281SS..Hα-helixtrans-65.3-39176.7-167.21.3000112.8I769 L776 T777 L844 R847I769-N773 WeakPolarHBondContact O-CB 3.48Å; I769-N773 PolarHBondContact O-N 3.32Å; N773-L776 PolarHBondContact O-N 3.27Å; N773-T777 WeakPolarHBondContact O-CB 3.41Å; N773-T777 PolarHBondContact O-N 2.96Å; N773-T777 PolarHBondContact O-OG1 3.49Å; N773-L844 HydrophobicContact CB-CD2 3.81Å; N773-R847 PolarHBondContact OD1-NH1 3.35Å
774Q90Very high86.6Confident108 Ų10863.7 Ų63.751%0.50528%0.284SS..Hα-helixtrans-57.6-52171.9-178.575.242.400110.7K770 I771 L776 T777 E778K770-Q774 WeakPolarHBondContact O-CB 3.22Å; K770-Q774 PolarHBondContact O-N 3.49Å; I771-Q774 PolarHBondContact O-N 3.21Å; Q774-L776 PolarHBondContact O-N 3.16Å; Q774-T777 PolarHBondContact O-N 2.98Å; Q774-E778 WeakPolarHBondContact CG-OE1 3.46Å; Q774-E778 PolarHBondContact NE2-OE1 2.91Å; Q774-E778 WeakPolarHBondContact O-CG 3.32Å; Q774-E778 PolarHBondContact O-N 2.8Å
775W92.7Very high85.7Confident36 Ų3663 Ų6314%0.13628%0.284CS..Hα-helixtrans-63.7-40.3179.3-178.684.5000113I771 F772 T777 E778 A779 L804 I808 R811 W848 V851I771-W775 PolarHBondContact O-N 2.88Å; I771-W775 VanDerWaalsContact O-N 3.07Å; F772-W775 HydrophobicContact CE2-CE3 4.24Å; F772-W775 PolarHBondContact O-N 3.05Å; W775-T777 VanDerWaalsContact C-N 3.32Å; W775-T777 PolarHBondContact O-N 2.75Å; W775-E778 PolarHBondContact O-N 2.75Å; W775-A779 HydrophobicContact CH2-CB 4.44Å; W775-A779 HydrophobicContact CZ3-CB 4.43Å; W775-A779 WeakPolarHBondContact O-CB 3.43Å; W775-A779 PolarHBondContact O-N 3.48Å; W775-L804 HydrophobicContact CH2-CD2 4.44Å; W775-L804 HydrophobicContact CZ2-CD2 4.26Å; W775-I808 HydrophobicContact CH2-CG1 4.02Å; W775-R811 HydrophobicContact CD2-CG 3.7Å; W775-R811 HydrophobicContact CE3-CB 4.49Å; W775-R811 HydrophobicContact CE3-CG 3.92Å; W775-R811 HydrophobicContact CG-CG 4.26Å; W775-R811 HydrophobicContact CH2-CB 4.5Å; W775-R811 HydrophobicContact CH2-CG 4.21Å; W775-R811 HydrophobicContact CZ2-CG 3.99Å; W775-R811 HydrophobicContact CZ3-CB 4.4Å; W775-R811 HydrophobicContact CZ3-CG 4.18Å; W775-W848 HydrophobicContact CE3-CZ3 4.49Å; W775-W848 HydrophobicContact CH2-CE3 4.49Å; W775-W848 AromaticContact CH2-CZ3 3.81Å; W775-W848 HydrophobicContact CH2-CZ3 3.81Å; W775-W848 AromaticContact CZ3-CE3 3.86Å; W775-W848 HydrophobicContact CZ3-CE3 3.86Å; W775-W848 AromaticContact CZ3-CZ3 3.53Å; W775-W848 HydrophobicContact CZ3-CZ3 3.53Å; W775-V851 HydrophobicContact CH2-CG1 4.49Å
776L92.9Very high84.4Confident0 Ų063.3 Ų63.30%029%0.287CS..Hα-helixtrans-59.7-43.5173.8-80.4174.3000111.5F772 N773 Q774 E778 A779 E780 L844 R847 W848 V851F772-L776 HydrophobicContact CD1-CD1 3.96Å; F772-L776 HydrophobicContact CE1-CD1 3.5Å; F772-L776 VanDerWaalsContact CE1-CD1 3.5Å; F772-L776 HydrophobicContact CE1-CG 4.14Å; F772-L776 HydrophobicContact CE2-CD1 4.41Å; F772-L776 HydrophobicContact CE2-CD2 4.45Å; F772-L776 HydrophobicContact CE2-CG 4.15Å; F772-L776 HydrophobicContact CZ-CD1 3.74Å; F772-L776 HydrophobicContact CZ-CD2 4.1Å; F772-L776 HydrophobicContact CZ-CG 3.9Å; F772-L776 WeakPolarHBondContact O-CG 3.38Å; F772-L776 PolarHBondContact O-N 3.28Å; N773-L776 PolarHBondContact O-N 3.27Å; Q774-L776 PolarHBondContact O-N 3.16Å; L776-E778 VanDerWaalsContact C-N 3.34Å; L776-E778 PolarHBondContact O-N 3.19Å; L776-A779 PolarHBondContact O-N 2.63Å; L776-E780 WeakPolarHBondContact O-CB 3.16Å; L776-E780 WeakPolarHBondContact O-CG 3.31Å; L776-E780 PolarHBondContact O-N 2.94Å; L776-L844 HydrophobicContact CD1-CD2 3.79Å; L776-R847 HydrophobicContact CD1-CB 4.11Å; L776-W848 HydrophobicContact CD2-CB 4.22Å; L776-W848 HydrophobicContact CD2-CE3 4.27Å; L776-V851 HydrophobicContact CD2-CG2 4.14Å
777T89.5Confident82.9Confident51 Ų5164.9 Ų64.931%0.31329%0.294SS..Hα-helixtrans-66.1-37179.7-54.10000111.8N773 Q774 W775 Q781 R847N773-T777 WeakPolarHBondContact O-CB 3.41Å; N773-T777 PolarHBondContact O-N 2.96Å; N773-T777 PolarHBondContact O-OG1 3.49Å; Q774-T777 PolarHBondContact O-N 2.98Å; W775-T777 VanDerWaalsContact C-N 3.32Å; W775-T777 PolarHBondContact O-N 2.75Å; T777-Q781 WeakPolarHBondContact O-CB 3.28Å; T777-Q781 WeakPolarHBondContact O-CG 3.09Å; T777-Q781 PolarHBondContact O-N 3.17Å; T777-R847 PolarHBondContact OG1-NH2 2.63Å; T777-R847 VanDerWaalsContact OG1-NH2 3.08Å
778E85.4Confident81.3Confident100 Ų10061.6 Ų61.647%0.46729%0.285SS..Hα-helixtrans-66.1-44.8173.8-73162.8-167.400111.7Q774 W775 L776 Q781 F782Q774-E778 WeakPolarHBondContact CG-OE1 3.46Å; Q774-E778 PolarHBondContact NE2-OE1 2.91Å; Q774-E778 WeakPolarHBondContact O-CG 3.32Å; Q774-E778 PolarHBondContact O-N 2.8Å; W775-E778 PolarHBondContact O-N 2.75Å; L776-E778 VanDerWaalsContact C-N 3.34Å; L776-E778 PolarHBondContact O-N 3.19Å; E778-Q781 PolarHBondContact O-N 3.05Å; E778-F782 PolarHBondContact O-N 3.5Å
779A87.9Confident79.1Confident5 Ų565.4 Ų65.44%0.04131%0.312CS..Hα-helixtrans-61.6-46.9174.600000112.3W775 L776 F782 L783 L804 V851W775-A779 HydrophobicContact CH2-CB 4.44Å; W775-A779 HydrophobicContact CZ3-CB 4.43Å; W775-A779 WeakPolarHBondContact O-CB 3.43Å; W775-A779 PolarHBondContact O-N 3.48Å; L776-A779 PolarHBondContact O-N 2.63Å; A779-F782 PolarHBondContact O-N 2.95Å; A779-L783 WeakPolarHBondContact O-CB 3.24Å; A779-L783 VanDerWaalsContact O-CG 3.3Å; A779-L783 WeakPolarHBondContact O-CG 3.41Å; A779-L783 PolarHBondContact O-N 3.01Å; A779-L804 HydrophobicContact CB-CD2 3.89Å; A779-V851 HydrophobicContact CB-CG1 4.02Å; A779-V851 HydrophobicContact CB-CG2 4.44Å
780E90.1Very high77Confident44 Ų4472.2 Ų72.221%0.20634%0.343CS..Hα-helixtrans-62.8-42.8177.1-73.6166.316900112.2L776 F782 L783 R784 R847 V851L776-E780 WeakPolarHBondContact O-CB 3.16Å; L776-E780 WeakPolarHBondContact O-CG 3.31Å; L776-E780 PolarHBondContact O-N 2.94Å; E780-F782 VanDerWaalsContact C-N 3.31Å; E780-F782 PolarHBondContact O-N 3.45Å; E780-L783 PolarHBondContact O-N 3Å; E780-R784 WeakPolarHBondContact O-CG 3.28Å; E780-R784 PolarHBondContact O-N 2.65Å; E780-R847 WeakPolarHBondContact OE1-CB 3.48Å; E780-R847 WeakPolarHBondContact OE1-CG 3.43Å; E780-R847 IonicContact OE1-CZ 2.9Å; E780-R847 IonicContact OE1-NE 2.86Å; E780-R847 PolarHBondContact OE1-NE 2.99Å; E780-R847 IonicContact OE1-NH2 3.91Å; E780-R847 PolarHBondContact OE1-NH2 2.85Å; E780-R847 IonicContact OE2-CZ 2.9Å; E780-R847 IonicContact OE2-NE 3.18Å; E780-R847 PolarHBondContact OE2-NE 3.32Å; E780-R847 IonicContact OE2-NH2 3.46Å; E780-R847 PolarHBondContact OE2-NH2 2.72Å; E780-V851 HydrophobicContact CG-CG2 3.76Å
781Q81.6Confident74.9Confident103 Ų10370.6 Ų70.648%0.48134%0.341SS..Hα-helixtrans-62.5-38.6174.6-80.2-16920.400111.9T777 E778 R784 K785T777-Q781 WeakPolarHBondContact O-CB 3.28Å; T777-Q781 WeakPolarHBondContact O-CG 3.09Å; T777-Q781 PolarHBondContact O-N 3.17Å; E778-Q781 PolarHBondContact O-N 3.05Å; Q781-R784 PolarHBondContact O-N 2.76Å; Q781-K785 WeakPolarHBondContact O-CB 3.47Å; Q781-K785 VanDerWaalsContact O-CG 3.27Å; Q781-K785 WeakPolarHBondContact O-CG 3.4Å; Q781-K785 PolarHBondContact O-N 3.48Å
782F72.6Confident72.9Confident23 Ų2371.7 Ų71.710%0.10134%0.342CS..Hα-helixtrans-67.1-45.1175.6-178.2-91.3000111.9E778 A779 E780 R784 K785 T786 W792 Y797 Y800 L804E778-F782 PolarHBondContact O-N 3.5Å; A779-F782 PolarHBondContact O-N 2.95Å; E780-F782 VanDerWaalsContact C-N 3.31Å; E780-F782 PolarHBondContact O-N 3.45Å; F782-R784 PolarHBondContact O-N 3.25Å; F782-K785 PolarHBondContact O-N 3.1Å; F782-T786 HydrophobicContact CD1-CG2 4.31Å; F782-T786 HydrophobicContact CD2-CG2 4.39Å; F782-T786 HydrophobicContact CE1-CG2 3.79Å; F782-T786 HydrophobicContact CE2-CG2 3.88Å; F782-T786 HydrophobicContact CZ-CG2 3.54Å; F782-T786 PolarHBondContact O-N 3.4Å; F782-T786 PolarHBondContact O-OG1 2.99Å; F782-W792 HydrophobicContact CD2-CH2 4.43Å; F782-W792 AromaticContact CE2-CH2 3.77Å; F782-W792 HydrophobicContact CE2-CH2 3.77Å; F782-W792 HydrophobicContact CE2-CZ2 4.23Å; F782-W792 HydrophobicContact CE2-CZ3 4.18Å; F782-Y797 HydrophobicContact CE1-CE2 4.44Å; F782-Y797 HydrophobicContact CZ-CD2 4.33Å; F782-Y800 HydrophobicContact CD2-CD1 4.46Å; F782-Y800 HydrophobicContact CE2-CD1 4.02Å; F782-Y800 HydrophobicContact CE2-CD2 4.35Å; F782-Y800 AromaticContact CE2-CG 3.8Å; F782-Y800 HydrophobicContact CE2-CG 3.8Å; F782-Y800 VanDerWaalsContact CZ-CB 3.43Å; F782-Y800 HydrophobicContact CZ-CD1 4.35Å; F782-Y800 AromaticContact CZ-CG 3.95Å; F782-Y800 HydrophobicContact CZ-CG 3.95Å; F782-L804 HydrophobicContact CD1-CD1 3.4Å; F782-L804 HydrophobicContact CE1-CD1 3.88Å; F782-L804 HydrophobicContact CG-CD1 4.16Å
783L78.9Confident70.9Confident1 Ų177.5 Ų77.51%0.00537%0.369CS..Hα-helixtrans-62.4-27.1176.3-70.6169.3000112.4A779 E780 V851 Q854 R858A779-L783 WeakPolarHBondContact O-CB 3.24Å; A779-L783 VanDerWaalsContact O-CG 3.3Å; A779-L783 WeakPolarHBondContact O-CG 3.41Å; A779-L783 PolarHBondContact O-N 3.01Å; E780-L783 PolarHBondContact O-N 3Å; L783-V851 HydrophobicContact CD1-CB 4.29Å; L783-V851 HydrophobicContact CD1-CG1 4.05Å; L783-V851 HydrophobicContact CD1-CG2 4.12Å; L783-Q854 HydrophobicContact CD1-CB 4.1Å; L783-Q854 HydrophobicContact CD2-CB 4.34Å; L783-R858 VanDerWaalsContact CD2-NH1 3.27Å; L783-R858 VanDerWaalsContact O-CZ 3.22Å; L783-R858 PolarHBondContact O-NH1 3.44Å; L783-R858 PolarHBondContact O-NH2 3.22Å
784R74.3Confident69.3Low175 Ų17578.4 Ų78.466%0.6637%0.371SS*.Hα-helixtrans-77.6-49168.2-69.6-179.4-171.3-173.64112.8E780 Q781 F782 T786 Q787E780-R784 WeakPolarHBondContact O-CG 3.28Å; E780-R784 PolarHBondContact O-N 2.65Å; Q781-R784 PolarHBondContact O-N 2.76Å; F782-R784 PolarHBondContact O-N 3.25Å; R784-T786 PolarHBondContact O-N 3.03Å; R784-Q787 WeakPolarHBondContact O-CB 3.49Å; R784-Q787 PolarHBondContact O-N 3.07Å
785K65.7Low67.8Low134 Ų13476.5 Ų76.558%0.58337%0.374SS*.Hα-helixtrans-59.4-21.1-180-76.4171.4-176.9170.70114.4Q781 F782 W792Q781-K785 WeakPolarHBondContact O-CB 3.47Å; Q781-K785 VanDerWaalsContact O-CG 3.27Å; Q781-K785 WeakPolarHBondContact O-CG 3.4Å; Q781-K785 PolarHBondContact O-N 3.48Å; F782-K785 PolarHBondContact O-N 3.1Å; K785-W792 PolarHBondContact O-NE1 2.97Å
786T62.5Low66.3Low10 Ų1080.2 Ų80.26%0.06139%0.391CS..THydrogen-bonded Turntrans-104.120.617855.80000112.9F782 R784 W792 Y797 R858F782-T786 HydrophobicContact CD1-CG2 4.31Å; F782-T786 HydrophobicContact CD2-CG2 4.39Å; F782-T786 HydrophobicContact CE1-CG2 3.79Å; F782-T786 HydrophobicContact CE2-CG2 3.88Å; F782-T786 HydrophobicContact CZ-CG2 3.54Å; F782-T786 PolarHBondContact O-N 3.4Å; F782-T786 PolarHBondContact O-OG1 2.99Å; R784-T786 PolarHBondContact O-N 3.03Å; T786-W792 HydrophobicContact CG2-CD2 4.25Å; T786-W792 HydrophobicContact CG2-CZ2 4.1Å; T786-Y797 HydrophobicContact CG2-CD2 3.78Å; T786-Y797 HydrophobicContact CG2-CE2 3.64Å; T786-R858 PolarHBondContact O-NH2 3.31Å; T786-R858 PolarHBondContact OG1-NH2 3.34Å
787Q53.8Low64.9Low124 Ų12481.7 Ų81.758%0.57940%0.397SS*.SBendtrans-84.1-21.9175.7-161.11591.800112R784R784-Q787 WeakPolarHBondContact O-CB 3.49Å; R784-Q787 PolarHBondContact O-N 3.07Å
788I51.1Low64Low63 Ų6385.1 Ų85.132%0.32341%0.407SS..SBendtrans-100.3112.3172.2-55.5170.4000108.1E790I788-E790 PolarHBondContact O-N 3.45Å
789P44.9Very low63.4Low110 Ų11087.5 Ų87.571%0.71441%0.412SS*.G310 helixtrans-68.7-30.2-171.1-23.434.9000115.5N791P789-N791 VanDerWaalsContact C-N 3.28Å; P789-N791 PolarHBondContact O-N 3.14Å; P789-N791 VanDerWaalsContact O-N 3.17Å
790E45.4Very low62.6Low161 Ų16191.8 Ų91.875%0.75243%0.428SS*.G310 helixtrans-68-19.1-162.4-62.6175.1158.500115.1I788I788-E790 PolarHBondContact O-N 3.45Å
791N43.9Very low62Low114 Ų11490.6 Ų90.661%0.6142%0.423SS*.G310 helixtrans-99.87.6-169.9-80.8-51000115.6P789P789-N791 VanDerWaalsContact C-N 3.28Å; P789-N791 PolarHBondContact O-N 3.14Å; P789-N791 VanDerWaalsContact O-N 3.17Å
792W43.2Very low61.8Low81 Ų8192.1 Ų92.131%0.30743%0.428SS..SBendtrans-124.5123.5-175.3-74.984.3000113.7F782 K785 T786 H794 K796F782-W792 HydrophobicContact CD2-CH2 4.43Å; F782-W792 AromaticContact CE2-CH2 3.77Å; F782-W792 HydrophobicContact CE2-CH2 3.77Å; F782-W792 HydrophobicContact CE2-CZ2 4.23Å; F782-W792 HydrophobicContact CE2-CZ3 4.18Å; K785-W792 PolarHBondContact O-NE1 2.97Å; T786-W792 HydrophobicContact CG2-CD2 4.25Å; T786-W792 HydrophobicContact CG2-CZ2 4.1Å; W792-H794 PolarHBondContact O-N 3.43Å; W792-K796 HydrophobicContact CE3-CB 4.49Å
793E52.8Low62Low126 Ų12695.4 Ų95.459%0.58944%0.443SS*.  trans-54.6121.2165.4-72.7175.3154.700110.1A795 K796 Y797E793-A795 PolarHBondContact O-N 3.16Å; E793-A795 VanDerWaalsContact O-N 3.09Å; E793-K796 HydrophobicContact CB-CB 4.48Å; E793-K796 HydrophobicContact CB-CD 4.44Å; E793-K796 WeakPolarHBondContact O-CB 3.31Å; E793-K796 PolarHBondContact O-N 3.27Å; E793-K796 VanDerWaalsContact OE2-CD 3.28Å; E793-K796 WeakPolarHBondContact OE2-CD 3.38Å; E793-K796 WeakPolarHBondContact OE2-CE 3.33Å; E793-K796 IonicContact OE2-NZ 3.01Å; E793-K796 PolarHBondContact OE2-NZ 3.41Å; E793-Y797 PolarHBondContact O-N 3.02Å; E793-Y797 VanDerWaalsContact O-N 3.13Å
794H55.6Low62.1Low78 Ų7896.1 Ų96.136%0.36145%0.447SS..Hα-helixtrans-59.8-32.4-167.2-145.465.8000113.4W792 Y797 K798 P938W792-H794 PolarHBondContact O-N 3.43Å; H794-Y797 PolarHBondContact O-N 2.93Å; H794-K798 WeakPolarHBondContact O-CB 3.37Å; H794-K798 PolarHBondContact O-N 3.46Å; H794-P938 WeakPolarHBondContact CE1-CB 3.45Å; H794-P938 WeakPolarHBondContact CE1-CG 3.4Å; H794-P938 WeakPolarHBondContact NE2-CG 3.4Å
795A60.1Low62.4Low67 Ų6792 Ų9255%0.55444%0.435SS*.Hα-helixtrans-63.9-41.1173.900000113.3E793 W799E793-A795 PolarHBondContact O-N 3.16Å; E793-A795 VanDerWaalsContact O-N 3.09Å; A795-W799 WeakPolarHBondContact O-CB 3.41Å; A795-W799 PolarHBondContact O-N 3.37Å
796K60.3Low62.9Low114 Ų11489.8 Ų89.850%0.49643%0.43SS..Hα-helixtrans-67.4-42.1175.1-78.3177.7-179.9145.10111W792 E793 W799 Y800W792-K796 HydrophobicContact CE3-CB 4.49Å; E793-K796 HydrophobicContact CB-CB 4.48Å; E793-K796 HydrophobicContact CB-CD 4.44Å; E793-K796 WeakPolarHBondContact O-CB 3.31Å; E793-K796 PolarHBondContact O-N 3.27Å; E793-K796 VanDerWaalsContact OE2-CD 3.28Å; E793-K796 WeakPolarHBondContact OE2-CD 3.38Å; E793-K796 WeakPolarHBondContact OE2-CE 3.33Å; E793-K796 IonicContact OE2-NZ 3.01Å; E793-K796 PolarHBondContact OE2-NZ 3.41Å; K796-W799 PolarHBondContact O-N 3.3Å; K796-Y800 PolarHBondContact O-N 3.47Å
797Y63.9Low63.7Low32 Ų3289.9 Ų89.913%0.12543%0.433CS..Hα-helixtrans-60.5-47.1177.8-176.7-121000111.9F782 T786 E793 H794 W799 Y800 L801 R858 L862F782-Y797 HydrophobicContact CE1-CE2 4.44Å; F782-Y797 HydrophobicContact CZ-CD2 4.33Å; T786-Y797 HydrophobicContact CG2-CD2 3.78Å; T786-Y797 HydrophobicContact CG2-CE2 3.64Å; E793-Y797 PolarHBondContact O-N 3.02Å; E793-Y797 VanDerWaalsContact O-N 3.13Å; H794-Y797 PolarHBondContact O-N 2.93Å; Y797-W799 PolarHBondContact O-N 3.04Å; Y797-Y800 PolarHBondContact O-N 3.39Å; Y797-L801 HydrophobicContact CD1-CD1 4.05Å; Y797-L801 HydrophobicContact CE1-CD1 3.56Å; Y797-L801 HydrophobicContact CE1-CG 4.33Å; Y797-L801 HydrophobicContact CE2-CD1 4.21Å; Y797-L801 HydrophobicContact CE2-CD2 4.41Å; Y797-L801 HydrophobicContact CE2-CG 4.1Å; Y797-L801 PolarHBondContact O-N 3.33Å; Y797-R858 WeakPolarHBondContact OH-CD 3.44Å; Y797-R858 PolarHBondContact OH-NE 2.98Å; Y797-L862 HydrophobicContact CD1-CD1 4.29Å; Y797-L862 HydrophobicContact CE1-CD1 3.95Å
798K70.1Confident65.1Low123 Ų12385.2 Ų85.254%0.53541%0.412SS..Hα-helixtrans-66-35.7178.1-166.3168.3-173.41700113H794 K802H794-K798 WeakPolarHBondContact O-CB 3.37Å; H794-K798 PolarHBondContact O-N 3.46Å; K798-K802 PolarHBondContact O-N 3.26Å
799W73.8Confident66.3Low149 Ų14984.4 Ų84.456%0.56442%0.419SS*.Hα-helixtrans-66.2-47.4173.4-176.989.4000111.7A795 K796 Y797 K802 E803A795-W799 WeakPolarHBondContact O-CB 3.41Å; A795-W799 PolarHBondContact O-N 3.37Å; K796-W799 PolarHBondContact O-N 3.3Å; Y797-W799 PolarHBondContact O-N 3.04Å; W799-K802 WeakPolarHBondContact O-CA 3.2Å; W799-K802 WeakPolarHBondContact O-CB 3.48Å; W799-K802 PolarHBondContact O-N 3.37Å; W799-K802 VanDerWaalsContact O-N 3.09Å; W799-E803 HydrophobicContact CH2-CB 4.49Å; W799-E803 HydrophobicContact CH2-CG 4.45Å; W799-E803 WeakPolarHBondContact CH2-OE2 3.44Å; W799-E803 HydrophobicContact CZ3-CB 4.36Å; W799-E803 VanDerWaalsContact CZ3-OE2 3.26Å; W799-E803 WeakPolarHBondContact CZ3-OE2 3.21Å; W799-E803 PolarHBondContact O-N 3.36Å
800Y69Low67.8Low96 Ų9686 Ų8638%0.37642%0.417SS..Hα-helixtrans-67-37.3179.2-102.8-72.5000113.4F782 K796 Y797 K802 E803 L804F782-Y800 HydrophobicContact CD2-CD1 4.46Å; F782-Y800 HydrophobicContact CE2-CD1 4.02Å; F782-Y800 HydrophobicContact CE2-CD2 4.35Å; F782-Y800 AromaticContact CE2-CG 3.8Å; F782-Y800 HydrophobicContact CE2-CG 3.8Å; F782-Y800 VanDerWaalsContact CZ-CB 3.43Å; F782-Y800 HydrophobicContact CZ-CD1 4.35Å; F782-Y800 AromaticContact CZ-CG 3.95Å; F782-Y800 HydrophobicContact CZ-CG 3.95Å; K796-Y800 PolarHBondContact O-N 3.47Å; Y797-Y800 PolarHBondContact O-N 3.39Å; Y800-K802 PolarHBondContact O-N 3.11Å; Y800-E803 WeakPolarHBondContact CD1-OE2 3.45Å; Y800-E803 WeakPolarHBondContact CE1-OE2 3.48Å; Y800-E803 PolarHBondContact O-N 3.07Å; Y800-L804 WeakPolarHBondContact O-CB 3.32Å; Y800-L804 PolarHBondContact O-N 3.41Å
801L77.8Confident69.7Low19 Ų1981.5 Ų81.510%0.09939%0.393CS..Hα-helixtrans-58.1-36.1171.2-80.9176.5000111.5Y797 Q805 L855 R858 L862Y797-L801 HydrophobicContact CD1-CD1 4.05Å; Y797-L801 HydrophobicContact CE1-CD1 3.56Å; Y797-L801 HydrophobicContact CE1-CG 4.33Å; Y797-L801 HydrophobicContact CE2-CD1 4.21Å; Y797-L801 HydrophobicContact CE2-CD2 4.41Å; Y797-L801 HydrophobicContact CE2-CG 4.1Å; Y797-L801 PolarHBondContact O-N 3.33Å; L801-Q805 WeakPolarHBondContact O-CB 3.44Å; L801-Q805 PolarHBondContact O-N 3.24Å; L801-L855 HydrophobicContact CD2-CD1 3.56Å; L801-R858 HydrophobicContact CD2-CB 4.49Å; L801-L862 HydrophobicContact CD1-CD1 3.79Å
802K79.2Confident71.7Confident134 Ų13480.1 Ų80.158%0.58338%0.383SS*.Hα-helixtrans-72.6-42.5175.7-171.7165.9-178.5174.70112.3K798 W799 Y800 L804 Q805 D806K798-K802 PolarHBondContact O-N 3.26Å; W799-K802 WeakPolarHBondContact O-CA 3.2Å; W799-K802 WeakPolarHBondContact O-CB 3.48Å; W799-K802 PolarHBondContact O-N 3.37Å; W799-K802 VanDerWaalsContact O-N 3.09Å; Y800-K802 PolarHBondContact O-N 3.11Å; K802-L804 VanDerWaalsContact C-N 3.29Å; K802-L804 PolarHBondContact O-N 3.3Å; K802-Q805 WeakPolarHBondContact O-CB 3.45Å; K802-Q805 PolarHBondContact O-N 3.44Å; K802-Q805 VanDerWaalsContact O-N 3.08Å; K802-D806 PolarHBondContact O-N 2.92Å
803E76.4Confident73.6Confident92 Ų9279.9 Ų79.943%0.4339%0.391SS..Hα-helixtrans-59-40.5173.5-170.6-179.9-142.500111.7W799 Y800 G807W799-E803 HydrophobicContact CH2-CB 4.49Å; W799-E803 HydrophobicContact CH2-CG 4.45Å; W799-E803 WeakPolarHBondContact CH2-OE2 3.44Å; W799-E803 HydrophobicContact CZ3-CB 4.36Å; W799-E803 VanDerWaalsContact CZ3-OE2 3.26Å; W799-E803 WeakPolarHBondContact CZ3-OE2 3.21Å; W799-E803 PolarHBondContact O-N 3.36Å; Y800-E803 WeakPolarHBondContact CD1-OE2 3.45Å; Y800-E803 WeakPolarHBondContact CE1-OE2 3.48Å; Y800-E803 PolarHBondContact O-N 3.07Å; E803-G807 PolarHBondContact O-N 3.46Å
804L81.3Confident75.2Confident17 Ų1775.6 Ų75.69%0.08937%0.373CS..Hα-helixtrans-63.6-40.8172.4-110.4155.6000112.5W775 A779 F782 Y800 K802 G807 I808 L855W775-L804 HydrophobicContact CH2-CD2 4.44Å; W775-L804 HydrophobicContact CZ2-CD2 4.26Å; A779-L804 HydrophobicContact CB-CD2 3.89Å; F782-L804 HydrophobicContact CD1-CD1 3.4Å; F782-L804 HydrophobicContact CE1-CD1 3.88Å; F782-L804 HydrophobicContact CG-CD1 4.16Å; Y800-L804 WeakPolarHBondContact O-CB 3.32Å; Y800-L804 PolarHBondContact O-N 3.41Å; K802-L804 VanDerWaalsContact C-N 3.29Å; K802-L804 PolarHBondContact O-N 3.3Å; L804-G807 PolarHBondContact O-N 3.31Å; L804-I808 WeakPolarHBondContact O-CG1 3.38Å; L804-I808 PolarHBondContact O-N 2.99Å; L804-L855 HydrophobicContact CB-CD1 3.91Å; L804-L855 HydrophobicContact CB-CD2 4.45Å; L804-L855 HydrophobicContact CD1-CD1 4.5Å
805Q80.1Confident76.7Confident87 Ų8772.4 Ų72.441%0.40736%0.359SS..Hα-helixtrans-66.6-44.2178-159.4-169.6-59.900111.7L801 K802 G807 I808 L855 K859L801-Q805 WeakPolarHBondContact O-CB 3.44Å; L801-Q805 PolarHBondContact O-N 3.24Å; K802-Q805 WeakPolarHBondContact O-CB 3.45Å; K802-Q805 PolarHBondContact O-N 3.44Å; K802-Q805 VanDerWaalsContact O-N 3.08Å; Q805-G807 VanDerWaalsContact C-N 3.32Å; Q805-I808 PolarHBondContact O-N 3.45Å; Q805-L855 HydrophobicContact CB-CD2 3.96Å; Q805-L855 HydrophobicContact CG-CD2 4.19Å; Q805-K859 VanDerWaalsContact OE1-NZ 3.1Å
806D75.3Confident78Confident88 Ų8876.7 Ų76.747%0.47136%0.361SS..Hα-helixtrans-67.6-35.8176.7-64.6-19.6000110.6K802 G809 Q810K802-D806 PolarHBondContact O-N 2.92Å; D806-G809 PolarHBondContact O-N 3.47Å; D806-Q810 PolarHBondContact O-N 3.35Å
807G79.8Confident79.3Confident12 Ų1275 Ų7512%0.12436%0.36CS..Hα-helixtrans-62.9-38.5172.500000113.9E803 L804 Q805 G809 Q810 R811E803-G807 PolarHBondContact O-N 3.46Å; L804-G807 PolarHBondContact O-N 3.31Å; Q805-G807 VanDerWaalsContact C-N 3.32Å; G807-G809 VanDerWaalsContact C-N 3.32Å; G807-G809 PolarHBondContact O-N 3.22Å; G807-Q810 PolarHBondContact O-N 3.21Å; G807-R811 WeakPolarHBondContact O-CB 3.4Å; G807-R811 VanDerWaalsContact O-CG 3.32Å; G807-R811 WeakPolarHBondContact O-CG 3.41Å; G807-R811 PolarHBondContact O-N 3.01Å
808I82.9Confident80.5Confident26 Ų2673.7 Ų73.713%0.13336%0.355CS..Hα-helixtrans-58.5-43.6174.5-78.5175.8000110.9W775 L804 Q805 Q810 R811 Q812 W848 C852 L855W775-I808 HydrophobicContact CH2-CG1 4.02Å; L804-I808 WeakPolarHBondContact O-CG1 3.38Å; L804-I808 PolarHBondContact O-N 2.99Å; Q805-I808 PolarHBondContact O-N 3.45Å; I808-Q810 VanDerWaalsContact C-N 3.3Å; I808-Q810 PolarHBondContact O-N 2.87Å; I808-R811 PolarHBondContact O-N 3.08Å; I808-R811 VanDerWaalsContact O-N 3.16Å; I808-Q812 WeakPolarHBondContact O-CB 3.42Å; I808-Q812 PolarHBondContact O-N 3.27Å; I808-W848 HydrophobicContact CB-CH2 4.09Å; I808-W848 HydrophobicContact CG1-CH2 4.09Å; I808-W848 HydrophobicContact CG1-CZ3 4.27Å; I808-W848 HydrophobicContact CG2-CH2 3.78Å; I808-W848 HydrophobicContact CG2-CZ2 4.06Å; I808-W848 WeakPolarHBondContact O-CH2 2.91Å; I808-C852 HydrophobicContact CD1-CB 4.49Å; I808-L855 HydrophobicContact CD1-CB 4.45Å; I808-L855 HydrophobicContact CD1-CD2 3.54Å
809G75.5Confident81.4Confident47 Ų4770.1 Ų70.149%0.48534%0.342SS..Hα-helixtrans-57.5-42.317800000113D806 G807D806-G809 PolarHBondContact O-N 3.47Å; G807-G809 VanDerWaalsContact C-N 3.32Å; G807-G809 PolarHBondContact O-N 3.22Å
810Q76.8Confident82.1Confident144 Ų14466.2 Ų66.267%0.67334%0.341SS*.Hα-helixtrans-72.4-35.3177.1-60.5-18021.400112.8D806 G807 I808 T813D806-Q810 PolarHBondContact O-N 3.35Å; G807-Q810 PolarHBondContact O-N 3.21Å; I808-Q810 VanDerWaalsContact C-N 3.3Å; I808-Q810 PolarHBondContact O-N 2.87Å; Q810-T813 PolarHBondContact O-OG1 3.47Å
811R84.9Confident82.9Confident65 Ų6563.6 Ų63.625%0.24534%0.336CS..Hα-helixtrans-79.2-25.3-179.3-67.6-61.8-176.5-154-3113.3F772 W775 G807 I808 T813 V814 V815 W848F772-R811 HydrophobicContact CE2-CB 4.28Å; W775-R811 HydrophobicContact CD2-CG 3.7Å; W775-R811 HydrophobicContact CE3-CB 4.49Å; W775-R811 HydrophobicContact CE3-CG 3.92Å; W775-R811 HydrophobicContact CG-CG 4.26Å; W775-R811 HydrophobicContact CH2-CB 4.5Å; W775-R811 HydrophobicContact CH2-CG 4.21Å; W775-R811 HydrophobicContact CZ2-CG 3.99Å; W775-R811 HydrophobicContact CZ3-CB 4.4Å; W775-R811 HydrophobicContact CZ3-CG 4.18Å; G807-R811 WeakPolarHBondContact O-CB 3.4Å; G807-R811 VanDerWaalsContact O-CG 3.32Å; G807-R811 WeakPolarHBondContact O-CG 3.41Å; G807-R811 PolarHBondContact O-N 3.01Å; I808-R811 PolarHBondContact O-N 3.08Å; I808-R811 VanDerWaalsContact O-N 3.16Å; R811-T813 VanDerWaalsContact C-N 3.27Å; R811-T813 PolarHBondContact O-N 3.09Å; R811-V814 WeakPolarHBondContact O-CA 3.39Å; R811-V814 WeakPolarHBondContact O-CB 3.36Å; R811-V814 PolarHBondContact O-N 3.34Å; R811-V815 WeakPolarHBondContact O-CG2 3.5Å; R811-V815 PolarHBondContact O-N 3.38Å; R811-W848 HydrophobicContact CB-CH2 3.75Å; R811-W848 HydrophobicContact CB-CZ3 3.56Å
812Q87.3Confident83.5Confident85 Ų8562.7 Ų62.740%0.39733%0.331SS..Hα-helixtrans-63.6-31.5179.1-164.1172.51200112.8I808 R816 W848I808-Q812 WeakPolarHBondContact O-CB 3.42Å; I808-Q812 PolarHBondContact O-N 3.27Å; Q812-R816 WeakPolarHBondContact O-CG 3.42Å; Q812-R816 PolarHBondContact O-N 3.34Å; Q812-R816 VanDerWaalsContact O-N 3.15Å; Q812-W848 HydrophobicContact CB-CH2 4.26Å; Q812-W848 HydrophobicContact CB-CZ2 3.87Å; Q812-W848 HydrophobicContact CG-CZ2 4.12Å
813T83.1Confident83.9Confident77 Ų7760.1 Ų60.147%0.47232%0.321SS..Hα-helixtrans-67.9-40.3170.439.50000111.9Q810 R811 V815 R816 T817Q810-T813 PolarHBondContact O-OG1 3.47Å; R811-T813 VanDerWaalsContact C-N 3.27Å; R811-T813 PolarHBondContact O-N 3.09Å; T813-V815 PolarHBondContact O-N 3Å; T813-R816 PolarHBondContact O-N 3.12Å; T813-T817 PolarHBondContact O-N 2.85Å; T813-T817 PolarHBondContact O-OG1 3.01Å; T813-T817 VanDerWaalsContact O-OG1 3.06Å
814V86Confident84.4Confident36 Ų3658.7 Ų58.722%0.21831%0.314CS..Hα-helixtrans-61.2-42.4174.2-177.80000111.3F772 R811 T817 L818F772-V814 HydrophobicContact CB-CG1 4.47Å; R811-V814 WeakPolarHBondContact O-CA 3.39Å; R811-V814 WeakPolarHBondContact O-CB 3.36Å; R811-V814 PolarHBondContact O-N 3.34Å; V814-T817 PolarHBondContact O-N 2.82Å; V814-L818 HydrophobicContact CG1-CD1 4.09Å; V814-L818 WeakPolarHBondContact O-CB 3.33Å; V814-L818 PolarHBondContact O-N 3.46Å
815V88.2Confident84.8Confident10 Ų1058 Ų586%0.06131%0.31CS..Hα-helixtrans-60.4-46.4175.7175.40000111.8F772 R811 T813 T817 L818 N819 N845 W848F772-V815 HydrophobicContact CD2-CG2 4.34Å; F772-V815 HydrophobicContact CE1-CG2 3.77Å; F772-V815 HydrophobicContact CE2-CG2 3.54Å; F772-V815 HydrophobicContact CZ-CG2 3.19Å; R811-V815 WeakPolarHBondContact O-CG2 3.5Å; R811-V815 PolarHBondContact O-N 3.38Å; T813-V815 PolarHBondContact O-N 3Å; V815-T817 VanDerWaalsContact C-N 3.35Å; V815-T817 PolarHBondContact O-N 3.46Å; V815-L818 PolarHBondContact O-N 3.48Å; V815-N819 WeakPolarHBondContact O-CB 3.42Å; V815-N819 VanDerWaalsContact O-CG 3.28Å; V815-N819 PolarHBondContact O-N 3.28Å; V815-N845 WeakPolarHBondContact CG1-OD1 3.31Å; V815-W848 HydrophobicContact CG2-CD2 3.87Å; V815-W848 HydrophobicContact CG2-CE3 4.19Å; V815-W848 HydrophobicContact CG2-CG 4.16Å; V815-W848 HydrophobicContact CG2-CZ2 4.42Å
816R86.5Confident85.2Confident158 Ų15854.5 Ų54.560%0.59629%0.294SS*.Hα-helixtrans-60.5-44.1176.5-68.2179.3-156.9160.76111.8Q812 T813 N819 A820Q812-R816 WeakPolarHBondContact O-CG 3.42Å; Q812-R816 PolarHBondContact O-N 3.34Å; Q812-R816 VanDerWaalsContact O-N 3.15Å; T813-R816 PolarHBondContact O-N 3.12Å; R816-N819 PolarHBondContact O-N 3.04Å; R816-A820 WeakPolarHBondContact O-CB 3.43Å; R816-A820 PolarHBondContact O-N 3.35Å
817T87Confident85.7Confident77 Ų7756.6 Ų56.647%0.47230%0.301SS..Hα-helixtrans-65.8-41.1178.3-53.80000111.9T813 V814 V815 T821T813-T817 PolarHBondContact O-N 2.85Å; T813-T817 PolarHBondContact O-OG1 3.01Å; T813-T817 VanDerWaalsContact O-OG1 3.06Å; V814-T817 PolarHBondContact O-N 2.82Å; V815-T817 VanDerWaalsContact C-N 3.35Å; V815-T817 PolarHBondContact O-N 3.46Å; T817-T821 WeakPolarHBondContact O-CB 3.44Å; T817-T821 PolarHBondContact O-N 2.89Å; T817-T821 PolarHBondContact O-OG1 3.09Å
818L89.1Confident86.1Confident5 Ų559.2 Ų59.23%0.02631%0.31CS..Hα-helixtrans-63.2-40.8174.6-93.3170.8000112.7F765 D768 I769 F772 V814 V815 G822F765-L818 HydrophobicContact CD2-CD2 3.78Å; F765-L818 HydrophobicContact CE2-CD2 3.87Å; D768-L818 HydrophobicContact CB-CD2 4.06Å; D768-L818 HydrophobicContact CB-CG 4.2Å; I769-L818 HydrophobicContact CB-CD2 4.36Å; I769-L818 HydrophobicContact CG1-CD2 3.47Å; I769-L818 VanDerWaalsContact CG1-CD2 3.47Å; F772-L818 HydrophobicContact CB-CD1 3.72Å; F772-L818 HydrophobicContact CD1-CD1 3.9Å; F772-L818 HydrophobicContact CG-CD1 3.98Å; V814-L818 HydrophobicContact CG1-CD1 4.09Å; V814-L818 WeakPolarHBondContact O-CB 3.33Å; V814-L818 PolarHBondContact O-N 3.46Å; V815-L818 PolarHBondContact O-N 3.48Å; L818-G822 WeakPolarHBondContact O-CA 3.49Å; L818-G822 PolarHBondContact O-N 3.39Å
819N89.7Confident86.3Confident49 Ų4958 Ų5826%0.26230%0.304SS..Hα-helixtrans-68.7-47.7178.1-69.7-13.9000110.7V815 R816 G822 E823 N845V815-N819 WeakPolarHBondContact O-CB 3.42Å; V815-N819 VanDerWaalsContact O-CG 3.28Å; V815-N819 PolarHBondContact O-N 3.28Å; R816-N819 PolarHBondContact O-N 3.04Å; N819-G822 PolarHBondContact O-N 3.12Å; N819-E823 PolarHBondContact O-N 3.33Å; N819-N845 PolarHBondContact ND2-ND2 2.93Å; N819-N845 PolarHBondContact ND2-OD1 3.1Å; N819-N845 PolarHBondContact OD1-ND2 3.37Å; N819-N845 PolarHBondContact OD1-OD1 2.93Å
820A88.4Confident86.5Confident66 Ų6656.5 Ų56.555%0.54529%0.286SS..Hα-helixtrans-61.1-48177.700000113R816 G822 E824R816-A820 WeakPolarHBondContact O-CB 3.43Å; R816-A820 PolarHBondContact O-N 3.35Å; A820-G822 VanDerWaalsContact C-N 3.34Å; A820-E824 PolarHBondContact O-N 2.8Å; A820-E824 VanDerWaalsContact O-N 3.1Å
821T86.7Confident86.6Confident42 Ų4258.8 Ų58.826%0.25829%0.294SS..Hα-helixtrans-71.3-29.3177.151.80000112.9T817 I825T817-T821 WeakPolarHBondContact O-CB 3.44Å; T817-T821 PolarHBondContact O-N 2.89Å; T817-T821 PolarHBondContact O-OG1 3.09Å; T821-I825 WeakPolarHBondContact O-CB 3.29Å; T821-I825 WeakPolarHBondContact O-CD1 3.38Å; T821-I825 WeakPolarHBondContact O-CG1 3.41Å; T821-I825 PolarHBondContact O-N 3.01Å
822G89.3Confident86.3Confident0 Ų060.4 Ų60.40%031%0.311CS..Hα-helixtrans-64.6-49.4172.300000111.9L818 N819 A820 E824 I825 I826L818-G822 WeakPolarHBondContact O-CA 3.49Å; L818-G822 PolarHBondContact O-N 3.39Å; N819-G822 PolarHBondContact O-N 3.12Å; A820-G822 VanDerWaalsContact C-N 3.34Å; G822-E824 VanDerWaalsContact C-N 3.35Å; G822-E824 PolarHBondContact O-N 3.22Å; G822-I825 PolarHBondContact O-N 3.44Å; G822-I826 VanDerWaalsContact O-CB 3.29Å; G822-I826 WeakPolarHBondContact O-CB 3.21Å; G822-I826 WeakPolarHBondContact O-CD1 3.47Å; G822-I826 WeakPolarHBondContact O-CG1 3.19Å; G822-I826 PolarHBondContact O-N 3.04Å
823E88.4Confident85.9Confident79 Ų7959.4 Ų59.437%0.36931%0.309SS..Hα-helixtrans-61.3-42.5177-136.166.6-140.500111.5N819 I825 I826 Q827N819-E823 PolarHBondContact O-N 3.33Å; E823-I825 PolarHBondContact O-N 2.88Å; E823-I826 PolarHBondContact O-N 3.5Å; E823-Q827 WeakPolarHBondContact O-CG 3.36Å; E823-Q827 PolarHBondContact O-N 2.68Å
824E87Confident85.9Confident63 Ų6356.5 Ų56.529%0.29429%0.292SS..Hα-helixtrans-57.5-48.6174.8-162.2-152.2140.700111.5K761 A820 G822 Q828K761-E824 IonicContact NZ-OE1 3.81Å; K761-E824 PolarHBondContact NZ-OE1 2.83Å; K761-E824 IonicContact NZ-OE2 3.23Å; K761-E824 PolarHBondContact NZ-OE2 3.2Å; A820-E824 PolarHBondContact O-N 2.8Å; A820-E824 VanDerWaalsContact O-N 3.1Å; G822-E824 VanDerWaalsContact C-N 3.35Å; G822-E824 PolarHBondContact O-N 3.22Å; E824-Q828 PolarHBondContact O-N 3.24Å
825I89.4Confident85.8Confident2 Ų258.1 Ų58.11%0.0131%0.305CS..Hα-helixtrans-67-42.2179-70.3167.2000110.8F684 W762 F765 T821 G822 E823 Q827 Q828 S829 L837F684-I825 HydrophobicContact CD1-CG1 4.42Å; F684-I825 HydrophobicContact CD2-CB 4.28Å; F684-I825 HydrophobicContact CD2-CG1 4.2Å; F684-I825 HydrophobicContact CD2-CG2 4.12Å; F684-I825 HydrophobicContact CE1-CG1 4Å; F684-I825 HydrophobicContact CE2-CB 4.25Å; F684-I825 HydrophobicContact CE2-CG1 3.79Å; F684-I825 HydrophobicContact CG-CG2 4.13Å; F684-I825 HydrophobicContact CZ-CG1 3.68Å; W762-I825 HydrophobicContact CE3-CG2 3.72Å; W762-I825 HydrophobicContact CZ3-CG2 3.52Å; F765-I825 HydrophobicContact CB-CD1 3.5Å; F765-I825 VanDerWaalsContact CB-CD1 3.5Å; F765-I825 HydrophobicContact CD1-CD1 3.56Å; F765-I825 HydrophobicContact CD2-CD1 4.1Å; F765-I825 HydrophobicContact CE1-CD1 4.23Å; F765-I825 HydrophobicContact CG-CD1 3.46Å; F765-I825 VanDerWaalsContact CG-CD1 3.46Å; T821-I825 WeakPolarHBondContact O-CB 3.29Å; T821-I825 WeakPolarHBondContact O-CD1 3.38Å; T821-I825 WeakPolarHBondContact O-CG1 3.41Å; T821-I825 PolarHBondContact O-N 3.01Å; G822-I825 PolarHBondContact O-N 3.44Å; E823-I825 PolarHBondContact O-N 2.88Å; I825-Q827 PolarHBondContact O-N 3.25Å; I825-Q828 CarbonylContact O-C 3.58Å; I825-Q828 VanDerWaalsContact O-C 3.27Å; I825-Q828 PolarHBondContact O-N 3.31Å; I825-Q828 VanDerWaalsContact O-N 3.15Å; I825-S829 VanDerWaalsContact O-CB 3.26Å; I825-S829 WeakPolarHBondContact O-CB 3.47Å; I825-S829 PolarHBondContact O-N 3.22Å; I825-S829 PolarHBondContact O-OG 3.47Å; I825-L837 HydrophobicContact CG2-CD1 3.63Å
826I87.4Confident85.4Confident13 Ų1361.4 Ų61.47%0.06732%0.322CS..Hα-helixtrans-59.2-46.5177.8-76.2165.2000110.6G822 E823 Q828 S829 A834 L837 Q838 L841G822-I826 VanDerWaalsContact O-CB 3.29Å; G822-I826 WeakPolarHBondContact O-CB 3.21Å; G822-I826 WeakPolarHBondContact O-CD1 3.47Å; G822-I826 WeakPolarHBondContact O-CG1 3.19Å; G822-I826 PolarHBondContact O-N 3.04Å; E823-I826 PolarHBondContact O-N 3.5Å; I826-Q828 VanDerWaalsContact C-N 3.28Å; I826-Q828 PolarHBondContact O-N 2.89Å; I826-S829 PolarHBondContact O-N 3.24Å; I826-A834 HydrophobicContact CG2-CB 3.96Å; I826-L837 HydrophobicContact CD1-CB 4.11Å; I826-L837 HydrophobicContact CG1-CB 3.72Å; I826-L837 HydrophobicContact CG1-CD1 4.32Å; I826-Q838 HydrophobicContact CD1-CB 3.94Å; I826-Q838 HydrophobicContact CD1-CG 4.23Å; I826-L841 HydrophobicContact CD1-CD2 4.45Å
827Q87.1Confident85.4Confident133 Ų13354.5 Ų54.562%0.62130%0.297SS*.Hα-helixtrans-61.1-37.4175.6-72.7-174.815.600112.4K682 E823 I825K682-Q827 WeakPolarHBondContact CE-O 3.37Å; K682-Q827 PolarHBondContact NZ-O 3.17Å; E823-Q827 WeakPolarHBondContact O-CG 3.36Å; E823-Q827 PolarHBondContact O-N 2.68Å; I825-Q827 PolarHBondContact O-N 3.25Å
828Q88Confident85.4Confident66 Ų6655.8 Ų55.831%0.30830%0.297SS..THydrogen-bonded Turntrans-95.717.2-178.9-65.6-63.1-18.800114.2K682 D683 F684 E824 I825 I826K682-Q828 WeakPolarHBondContact CB-O 3.31Å; D683-Q828 HydrophobicContact CB-CB 4.25Å; D683-Q828 PolarHBondContact N-O 3.23Å; F684-Q828 HydrophobicContact CD2-CB 3.46Å; F684-Q828 VanDerWaalsContact CD2-CB 3.46Å; F684-Q828 HydrophobicContact CE2-CB 3.63Å; F684-Q828 HydrophobicContact CE2-CG 4.42Å; F684-Q828 PolarHBondContact N-O 2.79Å; E824-Q828 PolarHBondContact O-N 3.24Å; I825-Q828 CarbonylContact O-C 3.58Å; I825-Q828 VanDerWaalsContact O-C 3.27Å; I825-Q828 PolarHBondContact O-N 3.31Å; I825-Q828 VanDerWaalsContact O-N 3.15Å; I826-Q828 VanDerWaalsContact C-N 3.28Å; I826-Q828 PolarHBondContact O-N 2.89Å
829S85.7Confident85.2Confident1 Ų162.6 Ų62.61%0.00733%0.329CS..SBendtrans-108168.8175.4-68.30000112.6K682 I825 I826K682-S829 WeakPolarHBondContact CD-O 3.34Å; K682-S829 PolarHBondContact NZ-O 3.16Å; I825-S829 VanDerWaalsContact O-CB 3.26Å; I825-S829 WeakPolarHBondContact O-CB 3.47Å; I825-S829 PolarHBondContact O-N 3.22Å; I825-S829 PolarHBondContact O-OG 3.47Å; I826-S829 PolarHBondContact O-N 3.24Å
830S80.8Confident84.9Confident15 Ų1565.5 Ų65.511%0.10534%0.339CS..  trans-59.2155.5165.488.80000110.3E685 T832 D833 A834E685-S830 VanDerWaalsContact OE1-CA 3.22Å; E685-S830 WeakPolarHBondContact OE1-CA 3.44Å; E685-S830 WeakPolarHBondContact OE1-CB 3.11Å; S830-T832 PolarHBondContact O-N 2.94Å; S830-T832 PolarHBondContact OG-N 2.9Å; S830-D833 WeakPolarHBondContact CB-OD2 3.36Å; S830-D833 PolarHBondContact O-N 3.35Å; S830-D833 VanDerWaalsContact OG-CG 3.27Å; S830-D833 PolarHBondContact OG-N 2.71Å; S830-D833 VanDerWaalsContact OG-N 3.07Å; S830-D833 PolarHBondContact OG-OD2 2.84Å; S830-A834 WeakPolarHBondContact O-CB 3.25Å; S830-A834 PolarHBondContact O-N 3.42Å
831K78.4Confident85Confident192 Ų19262.8 Ų62.884%0.83532%0.316SS*.Hα-helixtrans-59-32.2177.3-74.2-172.8175.7-175.70112.9S835K831-S835 PolarHBondContact O-N 3.08Å
832T78.5Confident85.1Confident99 Ų9962.3 Ų62.361%0.60732%0.319SS*.Hα-helixtrans-73.5-48.2-179-45.80000110.9S830 S835 I836S830-T832 PolarHBondContact O-N 2.94Å; S830-T832 PolarHBondContact OG-N 2.9Å; T832-S835 WeakPolarHBondContact O-CB 3.49Å; T832-S835 PolarHBondContact O-N 3.25Å; T832-I836 HydrophobicContact CG2-CD1 4.3Å; T832-I836 WeakPolarHBondContact O-CG1 3.48Å; T832-I836 PolarHBondContact O-N 3.48Å; T832-I836 VanDerWaalsContact O-N 3.14Å
833D78.5Confident85Confident65 Ų6565.3 Ų65.335%0.34834%0.34SS..Hα-helixtrans-69.1-39179.4-58.7-55.2000111.3S830 S835 I836 L837S830-D833 WeakPolarHBondContact CB-OD2 3.36Å; S830-D833 PolarHBondContact O-N 3.35Å; S830-D833 VanDerWaalsContact OG-CG 3.27Å; S830-D833 PolarHBondContact OG-N 2.71Å; S830-D833 VanDerWaalsContact OG-N 3.07Å; S830-D833 PolarHBondContact OG-OD2 2.84Å; D833-S835 VanDerWaalsContact C-N 3.33Å; D833-S835 PolarHBondContact O-N 3.4Å; D833-I836 PolarHBondContact O-N 3.3Å; D833-L837 WeakPolarHBondContact O-CB 3.43Å; D833-L837 VanDerWaalsContact O-CG 3.28Å; D833-L837 WeakPolarHBondContact O-CG 3.42Å; D833-L837 PolarHBondContact O-N 3.27Å
834A83.7Confident85.1Confident15 Ų1562.1 Ų62.112%0.12433%0.325CS..Hα-helixtrans-52.7-49.5171.800000111.4I826 S830 L837 Q838I826-A834 HydrophobicContact CG2-CB 3.96Å; S830-A834 WeakPolarHBondContact O-CB 3.25Å; S830-A834 PolarHBondContact O-N 3.42Å; A834-L837 PolarHBondContact O-N 2.85Å; A834-Q838 VanDerWaalsContact O-CB 3.28Å; A834-Q838 WeakPolarHBondContact O-CB 3.47Å; A834-Q838 PolarHBondContact O-N 3.3Å
835S83.2Confident85.3Confident71 Ų7160.7 Ų60.750%0.49732%0.32SS..Hα-helixtrans-59.3-49176.7-1750000112.5K831 T832 D833 L837 Q838 E839K831-S835 PolarHBondContact O-N 3.08Å; T832-S835 WeakPolarHBondContact O-CB 3.49Å; T832-S835 PolarHBondContact O-N 3.25Å; D833-S835 VanDerWaalsContact C-N 3.33Å; D833-S835 PolarHBondContact O-N 3.4Å; S835-L837 VanDerWaalsContact C-N 3.32Å; S835-L837 PolarHBondContact O-N 3.28Å; S835-Q838 PolarHBondContact O-N 3.17Å; S835-E839 PolarHBondContact O-N 3.43Å
836I81.2Confident85.3Confident79 Ų7966.3 Ų66.341%0.40535%0.349SS..Hα-helixtrans-63.5-38.4-179.8-65.7164.7000111.6T832 D833 K840T832-I836 HydrophobicContact CG2-CD1 4.3Å; T832-I836 WeakPolarHBondContact O-CG1 3.48Å; T832-I836 PolarHBondContact O-N 3.48Å; T832-I836 VanDerWaalsContact O-N 3.14Å; D833-I836 PolarHBondContact O-N 3.3Å; I836-K840 PolarHBondContact O-N 2.96Å; I836-K840 VanDerWaalsContact O-N 3.09Å
837L86.5Confident85.7Confident13 Ų1368.3 Ų68.37%0.06836%0.356CS..Hα-helixtrans-68.4-43.7175.6-73.6179.1000111.4W762 F765 I825 I826 D833 A834 S835 E839 K840 L841W762-L837 HydrophobicContact CH2-CD1 4.07Å; W762-L837 HydrophobicContact CH2-CD2 4.35Å; W762-L837 HydrophobicContact CZ3-CD1 3.86Å; F765-L837 HydrophobicContact CE1-CD2 3.9Å; F765-L837 HydrophobicContact CZ-CD2 4.45Å; I825-L837 HydrophobicContact CG2-CD1 3.63Å; I826-L837 HydrophobicContact CD1-CB 4.11Å; I826-L837 HydrophobicContact CG1-CB 3.72Å; I826-L837 HydrophobicContact CG1-CD1 4.32Å; D833-L837 WeakPolarHBondContact O-CB 3.43Å; D833-L837 VanDerWaalsContact O-CG 3.28Å; D833-L837 WeakPolarHBondContact O-CG 3.42Å; D833-L837 PolarHBondContact O-N 3.27Å; A834-L837 PolarHBondContact O-N 2.85Å; S835-L837 VanDerWaalsContact C-N 3.32Å; S835-L837 PolarHBondContact O-N 3.28Å; L837-E839 VanDerWaalsContact C-N 3.35Å; L837-E839 PolarHBondContact O-N 2.87Å; L837-K840 PolarHBondContact O-N 2.67Å; L837-L841 WeakPolarHBondContact O-CB 3.49Å; L837-L841 PolarHBondContact O-N 3.02Å
838Q86.7Confident86.1Confident104 Ų10463 Ų6349%0.48633%0.33SS..Hα-helixtrans-64.4-38.6178.9-154.4167.641.100111.4I826 A834 S835 L841 G842I826-Q838 HydrophobicContact CD1-CB 3.94Å; I826-Q838 HydrophobicContact CD1-CG 4.23Å; A834-Q838 VanDerWaalsContact O-CB 3.28Å; A834-Q838 WeakPolarHBondContact O-CB 3.47Å; A834-Q838 PolarHBondContact O-N 3.3Å; S835-Q838 PolarHBondContact O-N 3.17Å; Q838-L841 PolarHBondContact O-N 3.1Å; Q838-G842 PolarHBondContact O-N 3.41Å
839E84.7Confident86.2Confident147 Ų14765.9 Ų65.969%0.68734%0.343SS*.Hα-helixtrans-63.7-45.1172-170-177.2-17600111.9S835 L837 G842 S843S835-E839 PolarHBondContact O-N 3.43Å; L837-E839 VanDerWaalsContact C-N 3.35Å; L837-E839 PolarHBondContact O-N 2.87Å; E839-G842 PolarHBondContact O-N 3.07Å; E839-S843 WeakPolarHBondContact O-CB 3.21Å; E839-S843 PolarHBondContact O-N 3.05Å
840K84.1Confident86.2Confident111 Ų11169.7 Ų69.748%0.48336%0.361SS..Hα-helixtrans-62.6-43.9174.9-89.1178.5176169.80112.8I836 L837 S843 L844I836-K840 PolarHBondContact O-N 2.96Å; I836-K840 VanDerWaalsContact O-N 3.09Å; L837-K840 PolarHBondContact O-N 2.67Å; K840-S843 PolarHBondContact O-N 2.88Å; K840-L844 WeakPolarHBondContact O-CG 3.11Å; K840-L844 PolarHBondContact O-N 3.25Å
841L89.8Confident86.6Confident9 Ų969.1 Ų69.15%0.04736%0.357CS..Hα-helixtrans-64.6-46178.2-134.974000110.2F765 I826 L837 Q838 S843 L844 N845F765-L841 HydrophobicContact CE2-CD1 3.86Å; F765-L841 HydrophobicContact CZ-CD1 3.84Å; I826-L841 HydrophobicContact CD1-CD2 4.45Å; L837-L841 WeakPolarHBondContact O-CB 3.49Å; L837-L841 PolarHBondContact O-N 3.02Å; Q838-L841 PolarHBondContact O-N 3.1Å; L841-S843 PolarHBondContact O-N 2.75Å; L841-L844 PolarHBondContact O-N 3.37Å; L841-N845 WeakPolarHBondContact O-CB 3.49Å; L841-N845 PolarHBondContact O-N 3.1Å; L841-N845 PolarHBondContact O-ND2 3.33Å
842G88.2Confident87Confident32 Ų3261.6 Ų61.633%0.3333%0.328SS..Hα-helixtrans-58.7-45.3175.300000112.2Q838 E839 L844 N845 L846Q838-G842 PolarHBondContact O-N 3.41Å; E839-G842 PolarHBondContact O-N 3.07Å; G842-L844 PolarHBondContact O-N 3.19Å; G842-N845 PolarHBondContact O-N 3.21Å; G842-L846 WeakPolarHBondContact O-CB 3.37Å; G842-L846 PolarHBondContact O-N 3.08Å
843S88.4Confident87.3Confident63 Ų6362.2 Ų62.244%0.44132%0.323SS..Hα-helixtrans-60.1-44.2175.6-175.70000112.8E839 K840 L841 R847E839-S843 WeakPolarHBondContact O-CB 3.21Å; E839-S843 PolarHBondContact O-N 3.05Å; K840-S843 PolarHBondContact O-N 2.88Å; L841-S843 PolarHBondContact O-N 2.75Å; S843-R847 WeakPolarHBondContact O-CB 3.29Å; S843-R847 WeakPolarHBondContact O-CG 3.48Å; S843-R847 PolarHBondContact O-N 3.39Å
844L90.1Very high87.5Confident11 Ų1162 Ų626%0.05832%0.319CS..Hα-helixtrans-66.7-39.9176.6-72.8167.1000112.3I769 F772 N773 L776 K840 L841 G842 W848I769-L844 HydrophobicContact CG1-CD1 4.35Å; I769-L844 HydrophobicContact CG2-CD1 4.2Å; F772-L844 HydrophobicContact CD1-CB 4.43Å; F772-L844 HydrophobicContact CD1-CD2 4.35Å; F772-L844 HydrophobicContact CE1-CB 4.28Å; N773-L844 HydrophobicContact CB-CD2 3.81Å; L776-L844 HydrophobicContact CD1-CD2 3.79Å; K840-L844 WeakPolarHBondContact O-CG 3.11Å; K840-L844 PolarHBondContact O-N 3.25Å; L841-L844 PolarHBondContact O-N 3.37Å; G842-L844 PolarHBondContact O-N 3.19Å; L844-W848 VanDerWaalsContact O-CB 3.29Å; L844-W848 WeakPolarHBondContact O-CB 3.39Å; L844-W848 PolarHBondContact O-N 3.1Å
845N91.7Very high87.4Confident34 Ų3461.8 Ų61.818%0.18232%0.316CS..Hα-helixtrans-67.6-39.9176.7-78.6-64000112.4V815 N819 L841 G842 W848 Q849V815-N845 WeakPolarHBondContact CG1-OD1 3.31Å; N819-N845 PolarHBondContact ND2-ND2 2.93Å; N819-N845 PolarHBondContact ND2-OD1 3.1Å; N819-N845 PolarHBondContact OD1-ND2 3.37Å; N819-N845 PolarHBondContact OD1-OD1 2.93Å; L841-N845 WeakPolarHBondContact O-CB 3.49Å; L841-N845 PolarHBondContact O-N 3.1Å; L841-N845 PolarHBondContact O-ND2 3.33Å; G842-N845 PolarHBondContact O-N 3.21Å; N845-W848 WeakPolarHBondContact O-CB 3.45Å; N845-W848 PolarHBondContact O-N 2.97Å; N845-Q849 WeakPolarHBondContact O-CG 3.46Å; N845-Q849 PolarHBondContact O-N 3.13Å
846L89.7Confident87.1Confident120 Ų12061.9 Ų61.963%0.62832%0.317SS*.Hα-helixtrans-61.9-47.2173.5-92.9158.8000111.9G842 W848 Q849 E850G842-L846 WeakPolarHBondContact O-CB 3.37Å; G842-L846 PolarHBondContact O-N 3.08Å; L846-W848 VanDerWaalsContact C-N 3.33Å; L846-W848 PolarHBondContact O-N 3.45Å; L846-Q849 PolarHBondContact O-N 2.93Å; L846-E850 WeakPolarHBondContact O-CB 3.24Å; L846-E850 PolarHBondContact O-N 3.3Å
847R95.1Very high86.7Confident55 Ų5561.3 Ų61.321%0.20832%0.315CS..Hα-helixtrans-61.8-41176.1-73.917365.1-155.1-0.1112.1N773 L776 T777 E780 S843 E850 V851N773-R847 PolarHBondContact OD1-NH1 3.35Å; L776-R847 HydrophobicContact CD1-CB 4.11Å; T777-R847 PolarHBondContact OG1-NH2 2.63Å; T777-R847 VanDerWaalsContact OG1-NH2 3.08Å; E780-R847 WeakPolarHBondContact OE1-CB 3.48Å; E780-R847 WeakPolarHBondContact OE1-CG 3.43Å; E780-R847 IonicContact OE1-CZ 2.9Å; E780-R847 IonicContact OE1-NE 2.86Å; E780-R847 PolarHBondContact OE1-NE 2.99Å; E780-R847 IonicContact OE1-NH2 3.91Å; E780-R847 PolarHBondContact OE1-NH2 2.85Å; E780-R847 IonicContact OE2-CZ 2.9Å; E780-R847 IonicContact OE2-NE 3.18Å; E780-R847 PolarHBondContact OE2-NE 3.32Å; E780-R847 IonicContact OE2-NH2 3.46Å; E780-R847 PolarHBondContact OE2-NH2 2.72Å; S843-R847 WeakPolarHBondContact O-CB 3.29Å; S843-R847 WeakPolarHBondContact O-CG 3.48Å; S843-R847 PolarHBondContact O-N 3.39Å; R847-E850 PolarHBondContact O-N 3.44Å; R847-V851 WeakPolarHBondContact O-CG2 3.41Å; R847-V851 PolarHBondContact O-N 3.3Å
848W94.5Very high86.2Confident21 Ų2161.8 Ų61.88%0.0832%0.315CS..Hα-helixtrans-59.7-48173169.5-103.4000113.1F772 W775 L776 I808 R811 Q812 V815 L844 N845 L846 E850 V851 C852F772-W848 HydrophobicContact CE1-CB 4.42Å; F772-W848 HydrophobicContact CE2-CD2 4.42Å; F772-W848 AromaticContact CE2-CE3 3.67Å; F772-W848 HydrophobicContact CE2-CE3 3.67Å; F772-W848 HydrophobicContact CE2-CZ3 4.05Å; F772-W848 HydrophobicContact CZ-CB 3.9Å; F772-W848 AromaticContact CZ-CD2 3.93Å; F772-W848 HydrophobicContact CZ-CD2 3.93Å; F772-W848 AromaticContact CZ-CE3 3.57Å; F772-W848 HydrophobicContact CZ-CE3 3.57Å; F772-W848 HydrophobicContact CZ-CG 4.09Å; F772-W848 HydrophobicContact CZ-CZ3 4.38Å; W775-W848 HydrophobicContact CE3-CZ3 4.49Å; W775-W848 HydrophobicContact CH2-CE3 4.49Å; W775-W848 AromaticContact CH2-CZ3 3.81Å; W775-W848 HydrophobicContact CH2-CZ3 3.81Å; W775-W848 AromaticContact CZ3-CE3 3.86Å; W775-W848 HydrophobicContact CZ3-CE3 3.86Å; W775-W848 AromaticContact CZ3-CZ3 3.53Å; W775-W848 HydrophobicContact CZ3-CZ3 3.53Å; L776-W848 HydrophobicContact CD2-CB 4.22Å; L776-W848 HydrophobicContact CD2-CE3 4.27Å; I808-W848 HydrophobicContact CB-CH2 4.09Å; I808-W848 HydrophobicContact CG1-CH2 4.09Å; I808-W848 HydrophobicContact CG1-CZ3 4.27Å; I808-W848 HydrophobicContact CG2-CH2 3.78Å; I808-W848 HydrophobicContact CG2-CZ2 4.06Å; I808-W848 WeakPolarHBondContact O-CH2 2.91Å; R811-W848 HydrophobicContact CB-CH2 3.75Å; R811-W848 HydrophobicContact CB-CZ3 3.56Å; Q812-W848 HydrophobicContact CB-CH2 4.26Å; Q812-W848 HydrophobicContact CB-CZ2 3.87Å; Q812-W848 HydrophobicContact CG-CZ2 4.12Å; V815-W848 HydrophobicContact CG2-CD2 3.87Å; V815-W848 HydrophobicContact CG2-CE3 4.19Å; V815-W848 HydrophobicContact CG2-CG 4.16Å; V815-W848 HydrophobicContact CG2-CZ2 4.42Å; L844-W848 VanDerWaalsContact O-CB 3.29Å; L844-W848 WeakPolarHBondContact O-CB 3.39Å; L844-W848 PolarHBondContact O-N 3.1Å; N845-W848 WeakPolarHBondContact O-CB 3.45Å; N845-W848 PolarHBondContact O-N 2.97Å; L846-W848 VanDerWaalsContact C-N 3.33Å; L846-W848 PolarHBondContact O-N 3.45Å; W848-E850 VanDerWaalsContact C-N 3.34Å; W848-E850 PolarHBondContact O-N 2.73Å; W848-V851 PolarHBondContact O-N 3.24Å; W848-C852 VanDerWaalsContact CE2-SG 3.58Å; W848-C852 PolarHBondContact O-N 2.96Å; W848-C852 PolarHBondContact O-SG 3.1Å
849Q90.2Very high85.6Confident126 Ų12662.1 Ų62.159%0.58932%0.315SS*.Hα-helixtrans-61-43177-74.7174.4-4.600111.5N845 L846 C852 K853N845-Q849 WeakPolarHBondContact O-CG 3.46Å; N845-Q849 PolarHBondContact O-N 3.13Å; L846-Q849 PolarHBondContact O-N 2.93Å; Q849-C852 PolarHBondContact O-N 2.96Å; Q849-K853 VanDerWaalsContact O-CB 3.3Å; Q849-K853 WeakPolarHBondContact O-CB 3.15Å; Q849-K853 PolarHBondContact O-N 3.06Å
850E86.4Confident84.9Confident81 Ų8161.3 Ų61.338%0.37931%0.31SS..Hα-helixtrans-66.6-40.6178.5-176.257.5-157.200112.3L846 R847 W848 K853 Q854L846-E850 WeakPolarHBondContact O-CB 3.24Å; L846-E850 PolarHBondContact O-N 3.3Å; R847-E850 PolarHBondContact O-N 3.44Å; W848-E850 VanDerWaalsContact C-N 3.34Å; W848-E850 PolarHBondContact O-N 2.73Å; E850-K853 PolarHBondContact O-N 3.04Å; E850-K853 IonicContact OE2-NZ 3.3Å; E850-Q854 WeakPolarHBondContact O-CB 3.49Å; E850-Q854 WeakPolarHBondContact O-CG 3.43Å; E850-Q854 PolarHBondContact O-N 2.88Å; E850-Q854 WeakPolarHBondContact OE1-CG 3.46Å; E850-Q854 PolarHBondContact OE1-NE2 3.41Å
851V89.3Confident83.9Confident3 Ų362.6 Ų62.62%0.01831%0.312CS..Hα-helixtrans-60.9-45.1172166.90000111.3W775 L776 A779 E780 L783 R847 W848 L855W775-V851 HydrophobicContact CH2-CG1 4.49Å; L776-V851 HydrophobicContact CD2-CG2 4.14Å; A779-V851 HydrophobicContact CB-CG1 4.02Å; A779-V851 HydrophobicContact CB-CG2 4.44Å; E780-V851 HydrophobicContact CG-CG2 3.76Å; L783-V851 HydrophobicContact CD1-CB 4.29Å; L783-V851 HydrophobicContact CD1-CG1 4.05Å; L783-V851 HydrophobicContact CD1-CG2 4.12Å; R847-V851 WeakPolarHBondContact O-CG2 3.41Å; R847-V851 PolarHBondContact O-N 3.3Å; W848-V851 PolarHBondContact O-N 3.24Å; V851-L855 WeakPolarHBondContact O-CB 3.42Å; V851-L855 PolarHBondContact O-N 3.49Å
852C87.3Confident82.9Confident34 Ų3463.6 Ų63.623%0.2332%0.316CS..Hα-helixtrans-62.3-43.7177.3-670000111.8I808 W848 Q849 L855 S856I808-C852 HydrophobicContact CD1-CB 4.49Å; W848-C852 VanDerWaalsContact CE2-SG 3.58Å; W848-C852 PolarHBondContact O-N 2.96Å; W848-C852 PolarHBondContact O-SG 3.1Å; Q849-C852 PolarHBondContact O-N 2.96Å; C852-L855 PolarHBondContact O-N 3.38Å; C852-S856 WeakPolarHBondContact O-CB 3.32Å; C852-S856 PolarHBondContact O-N 2.75Å
853K85.1Confident82Confident113 Ų11366.2 Ų66.249%0.49132%0.32SS..Hα-helixtrans-63.3-50.7177.4-179.7-174.1167.9-1610111.6Q849 E850 L855 S856 D857Q849-K853 VanDerWaalsContact O-CB 3.3Å; Q849-K853 WeakPolarHBondContact O-CB 3.15Å; Q849-K853 PolarHBondContact O-N 3.06Å; E850-K853 PolarHBondContact O-N 3.04Å; E850-K853 IonicContact OE2-NZ 3.3Å; K853-L855 VanDerWaalsContact C-N 3.26Å; K853-L855 PolarHBondContact O-N 2.81Å; K853-S856 WeakPolarHBondContact O-CA 3.32Å; K853-S856 WeakPolarHBondContact O-CB 3.34Å; K853-S856 PolarHBondContact O-N 3.37Å; K853-D857 WeakPolarHBondContact O-CB 3.33Å; K853-D857 PolarHBondContact O-N 2.85Å
854Q80.9Confident81Confident59 Ų5967.2 Ų67.228%0.27632%0.318SS..Hα-helixtrans-61.6-33.5178.7-73.3-17426.400113L783 E850 R858L783-Q854 HydrophobicContact CD1-CB 4.1Å; L783-Q854 HydrophobicContact CD2-CB 4.34Å; E850-Q854 WeakPolarHBondContact O-CB 3.49Å; E850-Q854 WeakPolarHBondContact O-CG 3.43Å; E850-Q854 PolarHBondContact O-N 2.88Å; E850-Q854 WeakPolarHBondContact OE1-CG 3.46Å; E850-Q854 PolarHBondContact OE1-NE2 3.41Å; Q854-R858 WeakPolarHBondContact O-CB 3.49Å; Q854-R858 WeakPolarHBondContact O-CG 3.49Å; Q854-R858 PolarHBondContact O-N 3.32Å
855L82.4Confident79.8Confident11 Ų1169.9 Ų69.96%0.05833%0.33CS..Hα-helixtrans-68-43.8173-164.977.9000111.4L801 L804 Q805 I808 V851 C852 K853 R858 K859L801-L855 HydrophobicContact CD2-CD1 3.56Å; L804-L855 HydrophobicContact CB-CD1 3.91Å; L804-L855 HydrophobicContact CB-CD2 4.45Å; L804-L855 HydrophobicContact CD1-CD1 4.5Å; Q805-L855 HydrophobicContact CB-CD2 3.96Å; Q805-L855 HydrophobicContact CG-CD2 4.19Å; I808-L855 HydrophobicContact CD1-CB 4.45Å; I808-L855 HydrophobicContact CD1-CD2 3.54Å; V851-L855 WeakPolarHBondContact O-CB 3.42Å; V851-L855 PolarHBondContact O-N 3.49Å; C852-L855 PolarHBondContact O-N 3.38Å; K853-L855 VanDerWaalsContact C-N 3.26Å; K853-L855 PolarHBondContact O-N 2.81Å; L855-R858 PolarHBondContact O-N 3.06Å; L855-K859 WeakPolarHBondContact O-CB 3.39Å; L855-K859 PolarHBondContact O-N 2.98Å
856S76.2Confident78.7Confident73 Ų7373.2 Ų73.251%0.5134%0.343SS..Hα-helixtrans-60.4-49.2175.4-167.20000111.8C852 K853 R858 K859 K860C852-S856 WeakPolarHBondContact O-CB 3.32Å; C852-S856 PolarHBondContact O-N 2.75Å; K853-S856 WeakPolarHBondContact O-CA 3.32Å; K853-S856 WeakPolarHBondContact O-CB 3.34Å; K853-S856 PolarHBondContact O-N 3.37Å; S856-R858 VanDerWaalsContact C-N 3.28Å; S856-R858 PolarHBondContact O-N 3.02Å; S856-K859 PolarHBondContact O-N 2.87Å; S856-K860 WeakPolarHBondContact O-CB 3.31Å; S856-K860 PolarHBondContact O-N 3.48Å
857D73.5Confident77.8Confident68 Ų6870.9 Ų70.936%0.36433%0.331SS..Hα-helixtrans-65.4-29.5179.6-67.9-15.7000112.5K853 R861K853-D857 WeakPolarHBondContact O-CB 3.33Å; K853-D857 PolarHBondContact O-N 2.85Å; D857-R861 WeakPolarHBondContact O-CG 3.46Å; D857-R861 PolarHBondContact O-N 2.96Å; D857-R861 PolarHBondContact O-NE 3.43Å
858R76Confident76.6Confident22 Ų2272.1 Ų72.18%0.08334%0.341CS..Hα-helixtrans-74.1-44.7171.6-84177.4154.5119-5.8112L783 T786 Y797 L801 Q854 L855 S856 K860 R861 L862L783-R858 VanDerWaalsContact CD2-NH1 3.27Å; L783-R858 VanDerWaalsContact O-CZ 3.22Å; L783-R858 PolarHBondContact O-NH1 3.44Å; L783-R858 PolarHBondContact O-NH2 3.22Å; T786-R858 PolarHBondContact O-NH2 3.31Å; T786-R858 PolarHBondContact OG1-NH2 3.34Å; Y797-R858 WeakPolarHBondContact OH-CD 3.44Å; Y797-R858 PolarHBondContact OH-NE 2.98Å; L801-R858 HydrophobicContact CD2-CB 4.49Å; Q854-R858 WeakPolarHBondContact O-CB 3.49Å; Q854-R858 WeakPolarHBondContact O-CG 3.49Å; Q854-R858 PolarHBondContact O-N 3.32Å; L855-R858 PolarHBondContact O-N 3.06Å; S856-R858 VanDerWaalsContact C-N 3.28Å; S856-R858 PolarHBondContact O-N 3.02Å; R858-K860 VanDerWaalsContact C-N 3.35Å; R858-K860 PolarHBondContact O-N 3.37Å; R858-R861 PolarHBondContact O-N 2.87Å; R858-L862 WeakPolarHBondContact O-CB 3.41Å; R858-L862 PolarHBondContact O-N 2.91Å
859K73.9Confident75.7Confident111 Ų11172.9 Ų72.948%0.48335%0.347SS..Hα-helixtrans-61.1-43.7176.5-178.6178.5178.61740111.5Q805 L855 S856 L862 E863Q805-K859 VanDerWaalsContact OE1-NZ 3.1Å; L855-K859 WeakPolarHBondContact O-CB 3.39Å; L855-K859 PolarHBondContact O-N 2.98Å; S856-K859 PolarHBondContact O-N 2.87Å; K859-L862 PolarHBondContact O-N 3.06Å; K859-E863 PolarHBondContact O-N 2.94Å; K859-E863 VanDerWaalsContact O-N 3.08Å
860K69.7Low74.9Confident130 Ų13069.9 Ų69.957%0.56534%0.339SS*.Hα-helixtrans-58.8-51.9175.9179.1167.8172.6170.90111.2S856 R858 L862 E863 E864S856-K860 WeakPolarHBondContact O-CB 3.31Å; S856-K860 PolarHBondContact O-N 3.48Å; R858-K860 VanDerWaalsContact C-N 3.35Å; R858-K860 PolarHBondContact O-N 3.37Å; K860-L862 VanDerWaalsContact C-N 3.31Å; K860-L862 PolarHBondContact O-N 2.98Å; K860-E863 PolarHBondContact O-N 3.22Å; K860-E864 WeakPolarHBondContact CE-OE1 3.44Å; K860-E864 HydrophobicContact CG-CG 4.35Å; K860-E864 WeakPolarHBondContact CG-OE1 3.42Å; K860-E864 IonicContact NZ-OE1 3.43Å; K860-E864 WeakPolarHBondContact O-CB 3.49Å; K860-E864 WeakPolarHBondContact O-CG 3.35Å; K860-E864 PolarHBondContact O-N 3.49Å
861R64.5Low74.3Confident139 Ų13970.7 Ų70.753%0.52534%0.343SS..Hα-helixtrans-57.7-39.1176-80.6-179.9-76.7170.2-10.9113.7D857 R858 E864 Q865D857-R861 WeakPolarHBondContact O-CG 3.46Å; D857-R861 PolarHBondContact O-N 2.96Å; D857-R861 PolarHBondContact O-NE 3.43Å; R858-R861 PolarHBondContact O-N 2.87Å; R861-E864 PolarHBondContact O-N 2.95Å; R861-Q865 WeakPolarHBondContact O-CB 3.17Å; R861-Q865 WeakPolarHBondContact O-CG 3.29Å; R861-Q865 PolarHBondContact O-N 2.96Å
862L67.9Low73.9Confident29 Ų2970.9 Ų70.915%0.15234%0.344CS..Hα-helixtrans-70.6-32.5-178.9-149.5152.3000112Y797 L801 R858 K859 K860 K866Y797-L862 HydrophobicContact CD1-CD1 4.29Å; Y797-L862 HydrophobicContact CE1-CD1 3.95Å; L801-L862 HydrophobicContact CD1-CD1 3.79Å; R858-L862 WeakPolarHBondContact O-CB 3.41Å; R858-L862 PolarHBondContact O-N 2.91Å; K859-L862 PolarHBondContact O-N 3.06Å; K860-L862 VanDerWaalsContact C-N 3.31Å; K860-L862 PolarHBondContact O-N 2.98Å; L862-K866 WeakPolarHBondContact O-CB 3.43Å; L862-K866 PolarHBondContact O-N 2.88Å
863E70.1Confident73.6Confident87 Ų8773.5 Ų73.541%0.40735%0.353SS..Hα-helixtrans-77.2-38.4172.3-15665.9-145.400111.9K859 K860 K866 N867K859-E863 PolarHBondContact O-N 2.94Å; K859-E863 VanDerWaalsContact O-N 3.08Å; K860-E863 PolarHBondContact O-N 3.22Å; E863-K866 PolarHBondContact O-N 3.32Å; E863-K866 IonicContact OE1-NZ 3.62Å; E863-K866 PolarHBondContact OE1-NZ 3.33Å; E863-N867 WeakPolarHBondContact O-CB 3.26Å; E863-N867 PolarHBondContact O-N 3.07Å; E863-N867 PolarHBondContact O-OD1 2.94Å
864E66.9Low73.6Confident84 Ų8474.5 Ų74.539%0.39335%0.353SS..Hα-helixtrans-59.1-48.2173.5-74.3168.316300111.6K860 R861 K866 N867 I868K860-E864 WeakPolarHBondContact CE-OE1 3.44Å; K860-E864 HydrophobicContact CG-CG 4.35Å; K860-E864 WeakPolarHBondContact CG-OE1 3.42Å; K860-E864 IonicContact NZ-OE1 3.43Å; K860-E864 WeakPolarHBondContact O-CB 3.49Å; K860-E864 WeakPolarHBondContact O-CG 3.35Å; K860-E864 PolarHBondContact O-N 3.49Å; R861-E864 PolarHBondContact O-N 2.95Å; E864-K866 VanDerWaalsContact C-N 3.32Å; E864-K866 PolarHBondContact O-N 3.39Å; E864-N867 PolarHBondContact O-N 3.43Å; E864-I868 VanDerWaalsContact O-CG1 3.29Å; E864-I868 WeakPolarHBondContact O-CG1 3.46Å; E864-I868 PolarHBondContact O-N 3.08Å
865Q65Low73.7Confident67 Ų6774.5 Ų74.531%0.31336%0.355SS..Hα-helixtrans-59.8-40.8175.2-75.5-177.8-44.800112.6R861 L869 S936R861-Q865 WeakPolarHBondContact O-CB 3.17Å; R861-Q865 WeakPolarHBondContact O-CG 3.29Å; R861-Q865 PolarHBondContact O-N 2.96Å; Q865-L869 WeakPolarHBondContact O-CB 3.4Å; Q865-L869 PolarHBondContact O-N 3.39Å; Q865-S936 PolarHBondContact NE2-O 3.08Å
866K68.5Low73.9Confident104 Ų10474 Ų7445%0.45235%0.352SS..Hα-helixtrans-66.1-38.7176.8170.3174.3159.7-74.60112.1L862 E863 E864 S870L862-K866 WeakPolarHBondContact O-CB 3.43Å; L862-K866 PolarHBondContact O-N 2.88Å; E863-K866 PolarHBondContact O-N 3.32Å; E863-K866 IonicContact OE1-NZ 3.62Å; E863-K866 PolarHBondContact OE1-NZ 3.33Å; E864-K866 VanDerWaalsContact C-N 3.32Å; E864-K866 PolarHBondContact O-N 3.39Å; K866-S870 WeakPolarHBondContact O-CB 3.5Å; K866-S870 PolarHBondContact O-N 2.93Å; K866-S870 PolarHBondContact O-OG 3.34Å
867N71Confident74.4Confident72 Ų7273.2 Ų73.239%0.38534%0.343SS..Hα-helixtrans-66.9-49.4177.5-69.5-11.8000110.9E863 E864 L869 S870 E871E863-N867 WeakPolarHBondContact O-CB 3.26Å; E863-N867 PolarHBondContact O-N 3.07Å; E863-N867 PolarHBondContact O-OD1 2.94Å; E864-N867 PolarHBondContact O-N 3.43Å; N867-L869 VanDerWaalsContact C-N 3.29Å; N867-L869 PolarHBondContact O-N 3.27Å; N867-S870 PolarHBondContact O-N 3.43Å; N867-S870 PolarHBondContact O-OG 3.22Å; N867-E871 PolarHBondContact O-N 3.19Å
868I69.9Low74.9Confident80 Ų8075.9 Ų75.941%0.4135%0.353SS..Hα-helixtrans-57.1-42.9177.4-64163.7000111.1E864 S870 E871 F872 V933E864-I868 VanDerWaalsContact O-CG1 3.29Å; E864-I868 WeakPolarHBondContact O-CG1 3.46Å; E864-I868 PolarHBondContact O-N 3.08Å; I868-S870 PolarHBondContact O-N 2.92Å; I868-E871 PolarHBondContact O-N 3.07Å; I868-F872 WeakPolarHBondContact O-CB 3.49Å; I868-F872 PolarHBondContact O-N 3.47Å; I868-V933 HydrophobicContact CG2-CG2 3.51Å
869L75.3Confident75.5Confident38 Ų3875 Ų7520%0.19935%0.35CS..Hα-helixtrans-61.3-43.2174.8178.661.3000112.3Q865 N867 F872 Q873 V933 I939 L947Q865-L869 WeakPolarHBondContact O-CB 3.4Å; Q865-L869 PolarHBondContact O-N 3.39Å; N867-L869 VanDerWaalsContact C-N 3.29Å; N867-L869 PolarHBondContact O-N 3.27Å; L869-F872 PolarHBondContact O-N 2.84Å; L869-Q873 WeakPolarHBondContact O-CB 3.5Å; L869-Q873 PolarHBondContact O-N 2.88Å; L869-V933 HydrophobicContact CD1-CG1 3.85Å; L869-I939 HydrophobicContact CD1-CD1 3.59Å; L869-I939 HydrophobicContact CD1-CG1 4.11Å; L869-I939 HydrophobicContact CD2-CD1 4.26Å; L869-I939 HydrophobicContact CD2-CG1 3.82Å; L869-L947 HydrophobicContact CD1-CD1 3.89Å
870S73Confident76.2Confident62 Ų6270.4 Ų70.443%0.43433%0.331SS..Hα-helixtrans-68.7-34.3179.971.60000113.2K866 N867 I868 R874K866-S870 WeakPolarHBondContact O-CB 3.5Å; K866-S870 PolarHBondContact O-N 2.93Å; K866-S870 PolarHBondContact O-OG 3.34Å; N867-S870 PolarHBondContact O-N 3.43Å; N867-S870 PolarHBondContact O-OG 3.22Å; I868-S870 PolarHBondContact O-N 2.92Å; S870-R874 VanDerWaalsContact O-CB 3.31Å; S870-R874 WeakPolarHBondContact O-CB 3.27Å; S870-R874 PolarHBondContact O-N 3.11Å
871E73.6Confident77Confident99 Ų9969.6 Ų69.646%0.46333%0.332SS..Hα-helixtrans-68.5-50173.2-70.4-17714800110.6N867 I868 Q873 R874 D875N867-E871 PolarHBondContact O-N 3.19Å; I868-E871 PolarHBondContact O-N 3.07Å; E871-Q873 VanDerWaalsContact C-N 3.3Å; E871-Q873 PolarHBondContact O-N 3.17Å; E871-R874 PolarHBondContact O-N 3.48Å; E871-R874 VanDerWaalsContact O-N 3.13Å; E871-D875 WeakPolarHBondContact O-CB 3.33Å; E871-D875 PolarHBondContact O-N 2.97Å
872F81.9Confident78.3Confident6 Ų664.3 Ų64.33%0.02631%0.312CS..Hα-helixtrans-55.2-44.3175173.8-109.8000112.3I868 L869 L876 L926 G930 V933 L947 L951I868-F872 WeakPolarHBondContact O-CB 3.49Å; I868-F872 PolarHBondContact O-N 3.47Å; L869-F872 PolarHBondContact O-N 2.84Å; F872-L876 HydrophobicContact CE1-CD2 4.35Å; F872-L876 HydrophobicContact CZ-CD2 4.19Å; F872-L876 WeakPolarHBondContact O-CB 3.49Å; F872-L876 PolarHBondContact O-N 3.43Å; F872-L926 HydrophobicContact CD2-CD2 3.99Å; F872-L926 HydrophobicContact CE2-CD2 4.03Å; F872-L926 WeakPolarHBondContact CE2-O 3.24Å; F872-G930 VanDerWaalsContact CE2-CA 3.49Å; F872-V933 HydrophobicContact CB-CG1 4.42Å; F872-V933 HydrophobicContact CD1-CG1 4.1Å; F872-V933 HydrophobicContact CG-CG1 4.4Å; F872-L947 HydrophobicContact CE1-CD2 4.26Å; F872-L951 HydrophobicContact CZ-CD1 4.39Å; F872-L951 HydrophobicContact CZ-CD2 4.26Å
873Q81.1Confident79.3Confident90 Ų9063 Ų6342%0.42131%0.305SS..Hα-helixtrans-68.6-37.6178.6-171.6175.221.100112.6L869 E871 N877 L947L869-Q873 WeakPolarHBondContact O-CB 3.5Å; L869-Q873 PolarHBondContact O-N 2.88Å; E871-Q873 VanDerWaalsContact C-N 3.3Å; E871-Q873 PolarHBondContact O-N 3.17Å; Q873-N877 WeakPolarHBondContact O-CB 3.46Å; Q873-N877 PolarHBondContact O-N 3.37Å; Q873-N877 VanDerWaalsContact O-N 3.1Å; Q873-N877 PolarHBondContact O-ND2 3.45Å; Q873-L947 HydrophobicContact CB-CD2 4.37Å; Q873-L947 HydrophobicContact CG-CD2 4.1Å
874R84.5Confident80Confident134 Ų13463 Ų6351%0.50631%0.305SS..Hα-helixtrans-62.8-52.4174.3-179.5-165.867.2-155.2-8.5110.6S870 E871 L876 N877 E878S870-R874 VanDerWaalsContact O-CB 3.31Å; S870-R874 WeakPolarHBondContact O-CB 3.27Å; S870-R874 PolarHBondContact O-N 3.11Å; E871-R874 PolarHBondContact O-N 3.48Å; E871-R874 VanDerWaalsContact O-N 3.13Å; R874-L876 VanDerWaalsContact C-N 3.33Å; R874-L876 PolarHBondContact O-N 3.36Å; R874-N877 WeakPolarHBondContact O-CB 3.45Å; R874-N877 PolarHBondContact O-N 2.9Å; R874-N877 VanDerWaalsContact O-N 3.11Å; R874-E878 PolarHBondContact O-N 3.33Å
875D82.3Confident80.8Confident58 Ų5864.2 Ų64.231%0.3131%0.311SS..Hα-helixtrans-68.7-35.7-173.1-61.1-2.4000110.7E871 F879 L926E871-D875 WeakPolarHBondContact O-CB 3.33Å; E871-D875 PolarHBondContact O-N 2.97Å; D875-F879 WeakPolarHBondContact O-CB 3.46Å; D875-F879 PolarHBondContact O-N 2.91Å; D875-L926 HydrophobicContact CB-CD2 3.92Å
876L87.5Confident81.8Confident0 Ų061 Ų610%030%0.296CS..Hα-helixtrans-63-43.2170.3-178.962.4000112F872 R874 F879 V880 L926 L947 K950 L951 T954F872-L876 HydrophobicContact CE1-CD2 4.35Å; F872-L876 HydrophobicContact CZ-CD2 4.19Å; F872-L876 WeakPolarHBondContact O-CB 3.49Å; F872-L876 PolarHBondContact O-N 3.43Å; R874-L876 VanDerWaalsContact C-N 3.33Å; R874-L876 PolarHBondContact O-N 3.36Å; L876-F879 PolarHBondContact O-N 3.47Å; L876-V880 WeakPolarHBondContact O-CG2 3.48Å; L876-V880 PolarHBondContact O-N 3Å; L876-L926 HydrophobicContact CB-CD2 4.2Å; L876-L926 HydrophobicContact CD1-CD1 4.37Å; L876-L947 HydrophobicContact CD2-CD2 4.31Å; L876-K950 HydrophobicContact CD2-CB 4.35Å; L876-K950 HydrophobicContact CD2-CD 4.46Å; L876-K950 HydrophobicContact CD2-CG 4.27Å; L876-L951 HydrophobicContact CD1-CD1 3.84Å; L876-T954 HydrophobicContact CD1-CG2 4.04Å
877N85.7Confident82.6Confident57 Ų5757.5 Ų57.531%0.30528%0.282SS..Hα-helixtrans-66.2-41.5178.3-72.6-28.3000112.1Q873 R874 F879 V880 L881 K950Q873-N877 WeakPolarHBondContact O-CB 3.46Å; Q873-N877 PolarHBondContact O-N 3.37Å; Q873-N877 VanDerWaalsContact O-N 3.1Å; Q873-N877 PolarHBondContact O-ND2 3.45Å; R874-N877 WeakPolarHBondContact O-CB 3.45Å; R874-N877 PolarHBondContact O-N 2.9Å; R874-N877 VanDerWaalsContact O-N 3.11Å; N877-F879 VanDerWaalsContact C-N 3.33Å; N877-F879 PolarHBondContact O-N 3.5Å; N877-V880 PolarHBondContact O-N 3.29Å; N877-L881 WeakPolarHBondContact O-CG 3.46Å; N877-L881 PolarHBondContact O-N 2.97Å; N877-K950 PolarHBondContact OD1-NZ 3.47Å
878E84.8Confident83.1Confident125 Ų12558.8 Ų58.858%0.58429%0.289SS*.Hα-helixtrans-62.6-40.7176.1-170.4177.1157.500111.4R874 L881 W882R874-E878 PolarHBondContact O-N 3.33Å; E878-L881 PolarHBondContact O-N 3.28Å; E878-W882 PolarHBondContact O-N 3.34Å; E878-W882 VanDerWaalsContact O-N 3.1Å
879F89.6Confident83.7Confident4 Ų456.5 Ų56.52%0.01828%0.277CS..Hα-helixtrans-66.7-37.8176.4-161.6-96.9000113.2D875 L876 N877 W882 L883 R919 I922 L923 L926 T954 W958D875-F879 WeakPolarHBondContact O-CB 3.46Å; D875-F879 PolarHBondContact O-N 2.91Å; L876-F879 PolarHBondContact O-N 3.47Å; N877-F879 VanDerWaalsContact C-N 3.33Å; N877-F879 PolarHBondContact O-N 3.5Å; F879-W882 PolarHBondContact O-N 3.04Å; F879-L883 HydrophobicContact CD1-CD1 3.76Å; F879-L883 HydrophobicContact CD1-CG 4.2Å; F879-L883 HydrophobicContact CE1-CD1 3.71Å; F879-L883 HydrophobicContact CE1-CD2 4.49Å; F879-L883 HydrophobicContact CE1-CG 4.03Å; F879-L883 WeakPolarHBondContact O-CG 3.45Å; F879-L883 PolarHBondContact O-N 3.47Å; F879-R919 HydrophobicContact CE2-CB 3.83Å; F879-R919 WeakPolarHBondContact CE2-O 3.46Å; F879-R919 HydrophobicContact CZ-CB 4.19Å; F879-R919 WeakPolarHBondContact CZ-O 3.46Å; F879-I922 HydrophobicContact CD2-CB 4.1Å; F879-I922 HydrophobicContact CD2-CG2 3.72Å; F879-I922 HydrophobicContact CE2-CB 4.08Å; F879-I922 HydrophobicContact CE2-CG2 4.2Å; F879-L923 HydrophobicContact CD1-CD1 4.37Å; F879-L923 HydrophobicContact CE1-CB 3.98Å; F879-L923 HydrophobicContact CE1-CD1 3.95Å; F879-L923 HydrophobicContact CE1-CD2 4.35Å; F879-L923 HydrophobicContact CE1-CG 4.32Å; F879-L923 HydrophobicContact CE2-CB 4.35Å; F879-L923 HydrophobicContact CZ-CB 3.72Å; F879-L926 HydrophobicContact CB-CD1 3.75Å; F879-L926 HydrophobicContact CD1-CD1 4.4Å; F879-L926 HydrophobicContact CD2-CD1 4.5Å; F879-L926 HydrophobicContact CG-CD1 3.97Å; F879-T954 HydrophobicContact CD1-CG2 3.57Å; F879-T954 HydrophobicContact CE1-CG2 4.14Å; F879-W958 HydrophobicContact CE1-CE3 4.14Å; F879-W958 HydrophobicContact CZ-CD2 4.43Å; F879-W958 AromaticContact CZ-CE3 3.68Å; F879-W958 HydrophobicContact CZ-CE3 3.68Å; F879-W958 HydrophobicContact CZ-CZ3 4.1Å
880V87.8Confident83.9Confident13 Ų1355.1 Ų55.18%0.07927%0.271CS..Hα-helixtrans-63.3-44.2173.4169.10000111.4L876 N877 W882 L883 E884 T954L876-V880 WeakPolarHBondContact O-CG2 3.48Å; L876-V880 PolarHBondContact O-N 3Å; N877-V880 PolarHBondContact O-N 3.29Å; V880-W882 VanDerWaalsContact C-N 3.33Å; V880-W882 PolarHBondContact O-N 3.41Å; V880-L883 WeakPolarHBondContact O-CB 3.3Å; V880-L883 PolarHBondContact O-N 2.97Å; V880-L883 VanDerWaalsContact O-N 3.15Å; V880-E884 HydrophobicContact CG1-CG 4.48Å; V880-E884 WeakPolarHBondContact O-CG 3.35Å; V880-E884 PolarHBondContact O-N 3.49Å; V880-T954 HydrophobicContact CG2-CG2 3.98Å; V880-T954 WeakPolarHBondContact CG2-OG1 3.25Å
881L85.9Confident84Confident113 Ų11355.6 Ų55.659%0.59228%0.275SS*.Hα-helixtrans-61.9-39.9177.7-71.9168.9000112.1N877 E878 E884 E885N877-L881 WeakPolarHBondContact O-CG 3.46Å; N877-L881 PolarHBondContact O-N 2.97Å; E878-L881 PolarHBondContact O-N 3.28Å; L881-E884 PolarHBondContact O-N 3.26Å; L881-E885 PolarHBondContact O-N 3.37Å; L881-E885 VanDerWaalsContact O-N 3.09Å
882W91.4Very high84.1Confident28 Ų2853.4 Ų53.411%0.10627%0.266CS..Hα-helixtrans-65.2-39.9173.7179.487.9000112.3E878 F879 V880 E884 E885 A886 L912 E915 L916 R919 W958E878-W882 PolarHBondContact O-N 3.34Å; E878-W882 VanDerWaalsContact O-N 3.1Å; F879-W882 PolarHBondContact O-N 3.04Å; V880-W882 VanDerWaalsContact C-N 3.33Å; V880-W882 PolarHBondContact O-N 3.41Å; W882-E884 VanDerWaalsContact C-N 3.34Å; W882-E884 PolarHBondContact O-N 2.91Å; W882-E885 PolarHBondContact O-N 2.71Å; W882-A886 HydrophobicContact CH2-CB 4.16Å; W882-A886 HydrophobicContact CZ2-CB 4.24Å; W882-A886 HydrophobicContact CZ3-CB 4.33Å; W882-A886 VanDerWaalsContact O-CB 3.29Å; W882-A886 WeakPolarHBondContact O-CB 3.45Å; W882-A886 PolarHBondContact O-N 3Å; W882-L912 HydrophobicContact CZ2-CD2 4.22Å; W882-E915 HydrophobicContact CZ2-CB 4.23Å; W882-E915 PolarHBondContact NE1-OE2 3Å; W882-L916 HydrophobicContact CH2-CD2 4.05Å; W882-R919 VanDerWaalsContact CD1-CZ 3.4Å; W882-R919 HydrophobicContact CD2-CG 4.03Å; W882-R919 VanDerWaalsContact CE2-NE 3.34Å; W882-R919 HydrophobicContact CE3-CB 4.46Å; W882-R919 HydrophobicContact CE3-CG 4.1Å; W882-R919 HydrophobicContact CH2-CB 4.15Å; W882-R919 HydrophobicContact CH2-CG 3.78Å; W882-R919 HydrophobicContact CZ2-CG 3.65Å; W882-R919 HydrophobicContact CZ3-CB 4.11Å; W882-R919 HydrophobicContact CZ3-CG 3.99Å; W882-R919 VanDerWaalsContact NE1-NE 3.14Å; W882-W958 HydrophobicContact CH2-CZ3 4.01Å; W882-W958 HydrophobicContact CZ3-CE3 4.07Å; W882-W958 AromaticContact CZ3-CZ3 3.69Å; W882-W958 HydrophobicContact CZ3-CZ3 3.69Å
883L88.9Confident83.6Confident1 Ų158.6 Ų58.61%0.00530%0.3CS..Hα-helixtrans-62.3-39.5175-81.2170.9000112.5F879 V880 A886 D887 T954 Q957 W958 V961F879-L883 HydrophobicContact CD1-CD1 3.76Å; F879-L883 HydrophobicContact CD1-CG 4.2Å; F879-L883 HydrophobicContact CE1-CD1 3.71Å; F879-L883 HydrophobicContact CE1-CD2 4.49Å; F879-L883 HydrophobicContact CE1-CG 4.03Å; F879-L883 WeakPolarHBondContact O-CG 3.45Å; F879-L883 PolarHBondContact O-N 3.47Å; V880-L883 WeakPolarHBondContact O-CB 3.3Å; V880-L883 PolarHBondContact O-N 2.97Å; V880-L883 VanDerWaalsContact O-N 3.15Å; L883-A886 PolarHBondContact O-N 2.92Å; L883-D887 VanDerWaalsContact O-CB 3.3Å; L883-D887 WeakPolarHBondContact O-CB 3.22Å; L883-D887 PolarHBondContact O-N 3.18Å; L883-T954 HydrophobicContact CD1-CG2 3.66Å; L883-T954 WeakPolarHBondContact CD1-O 3.48Å; L883-Q957 HydrophobicContact CD1-CB 3.99Å; L883-W958 HydrophobicContact CD1-CB 4.42Å; L883-W958 HydrophobicContact CD2-CB 4.12Å; L883-W958 HydrophobicContact CD2-CE3 4.05Å; L883-V961 HydrophobicContact CD2-CB 4.1Å; L883-V961 HydrophobicContact CD2-CG1 4.39Å; L883-V961 HydrophobicContact CD2-CG2 4.15Å
884E86.2Confident83Confident87 Ų8755.8 Ų55.841%0.40729%0.288SS..Hα-helixtrans-65.6-44.8176.9-72.7175175.800111.4V880 L881 W882 A886 D887 N888V880-E884 HydrophobicContact CG1-CG 4.48Å; V880-E884 WeakPolarHBondContact O-CG 3.35Å; V880-E884 PolarHBondContact O-N 3.49Å; L881-E884 PolarHBondContact O-N 3.26Å; W882-E884 VanDerWaalsContact C-N 3.34Å; W882-E884 PolarHBondContact O-N 2.91Å; E884-A886 VanDerWaalsContact C-N 3.35Å; E884-A886 PolarHBondContact O-N 3.43Å; E884-D887 PolarHBondContact O-N 3.1Å; E884-N888 VanDerWaalsContact O-CB 3.31Å; E884-N888 WeakPolarHBondContact O-CB 3.36Å; E884-N888 PolarHBondContact O-N 3.03Å; E884-N888 PolarHBondContact O-ND2 3.45Å; E884-N888 VanDerWaalsContact O-ND2 3.13Å
885E83.8Confident81.9Confident110 Ų11054.9 Ų54.951%0.51429%0.289SS..Hα-helixtrans-62.5-41.2175.3-170.664.4-171.100111.9L881 W882 N888 I889L881-E885 PolarHBondContact O-N 3.37Å; L881-E885 VanDerWaalsContact O-N 3.09Å; W882-E885 PolarHBondContact O-N 2.71Å; E885-N888 WeakPolarHBondContact O-CB 3.23Å; E885-N888 PolarHBondContact O-N 3.42Å; E885-I889 HydrophobicContact CG-CD1 4.28Å; E885-I889 WeakPolarHBondContact O-CG1 3.43Å; E885-I889 PolarHBondContact O-N 2.99Å
886A86.1Confident80.7Confident0 Ų057.7 Ų57.70%031%0.311CS..Hα-helixtrans-68-40.2177.100000113W882 L883 E884 I889 A890 L912 V961 L965W882-A886 HydrophobicContact CH2-CB 4.16Å; W882-A886 HydrophobicContact CZ2-CB 4.24Å; W882-A886 HydrophobicContact CZ3-CB 4.33Å; W882-A886 VanDerWaalsContact O-CB 3.29Å; W882-A886 WeakPolarHBondContact O-CB 3.45Å; W882-A886 PolarHBondContact O-N 3Å; L883-A886 PolarHBondContact O-N 2.92Å; E884-A886 VanDerWaalsContact C-N 3.35Å; E884-A886 PolarHBondContact O-N 3.43Å; A886-I889 PolarHBondContact O-N 3.29Å; A886-A890 WeakPolarHBondContact O-CB 3.12Å; A886-A890 PolarHBondContact O-N 2.94Å; A886-L912 HydrophobicContact CB-CD1 4.34Å; A886-V961 HydrophobicContact CB-CG1 3.61Å; A886-L965 HydrophobicContact CB-CD1 4.29Å
887D84.6Confident79.5Confident31 Ų3159.5 Ų59.517%0.16633%0.33CS..Hα-helixtrans-68.4-36.7175-159.838.3000111.6L883 E884 A890 S891 K960 V961L883-D887 VanDerWaalsContact O-CB 3.3Å; L883-D887 WeakPolarHBondContact O-CB 3.22Å; L883-D887 PolarHBondContact O-N 3.18Å; E884-D887 PolarHBondContact O-N 3.1Å; D887-A890 PolarHBondContact O-N 3.22Å; D887-S891 WeakPolarHBondContact O-CB 3.39Å; D887-S891 PolarHBondContact O-N 2.79Å; D887-S891 PolarHBondContact O-OG 2.9Å; D887-K960 IonicContact OD1-NZ 3.6Å; D887-K960 PolarHBondContact OD1-NZ 3.42Å; D887-K960 IonicContact OD2-NZ 3.57Å; D887-K960 PolarHBondContact OD2-NZ 3.43Å; D887-V961 HydrophobicContact CB-CG2 3.68Å
888N82.4Confident78.8Confident99 Ų9961.7 Ų61.753%0.52934%0.336SS..Hα-helixtrans-60.1-48.8172.4-76.8-29.9000111.1E884 E885 S891 I892E884-N888 VanDerWaalsContact O-CB 3.31Å; E884-N888 WeakPolarHBondContact O-CB 3.36Å; E884-N888 PolarHBondContact O-N 3.03Å; E884-N888 PolarHBondContact O-ND2 3.45Å; E884-N888 VanDerWaalsContact O-ND2 3.13Å; E885-N888 WeakPolarHBondContact O-CB 3.23Å; E885-N888 PolarHBondContact O-N 3.42Å; N888-S891 PolarHBondContact O-N 2.79Å; N888-I892 WeakPolarHBondContact O-CG1 3.38Å; N888-I892 PolarHBondContact O-N 2.9Å
889I82.2Confident78.1Confident31 Ų3159.5 Ų59.516%0.15933%0.326CS..Hα-helixtrans-65.7-41.5179.2-71.1166.8000111.5E885 A886 S891 I892 V909 L912E885-I889 HydrophobicContact CG-CD1 4.28Å; E885-I889 WeakPolarHBondContact O-CG1 3.43Å; E885-I889 PolarHBondContact O-N 2.99Å; A886-I889 PolarHBondContact O-N 3.29Å; I889-S891 PolarHBondContact O-N 2.76Å; I889-I892 HydrophobicContact CG1-CD1 4.5Å; I889-I892 WeakPolarHBondContact O-CG1 3.49Å; I889-I892 PolarHBondContact O-N 3.46Å; I889-V909 HydrophobicContact CG2-CG2 4.24Å; I889-L912 HydrophobicContact CB-CD1 3.84Å; I889-L912 HydrophobicContact CD1-CD1 3.81Å; I889-L912 HydrophobicContact CG1-CD1 4.42Å; I889-L912 HydrophobicContact CG2-CD1 3.69Å
890A78.4Confident77.4Confident9 Ų965.1 Ų65.17%0.07435%0.353CS..Hα-helixtrans-62-32.6173.900000112.8A886 D887 A964 L965 K968A886-A890 WeakPolarHBondContact O-CB 3.12Å; A886-A890 PolarHBondContact O-N 2.94Å; D887-A890 PolarHBondContact O-N 3.22Å; A890-A964 HydrophobicContact CB-CB 4.24Å; A890-L965 HydrophobicContact CB-CD2 3.97Å; A890-L965 HydrophobicContact CB-CG 4.34Å; A890-K968 WeakPolarHBondContact O-CD 3.43Å; A890-K968 WeakPolarHBondContact O-CE 2.95Å
891S76Confident76.8Confident73 Ų7369 Ų6951%0.5137%0.369SS..THydrogen-bonded Turntrans-82.7-3.4-177.9-60.20000114.7D887 N888 I889 P893D887-S891 WeakPolarHBondContact O-CB 3.39Å; D887-S891 PolarHBondContact O-N 2.79Å; D887-S891 PolarHBondContact O-OG 2.9Å; N888-S891 PolarHBondContact O-N 2.79Å; I889-S891 PolarHBondContact O-N 2.76Å; S891-P893 WeakPolarHBondContact O-CD 3.32Å
892I74.9Confident76.5Confident52 Ų5263.8 Ų63.827%0.26734%0.342SS..PPolyproline II helixtrans-63.4125.4-178.1-62.2-179.3000110.6N888 I889 L894 K905N888-I892 WeakPolarHBondContact O-CG1 3.38Å; N888-I892 PolarHBondContact O-N 2.9Å; I889-I892 HydrophobicContact CG1-CD1 4.5Å; I889-I892 WeakPolarHBondContact O-CG1 3.49Å; I889-I892 PolarHBondContact O-N 3.46Å; I892-L894 PolarHBondContact O-N 3.11Å; I892-K905 HydrophobicContact CD1-CD 4.38Å; I892-K905 VanDerWaalsContact CD1-NZ 3.29Å; I892-K905 HydrophobicContact CG2-CD 4.43Å
893P71.7Confident75.9Confident115 Ų11566.8 Ų66.875%0.74736%0.356SS*.PPolyproline II helixtrans-63.3132.2173.5-21.733.6000111.5S891S891-P893 WeakPolarHBondContact O-CD 3.32Å
894L67.8Low75.6Confident31 Ų3171.6 Ų71.616%0.16238%0.379CS..PPolyproline II helixtrans-87.4122.7175.7-59.2173.6000109.1I892 P896 L902 E971 I972I892-L894 PolarHBondContact O-N 3.11Å; L894-P896 WeakPolarHBondContact O-CD 3.37Å; L894-L902 HydrophobicContact CB-CD2 4.35Å; L894-L902 HydrophobicContact CD2-CD2 4.15Å; L894-E971 HydrophobicContact CD1-CG 4.1Å; L894-I972 HydrophobicContact CD1-CG1 3.63Å; L894-I972 HydrophobicContact CD2-CD1 4.06Å; L894-I972 HydrophobicContact CD2-CG1 3.78Å; L894-I972 HydrophobicContact CG-CG1 4.37Å
895E62.3Low75.4Confident115 Ų11570.3 Ų70.354%0.53737%0.372SS..  trans-82.5114.4169.2-76.2-167.616800110G897 K898E895-G897 PolarHBondContact O-N 2.79Å; E895-K898 WeakPolarHBondContact OE2-CE 3.35Å; E895-K898 IonicContact OE2-NZ 3.41Å; E895-K898 PolarHBondContact OE2-NZ 3.41Å
896P56.9Low75.4Confident117 Ų11766 Ų6676%0.7635%0.352SS*.THydrogen-bonded Turntrans-69128.2-179.79-3.1000111.1L894L894-P896 WeakPolarHBondContact O-CD 3.37Å
897G63Low75.4Confident39 Ų3971.3 Ų71.340%0.40238%0.377SS..THydrogen-bonded Turntrans118.5-8.116900000116.9E895E895-G897 PolarHBondContact O-N 2.79Å
898K69.4Low75.4Confident103 Ų10373.7 Ų73.745%0.44839%0.387SS..  trans-105.887.3177.2-68.6172.6-177.6165.20111.4E895 Q900 Q901 L902E895-K898 WeakPolarHBondContact OE2-CE 3.35Å; E895-K898 IonicContact OE2-NZ 3.41Å; E895-K898 PolarHBondContact OE2-NZ 3.41Å; K898-Q900 VanDerWaalsContact C-N 3.29Å; K898-Q900 PolarHBondContact O-N 3.13Å; K898-Q901 HydrophobicContact CB-CB 4.15Å; K898-Q901 HydrophobicContact CB-CG 4.4Å; K898-Q901 HydrophobicContact CD-CG 4.48Å; K898-Q901 PolarHBondContact O-N 3.46Å; K898-Q901 VanDerWaalsContact O-N 3.09Å; K898-L902 PolarHBondContact O-N 2.98Å; K898-L902 VanDerWaalsContact O-N 3.08Å
899E71.2Confident75.6Confident79 Ų7969.1 Ų69.137%0.36936%0.363SS..Hα-helixtrans-52.2-42.2-176.1-164.4-160.1164.200113.7Q901 L902 K903E899-Q901 PolarHBondContact O-N 2.95Å; E899-L902 PolarHBondContact O-N 3.14Å; E899-K903 HydrophobicContact CG-CD 4.38Å; E899-K903 WeakPolarHBondContact O-CG 3.38Å; E899-K903 PolarHBondContact O-N 3.49Å; E899-K903 WeakPolarHBondContact OE1-CE 3.36Å; E899-K903 IonicContact OE1-NZ 2.9Å; E899-K903 PolarHBondContact OE1-NZ 3.1Å
900Q74.9Confident75.8Confident122 Ų12270.7 Ų70.757%0.5737%0.369SS*.Hα-helixtrans-63.7-40.9179.8-169.864.922.900112.7K898 K903 E904K898-Q900 VanDerWaalsContact C-N 3.29Å; K898-Q900 PolarHBondContact O-N 3.13Å; Q900-K903 PolarHBondContact O-N 3.13Å; Q900-E904 WeakPolarHBondContact O-CG 3.32Å; Q900-E904 PolarHBondContact O-N 3.27Å
901Q75.5Confident76.1Confident93 Ų9375.1 Ų75.144%0.43539%0.39SS..Hα-helixtrans-70.1-36.5176.3-74.3-169.2-3700111.8K898 E899 K903 E904 K905K898-Q901 HydrophobicContact CB-CB 4.15Å; K898-Q901 HydrophobicContact CB-CG 4.4Å; K898-Q901 HydrophobicContact CD-CG 4.48Å; K898-Q901 PolarHBondContact O-N 3.46Å; K898-Q901 VanDerWaalsContact O-N 3.09Å; E899-Q901 PolarHBondContact O-N 2.95Å; Q901-K903 VanDerWaalsContact C-N 3.33Å; Q901-E904 PolarHBondContact O-N 3.23Å; Q901-K905 WeakPolarHBondContact O-CB 3.43Å; Q901-K905 VanDerWaalsContact O-CG 3.3Å; Q901-K905 WeakPolarHBondContact O-CG 3.33Å; Q901-K905 PolarHBondContact O-N 2.87Å
902L78.6Confident76.5Confident4 Ų472.4 Ų72.42%0.02137%0.37CS..Hα-helixtrans-63.5-39.5173.2-67.9173.1000111.2L894 K898 E899 K905 L906 I972 Q975 I976 L979L894-L902 HydrophobicContact CB-CD2 4.35Å; L894-L902 HydrophobicContact CD2-CD2 4.15Å; K898-L902 PolarHBondContact O-N 2.98Å; K898-L902 VanDerWaalsContact O-N 3.08Å; E899-L902 PolarHBondContact O-N 3.14Å; L902-K905 PolarHBondContact O-N 2.86Å; L902-L906 VanDerWaalsContact O-CB 3.31Å; L902-L906 WeakPolarHBondContact O-CB 3.35Å; L902-L906 PolarHBondContact O-N 3.43Å; L902-I972 HydrophobicContact CB-CG2 4.27Å; L902-I972 HydrophobicContact CD2-CG2 4.46Å; L902-I972 WeakPolarHBondContact O-CG2 3.32Å; L902-Q975 HydrophobicContact CD1-CB 4.29Å; L902-I976 HydrophobicContact CB-CD1 3.99Å; L902-I976 HydrophobicContact CB-CG1 3.78Å; L902-I976 HydrophobicContact CD1-CG1 4.22Å; L902-L979 HydrophobicContact CD1-CD1 3.71Å
903K78.9Confident77.1Confident91 Ų9171.5 Ų71.540%0.39637%0.367SS..Hα-helixtrans-64.4-46.8173.9-78.2170.1165.6169.50112.8E899 Q900 Q901 K905 L906 E907 I976E899-K903 HydrophobicContact CG-CD 4.38Å; E899-K903 WeakPolarHBondContact O-CG 3.38Å; E899-K903 PolarHBondContact O-N 3.49Å; E899-K903 WeakPolarHBondContact OE1-CE 3.36Å; E899-K903 IonicContact OE1-NZ 2.9Å; E899-K903 PolarHBondContact OE1-NZ 3.1Å; Q900-K903 PolarHBondContact O-N 3.13Å; Q901-K903 VanDerWaalsContact C-N 3.33Å; K903-K905 VanDerWaalsContact C-N 3.32Å; K903-K905 PolarHBondContact O-N 2.76Å; K903-L906 WeakPolarHBondContact O-CB 3.27Å; K903-L906 PolarHBondContact O-N 3.09Å; K903-E907 PolarHBondContact O-N 3.49Å; K903-E907 VanDerWaalsContact O-N 3.1Å; K903-I976 HydrophobicContact CG-CD1 4.27Å
904E82.3Confident77.7Confident103 Ų10372.8 Ų72.848%0.48136%0.363SS..Hα-helixtrans-61.7-39.4175.9-74.7168.2-167.300112.3Q900 Q901 E907 Q908Q900-E904 WeakPolarHBondContact O-CG 3.32Å; Q900-E904 PolarHBondContact O-N 3.27Å; Q901-E904 PolarHBondContact O-N 3.23Å; E904-E907 PolarHBondContact O-N 3.02Å; E904-Q908 WeakPolarHBondContact O-CG 3.33Å; E904-Q908 PolarHBondContact O-N 2.97Å
905K81.7Confident78.6Confident60 Ų6074.2 Ų74.226%0.26137%0.369SS..Hα-helixtrans-72-35176.2-72-73.3161.4-163.50112.8I892 Q901 L902 K903 E907 Q908 V909 I972I892-K905 HydrophobicContact CD1-CD 4.38Å; I892-K905 VanDerWaalsContact CD1-NZ 3.29Å; I892-K905 HydrophobicContact CG2-CD 4.43Å; Q901-K905 WeakPolarHBondContact O-CB 3.43Å; Q901-K905 VanDerWaalsContact O-CG 3.3Å; Q901-K905 WeakPolarHBondContact O-CG 3.33Å; Q901-K905 PolarHBondContact O-N 2.87Å; L902-K905 PolarHBondContact O-N 2.86Å; K903-K905 VanDerWaalsContact C-N 3.32Å; K903-K905 PolarHBondContact O-N 2.76Å; K905-E907 VanDerWaalsContact C-N 3.31Å; K905-E907 PolarHBondContact O-N 3.04Å; K905-Q908 PolarHBondContact O-N 3.19Å; K905-V909 WeakPolarHBondContact O-CG2 3.49Å; K905-V909 PolarHBondContact O-N 2.93Å; K905-I972 HydrophobicContact CB-CD1 4.33Å
906L84.8Confident79.8Confident18 Ų1869.7 Ų69.79%0.09435%0.348CS..Hα-helixtrans-59.9-43.7172.9-176.658.3000111.1L902 K903 V909 K910 Q969 I972 E973 I976L902-L906 VanDerWaalsContact O-CB 3.31Å; L902-L906 WeakPolarHBondContact O-CB 3.35Å; L902-L906 PolarHBondContact O-N 3.43Å; K903-L906 WeakPolarHBondContact O-CB 3.27Å; K903-L906 PolarHBondContact O-N 3.09Å; L906-V909 PolarHBondContact O-N 3.5Å; L906-K910 HydrophobicContact CD1-CD 4.42Å; L906-K910 HydrophobicContact CD1-CG 4.37Å; L906-K910 HydrophobicContact CG-CD 4.13Å; L906-K910 HydrophobicContact CG-CG 4.49Å; L906-K910 WeakPolarHBondContact O-CB 3.33Å; L906-K910 WeakPolarHBondContact O-CG 3.15Å; L906-K910 PolarHBondContact O-N 3.35Å; L906-Q969 HydrophobicContact CD1-CG 3.65Å; L906-I972 HydrophobicContact CB-CG2 3.81Å; L906-I972 HydrophobicContact CD1-CB 4.3Å; L906-I972 HydrophobicContact CD1-CG2 4.18Å; L906-I972 HydrophobicContact CG-CG2 4.45Å; L906-E973 HydrophobicContact CD1-CG 3.72Å; L906-E973 HydrophobicContact CD2-CG 3.91Å; L906-I976 HydrophobicContact CD2-CD1 4.11Å
907E85Confident81Confident113 Ų11368.5 Ų68.553%0.52834%0.34SS..Hα-helixtrans-66.1-40.6-180-153.272168.700111.9K903 E904 K905 V909 K910 L911K903-E907 PolarHBondContact O-N 3.49Å; K903-E907 VanDerWaalsContact O-N 3.1Å; E904-E907 PolarHBondContact O-N 3.02Å; K905-E907 VanDerWaalsContact C-N 3.31Å; K905-E907 PolarHBondContact O-N 3.04Å; E907-V909 PolarHBondContact O-N 3.35Å; E907-K910 PolarHBondContact O-N 3.3Å; E907-L911 WeakPolarHBondContact O-CG 3.44Å; E907-L911 PolarHBondContact O-N 3.21Å; E907-L911 VanDerWaalsContact O-N 3.09Å
908Q85.1Confident81.8Confident80 Ų8072.9 Ų72.937%0.37435%0.354SS..Hα-helixtrans-61-42.7173.9-71.6172.85.800112.4E904 K905 L912E904-Q908 WeakPolarHBondContact O-CG 3.33Å; E904-Q908 PolarHBondContact O-N 2.97Å; K905-Q908 PolarHBondContact O-N 3.19Å; Q908-L912 PolarHBondContact O-N 3.38Å
909V87.4Confident82.6Confident4 Ų470.6 Ų70.62%0.02434%0.342CS..Hα-helixtrans-69.4-39.7176.9173.90000111.3I889 K905 L906 E907 L912 V913 L965 K968 Q969 I972I889-V909 HydrophobicContact CG2-CG2 4.24Å; K905-V909 WeakPolarHBondContact O-CG2 3.49Å; K905-V909 PolarHBondContact O-N 2.93Å; L906-V909 PolarHBondContact O-N 3.5Å; E907-V909 PolarHBondContact O-N 3.35Å; V909-L912 PolarHBondContact O-N 3.48Å; V909-V913 HydrophobicContact CG1-CG2 4.22Å; V909-V913 WeakPolarHBondContact O-CG2 3.26Å; V909-V913 PolarHBondContact O-N 3.49Å; V909-L965 HydrophobicContact CG1-CD2 4.19Å; V909-L965 WeakPolarHBondContact CG1-O 3.48Å; V909-K968 HydrophobicContact CG2-CG 4.43Å; V909-Q969 HydrophobicContact CG1-CB 3.9Å; V909-I972 HydrophobicContact CG2-CD1 4.1Å
910K85.3Confident83.2Confident64 Ų6472.5 Ų72.528%0.27835%0.351SS..Hα-helixtrans-60.9-45.3178.6-81.1177.8175.5178.60112.9L906 E907 L912 V913 E914 Q969 E973L906-K910 HydrophobicContact CD1-CD 4.42Å; L906-K910 HydrophobicContact CD1-CG 4.37Å; L906-K910 HydrophobicContact CG-CD 4.13Å; L906-K910 HydrophobicContact CG-CG 4.49Å; L906-K910 WeakPolarHBondContact O-CB 3.33Å; L906-K910 WeakPolarHBondContact O-CG 3.15Å; L906-K910 PolarHBondContact O-N 3.35Å; E907-K910 PolarHBondContact O-N 3.3Å; K910-L912 VanDerWaalsContact C-N 3.29Å; K910-L912 PolarHBondContact O-N 3.26Å; K910-V913 PolarHBondContact O-N 2.89Å; K910-V913 VanDerWaalsContact O-N 3.1Å; K910-E914 WeakPolarHBondContact O-CG 3.42Å; K910-E914 PolarHBondContact O-N 3.4Å; K910-Q969 HydrophobicContact CG-CG 4.33Å; K910-E973 WeakPolarHBondContact CE-OE1 3.43Å; K910-E973 IonicContact NZ-OE1 4Å
911L85.2Confident83.5Confident101 Ų10168.3 Ų68.353%0.52934%0.341SS..Hα-helixtrans-57.1-43.1176.2-70.6168.5000111.7E907 E914 E915E907-L911 WeakPolarHBondContact O-CG 3.44Å; E907-L911 PolarHBondContact O-N 3.21Å; E907-L911 VanDerWaalsContact O-N 3.09Å; L911-E914 PolarHBondContact O-N 2.87Å; L911-E915 PolarHBondContact O-N 3.5Å
912L85.5Confident83.8Confident16 Ų1666.7 Ų66.78%0.08434%0.335CS..Hα-helixtrans-67.9-35.9175.6-67.9176000113.2W882 A886 I889 Q908 V909 K910 E914 E915 L916 L965W882-L912 HydrophobicContact CZ2-CD2 4.22Å; A886-L912 HydrophobicContact CB-CD1 4.34Å; I889-L912 HydrophobicContact CB-CD1 3.84Å; I889-L912 HydrophobicContact CD1-CD1 3.81Å; I889-L912 HydrophobicContact CG1-CD1 4.42Å; I889-L912 HydrophobicContact CG2-CD1 3.69Å; Q908-L912 PolarHBondContact O-N 3.38Å; V909-L912 PolarHBondContact O-N 3.48Å; K910-L912 VanDerWaalsContact C-N 3.29Å; K910-L912 PolarHBondContact O-N 3.26Å; L912-E914 VanDerWaalsContact C-N 3.33Å; L912-E915 PolarHBondContact O-N 3.41Å; L912-L916 PolarHBondContact O-N 2.99Å; L912-L965 HydrophobicContact CB-CD1 3.82Å; L912-L965 HydrophobicContact CB-CD2 4.17Å; L912-L965 HydrophobicContact CD1-CD1 4.42Å; L912-L965 HydrophobicContact CD1-CD2 3.89Å
913V85.9Confident84.2Confident33 Ų3366.8 Ų66.820%0.234%0.335CS..Hα-helixtrans-65.9-37174.8170.70000111.1V909 K910 E915 L916 L965 P966V909-V913 HydrophobicContact CG1-CG2 4.22Å; V909-V913 WeakPolarHBondContact O-CG2 3.26Å; V909-V913 PolarHBondContact O-N 3.49Å; K910-V913 PolarHBondContact O-N 2.89Å; K910-V913 VanDerWaalsContact O-N 3.1Å; V913-E915 VanDerWaalsContact C-N 3.34Å; V913-L916 HydrophobicContact CG1-CD1 4.5Å; V913-L916 HydrophobicContact CG2-CD1 4.48Å; V913-L916 WeakPolarHBondContact O-CB 3.5Å; V913-L916 PolarHBondContact O-N 3.29Å; V913-L965 HydrophobicContact CG2-CB 3.88Å; V913-P966 HydrophobicContact CG2-CG 4.46Å
914E84.6Confident84.3Confident143 Ų14368.1 Ų68.167%0.66834%0.341SS*.Hα-helixtrans-69-28.3173.4-71.7179.9-17600112.9K910 L911 L912 P917K910-E914 WeakPolarHBondContact O-CG 3.42Å; K910-E914 PolarHBondContact O-N 3.4Å; L911-E914 PolarHBondContact O-N 2.87Å; L912-E914 VanDerWaalsContact C-N 3.33Å; E914-P917 WeakPolarHBondContact O-CD 3.5Å
915E87.8Confident84.2Confident61 Ų6169.1 Ų69.129%0.28535%0.346SS..Hα-helixtrans-73.4-23.6172.4-77.1-170.2-153.600114W882 L911 L912 V913 L918 R919W882-E915 HydrophobicContact CZ2-CB 4.23Å; W882-E915 PolarHBondContact NE1-OE2 3Å; L911-E915 PolarHBondContact O-N 3.5Å; L912-E915 PolarHBondContact O-N 3.41Å; V913-E915 VanDerWaalsContact C-N 3.34Å; E915-L918 WeakPolarHBondContact O-CB 3.46Å; E915-L918 PolarHBondContact O-N 3.04Å; E915-R919 HydrophobicContact CB-CG 4.27Å; E915-R919 WeakPolarHBondContact O-CG 3.41Å; E915-R919 PolarHBondContact O-N 3.49Å; E915-R919 IonicContact OE2-CZ 2.58Å; E915-R919 IonicContact OE2-NE 3.14Å; E915-R919 PolarHBondContact OE2-NE 3.24Å; E915-R919 IonicContact OE2-NH2 3.73Å; E915-R919 PolarHBondContact OE2-NH2 3.31Å
916L86.9Confident84.4Confident19 Ų1966.6 Ų66.610%0.09934%0.335CS..Hα-helixtrans-51.1-46.6-173.9-73.1171000114W882 L912 V913 L918 R919 Q920 W958 L965 P966W882-L916 HydrophobicContact CH2-CD2 4.05Å; L912-L916 PolarHBondContact O-N 2.99Å; V913-L916 HydrophobicContact CG1-CD1 4.5Å; V913-L916 HydrophobicContact CG2-CD1 4.48Å; V913-L916 WeakPolarHBondContact O-CB 3.5Å; V913-L916 PolarHBondContact O-N 3.29Å; L916-L918 VanDerWaalsContact C-N 3.31Å; L916-L918 PolarHBondContact O-N 3Å; L916-R919 PolarHBondContact O-N 2.88Å; L916-Q920 WeakPolarHBondContact O-CB 3.39Å; L916-Q920 PolarHBondContact O-N 3.47Å; L916-W958 HydrophobicContact CB-CH2 4.09Å; L916-W958 HydrophobicContact CD2-CH2 3.4Å; L916-W958 HydrophobicContact CD2-CZ2 4.21Å; L916-W958 HydrophobicContact CD2-CZ3 3.7Å; L916-W958 HydrophobicContact CG-CH2 4.36Å; L916-W958 VanDerWaalsContact O-CH2 3.24Å; L916-W958 WeakPolarHBondContact O-CH2 3.16Å; L916-L965 HydrophobicContact CD2-CD1 4.38Å; L916-P966 HydrophobicContact CD1-CG 4.35Å
917P81.3Confident84.3Confident93 Ų9368.8 Ų68.860%0.60435%0.347SS*.Hα-helixtrans-62.6-36-179.6-22.435.1000113.4E914 G921E914-P917 WeakPolarHBondContact O-CD 3.5Å; P917-G921 PolarHBondContact O-N 2.67Å
918L80Confident83.9Confident130 Ų13068.5 Ų68.568%0.68135%0.345SS*.Hα-helixtrans-69.1-45.6177.3-65.5169.5000110.6E915 L916 Q920 G921 I922E915-L918 WeakPolarHBondContact O-CB 3.46Å; E915-L918 PolarHBondContact O-N 3.04Å; L916-L918 VanDerWaalsContact C-N 3.31Å; L916-L918 PolarHBondContact O-N 3Å; L918-Q920 VanDerWaalsContact C-N 3.32Å; L918-Q920 PolarHBondContact O-N 3.29Å; L918-G921 PolarHBondContact O-N 3.48Å; L918-G921 VanDerWaalsContact O-N 3.1Å; L918-I922 PolarHBondContact O-N 3.15Å
919R86.1Confident83.3Confident56 Ų5667.6 Ų67.621%0.21135%0.346CS..Hα-helixtrans-64.6-35.9178.2-61.3-73.6176.9-159.5-1111.7F879 W882 E915 L916 G921 I922 L923 W958F879-R919 HydrophobicContact CE2-CB 3.83Å; F879-R919 WeakPolarHBondContact CE2-O 3.46Å; F879-R919 HydrophobicContact CZ-CB 4.19Å; F879-R919 WeakPolarHBondContact CZ-O 3.46Å; W882-R919 VanDerWaalsContact CD1-CZ 3.4Å; W882-R919 HydrophobicContact CD2-CG 4.03Å; W882-R919 VanDerWaalsContact CE2-NE 3.34Å; W882-R919 HydrophobicContact CE3-CB 4.46Å; W882-R919 HydrophobicContact CE3-CG 4.1Å; W882-R919 HydrophobicContact CH2-CB 4.15Å; W882-R919 HydrophobicContact CH2-CG 3.78Å; W882-R919 HydrophobicContact CZ2-CG 3.65Å; W882-R919 HydrophobicContact CZ3-CB 4.11Å; W882-R919 HydrophobicContact CZ3-CG 3.99Å; W882-R919 VanDerWaalsContact NE1-NE 3.14Å; E915-R919 HydrophobicContact CB-CG 4.27Å; E915-R919 WeakPolarHBondContact O-CG 3.41Å; E915-R919 PolarHBondContact O-N 3.49Å; E915-R919 IonicContact OE2-CZ 2.58Å; E915-R919 IonicContact OE2-NE 3.14Å; E915-R919 PolarHBondContact OE2-NE 3.24Å; E915-R919 IonicContact OE2-NH2 3.73Å; E915-R919 PolarHBondContact OE2-NH2 3.31Å; L916-R919 PolarHBondContact O-N 2.88Å; R919-G921 VanDerWaalsContact C-N 3.27Å; R919-G921 PolarHBondContact O-N 3.32Å; R919-I922 PolarHBondContact O-N 3.07Å; R919-L923 PolarHBondContact O-N 2.61Å; R919-W958 HydrophobicContact CB-CH2 3.95Å; R919-W958 HydrophobicContact CB-CZ3 3.56Å
920Q84.8Confident82.6Confident118 Ų11867.4 Ų67.455%0.55134%0.344SS*.Hα-helixtrans-61.9-34.6173-167.3174.42.900112.4L916 L918 K924 W958L916-Q920 WeakPolarHBondContact O-CB 3.39Å; L916-Q920 PolarHBondContact O-N 3.47Å; L918-Q920 VanDerWaalsContact C-N 3.32Å; L918-Q920 PolarHBondContact O-N 3.29Å; Q920-K924 WeakPolarHBondContact O-CB 3.5Å; Q920-K924 PolarHBondContact O-N 2.77Å; Q920-W958 HydrophobicContact CB-CH2 4.09Å; Q920-W958 HydrophobicContact CB-CZ2 3.7Å; Q920-W958 HydrophobicContact CG-CZ2 4.08Å
921G80.3Confident81.8Confident35 Ų3566.1 Ų66.136%0.36135%0.349SS..Hα-helixtrans-63.1-44.8172.200000112.7P917 L918 R919 K924 Q925P917-G921 PolarHBondContact O-N 2.67Å; L918-G921 PolarHBondContact O-N 3.48Å; L918-G921 VanDerWaalsContact O-N 3.1Å; R919-G921 VanDerWaalsContact C-N 3.27Å; R919-G921 PolarHBondContact O-N 3.32Å; G921-K924 WeakPolarHBondContact O-CB 3.49Å; G921-K924 PolarHBondContact O-N 2.97Å; G921-Q925 PolarHBondContact O-N 2.74Å
922I83.3Confident80.7Confident58 Ų5865 Ų6530%0.29735%0.348SS..Hα-helixtrans-63.8-44.6176.6-60.1170.4000110.7F879 L918 R919 K924 Q925 L926F879-I922 HydrophobicContact CD2-CB 4.1Å; F879-I922 HydrophobicContact CD2-CG2 3.72Å; F879-I922 HydrophobicContact CE2-CB 4.08Å; F879-I922 HydrophobicContact CE2-CG2 4.2Å; L918-I922 PolarHBondContact O-N 3.15Å; R919-I922 PolarHBondContact O-N 3.07Å; I922-K924 VanDerWaalsContact C-N 3.29Å; I922-K924 PolarHBondContact O-N 3.36Å; I922-Q925 PolarHBondContact O-N 3.13Å; I922-L926 HydrophobicContact CG2-CD1 4.24Å; I922-L926 WeakPolarHBondContact O-CG 3.43Å; I922-L926 PolarHBondContact O-N 3.44Å
923L86.1Confident79.9Confident7 Ų764.5 Ų64.54%0.03735%0.346CS..Hα-helixtrans-62-37.1176.2-176.760.4000112.3F879 R919 L926 N927 T954 W958F879-L923 HydrophobicContact CD1-CD1 4.37Å; F879-L923 HydrophobicContact CE1-CB 3.98Å; F879-L923 HydrophobicContact CE1-CD1 3.95Å; F879-L923 HydrophobicContact CE1-CD2 4.35Å; F879-L923 HydrophobicContact CE1-CG 4.32Å; F879-L923 HydrophobicContact CE2-CB 4.35Å; F879-L923 HydrophobicContact CZ-CB 3.72Å; R919-L923 PolarHBondContact O-N 2.61Å; L923-L926 PolarHBondContact O-N 3.35Å; L923-N927 WeakPolarHBondContact O-CB 3.28Å; L923-N927 PolarHBondContact O-N 3.27Å; L923-N927 PolarHBondContact O-ND2 3.11Å; L923-T954 HydrophobicContact CD1-CG2 4.37Å; L923-W958 HydrophobicContact CD2-CB 3.68Å; L923-W958 HydrophobicContact CD2-CD2 3.85Å; L923-W958 HydrophobicContact CD2-CG 3.31Å
924K81Confident79Confident118 Ų11863.4 Ų63.451%0.51334%0.339SS..Hα-helixtrans-62.3-46.5173.9-178.3176.6169.1-179.80111Q920 G921 I922 L926 N927 E928Q920-K924 WeakPolarHBondContact O-CB 3.5Å; Q920-K924 PolarHBondContact O-N 2.77Å; G921-K924 WeakPolarHBondContact O-CB 3.49Å; G921-K924 PolarHBondContact O-N 2.97Å; I922-K924 VanDerWaalsContact C-N 3.29Å; I922-K924 PolarHBondContact O-N 3.36Å; K924-L926 PolarHBondContact O-N 3.15Å; K924-N927 PolarHBondContact O-N 2.95Å; K924-E928 WeakPolarHBondContact CE-OE1 3.44Å; K924-E928 HydrophobicContact CG-CG 4.38Å; K924-E928 IonicContact NZ-OE1 3.06Å; K924-E928 WeakPolarHBondContact O-CB 3.2Å; K924-E928 WeakPolarHBondContact O-CG 3.36Å; K924-E928 PolarHBondContact O-N 3.07Å
925Q80.8Confident77.7Confident125 Ų12562.7 Ų62.758%0.58434%0.344SS*.Hα-helixtrans-61.1-41.5175.1-71.9177-20.300112.6G921 I922 E928 T929G921-Q925 PolarHBondContact O-N 2.74Å; I922-Q925 PolarHBondContact O-N 3.13Å; Q925-E928 PolarHBondContact O-N 2.93Å; Q925-T929 VanDerWaalsContact O-CB 3.24Å; Q925-T929 WeakPolarHBondContact O-CB 3.28Å; Q925-T929 PolarHBondContact O-N 3.47Å; Q925-T929 PolarHBondContact O-OG1 3.33Å
926L86Confident75.7Confident7 Ų763.2 Ų63.24%0.03735%0.354CS..Hα-helixtrans-62.1-40.9174.4-74.6171.9000112.2F872 D875 L876 F879 I922 L923 K924 G930 L951F872-L926 HydrophobicContact CD2-CD2 3.99Å; F872-L926 HydrophobicContact CE2-CD2 4.03Å; F872-L926 WeakPolarHBondContact CE2-O 3.24Å; D875-L926 HydrophobicContact CB-CD2 3.92Å; L876-L926 HydrophobicContact CB-CD2 4.2Å; L876-L926 HydrophobicContact CD1-CD1 4.37Å; F879-L926 HydrophobicContact CB-CD1 3.75Å; F879-L926 HydrophobicContact CD1-CD1 4.4Å; F879-L926 HydrophobicContact CD2-CD1 4.5Å; F879-L926 HydrophobicContact CG-CD1 3.97Å; I922-L926 HydrophobicContact CG2-CD1 4.24Å; I922-L926 WeakPolarHBondContact O-CG 3.43Å; I922-L926 PolarHBondContact O-N 3.44Å; L923-L926 PolarHBondContact O-N 3.35Å; K924-L926 PolarHBondContact O-N 3.15Å; L926-G930 WeakPolarHBondContact O-CA 3.34Å; L926-G930 PolarHBondContact O-N 3.31Å; L926-L951 HydrophobicContact CB-CD1 4.32Å
927N82.8Confident73.9Confident64 Ų6462.8 Ų62.834%0.34235%0.354SS..Hα-helixtrans-69.9-41.1176.1-73.7-33.9000112.3L923 K924 N955L923-N927 WeakPolarHBondContact O-CB 3.28Å; L923-N927 PolarHBondContact O-N 3.27Å; L923-N927 PolarHBondContact O-ND2 3.11Å; K924-N927 PolarHBondContact O-N 2.95Å; N927-N955 PolarHBondContact ND2-OD1 3.13Å; N927-N955 PolarHBondContact OD1-ND2 3.37Å
928E75.3Confident72.4Confident106 Ų10661.2 Ų61.250%0.49534%0.343SS..Hα-helixtrans-67.6-33.6177.6-74.1176.4163.100112.7K924 Q925 P932K924-E928 WeakPolarHBondContact CE-OE1 3.44Å; K924-E928 HydrophobicContact CG-CG 4.38Å; K924-E928 IonicContact NZ-OE1 3.06Å; K924-E928 WeakPolarHBondContact O-CB 3.2Å; K924-E928 WeakPolarHBondContact O-CG 3.36Å; K924-E928 PolarHBondContact O-N 3.07Å; Q925-E928 PolarHBondContact O-N 2.93Å; E928-P932 WeakPolarHBondContact O-CD 3.39Å; E928-P932 WeakPolarHBondContact O-CG 3.43Å
929T73.6Confident71.2Confident61 Ų6156.1 Ų56.137%0.37432%0.316SS..Hα-helixtrans-84.8-37178.1-50.50000111.5Q925 G931 P932 V933Q925-T929 VanDerWaalsContact O-CB 3.24Å; Q925-T929 WeakPolarHBondContact O-CB 3.28Å; Q925-T929 PolarHBondContact O-N 3.47Å; Q925-T929 PolarHBondContact O-OG1 3.33Å; T929-G931 PolarHBondContact O-N 3.06Å; T929-P932 WeakPolarHBondContact O-CD 3.37Å; T929-V933 HydrophobicContact CG2-CG2 3.92Å; T929-V933 WeakPolarHBondContact O-CB 3.32Å; T929-V933 VanDerWaalsContact O-CG2 3.26Å; T929-V933 WeakPolarHBondContact O-CG2 3.45Å; T929-V933 PolarHBondContact O-N 3.13Å
930G72.1Confident69.8Low0 Ų055.7 Ų55.70%032%0.322CS..Hα-helixtrans-62.1-41.9-175.400000113.5F872 L926 V933 L934F872-G930 VanDerWaalsContact CE2-CA 3.49Å; L926-G930 WeakPolarHBondContact O-CA 3.34Å; L926-G930 PolarHBondContact O-N 3.31Å; G930-V933 PolarHBondContact O-N 2.85Å; G930-L934 VanDerWaalsContact O-CB 3.28Å; G930-L934 WeakPolarHBondContact O-CB 3.48Å; G930-L934 WeakPolarHBondContact O-CD1 3.49Å; G930-L934 WeakPolarHBondContact O-CG 3.29Å; G930-L934 PolarHBondContact O-N 3.23Å
931G67.9Low68.6Low37 Ų3754.7 Ų54.738%0.38133%0.326SS..Hα-helixtrans-57.3-58.3176.600000113.1T929 V933 L934 V935T929-G931 PolarHBondContact O-N 3.06Å; G931-V933 VanDerWaalsContact C-N 3.35Å; G931-V933 PolarHBondContact O-N 3.34Å; G931-L934 PolarHBondContact O-N 3.16Å; G931-V935 WeakPolarHBondContact O-CG2 3.39Å; G931-V935 PolarHBondContact O-N 2.94Å; G931-V935 VanDerWaalsContact O-N 3.16Å
932P62.2Low67.6Low78 Ų7856.7 Ų56.751%0.50633%0.326SS..Hα-helixtrans-55.8-42.8173.6-27.835.1000113.9E928 T929 V935 S936E928-P932 WeakPolarHBondContact O-CD 3.39Å; E928-P932 WeakPolarHBondContact O-CG 3.43Å; T929-P932 WeakPolarHBondContact O-CD 3.37Å; P932-V935 PolarHBondContact O-N 2.93Å; P932-S936 VanDerWaalsContact O-CB 3.23Å; P932-S936 WeakPolarHBondContact O-CB 3.33Å; P932-S936 PolarHBondContact O-N 2.95Å; P932-S936 PolarHBondContact O-OG 3.43Å
933V69.4Low66.7Low6 Ų659 Ų594%0.03634%0.335CS..Hα-helixtrans-67.2-46.1-178.1171.60000111.6I868 L869 F872 T929 G930 G931 V935 S936 A937I868-V933 HydrophobicContact CG2-CG2 3.51Å; L869-V933 HydrophobicContact CD1-CG1 3.85Å; F872-V933 HydrophobicContact CB-CG1 4.42Å; F872-V933 HydrophobicContact CD1-CG1 4.1Å; F872-V933 HydrophobicContact CG-CG1 4.4Å; T929-V933 HydrophobicContact CG2-CG2 3.92Å; T929-V933 WeakPolarHBondContact O-CB 3.32Å; T929-V933 VanDerWaalsContact O-CG2 3.26Å; T929-V933 WeakPolarHBondContact O-CG2 3.45Å; T929-V933 PolarHBondContact O-N 3.13Å; G930-V933 PolarHBondContact O-N 2.85Å; G931-V933 VanDerWaalsContact C-N 3.35Å; G931-V933 PolarHBondContact O-N 3.34Å; V933-V935 VanDerWaalsContact C-N 3.29Å; V933-V935 PolarHBondContact O-N 3.2Å; V933-S936 PolarHBondContact O-N 3.11Å; V933-A937 HydrophobicContact CG1-CB 4.34Å; V933-A937 WeakPolarHBondContact O-CB 3.24Å; V933-A937 PolarHBondContact O-N 3.34Å
934L66.6Low65.9Low10 Ų1061.5 Ų61.55%0.05235%0.347CS..Hα-helixtrans-63.9-32.6178.6-70.1166.4000112.6G930 G931 Q944 L947 E948G930-L934 VanDerWaalsContact O-CB 3.28Å; G930-L934 WeakPolarHBondContact O-CB 3.48Å; G930-L934 WeakPolarHBondContact O-CD1 3.49Å; G930-L934 WeakPolarHBondContact O-CG 3.29Å; G930-L934 PolarHBondContact O-N 3.23Å; G931-L934 PolarHBondContact O-N 3.16Å; L934-Q944 HydrophobicContact CB-CG 4.36Å; L934-Q944 HydrophobicContact CD2-CG 3.86Å; L934-Q944 VanDerWaalsContact O-CD 3.26Å; L934-Q944 PolarHBondContact O-NE2 3.44Å; L934-Q944 VanDerWaalsContact O-NE2 3.13Å; L934-L947 HydrophobicContact CD2-CB 3.79Å; L934-E948 HydrophobicContact CD1-CB 3.86Å; L934-E948 HydrophobicContact CD1-CG 3.99Å; L934-E948 HydrophobicContact CD2-CB 4.34Å
935V57.1Low65.4Low128 Ų12860.3 Ų60.378%0.77635%0.346SS*.Hα-helixtrans-86.2-32.2-179.7175.60000113G931 P932 V933G931-V935 WeakPolarHBondContact O-CG2 3.39Å; G931-V935 PolarHBondContact O-N 2.94Å; G931-V935 VanDerWaalsContact O-N 3.16Å; P932-V935 PolarHBondContact O-N 2.93Å; V933-V935 VanDerWaalsContact C-N 3.29Å; V933-V935 PolarHBondContact O-N 3.2Å
936S45.2Very low65.1Low72 Ų7258.6 Ų58.650%0.50334%0.337SS..Hα-helixtrans-107.3-20.8-170.471.50000115.5Q865 P932 V933Q865-S936 PolarHBondContact NE2-O 3.08Å; P932-S936 VanDerWaalsContact O-CB 3.23Å; P932-S936 WeakPolarHBondContact O-CB 3.33Å; P932-S936 PolarHBondContact O-N 2.95Å; P932-S936 PolarHBondContact O-OG 3.43Å; V933-S936 PolarHBondContact O-N 3.11Å
937A49.3Very low64.9Low10 Ų1058.9 Ų58.98%0.08334%0.338CS..SBendtrans-82.1136.9175.800000110.1V933 I939V933-A937 HydrophobicContact CG1-CB 4.34Å; V933-A937 WeakPolarHBondContact O-CB 3.24Å; V933-A937 PolarHBondContact O-N 3.34Å; A937-I939 HydrophobicContact CB-CD1 3.97Å; A937-I939 HydrophobicContact CB-CG1 3.85Å; A937-I939 PolarHBondContact O-N 2.91Å
938P49.9Very low64.8Low59 Ų5958.8 Ų58.838%0.38334%0.336SS..  trans-80.373.7-179.533.4-35.4000110.9H794H794-P938 WeakPolarHBondContact CE1-CB 3.45Å; H794-P938 WeakPolarHBondContact CE1-CG 3.4Å; H794-P938 WeakPolarHBondContact NE2-CG 3.4Å
939I54.7Low65.2Low23 Ų2357.8 Ų57.812%0.11833%0.334CS..  trans-89.8154.7178.7-51.8165.7000108.5L869 A937 E943 Q944 L947L869-I939 HydrophobicContact CD1-CD1 3.59Å; L869-I939 HydrophobicContact CD1-CG1 4.11Å; L869-I939 HydrophobicContact CD2-CD1 4.26Å; L869-I939 HydrophobicContact CD2-CG1 3.82Å; A937-I939 HydrophobicContact CB-CD1 3.97Å; A937-I939 HydrophobicContact CB-CG1 3.85Å; A937-I939 PolarHBondContact O-N 2.91Å; I939-E943 HydrophobicContact CG2-CB 3.38Å; I939-Q944 HydrophobicContact CB-CB 4.36Å; I939-Q944 HydrophobicContact CG2-CB 4.24Å; I939-L947 HydrophobicContact CD1-CD1 4.28Å
940S56.5Low65.7Low48 Ų4858.5 Ų58.534%0.33633%0.332SS..  trans-65.2143.8167.464.40000110E942 E943 Q944S940-E942 PolarHBondContact O-N 2.98Å; S940-E942 VanDerWaalsContact O-N 3.11Å; S940-E943 PolarHBondContact O-N 3.48Å; S940-E943 VanDerWaalsContact OG-CB 3.28Å; S940-E943 WeakPolarHBondContact OG-CB 3.29Å; S940-E943 VanDerWaalsContact OG-CG 3.25Å; S940-E943 WeakPolarHBondContact OG-CG 3.27Å; S940-E943 PolarHBondContact OG-N 3.17Å; S940-E943 PolarHBondContact OG-OE2 3.21Å; S940-Q944 WeakPolarHBondContact O-CB 3.44Å; S940-Q944 PolarHBondContact O-N 3.44Å
941P60.4Low66.4Low96 Ų9659.3 Ų59.362%0.62334%0.336SS*.Hα-helixtrans-55.6-33.5-179.4-27.435.3000113Q944 D945P941-Q944 PolarHBondContact O-N 3.15Å; P941-D945 WeakPolarHBondContact O-CB 3.5Å; P941-D945 PolarHBondContact O-N 3.33Å
942E59.6Low67.2Low78 Ų7862.4 Ų62.436%0.36434%0.339SS..Hα-helixtrans-70.9-38.1177.8-65.8167.717400112.2S940 K946 K1168S940-E942 PolarHBondContact O-N 2.98Å; S940-E942 VanDerWaalsContact O-N 3.11Å; E942-K946 WeakPolarHBondContact O-CB 3.42Å; E942-K946 VanDerWaalsContact O-CG 3.23Å; E942-K946 WeakPolarHBondContact O-CG 3.47Å; E942-K946 PolarHBondContact O-N 3.02Å; E942-K1168 IonicContact OE1-NZ 2.8Å; E942-K1168 PolarHBondContact OE1-NZ 3.06Å
943E65.2Low68.2Low107 Ų10764.2 Ų64.250%0.534%0.341SS..Hα-helixtrans-72.7-34.8170.9-76.3170131.800112.6I939 S940 K946 L947I939-E943 HydrophobicContact CG2-CB 3.38Å; S940-E943 PolarHBondContact O-N 3.48Å; S940-E943 VanDerWaalsContact OG-CB 3.28Å; S940-E943 WeakPolarHBondContact OG-CB 3.29Å; S940-E943 VanDerWaalsContact OG-CG 3.25Å; S940-E943 WeakPolarHBondContact OG-CG 3.27Å; S940-E943 PolarHBondContact OG-N 3.17Å; S940-E943 PolarHBondContact OG-OE2 3.21Å; E943-K946 PolarHBondContact O-N 3.46Å; E943-L947 WeakPolarHBondContact O-CB 3.3Å; E943-L947 WeakPolarHBondContact O-CG 3.16Å; E943-L947 PolarHBondContact O-N 3.15Å
944Q68.9Low69Low58 Ų5864 Ų6427%0.27134%0.339SS..Hα-helixtrans-63-49.4174.5-174.8-175.1-2000109.9L934 I939 S940 P941 K946 L947 E948L934-Q944 HydrophobicContact CB-CG 4.36Å; L934-Q944 HydrophobicContact CD2-CG 3.86Å; L934-Q944 VanDerWaalsContact O-CD 3.26Å; L934-Q944 PolarHBondContact O-NE2 3.44Å; L934-Q944 VanDerWaalsContact O-NE2 3.13Å; I939-Q944 HydrophobicContact CB-CB 4.36Å; I939-Q944 HydrophobicContact CG2-CB 4.24Å; S940-Q944 WeakPolarHBondContact O-CB 3.44Å; S940-Q944 PolarHBondContact O-N 3.44Å; P941-Q944 PolarHBondContact O-N 3.15Å; Q944-K946 PolarHBondContact O-N 2.92Å; Q944-L947 PolarHBondContact O-N 2.97Å; Q944-E948 WeakPolarHBondContact O-CB 3.46Å; Q944-E948 PolarHBondContact O-N 2.97Å
945D70.2Confident70Confident93 Ų9365.4 Ų65.450%0.49735%0.347SS..Hα-helixtrans-61-42.1173-89.9-7.5000111.6P941 L947 N949P941-D945 WeakPolarHBondContact O-CB 3.5Å; P941-D945 PolarHBondContact O-N 3.33Å; D945-L947 PolarHBondContact O-N 3.11Å; D945-N949 WeakPolarHBondContact O-CB 3.24Å; D945-N949 PolarHBondContact O-N 2.9Å; D945-N949 PolarHBondContact O-ND2 2.76Å
946K75.2Confident71.3Confident89 Ų8965 Ų6539%0.38734%0.34SS..Hα-helixtrans-60-45.2175-79.9174.9-177-178.50111.5E942 E943 Q944 K950 D1158 E1160E942-K946 WeakPolarHBondContact O-CB 3.42Å; E942-K946 VanDerWaalsContact O-CG 3.23Å; E942-K946 WeakPolarHBondContact O-CG 3.47Å; E942-K946 PolarHBondContact O-N 3.02Å; E943-K946 PolarHBondContact O-N 3.46Å; Q944-K946 PolarHBondContact O-N 2.92Å; K946-K950 VanDerWaalsContact O-CB 3.25Å; K946-K950 WeakPolarHBondContact O-CB 3.3Å; K946-K950 PolarHBondContact O-N 3.43Å; K946-D1158 IonicContact NZ-OD1 2.71Å; K946-E1160 IonicContact NZ-OE2 3.9Å
947L81Confident73.1Confident14 Ų1463.5 Ų63.57%0.07332%0.324CS..Hα-helixtrans-68.8-43.1178.5-80.5161.8000112.4L869 F872 Q873 L876 L934 I939 E943 Q944 D945 K950 L951L869-L947 HydrophobicContact CD1-CD1 3.89Å; F872-L947 HydrophobicContact CE1-CD2 4.26Å; Q873-L947 HydrophobicContact CB-CD2 4.37Å; Q873-L947 HydrophobicContact CG-CD2 4.1Å; L876-L947 HydrophobicContact CD2-CD2 4.31Å; L934-L947 HydrophobicContact CD2-CB 3.79Å; I939-L947 HydrophobicContact CD1-CD1 4.28Å; E943-L947 WeakPolarHBondContact O-CB 3.3Å; E943-L947 WeakPolarHBondContact O-CG 3.16Å; E943-L947 PolarHBondContact O-N 3.15Å; Q944-L947 PolarHBondContact O-N 2.97Å; D945-L947 PolarHBondContact O-N 3.11Å; L947-K950 PolarHBondContact O-N 2.96Å; L947-L951 WeakPolarHBondContact O-CB 3.45Å; L947-L951 PolarHBondContact O-N 3.06Å
948E81.6Confident75.1Confident61 Ų6164 Ų6429%0.28532%0.324SS..Hα-helixtrans-65.6-43.6177.6-168.5-178.414900111.2L934 Q944 K950 L951 K952L934-E948 HydrophobicContact CD1-CB 3.86Å; L934-E948 HydrophobicContact CD1-CG 3.99Å; L934-E948 HydrophobicContact CD2-CB 4.34Å; Q944-E948 WeakPolarHBondContact O-CB 3.46Å; Q944-E948 PolarHBondContact O-N 2.97Å; E948-K950 VanDerWaalsContact C-N 3.35Å; E948-L951 PolarHBondContact O-N 3.01Å; E948-K952 HydrophobicContact CG-CD 4.4Å; E948-K952 WeakPolarHBondContact O-CB 3.24Å; E948-K952 VanDerWaalsContact O-CG 3.31Å; E948-K952 WeakPolarHBondContact O-CG 3.09Å; E948-K952 PolarHBondContact O-N 3.15Å; E948-K952 WeakPolarHBondContact OE1-CE 3.36Å; E948-K952 IonicContact OE1-NZ 3.55Å; E948-K952 PolarHBondContact OE1-NZ 2.97Å
949N81.7Confident76.8Confident85 Ų8566.1 Ų66.146%0.45533%0.331SS..Hα-helixtrans-65.3-37.9174.5-72.5-45.7000111.7D945 K952 Q953D945-N949 WeakPolarHBondContact O-CB 3.24Å; D945-N949 PolarHBondContact O-N 2.9Å; D945-N949 PolarHBondContact O-ND2 2.76Å; N949-K952 PolarHBondContact O-N 3.13Å; N949-Q953 WeakPolarHBondContact O-CB 3.23Å; N949-Q953 PolarHBondContact O-N 2.68Å
950K84.9Confident78.3Confident77 Ų7770.1 Ų70.134%0.33535%0.348SS..Hα-helixtrans-64.4-42.8173.8-165.4169.9-168.8177.20111.5L876 N877 K946 L947 E948 Q953 T954L876-K950 HydrophobicContact CD2-CB 4.35Å; L876-K950 HydrophobicContact CD2-CD 4.46Å; L876-K950 HydrophobicContact CD2-CG 4.27Å; N877-K950 PolarHBondContact OD1-NZ 3.47Å; K946-K950 VanDerWaalsContact O-CB 3.25Å; K946-K950 WeakPolarHBondContact O-CB 3.3Å; K946-K950 PolarHBondContact O-N 3.43Å; L947-K950 PolarHBondContact O-N 2.96Å; E948-K950 VanDerWaalsContact C-N 3.35Å; K950-Q953 PolarHBondContact O-N 2.84Å; K950-T954 WeakPolarHBondContact O-CB 3.35Å; K950-T954 PolarHBondContact O-N 3.33Å; K950-T954 PolarHBondContact O-OG1 3.08Å
951L87.2Confident79.7Confident16 Ų1667.8 Ų67.88%0.08433%0.332CS..Hα-helixtrans-62.6-42.8174.2-175.767.3000111.7F872 L876 L926 L947 E948 T954 N955F872-L951 HydrophobicContact CZ-CD1 4.39Å; F872-L951 HydrophobicContact CZ-CD2 4.26Å; L876-L951 HydrophobicContact CD1-CD1 3.84Å; L926-L951 HydrophobicContact CB-CD1 4.32Å; L947-L951 WeakPolarHBondContact O-CB 3.45Å; L947-L951 PolarHBondContact O-N 3.06Å; E948-L951 PolarHBondContact O-N 3.01Å; L951-T954 WeakPolarHBondContact O-CB 3.35Å; L951-T954 PolarHBondContact O-N 2.87Å; L951-N955 PolarHBondContact O-N 2.97Å; L951-N955 PolarHBondContact O-ND2 3.11Å
952K84.6Confident80.9Confident103 Ų10365 Ų6545%0.44831%0.314SS..Hα-helixtrans-61.2-46.3173.9-73.2167.2-176.51630111.9E948 N949 T954 N955 L956E948-K952 HydrophobicContact CG-CD 4.4Å; E948-K952 WeakPolarHBondContact O-CB 3.24Å; E948-K952 VanDerWaalsContact O-CG 3.31Å; E948-K952 WeakPolarHBondContact O-CG 3.09Å; E948-K952 PolarHBondContact O-N 3.15Å; E948-K952 WeakPolarHBondContact OE1-CE 3.36Å; E948-K952 IonicContact OE1-NZ 3.55Å; E948-K952 PolarHBondContact OE1-NZ 2.97Å; N949-K952 PolarHBondContact O-N 3.13Å; K952-T954 VanDerWaalsContact C-N 3.33Å; K952-T954 PolarHBondContact O-N 3.44Å; K952-N955 PolarHBondContact O-N 2.78Å; K952-L956 WeakPolarHBondContact O-CG 3.28Å; K952-L956 PolarHBondContact O-N 3.11Å
953Q82.8Confident82.1Confident116 Ų11669.3 Ų69.354%0.54233%0.327SS..Hα-helixtrans-62.7-40.2177.1-176.3174.2-4.800111.8N949 K950 L956 Q957N949-Q953 WeakPolarHBondContact O-CB 3.23Å; N949-Q953 PolarHBondContact O-N 2.68Å; K950-Q953 PolarHBondContact O-N 2.84Å; Q953-L956 PolarHBondContact O-N 3.42Å; Q953-Q957 PolarHBondContact O-N 3.19Å
954T86.3Confident83Confident1 Ų165.4 Ų65.41%0.00631%0.314CS..Hα-helixtrans-60.2-46.6174.8-56.20000111.2L876 F879 V880 L883 L923 K950 L951 K952 L956 Q957 W958L876-T954 HydrophobicContact CD1-CG2 4.04Å; F879-T954 HydrophobicContact CD1-CG2 3.57Å; F879-T954 HydrophobicContact CE1-CG2 4.14Å; V880-T954 HydrophobicContact CG2-CG2 3.98Å; V880-T954 WeakPolarHBondContact CG2-OG1 3.25Å; L883-T954 HydrophobicContact CD1-CG2 3.66Å; L883-T954 WeakPolarHBondContact CD1-O 3.48Å; L923-T954 HydrophobicContact CD1-CG2 4.37Å; K950-T954 WeakPolarHBondContact O-CB 3.35Å; K950-T954 PolarHBondContact O-N 3.33Å; K950-T954 PolarHBondContact O-OG1 3.08Å; L951-T954 WeakPolarHBondContact O-CB 3.35Å; L951-T954 PolarHBondContact O-N 2.87Å; K952-T954 VanDerWaalsContact C-N 3.33Å; K952-T954 PolarHBondContact O-N 3.44Å; T954-L956 VanDerWaalsContact C-N 3.34Å; T954-L956 PolarHBondContact O-N 3.16Å; T954-Q957 PolarHBondContact O-N 2.98Å; T954-W958 WeakPolarHBondContact O-CB 3.47Å; T954-W958 PolarHBondContact O-N 2.98Å
955N87.4Confident84Confident39 Ų3962.7 Ų62.721%0.20930%0.301CS..Hα-helixtrans-62.3-38.4175.2-81.5-82.3000112.2N927 L951 K952 W958 I959N927-N955 PolarHBondContact ND2-OD1 3.13Å; N927-N955 PolarHBondContact OD1-ND2 3.37Å; L951-N955 PolarHBondContact O-N 2.97Å; L951-N955 PolarHBondContact O-ND2 3.11Å; K952-N955 PolarHBondContact O-N 2.78Å; N955-W958 PolarHBondContact O-N 3.34Å; N955-I959 WeakPolarHBondContact O-CG1 3.31Å; N955-I959 PolarHBondContact O-N 3.18Å; N955-I959 VanDerWaalsContact O-N 3.07Å
956L84.3Confident84.7Confident120 Ų12061 Ų6163%0.62830%0.295SS*.Hα-helixtrans-68.3-42.6176-70.7170.1000112.5K952 Q953 T954 I959 K960K952-L956 WeakPolarHBondContact O-CG 3.28Å; K952-L956 PolarHBondContact O-N 3.11Å; Q953-L956 PolarHBondContact O-N 3.42Å; T954-L956 VanDerWaalsContact C-N 3.34Å; T954-L956 PolarHBondContact O-N 3.16Å; L956-I959 PolarHBondContact O-N 2.85Å; L956-K960 PolarHBondContact O-N 3.03Å
957Q84Confident85.1Confident40 Ų4062.6 Ų62.619%0.18730%0.304CS..Hα-helixtrans-61.8-42.6172.9-80174.9-3900111.1L883 Q953 T954 I959 K960 V961L883-Q957 HydrophobicContact CD1-CB 3.99Å; Q953-Q957 PolarHBondContact O-N 3.19Å; T954-Q957 PolarHBondContact O-N 2.98Å; Q957-I959 PolarHBondContact O-N 3.24Å; Q957-K960 WeakPolarHBondContact O-CB 3.49Å; Q957-K960 PolarHBondContact O-N 2.81Å; Q957-K960 VanDerWaalsContact O-N 3.14Å; Q957-V961 WeakPolarHBondContact O-CB 3.25Å; Q957-V961 WeakPolarHBondContact O-CG2 3.46Å; Q957-V961 PolarHBondContact O-N 2.94Å
958W91.4Very high85.3Confident20 Ų2063.4 Ų63.48%0.07631%0.307CS..Hα-helixtrans-56.8-46.5173.5170.8-96.8000112.5F879 W882 L883 L916 R919 Q920 L923 T954 N955 K960 V961 S962F879-W958 HydrophobicContact CE1-CE3 4.14Å; F879-W958 HydrophobicContact CZ-CD2 4.43Å; F879-W958 AromaticContact CZ-CE3 3.68Å; F879-W958 HydrophobicContact CZ-CE3 3.68Å; F879-W958 HydrophobicContact CZ-CZ3 4.1Å; W882-W958 HydrophobicContact CH2-CZ3 4.01Å; W882-W958 HydrophobicContact CZ3-CE3 4.07Å; W882-W958 AromaticContact CZ3-CZ3 3.69Å; W882-W958 HydrophobicContact CZ3-CZ3 3.69Å; L883-W958 HydrophobicContact CD1-CB 4.42Å; L883-W958 HydrophobicContact CD2-CB 4.12Å; L883-W958 HydrophobicContact CD2-CE3 4.05Å; L916-W958 HydrophobicContact CB-CH2 4.09Å; L916-W958 HydrophobicContact CD2-CH2 3.4Å; L916-W958 HydrophobicContact CD2-CZ2 4.21Å; L916-W958 HydrophobicContact CD2-CZ3 3.7Å; L916-W958 HydrophobicContact CG-CH2 4.36Å; L916-W958 VanDerWaalsContact O-CH2 3.24Å; L916-W958 WeakPolarHBondContact O-CH2 3.16Å; R919-W958 HydrophobicContact CB-CH2 3.95Å; R919-W958 HydrophobicContact CB-CZ3 3.56Å; Q920-W958 HydrophobicContact CB-CH2 4.09Å; Q920-W958 HydrophobicContact CB-CZ2 3.7Å; Q920-W958 HydrophobicContact CG-CZ2 4.08Å; L923-W958 HydrophobicContact CD2-CB 3.68Å; L923-W958 HydrophobicContact CD2-CD2 3.85Å; L923-W958 HydrophobicContact CD2-CG 3.31Å; T954-W958 WeakPolarHBondContact O-CB 3.47Å; T954-W958 PolarHBondContact O-N 2.98Å; N955-W958 PolarHBondContact O-N 3.34Å; W958-K960 VanDerWaalsContact C-N 3.29Å; W958-K960 PolarHBondContact O-N 3.42Å; W958-V961 PolarHBondContact O-N 3.48Å; W958-S962 WeakPolarHBondContact O-CB 3.18Å; W958-S962 PolarHBondContact O-N 3.11Å; W958-S962 PolarHBondContact O-OG 3.12Å
959I85.4Confident85.5Confident104 Ų10462.5 Ų62.553%0.53330%0.302SS..Hα-helixtrans-62.1-37.4176.9-67.7163.4000111.4N955 L956 Q957 S962 R963N955-I959 WeakPolarHBondContact O-CG1 3.31Å; N955-I959 PolarHBondContact O-N 3.18Å; N955-I959 VanDerWaalsContact O-N 3.07Å; L956-I959 PolarHBondContact O-N 2.85Å; Q957-I959 PolarHBondContact O-N 3.24Å; I959-S962 PolarHBondContact O-OG 3.36Å; I959-R963 PolarHBondContact O-N 3.14Å
960K84.8Confident85.4Confident107 Ų10760.2 Ų60.247%0.46530%0.299SS..Hα-helixtrans-64.6-54.2175-172.5-160.9-177.9-134.30111.2D887 L956 Q957 W958 R963 A964D887-K960 IonicContact OD1-NZ 3.6Å; D887-K960 PolarHBondContact OD1-NZ 3.42Å; D887-K960 IonicContact OD2-NZ 3.57Å; D887-K960 PolarHBondContact OD2-NZ 3.43Å; L956-K960 PolarHBondContact O-N 3.03Å; Q957-K960 WeakPolarHBondContact O-CB 3.49Å; Q957-K960 PolarHBondContact O-N 2.81Å; Q957-K960 VanDerWaalsContact O-N 3.14Å; W958-K960 VanDerWaalsContact C-N 3.29Å; W958-K960 PolarHBondContact O-N 3.42Å; K960-R963 PolarHBondContact O-N 3.46Å; K960-A964 VanDerWaalsContact O-CB 3.26Å; K960-A964 WeakPolarHBondContact O-CB 3.43Å; K960-A964 PolarHBondContact O-N 3.1Å
961V87.3Confident85.1Confident0 Ų060.5 Ų60.50%030%0.302CS..Hα-helixtrans-67.7-44.9-174.31710000112.1L883 A886 D887 Q957 W958 R963 A964 L965L883-V961 HydrophobicContact CD2-CB 4.1Å; L883-V961 HydrophobicContact CD2-CG1 4.39Å; L883-V961 HydrophobicContact CD2-CG2 4.15Å; A886-V961 HydrophobicContact CB-CG1 3.61Å; D887-V961 HydrophobicContact CB-CG2 3.68Å; Q957-V961 WeakPolarHBondContact O-CB 3.25Å; Q957-V961 WeakPolarHBondContact O-CG2 3.46Å; Q957-V961 PolarHBondContact O-N 2.94Å; W958-V961 PolarHBondContact O-N 3.48Å; V961-R963 PolarHBondContact O-N 3.05Å; V961-A964 PolarHBondContact O-N 2.94Å; V961-A964 VanDerWaalsContact O-N 3.16Å; V961-L965 HydrophobicContact CG1-CD1 3.67Å; V961-L965 HydrophobicContact CG1-CG 4.15Å; V961-L965 PolarHBondContact O-N 3.4Å
962S84.8Confident84.9Confident36 Ų3659.8 Ų59.825%0.25230%0.298SS..Hα-helixtrans-64.8-21.4178.960.10000113.8W958 I959 P966W958-S962 WeakPolarHBondContact O-CB 3.18Å; W958-S962 PolarHBondContact O-N 3.11Å; W958-S962 PolarHBondContact O-OG 3.12Å; I959-S962 PolarHBondContact O-OG 3.36Å; S962-P966 WeakPolarHBondContact O-CD 3.18Å; S962-P966 WeakPolarHBondContact O-CG 3.43Å
963R85.6Confident84.7Confident169 Ų16958.8 Ų58.864%0.63830%0.295SS*.Hα-helixtrans-85.8-47.7166.8174.9176.1-73.7174.6-2.5112.1I959 K960 V961 L965 P966 E967I959-R963 PolarHBondContact O-N 3.14Å; K960-R963 PolarHBondContact O-N 3.46Å; V961-R963 PolarHBondContact O-N 3.05Å; R963-L965 PolarHBondContact O-N 3.19Å; R963-P966 WeakPolarHBondContact O-CD 3.42Å; R963-E967 VanDerWaalsContact CD-OE1 3.28Å; R963-E967 WeakPolarHBondContact CD-OE1 3.38Å; R963-E967 VanDerWaalsContact CG-CD 3.43Å; R963-E967 HydrophobicContact CG-CG 4.28Å; R963-E967 WeakPolarHBondContact CG-OE1 3.28Å; R963-E967 WeakPolarHBondContact O-CG 3.44Å; R963-E967 PolarHBondContact O-N 3.02Å
964A84.2Confident84.5Confident26 Ų2655.3 Ų55.322%0.21529%0.286CS..Hα-helixtrans-64.5-37.2-172.800000113.1A890 K960 V961 E967 K968A890-A964 HydrophobicContact CB-CB 4.24Å; K960-A964 VanDerWaalsContact O-CB 3.26Å; K960-A964 WeakPolarHBondContact O-CB 3.43Å; K960-A964 PolarHBondContact O-N 3.1Å; V961-A964 PolarHBondContact O-N 2.94Å; V961-A964 VanDerWaalsContact O-N 3.16Å; A964-E967 PolarHBondContact O-N 3.15Å; A964-K968 VanDerWaalsContact O-CB 3.25Å; A964-K968 WeakPolarHBondContact O-CB 3.4Å; A964-K968 PolarHBondContact O-N 2.83Å
965L88.7Confident84Confident0 Ų057.5 Ų57.50%030%0.296CS..Hα-helixtrans-64.6-51.8-179.5-77.9171.3000113A886 A890 V909 L912 V913 L916 V961 R963 E967 K968 Q969A886-L965 HydrophobicContact CB-CD1 4.29Å; A890-L965 HydrophobicContact CB-CD2 3.97Å; A890-L965 HydrophobicContact CB-CG 4.34Å; V909-L965 HydrophobicContact CG1-CD2 4.19Å; V909-L965 WeakPolarHBondContact CG1-O 3.48Å; L912-L965 HydrophobicContact CB-CD1 3.82Å; L912-L965 HydrophobicContact CB-CD2 4.17Å; L912-L965 HydrophobicContact CD1-CD1 4.42Å; L912-L965 HydrophobicContact CD1-CD2 3.89Å; V913-L965 HydrophobicContact CG2-CB 3.88Å; L916-L965 HydrophobicContact CD2-CD1 4.38Å; V961-L965 HydrophobicContact CG1-CD1 3.67Å; V961-L965 HydrophobicContact CG1-CG 4.15Å; V961-L965 PolarHBondContact O-N 3.4Å; R963-L965 PolarHBondContact O-N 3.19Å; L965-E967 VanDerWaalsContact C-N 3.35Å; L965-E967 PolarHBondContact O-N 3.46Å; L965-K968 PolarHBondContact O-N 3.29Å; L965-Q969 PolarHBondContact O-N 3.3Å
966P84.8Confident83.5Confident58 Ų5857.3 Ų57.338%0.37730%0.295SS..Hα-helixtrans-60-39172.2-26.835000114V913 L916 S962 R963 K968 Q969 G970V913-P966 HydrophobicContact CG2-CG 4.46Å; L916-P966 HydrophobicContact CD1-CG 4.35Å; S962-P966 WeakPolarHBondContact O-CD 3.18Å; S962-P966 WeakPolarHBondContact O-CG 3.43Å; R963-P966 WeakPolarHBondContact O-CD 3.42Å; P966-K968 VanDerWaalsContact C-N 3.31Å; P966-K968 PolarHBondContact O-N 3.31Å; P966-Q969 PolarHBondContact O-N 3.03Å; P966-G970 PolarHBondContact O-N 2.82Å
967E84.2Confident83Confident122 Ų12258.5 Ų58.557%0.5730%0.295SS*.Hα-helixtrans-62-40.5174.7-74175.4178.900111.1R963 A964 L965 G970 E971R963-E967 VanDerWaalsContact CD-OE1 3.28Å; R963-E967 WeakPolarHBondContact CD-OE1 3.38Å; R963-E967 VanDerWaalsContact CG-CD 3.43Å; R963-E967 HydrophobicContact CG-CG 4.28Å; R963-E967 WeakPolarHBondContact CG-OE1 3.28Å; R963-E967 WeakPolarHBondContact O-CG 3.44Å; R963-E967 PolarHBondContact O-N 3.02Å; A964-E967 PolarHBondContact O-N 3.15Å; L965-E967 VanDerWaalsContact C-N 3.35Å; L965-E967 PolarHBondContact O-N 3.46Å; E967-G970 PolarHBondContact O-N 2.63Å; E967-E971 PolarHBondContact O-N 2.78Å
968K84.6Confident82.3Confident32 Ų3261.2 Ų61.214%0.13931%0.31CS..Hα-helixtrans-68.8-39177-16068.7177.51710112.6A890 V909 A964 L965 P966 G970 E971 I972A890-K968 WeakPolarHBondContact O-CD 3.43Å; A890-K968 WeakPolarHBondContact O-CE 2.95Å; V909-K968 HydrophobicContact CG2-CG 4.43Å; A964-K968 VanDerWaalsContact O-CB 3.25Å; A964-K968 WeakPolarHBondContact O-CB 3.4Å; A964-K968 PolarHBondContact O-N 2.83Å; L965-K968 PolarHBondContact O-N 3.29Å; P966-K968 VanDerWaalsContact C-N 3.31Å; P966-K968 PolarHBondContact O-N 3.31Å; K968-G970 VanDerWaalsContact C-N 3.33Å; K968-E971 WeakPolarHBondContact CD-OE2 3.42Å; K968-E971 WeakPolarHBondContact CE-OE2 3.47Å; K968-E971 IonicContact NZ-OE2 2.64Å; K968-E971 PolarHBondContact NZ-OE2 2.92Å; K968-E971 PolarHBondContact O-N 2.7Å; K968-I972 HydrophobicContact CG-CD1 4.28Å; K968-I972 VanDerWaalsContact O-CG1 3.29Å; K968-I972 WeakPolarHBondContact O-CG1 3.5Å; K968-I972 PolarHBondContact O-N 2.85Å
969Q87.1Confident81.4Confident41 Ų4161.3 Ų61.319%0.19231%0.312CS..Hα-helixtrans-58-49172-169.8-170.3-27.100110.2L906 V909 K910 L965 P966 E971 I972 E973L906-Q969 HydrophobicContact CD1-CG 3.65Å; V909-Q969 HydrophobicContact CG1-CB 3.9Å; K910-Q969 HydrophobicContact CG-CG 4.33Å; L965-Q969 PolarHBondContact O-N 3.3Å; P966-Q969 PolarHBondContact O-N 3.03Å; Q969-E971 PolarHBondContact O-N 3.32Å; Q969-I972 PolarHBondContact O-N 3.37Å; Q969-E973 PolarHBondContact NE2-OE1 2.86Å; Q969-E973 WeakPolarHBondContact O-CB 3.4Å; Q969-E973 WeakPolarHBondContact O-CG 3.41Å; Q969-E973 PolarHBondContact O-N 3.33Å
970G79.1Confident80.6Confident37 Ų3758.3 Ų58.338%0.38131%0.307SS..Hα-helixtrans-61.5-3917700000113.6P966 E967 K968 A974P966-G970 PolarHBondContact O-N 2.82Å; E967-G970 PolarHBondContact O-N 2.63Å; K968-G970 VanDerWaalsContact C-N 3.33Å; G970-A974 VanDerWaalsContact O-CB 3.28Å; G970-A974 WeakPolarHBondContact O-CB 3.29Å; G970-A974 PolarHBondContact O-N 3.5Å
971E79.5Confident79.8Confident84 Ų8457.3 Ų57.339%0.39330%0.304SS..Hα-helixtrans-62.3-46.2174.7-170.6-174.1-157.900111.7L894 E967 K968 Q969 A974 Q975L894-E971 HydrophobicContact CD1-CG 4.1Å; E967-E971 PolarHBondContact O-N 2.78Å; K968-E971 WeakPolarHBondContact CD-OE2 3.42Å; K968-E971 WeakPolarHBondContact CE-OE2 3.47Å; K968-E971 IonicContact NZ-OE2 2.64Å; K968-E971 PolarHBondContact NZ-OE2 2.92Å; K968-E971 PolarHBondContact O-N 2.7Å; Q969-E971 PolarHBondContact O-N 3.32Å; E971-A974 PolarHBondContact O-N 3.32Å; E971-Q975 WeakPolarHBondContact O-CG 3.4Å; E971-Q975 PolarHBondContact O-N 3.27Å
972I81.5Confident78.8Confident1 Ų158.6 Ų58.61%0.00531%0.311CS..Hα-helixtrans-67.1-44.2179.3-63.3164.6000110.9L894 L902 K905 L906 V909 K968 Q969 A974 Q975 I976L894-I972 HydrophobicContact CD1-CG1 3.63Å; L894-I972 HydrophobicContact CD2-CD1 4.06Å; L894-I972 HydrophobicContact CD2-CG1 3.78Å; L894-I972 HydrophobicContact CG-CG1 4.37Å; L902-I972 HydrophobicContact CB-CG2 4.27Å; L902-I972 HydrophobicContact CD2-CG2 4.46Å; L902-I972 WeakPolarHBondContact O-CG2 3.32Å; K905-I972 HydrophobicContact CB-CD1 4.33Å; L906-I972 HydrophobicContact CB-CG2 3.81Å; L906-I972 HydrophobicContact CD1-CB 4.3Å; L906-I972 HydrophobicContact CD1-CG2 4.18Å; L906-I972 HydrophobicContact CG-CG2 4.45Å; V909-I972 HydrophobicContact CG2-CD1 4.1Å; K968-I972 HydrophobicContact CG-CD1 4.28Å; K968-I972 VanDerWaalsContact O-CG1 3.29Å; K968-I972 WeakPolarHBondContact O-CG1 3.5Å; K968-I972 PolarHBondContact O-N 2.85Å; Q969-I972 PolarHBondContact O-N 3.37Å; I972-A974 VanDerWaalsContact C-N 3.3Å; I972-A974 PolarHBondContact O-N 2.85Å; I972-Q975 PolarHBondContact O-N 3.5Å; I972-I976 HydrophobicContact CG2-CD1 3.87Å; I972-I976 HydrophobicContact CG2-CG1 4.44Å; I972-I976 WeakPolarHBondContact O-CG1 3.29Å; I972-I976 PolarHBondContact O-N 2.88Å
973E81.7Confident78.1Confident81 Ų8161.1 Ų61.138%0.37932%0.319SS..Hα-helixtrans-62.4-37.5176.9-72.6178.6-179.300111.8L906 K910 Q969 K977L906-E973 HydrophobicContact CD1-CG 3.72Å; L906-E973 HydrophobicContact CD2-CG 3.91Å; K910-E973 WeakPolarHBondContact CE-OE1 3.43Å; K910-E973 IonicContact NZ-OE1 4Å; Q969-E973 PolarHBondContact NE2-OE1 2.86Å; Q969-E973 WeakPolarHBondContact O-CB 3.4Å; Q969-E973 WeakPolarHBondContact O-CG 3.41Å; Q969-E973 PolarHBondContact O-N 3.33Å; E973-K977 VanDerWaalsContact O-CB 3.27Å; E973-K977 WeakPolarHBondContact O-CB 3.43Å; E973-K977 PolarHBondContact O-N 3.22Å
974A76.7Confident77.3Confident43 Ų4359.4 Ų59.436%0.35532%0.316SS..Hα-helixtrans-64.2-48.217200000112.1G970 E971 I972 I976 K977 D978G970-A974 VanDerWaalsContact O-CB 3.28Å; G970-A974 WeakPolarHBondContact O-CB 3.29Å; G970-A974 PolarHBondContact O-N 3.5Å; E971-A974 PolarHBondContact O-N 3.32Å; I972-A974 VanDerWaalsContact C-N 3.3Å; I972-A974 PolarHBondContact O-N 2.85Å; A974-I976 VanDerWaalsContact C-N 3.35Å; A974-I976 PolarHBondContact O-N 3.5Å; A974-K977 WeakPolarHBondContact O-CB 3.4Å; A974-K977 PolarHBondContact O-N 2.87Å; A974-K977 VanDerWaalsContact O-N 3.15Å; A974-D978 PolarHBondContact O-N 3.26Å
975Q76.1Confident76.6Confident47 Ų4763.3 Ų63.322%0.2233%0.328CS..Hα-helixtrans-61.7-39.2178.5-72.4-173.325.100113L902 E971 I972 D978 L979L902-Q975 HydrophobicContact CD1-CB 4.29Å; E971-Q975 WeakPolarHBondContact O-CG 3.4Å; E971-Q975 PolarHBondContact O-N 3.27Å; I972-Q975 PolarHBondContact O-N 3.5Å; Q975-D978 PolarHBondContact O-N 3.01Å; Q975-L979 WeakPolarHBondContact O-CB 3.18Å; Q975-L979 PolarHBondContact O-N 3.05Å
976I77.5Confident75.7Confident36 Ų3664.6 Ų64.619%0.18534%0.335CS..Hα-helixtrans-64.5-43.5174.4-68.4169.5000110.5L902 K903 L906 I972 A974 D978 L979 G980L902-I976 HydrophobicContact CB-CD1 3.99Å; L902-I976 HydrophobicContact CB-CG1 3.78Å; L902-I976 HydrophobicContact CD1-CG1 4.22Å; K903-I976 HydrophobicContact CG-CD1 4.27Å; L906-I976 HydrophobicContact CD2-CD1 4.11Å; I972-I976 HydrophobicContact CG2-CD1 3.87Å; I972-I976 HydrophobicContact CG2-CG1 4.44Å; I972-I976 WeakPolarHBondContact O-CG1 3.29Å; I972-I976 PolarHBondContact O-N 2.88Å; A974-I976 VanDerWaalsContact C-N 3.35Å; A974-I976 PolarHBondContact O-N 3.5Å; I976-D978 VanDerWaalsContact C-N 3.34Å; I976-D978 PolarHBondContact O-N 2.99Å; I976-L979 PolarHBondContact O-N 3.49Å; I976-G980 PolarHBondContact O-N 3.15Å
977K73.9Confident75Confident145 Ų14568.9 Ų68.963%0.6335%0.35SS*.Hα-helixtrans-64.7-36.5177.9-175.4-174.2174.4-175.50112.6E973 A974 Q981E973-K977 VanDerWaalsContact O-CB 3.27Å; E973-K977 WeakPolarHBondContact O-CB 3.43Å; E973-K977 PolarHBondContact O-N 3.22Å; A974-K977 WeakPolarHBondContact O-CB 3.4Å; A974-K977 PolarHBondContact O-N 2.87Å; A974-K977 VanDerWaalsContact O-N 3.15Å; K977-Q981 WeakPolarHBondContact O-CG 3.49Å; K977-Q981 PolarHBondContact O-N 2.89Å; K977-Q981 PolarHBondContact O-NE2 3.43Å
978D69.9Low74.3Confident96 Ų9666.8 Ų66.851%0.51334%0.343SS..Hα-helixtrans-73.9-37.3177.7-71.7-16.4000111.7A974 Q975 I976 Q981 L982A974-D978 PolarHBondContact O-N 3.26Å; Q975-D978 PolarHBondContact O-N 3.01Å; I976-D978 VanDerWaalsContact C-N 3.34Å; I976-D978 PolarHBondContact O-N 2.99Å; D978-Q981 PolarHBondContact O-N 3.03Å; D978-Q981 PolarHBondContact OD1-NE2 3.37Å; D978-L982 WeakPolarHBondContact O-CB 3.39Å; D978-L982 PolarHBondContact O-N 3.34Å
979L71.3Confident73.7Confident22 Ų2265.5 Ų65.512%0.11534%0.337CS..Hα-helixtrans-57.6-49.8169.2-96.5162.9000112L902 Q975 I976 Q981 L982 E983L902-L979 HydrophobicContact CD1-CD1 3.71Å; Q975-L979 WeakPolarHBondContact O-CB 3.18Å; Q975-L979 PolarHBondContact O-N 3.05Å; I976-L979 PolarHBondContact O-N 3.49Å; L979-Q981 VanDerWaalsContact C-N 3.33Å; L979-Q981 PolarHBondContact O-N 3.42Å; L979-L982 WeakPolarHBondContact O-CB 3.36Å; L979-L982 PolarHBondContact O-N 3.27Å; L979-L982 VanDerWaalsContact O-N 3.13Å; L979-E983 PolarHBondContact O-N 3.33Å
980G68.4Low73Confident42 Ų4266.4 Ų66.443%0.43334%0.342SS..Hα-helixtrans-64.2-34.5178.200000113.5I976 K984I976-G980 PolarHBondContact O-N 3.15Å; G980-K984 PolarHBondContact O-N 2.96Å
981Q67.9Low72.7Confident85 Ų8571.3 Ų71.340%0.39735%0.354SS..Hα-helixtrans-67.2-36.6171.8-78.8175.977.300112.7K977 D978 L979 K985K977-Q981 WeakPolarHBondContact O-CG 3.49Å; K977-Q981 PolarHBondContact O-N 2.89Å; K977-Q981 PolarHBondContact O-NE2 3.43Å; D978-Q981 PolarHBondContact O-N 3.03Å; D978-Q981 PolarHBondContact OD1-NE2 3.37Å; L979-Q981 VanDerWaalsContact C-N 3.33Å; L979-Q981 PolarHBondContact O-N 3.42Å; Q981-K985 VanDerWaalsContact O-CG 3.3Å; Q981-K985 WeakPolarHBondContact O-CG 3.34Å; Q981-K985 PolarHBondContact O-N 3.46Å; Q981-K985 VanDerWaalsContact O-N 3.13Å
982L67.3Low72.6Confident28 Ų2870.9 Ų70.915%0.14735%0.352CS..Hα-helixtrans-67.8-40.1178.1-167.475.4000111.5D978 L979 K985 L986 L1045 E1048 K1049D978-L982 WeakPolarHBondContact O-CB 3.39Å; D978-L982 PolarHBondContact O-N 3.34Å; L979-L982 WeakPolarHBondContact O-CB 3.36Å; L979-L982 PolarHBondContact O-N 3.27Å; L979-L982 VanDerWaalsContact O-N 3.13Å; L982-K985 PolarHBondContact O-N 3.07Å; L982-L986 PolarHBondContact O-N 3.34Å; L982-L986 VanDerWaalsContact O-N 3.1Å; L982-L1045 HydrophobicContact CD1-CD2 4Å; L982-E1048 HydrophobicContact CD1-CB 4.49Å; L982-K1049 HydrophobicContact CD2-CB 4.1Å; L982-K1049 HydrophobicContact CD2-CD 3.96Å
983E69.1Low72.4Confident89 Ų8970.8 Ų70.842%0.41635%0.352SS..Hα-helixtrans-67-42.1178.5-72.5176.9176.100111.8L979 K985 L986 E987 K1049L979-E983 PolarHBondContact O-N 3.33Å; E983-K985 VanDerWaalsContact C-N 3.34Å; E983-K985 PolarHBondContact O-N 3.34Å; E983-L986 WeakPolarHBondContact O-CB 3.43Å; E983-L986 PolarHBondContact O-N 2.79Å; E983-L986 VanDerWaalsContact O-N 3.12Å; E983-E987 PolarHBondContact O-N 3.43Å; E983-E987 VanDerWaalsContact O-N 3.1Å; E983-K1049 IonicContact OE1-NZ 2.83Å; E983-K1049 PolarHBondContact OE1-NZ 2.93Å
984K69.5Low72.2Confident132 Ų13269.8 Ų69.857%0.57435%0.349SS*.Hα-helixtrans-60.3-40.4172.2-172.5168.5-176.3170.50113.1G980 L986 E987 D988G980-K984 PolarHBondContact O-N 2.96Å; K984-L986 VanDerWaalsContact C-N 3.28Å; K984-L986 PolarHBondContact O-N 3.34Å; K984-E987 PolarHBondContact O-N 2.99Å; K984-D988 PolarHBondContact O-N 3.05Å
985K69.1Low72.2Confident108 Ų10874.5 Ų74.547%0.4736%0.364SS..Hα-helixtrans-64-30.6175.3-74.3169.1-176.6172.40113.1Q981 L982 E983 L989 L1045Q981-K985 VanDerWaalsContact O-CG 3.3Å; Q981-K985 WeakPolarHBondContact O-CG 3.34Å; Q981-K985 PolarHBondContact O-N 3.46Å; Q981-K985 VanDerWaalsContact O-N 3.13Å; L982-K985 PolarHBondContact O-N 3.07Å; E983-K985 VanDerWaalsContact C-N 3.34Å; E983-K985 PolarHBondContact O-N 3.34Å; K985-L989 WeakPolarHBondContact O-CB 3.48Å; K985-L989 PolarHBondContact O-N 3.38Å; K985-L1045 HydrophobicContact CB-CD2 4.24Å; K985-L1045 HydrophobicContact CD-CD2 4.38Å
986L69.9Low72.4Confident28 Ų2872.9 Ų72.915%0.14736%0.357CS..Hα-helixtrans-73.6-36.2175.5-77.5164.3000111.9L982 E983 K984 L989 E990 L1045L982-L986 PolarHBondContact O-N 3.34Å; L982-L986 VanDerWaalsContact O-N 3.1Å; E983-L986 WeakPolarHBondContact O-CB 3.43Å; E983-L986 PolarHBondContact O-N 2.79Å; E983-L986 VanDerWaalsContact O-N 3.12Å; K984-L986 VanDerWaalsContact C-N 3.28Å; K984-L986 PolarHBondContact O-N 3.34Å; L986-L989 PolarHBondContact O-N 2.83Å; L986-E990 PolarHBondContact O-N 3.32Å; L986-L1045 HydrophobicContact CD2-CB 4.37Å
987E69.9Low72.5Confident148 Ų14873.1 Ų73.169%0.69236%0.358SS*.Hα-helixtrans-66.8-48.9176.9-157167.9-142.400111.3E983 K984 L989 E990 E991E983-E987 PolarHBondContact O-N 3.43Å; E983-E987 VanDerWaalsContact O-N 3.1Å; K984-E987 PolarHBondContact O-N 2.99Å; E987-L989 VanDerWaalsContact C-N 3.25Å; E987-L989 PolarHBondContact O-N 2.7Å; E987-E990 PolarHBondContact O-N 3.12Å; E987-E990 VanDerWaalsContact O-N 3.17Å; E987-E991 PolarHBondContact O-N 3.44Å
988D69.3Low72.7Confident77 Ų7772.5 Ų72.541%0.41236%0.361SS..Hα-helixtrans-57.1-37173.3-71.6-18.6000112.2K984 Q992K984-D988 PolarHBondContact O-N 3.05Å; D988-Q992 VanDerWaalsContact O-CG 3.32Å; D988-Q992 WeakPolarHBondContact O-CG 3.42Å; D988-Q992 PolarHBondContact O-N 3.28Å; D988-Q992 PolarHBondContact O-NE2 3.06Å
989L72.9Confident73.2Confident6 Ų671.4 Ų71.43%0.03135%0.349CS..Hα-helixtrans-69.5-40.2178.5-176.878000111.8K985 L986 E987 Q992 L993 I1038 K1041 L1045 V1055K985-L989 WeakPolarHBondContact O-CB 3.48Å; K985-L989 PolarHBondContact O-N 3.38Å; L986-L989 PolarHBondContact O-N 2.83Å; E987-L989 VanDerWaalsContact C-N 3.25Å; E987-L989 PolarHBondContact O-N 2.7Å; L989-Q992 PolarHBondContact O-N 2.93Å; L989-L993 HydrophobicContact CD2-CD1 4.27Å; L989-L993 HydrophobicContact CG-CD1 3.96Å; L989-L993 WeakPolarHBondContact O-CB 3.24Å; L989-L993 WeakPolarHBondContact O-CD1 3.43Å; L989-L993 PolarHBondContact O-N 2.96Å; L989-I1038 HydrophobicContact CD1-CG2 4.2Å; L989-K1041 HydrophobicContact CD1-CB 4.17Å; L989-L1045 HydrophobicContact CD2-CD1 4.04Å; L989-V1055 HydrophobicContact CD2-CG1 4.45Å
990E72.5Confident73.6Confident60 Ų6070.3 Ų70.328%0.2834%0.344SS..Hα-helixtrans-66.2-37.5179.7-176164.7-176.200111.8L986 E987 L993 N994 V1055 K1058L986-E990 PolarHBondContact O-N 3.32Å; E987-E990 PolarHBondContact O-N 3.12Å; E987-E990 VanDerWaalsContact O-N 3.17Å; E990-L993 WeakPolarHBondContact O-CB 3.32Å; E990-L993 PolarHBondContact O-N 2.88Å; E990-N994 PolarHBondContact O-N 3.26Å; E990-N994 VanDerWaalsContact O-N 3.11Å; E990-N994 PolarHBondContact O-ND2 3.4Å; E990-V1055 WeakPolarHBondContact OE2-CG2 3.46Å; E990-K1058 HydrophobicContact CG-CD 4.24Å; E990-K1058 WeakPolarHBondContact OE1-CE 3.43Å; E990-K1058 IonicContact OE1-NZ 2.67Å; E990-K1058 PolarHBondContact OE1-NZ 3.02Å
991E73.5Confident73.9Confident139 Ų13970.7 Ų70.765%0.6534%0.34SS*.Hα-helixtrans-64-43.7174.8-167.5172.3-148.400111.9E987 N994 H995E987-E991 PolarHBondContact O-N 3.44Å; E991-N994 PolarHBondContact O-N 2.94Å; E991-H995 PolarHBondContact O-N 2.81Å
992Q76.6Confident74.3Confident75 Ų7570 Ų7035%0.3534%0.343SS..Hα-helixtrans-63-41.9175.4-71.817132.600112.6D988 L989 N994 H995 L996 I1038D988-Q992 VanDerWaalsContact O-CG 3.32Å; D988-Q992 WeakPolarHBondContact O-CG 3.42Å; D988-Q992 PolarHBondContact O-N 3.28Å; D988-Q992 PolarHBondContact O-NE2 3.06Å; L989-Q992 PolarHBondContact O-N 2.93Å; Q992-N994 PolarHBondContact O-N 3.24Å; Q992-H995 PolarHBondContact O-N 3.33Å; Q992-L996 PolarHBondContact O-N 2.86Å; Q992-L996 VanDerWaalsContact O-N 3.14Å; Q992-I1038 HydrophobicContact CB-CD1 3.78Å; Q992-I1038 HydrophobicContact CB-CG1 4.35Å; Q992-I1038 HydrophobicContact CG-CD1 4.43Å
993L77.2Confident74.7Confident0 Ų069.4 Ų69.40%034%0.339CS..Hα-helixtrans-57.3-46.1174.5-90.3154.9000112.3L989 E990 H995 L996 L997 I1038 V1055 K1058 L1059 L1062L989-L993 HydrophobicContact CD2-CD1 4.27Å; L989-L993 HydrophobicContact CG-CD1 3.96Å; L989-L993 WeakPolarHBondContact O-CB 3.24Å; L989-L993 WeakPolarHBondContact O-CD1 3.43Å; L989-L993 PolarHBondContact O-N 2.96Å; E990-L993 WeakPolarHBondContact O-CB 3.32Å; E990-L993 PolarHBondContact O-N 2.88Å; L993-H995 VanDerWaalsContact C-N 3.33Å; L993-H995 PolarHBondContact O-N 2.85Å; L993-L996 PolarHBondContact O-N 3.4Å; L993-L997 WeakPolarHBondContact O-CG 3.37Å; L993-L997 PolarHBondContact O-N 3.48Å; L993-L997 VanDerWaalsContact O-N 3.07Å; L993-I1038 HydrophobicContact CD2-CG2 4.43Å; L993-I1038 HydrophobicContact CG-CG2 4.17Å; L993-V1055 HydrophobicContact CD1-CG1 4.06Å; L993-K1058 HydrophobicContact CD2-CB 4.44Å; L993-L1059 HydrophobicContact CD1-CD1 4.5Å; L993-L1059 HydrophobicContact CD1-CD2 4.2Å; L993-L1059 HydrophobicContact CD1-CG 3.86Å; L993-L1059 HydrophobicContact CD2-CD2 3.91Å; L993-L1059 HydrophobicContact CD2-CG 4.01Å; L993-L1062 HydrophobicContact CD2-CB 3.88Å; L993-L1062 HydrophobicContact CD2-CD2 3.53Å; L993-L1062 HydrophobicContact CD2-CG 4.3Å
994N77.4Confident75Confident59 Ų5967.6 Ų67.632%0.31633%0.329SS..Hα-helixtrans-62.3-41.7179.1-62.4-37.6000111.4E990 E991 Q992 L997 L998 K1058E990-N994 PolarHBondContact O-N 3.26Å; E990-N994 VanDerWaalsContact O-N 3.11Å; E990-N994 PolarHBondContact O-ND2 3.4Å; E991-N994 PolarHBondContact O-N 2.94Å; Q992-N994 PolarHBondContact O-N 3.24Å; N994-L997 PolarHBondContact O-N 2.73Å; N994-L998 WeakPolarHBondContact O-CG 3.32Å; N994-L998 PolarHBondContact O-N 2.76Å; N994-L998 VanDerWaalsContact O-N 3.16Å; N994-K1058 WeakPolarHBondContact OD1-CE 3.36Å; N994-K1058 PolarHBondContact OD1-NZ 3.45Å
995H77.2Confident75.2Confident143 Ų14364.5 Ų64.566%0.66232%0.318SS*.Hα-helixtrans-63.6-42179.7-121.493.6000112.6E991 Q992 L993 W999E991-H995 PolarHBondContact O-N 2.81Å; Q992-H995 PolarHBondContact O-N 3.33Å; L993-H995 VanDerWaalsContact C-N 3.33Å; L993-H995 PolarHBondContact O-N 2.85Å; H995-W999 PolarHBondContact O-N 3.03Å
996L80.4Confident75.4Confident13 Ų1363.5 Ų63.57%0.06832%0.316CS..Hα-helixtrans-70.7-39.5177.7-73.4-178.8000113.3Q992 L993 L998 W999 L1000 D1034 V1035 I1038 L1062Q992-L996 PolarHBondContact O-N 2.86Å; Q992-L996 VanDerWaalsContact O-N 3.14Å; L993-L996 PolarHBondContact O-N 3.4Å; L996-L998 VanDerWaalsContact C-N 3.31Å; L996-L998 PolarHBondContact O-N 2.71Å; L996-W999 PolarHBondContact O-N 2.88Å; L996-L1000 PolarHBondContact O-N 3.43Å; L996-D1034 HydrophobicContact CD2-CB 4.41Å; L996-V1035 HydrophobicContact CD1-CB 4.3Å; L996-V1035 HydrophobicContact CD1-CG2 3.91Å; L996-V1035 HydrophobicContact CD2-CG2 3.96Å; L996-V1035 HydrophobicContact CG-CG2 4.47Å; L996-I1038 HydrophobicContact CD1-CB 4.04Å; L996-I1038 HydrophobicContact CD1-CD1 3.45Å; L996-I1038 VanDerWaalsContact CD1-CD1 3.45Å; L996-I1038 HydrophobicContact CD1-CG1 4.32Å; L996-I1038 HydrophobicContact CD1-CG2 4.15Å; L996-I1038 HydrophobicContact CG-CD1 4.17Å; L996-L1062 HydrophobicContact CB-CD1 3.8Å; L996-L1062 HydrophobicContact CB-CD2 4.4Å; L996-L1062 HydrophobicContact CD1-CD2 3.99Å
997L80.3Confident75.5Confident40 Ų4062.2 Ų62.221%0.20931%0.309CS..Hα-helixtrans-60.7-41176-80.9167.4000111.9L993 N994 W999 L1000 S1001 K1058 D1061 L1062 E1065L993-L997 WeakPolarHBondContact O-CG 3.37Å; L993-L997 PolarHBondContact O-N 3.48Å; L993-L997 VanDerWaalsContact O-N 3.07Å; N994-L997 PolarHBondContact O-N 2.73Å; L997-W999 VanDerWaalsContact C-N 3.34Å; L997-W999 PolarHBondContact O-N 3.02Å; L997-L1000 PolarHBondContact O-N 2.99Å; L997-S1001 PolarHBondContact O-N 3.27Å; L997-K1058 HydrophobicContact CD1-CB 4.42Å; L997-D1061 HydrophobicContact CD2-CB 4.32Å; L997-L1062 HydrophobicContact CD2-CB 4.09Å; L997-L1062 HydrophobicContact CD2-CD1 4.24Å; L997-L1062 HydrophobicContact CG-CB 4.24Å; L997-L1062 HydrophobicContact CG-CD1 4.21Å; L997-E1065 HydrophobicContact CD2-CG 4.27Å
998L77.1Confident75.5Confident133 Ų13359.2 Ų59.270%0.69630%0.295SS*.Hα-helixtrans-64.4-36.1174.8-74.8167000112.7N994 L996 P1002N994-L998 WeakPolarHBondContact O-CG 3.32Å; N994-L998 PolarHBondContact O-N 2.76Å; N994-L998 VanDerWaalsContact O-N 3.16Å; L996-L998 VanDerWaalsContact C-N 3.31Å; L996-L998 PolarHBondContact O-N 2.71Å; L998-P1002 VanDerWaalsContact O-CD 3.24Å; L998-P1002 WeakPolarHBondContact O-CD 3.34Å
999W81.3Confident75.4Confident72 Ų7259.2 Ų59.227%0.27329%0.294SS..Hα-helixtrans-74.8-33.1177.4173.178.9000113.4H995 L996 L997 P1002 I1003 K1031 V1035 W1066H995-W999 PolarHBondContact O-N 3.03Å; L996-W999 PolarHBondContact O-N 2.88Å; L997-W999 VanDerWaalsContact C-N 3.34Å; L997-W999 PolarHBondContact O-N 3.02Å; W999-P1002 WeakPolarHBondContact O-CD 3.48Å; W999-I1003 HydrophobicContact CD2-CD1 4.21Å; W999-I1003 VanDerWaalsContact CE2-CD1 3.41Å; W999-I1003 HydrophobicContact CH2-CD1 3.67Å; W999-I1003 HydrophobicContact CZ2-CD1 3.11Å; W999-I1003 HydrophobicContact CZ3-CD1 4.44Å; W999-K1031 HydrophobicContact CD2-CG 4.29Å; W999-K1031 HydrophobicContact CE3-CB 4.29Å; W999-K1031 HydrophobicContact CE3-CG 4.44Å; W999-K1031 HydrophobicContact CH2-CB 3.25Å; W999-K1031 HydrophobicContact CH2-CG 3.76Å; W999-K1031 HydrophobicContact CZ2-CB 3.54Å; W999-K1031 HydrophobicContact CZ2-CG 3.47Å; W999-K1031 VanDerWaalsContact CZ2-CG 3.47Å; W999-K1031 HydrophobicContact CZ3-CB 3.64Å; W999-K1031 HydrophobicContact CZ3-CG 4.2Å; W999-V1035 HydrophobicContact CZ3-CG2 4.39Å; W999-W1066 HydrophobicContact CH2-CZ3 4.43Å; W999-W1066 HydrophobicContact CZ3-CZ3 4.14Å
1000L79.8Confident75.1Confident0 Ų062.2 Ų62.20%031%0.305CS..Hα-helixtrans-74.3-37.7-176.9-86.9164.9000114.6L996 L997 I1003 R1004 L1062 W1066 V1069L996-L1000 PolarHBondContact O-N 3.43Å; L997-L1000 PolarHBondContact O-N 2.99Å; L1000-I1003 PolarHBondContact O-N 2.99Å; L1000-R1004 PolarHBondContact O-N 3.43Å; L1000-L1062 HydrophobicContact CD1-CD1 3.44Å; L1000-L1062 VanDerWaalsContact CD1-CD1 3.44Å; L1000-W1066 HydrophobicContact CD1-CB 4.4Å; L1000-W1066 HydrophobicContact CD1-CE3 4.11Å; L1000-W1066 HydrophobicContact CD2-CE3 3.55Å; L1000-W1066 HydrophobicContact CD2-CZ3 3.86Å; L1000-W1066 HydrophobicContact CG-CE3 4.41Å; L1000-V1069 HydrophobicContact CD2-CB 4.24Å; L1000-V1069 HydrophobicContact CD2-CG1 4.28Å; L1000-V1069 HydrophobicContact CD2-CG2 3.83Å
1001S74.5Confident74.7Confident50 Ų5062.9 Ų62.935%0.3531%0.311SS..Hα-helixtrans-55.3-47.7-175.5171.70000113.4L997 I1003 R1004 N1005L997-S1001 PolarHBondContact O-N 3.27Å; S1001-I1003 VanDerWaalsContact C-N 3.32Å; S1001-I1003 PolarHBondContact O-N 2.88Å; S1001-R1004 PolarHBondContact O-N 3.3Å; S1001-N1005 PolarHBondContact O-N 2.83Å; S1001-N1005 PolarHBondContact O-ND2 3.37Å
1002P76.2Confident74Confident70 Ų7062.1 Ų62.146%0.45531%0.307SS..Hα-helixtrans-56.6-40.6173.3-26.434.5000114.3L998 W999 N1005 Q1006L998-P1002 VanDerWaalsContact O-CD 3.24Å; L998-P1002 WeakPolarHBondContact O-CD 3.34Å; W999-P1002 WeakPolarHBondContact O-CD 3.48Å; P1002-N1005 PolarHBondContact O-N 3.16Å; P1002-Q1006 WeakPolarHBondContact O-CG 3.44Å; P1002-Q1006 PolarHBondContact O-N 3.35Å; P1002-Q1006 VanDerWaalsContact O-N 3.07Å
1003I76Confident72.8Confident15 Ų1564 Ų648%0.07733%0.326CS..Hα-helixtrans-73.6-41.2-176.3-68.9178.9000111.4W999 L1000 S1001 N1005 Q1006 L1007 V1028 V1069W999-I1003 HydrophobicContact CD2-CD1 4.21Å; W999-I1003 VanDerWaalsContact CE2-CD1 3.41Å; W999-I1003 HydrophobicContact CH2-CD1 3.67Å; W999-I1003 HydrophobicContact CZ2-CD1 3.11Å; W999-I1003 HydrophobicContact CZ3-CD1 4.44Å; L1000-I1003 PolarHBondContact O-N 2.99Å; S1001-I1003 VanDerWaalsContact C-N 3.32Å; S1001-I1003 PolarHBondContact O-N 2.88Å; I1003-N1005 VanDerWaalsContact C-N 3.3Å; I1003-N1005 PolarHBondContact O-N 2.92Å; I1003-Q1006 PolarHBondContact O-N 2.88Å; I1003-L1007 HydrophobicContact CG2-CD1 3.87Å; I1003-L1007 HydrophobicContact CG2-CG 4.38Å; I1003-L1007 WeakPolarHBondContact O-CG 3.31Å; I1003-L1007 PolarHBondContact O-N 2.76Å; I1003-V1028 HydrophobicContact CD1-CG2 4.23Å; I1003-V1028 HydrophobicContact CG2-CG2 3.56Å; I1003-V1069 HydrophobicContact CG2-CG1 4.24Å; I1003-V1069 HydrophobicContact CG2-CG2 4.5Å
1004R75.3Confident71.1Confident51 Ų5171.7 Ų71.719%0.19237%0.367CS..Hα-helixtrans-57.4-48173.4-167.4-157.966.7-133.7-2.3110.3L1000 S1001 Q1006 L1007 E1008 E1065 A1068 V1069 L1072L1000-R1004 PolarHBondContact O-N 3.43Å; S1001-R1004 PolarHBondContact O-N 3.3Å; R1004-Q1006 VanDerWaalsContact C-N 3.29Å; R1004-Q1006 PolarHBondContact O-N 2.9Å; R1004-L1007 PolarHBondContact O-N 2.72Å; R1004-L1007 VanDerWaalsContact O-N 3.15Å; R1004-E1008 HydrophobicContact CG-CG 4.41Å; R1004-E1008 IonicContact CZ-OE2 2.78Å; R1004-E1008 IonicContact NE-OE2 2.81Å; R1004-E1008 PolarHBondContact NE-OE2 3.38Å; R1004-E1008 IonicContact NH2-OE2 2.68Å; R1004-E1008 WeakPolarHBondContact O-CB 3.46Å; R1004-E1008 WeakPolarHBondContact O-CG 3.48Å; R1004-E1008 PolarHBondContact O-N 2.68Å; R1004-E1065 WeakPolarHBondContact CD-OE2 3.36Å; R1004-E1065 IonicContact CZ-OE2 2.97Å; R1004-E1065 IonicContact NE-OE2 2.66Å; R1004-E1065 IonicContact NH1-OE1 2.72Å; R1004-E1065 PolarHBondContact NH1-OE1 3.47Å; R1004-E1065 IonicContact NH1-OE2 3.33Å; R1004-E1065 PolarHBondContact NH1-OE2 3.01Å; R1004-A1068 HydrophobicContact CG-CB 4.49Å; R1004-V1069 HydrophobicContact CB-CG2 3.68Å; R1004-V1069 HydrophobicContact CG-CG2 4.12Å; R1004-L1072 HydrophobicContact CG-CD1 4.04Å
1005N73.8Confident69.5Low67 Ų6774.4 Ų74.436%0.35838%0.378SS..Hα-helixtrans-60.8-36.6179.1-63.3-32.2000112.1S1001 P1002 I1003 I1009S1001-N1005 PolarHBondContact O-N 2.83Å; S1001-N1005 PolarHBondContact O-ND2 3.37Å; P1002-N1005 PolarHBondContact O-N 3.16Å; I1003-N1005 VanDerWaalsContact C-N 3.3Å; I1003-N1005 PolarHBondContact O-N 2.92Å; N1005-I1009 WeakPolarHBondContact O-CD1 3.35Å; N1005-I1009 VanDerWaalsContact O-CG1 3.25Å; N1005-I1009 WeakPolarHBondContact O-CG1 2.77Å; N1005-I1009 PolarHBondContact O-N 3.18Å
1006Q73.1Confident67.6Low88 Ų8877.6 Ų77.641%0.41139%0.393SS..Hα-helixtrans-66.9-44.8173.1-76.3179.9-16.600112.8P1002 I1003 R1004 I1009 Y1010P1002-Q1006 WeakPolarHBondContact O-CG 3.44Å; P1002-Q1006 PolarHBondContact O-N 3.35Å; P1002-Q1006 VanDerWaalsContact O-N 3.07Å; I1003-Q1006 PolarHBondContact O-N 2.88Å; R1004-Q1006 VanDerWaalsContact C-N 3.29Å; R1004-Q1006 PolarHBondContact O-N 2.9Å; Q1006-I1009 WeakPolarHBondContact O-CB 3.11Å; Q1006-I1009 PolarHBondContact O-N 3.42Å; Q1006-Y1010 WeakPolarHBondContact O-CD2 3.49Å; Q1006-Y1010 PolarHBondContact O-N 3.24Å
1007L71.1Confident65.8Low1 Ų178.6 Ų78.61%0.00541%0.407CS..Hα-helixtrans-68.2-33.9178.7-69.9168.8000112.5I1003 R1004 I1009 Y1010 N1011 V1069 L1072 L1073I1003-L1007 HydrophobicContact CG2-CD1 3.87Å; I1003-L1007 HydrophobicContact CG2-CG 4.38Å; I1003-L1007 WeakPolarHBondContact O-CG 3.31Å; I1003-L1007 PolarHBondContact O-N 2.76Å; R1004-L1007 PolarHBondContact O-N 2.72Å; R1004-L1007 VanDerWaalsContact O-N 3.15Å; L1007-I1009 VanDerWaalsContact C-N 3.35Å; L1007-Y1010 HydrophobicContact CD2-CD2 4.35Å; L1007-Y1010 PolarHBondContact O-N 3.13Å; L1007-N1011 PolarHBondContact O-N 3.21Å; L1007-N1011 VanDerWaalsContact O-N 3.09Å; L1007-V1069 HydrophobicContact CD1-CB 4.39Å; L1007-V1069 HydrophobicContact CD1-CG1 3.8Å; L1007-V1069 HydrophobicContact CD1-CG2 4.49Å; L1007-L1072 HydrophobicContact CB-CB 3.93Å; L1007-L1072 HydrophobicContact CB-CD1 3.81Å; L1007-L1072 HydrophobicContact CB-CG 4.45Å; L1007-L1072 HydrophobicContact CD1-CB 4.44Å; L1007-L1073 HydrophobicContact CD1-CD1 4.31Å; L1007-L1073 HydrophobicContact CD1-CD2 4.43Å; L1007-L1073 HydrophobicContact CD1-CG 3.96Å; L1007-L1073 HydrophobicContact CD2-CD2 3.83Å; L1007-L1073 HydrophobicContact CD2-CG 4.2Å
1008E70.8Confident64.1Low85 Ų8583.4 Ų83.440%0.39744%0.441SS..Hα-helixtrans-64.8-37.5171.7-77.217811900111.7R1004 N1011 Q1012 L1072R1004-E1008 HydrophobicContact CG-CG 4.41Å; R1004-E1008 IonicContact CZ-OE2 2.78Å; R1004-E1008 IonicContact NE-OE2 2.81Å; R1004-E1008 PolarHBondContact NE-OE2 3.38Å; R1004-E1008 IonicContact NH2-OE2 2.68Å; R1004-E1008 WeakPolarHBondContact O-CB 3.46Å; R1004-E1008 WeakPolarHBondContact O-CG 3.48Å; R1004-E1008 PolarHBondContact O-N 2.68Å; E1008-N1011 PolarHBondContact O-N 3.41Å; E1008-Q1012 WeakPolarHBondContact O-CG 3.37Å; E1008-L1072 HydrophobicContact CG-CD1 3.69Å; E1008-L1072 HydrophobicContact CG-CD2 4.33Å
1009I66.8Low62.9Low76 Ų7682 Ų8239%0.3943%0.429SS..Hα-helixtrans-63.4-43.8172.6-69.6163.3000110.5N1005 Q1006 L1007 N1011 Q1012N1005-I1009 WeakPolarHBondContact O-CD1 3.35Å; N1005-I1009 VanDerWaalsContact O-CG1 3.25Å; N1005-I1009 WeakPolarHBondContact O-CG1 2.77Å; N1005-I1009 PolarHBondContact O-N 3.18Å; Q1006-I1009 WeakPolarHBondContact O-CB 3.11Å; Q1006-I1009 PolarHBondContact O-N 3.42Å; L1007-I1009 VanDerWaalsContact C-N 3.35Å; I1009-N1011 VanDerWaalsContact C-N 3.27Å; I1009-N1011 PolarHBondContact O-N 2.9Å; I1009-Q1012 PolarHBondContact O-N 3.34Å
1010Y66.5Low61.5Low69 Ų6983.2 Ų83.227%0.27144%0.441SS..Hα-helixtrans-68.2-21.2179-61.2-27.3000114.4Q1006 L1007 F1019 T1024Q1006-Y1010 WeakPolarHBondContact O-CD2 3.49Å; Q1006-Y1010 PolarHBondContact O-N 3.24Å; L1007-Y1010 HydrophobicContact CD2-CD2 4.35Å; L1007-Y1010 PolarHBondContact O-N 3.13Å; Y1010-F1019 HydrophobicContact CD1-CB 4.25Å; Y1010-F1019 HydrophobicContact CD1-CD2 4.43Å; Y1010-F1019 HydrophobicContact CD1-CG 4.2Å; Y1010-F1019 HydrophobicContact CE1-CB 3.7Å; Y1010-F1019 AromaticContact CE1-CD1 3.66Å; Y1010-F1019 HydrophobicContact CE1-CD1 3.66Å; Y1010-F1019 HydrophobicContact CE1-CD2 4.18Å; Y1010-F1019 HydrophobicContact CE1-CE1 4.31Å; Y1010-F1019 AromaticContact CE1-CG 3.58Å; Y1010-F1019 HydrophobicContact CE1-CG 3.58Å; Y1010-T1024 HydrophobicContact CE2-CG2 4.31Å
1011N63.1Low60.4Low74 Ų7485.8 Ų85.840%0.39646%0.456SS..THydrogen-bonded Turntrans-88.7-0.7176.9-147.613.4000113L1007 E1008 I1009 L1072 E1075L1007-N1011 PolarHBondContact O-N 3.21Å; L1007-N1011 VanDerWaalsContact O-N 3.09Å; E1008-N1011 PolarHBondContact O-N 3.41Å; I1009-N1011 VanDerWaalsContact C-N 3.27Å; I1009-N1011 PolarHBondContact O-N 2.9Å; N1011-L1072 HydrophobicContact CB-CD2 4.23Å; N1011-E1075 PolarHBondContact ND2-OE2 2.94Å
1012Q60.3Low59.6Low124 Ų12489.9 Ų89.958%0.57947%0.468SS*.SBendtrans-81.7127.8175.4-66.6-166.212.700112E1008 I1009 N1014E1008-Q1012 WeakPolarHBondContact O-CG 3.37Å; I1009-Q1012 PolarHBondContact O-N 3.34Å; Q1012-N1014 PolarHBondContact O-N 3.02Å
1013P50Low58.9Low113 Ų11393.3 Ų93.373%0.73448%0.478SS*.SBendtrans-69.5132.7172.128.7-32.6000110.5
1014N42.6Very low58.5Low163 Ų16393.5 Ų93.587%0.87248%0.479SS*.  trans9446.8176.5-46.1-33000117.8Q1012Q1012-N1014 PolarHBondContact O-N 3.02Å
1015Q43Very low58Low116 Ų11693 Ų9354%0.54248%0.479SS..  trans-120.7122155.7-70.3-166.33.500111.6
1016E38.6Very low57.8Low209 Ų20994.8 Ų94.898%0.97749%0.488SS*.  trans-95.698.6176.9-67.1-176.315600110.1
1017G41.9Very low57.9Low35 Ų3592.8 Ų92.836%0.36149%0.486SS..SBendtrans-165.6144.2174.700000111.1F1019G1017-F1019 WeakPolarHBondContact O-CD2 3.36Å; G1017-F1019 PolarHBondContact O-N 2.85Å; G1017-F1019 VanDerWaalsContact O-N 3.09Å
1018P44.8Very low58.2Low141 Ų14192.8 Ų92.892%0.91649%0.487SS*.  trans-79.193.8-179.531.4-32.9000110.4
1019F50.9Low58.2Low104 Ų10493 Ų9346%0.45649%0.487SS..  trans-98.5127.3176.5-61.9-75.3000111.2Y1010 G1017 V1021Y1010-F1019 HydrophobicContact CD1-CB 4.25Å; Y1010-F1019 HydrophobicContact CD1-CD2 4.43Å; Y1010-F1019 HydrophobicContact CD1-CG 4.2Å; Y1010-F1019 HydrophobicContact CE1-CB 3.7Å; Y1010-F1019 AromaticContact CE1-CD1 3.66Å; Y1010-F1019 HydrophobicContact CE1-CD1 3.66Å; Y1010-F1019 HydrophobicContact CE1-CD2 4.18Å; Y1010-F1019 HydrophobicContact CE1-CE1 4.31Å; Y1010-F1019 AromaticContact CE1-CG 3.58Å; Y1010-F1019 HydrophobicContact CE1-CG 3.58Å; G1017-F1019 WeakPolarHBondContact O-CD2 3.36Å; G1017-F1019 PolarHBondContact O-N 2.85Å; G1017-F1019 VanDerWaalsContact O-N 3.09Å; F1019-V1021 PolarHBondContact O-N 3.47Å; F1019-V1021 VanDerWaalsContact O-N 3.11Å
1020D51.7Low58.8Low96 Ų9692.6 Ų92.651%0.51350%0.496SS..  trans-82.189.2177.5-165.1-7.7000111.1K1022 E1023 T1024D1020-K1022 PolarHBondContact O-N 3.24Å; D1020-K1022 VanDerWaalsContact O-N 3.17Å; D1020-K1022 WeakPolarHBondContact OD1-CA 3.38Å; D1020-K1022 WeakPolarHBondContact OD1-CB 3.47Å; D1020-K1022 PolarHBondContact OD1-N 3.45Å; D1020-E1023 HydrophobicContact CB-CB 4.23Å; D1020-E1023 PolarHBondContact O-N 3.09Å; D1020-E1023 PolarHBondContact OD1-N 2.91Å; D1020-T1024 PolarHBondContact O-OG1 3.29Å
1021V57.8Low59.4Low54 Ų5493 Ų9333%0.32750%0.499SS..Hα-helixtrans-56.7-26.1172.21790000111.3F1019 T1024 E1025 L1076F1019-V1021 PolarHBondContact O-N 3.47Å; F1019-V1021 VanDerWaalsContact O-N 3.11Å; V1021-T1024 PolarHBondContact O-OG1 3.5Å; V1021-E1025 WeakPolarHBondContact O-CB 3.29Å; V1021-E1025 PolarHBondContact O-N 2.85Å; V1021-L1076 HydrophobicContact CG1-CD1 4.28Å
1022K58.1Low60.3Low137 Ų13791.9 Ų91.960%0.59649%0.491SS*.Hα-helixtrans-74.5-33.6-177.4-140.9170.3-169.9172.90112.3D1020 I1026D1020-K1022 PolarHBondContact O-N 3.24Å; D1020-K1022 VanDerWaalsContact O-N 3.17Å; D1020-K1022 WeakPolarHBondContact OD1-CA 3.38Å; D1020-K1022 WeakPolarHBondContact OD1-CB 3.47Å; D1020-K1022 PolarHBondContact OD1-N 3.45Å; K1022-I1026 WeakPolarHBondContact O-CB 3.45Å; K1022-I1026 WeakPolarHBondContact O-CD1 3.46Å; K1022-I1026 WeakPolarHBondContact O-CG1 3.39Å; K1022-I1026 PolarHBondContact O-N 2.65Å
1023E61.7Low61.2Low141 Ų14189.4 Ų89.466%0.65949%0.486SS*.Hα-helixtrans-71-39.5176.4-164.2174-134.900111.4D1020 I1026 A1027D1020-E1023 HydrophobicContact CB-CB 4.23Å; D1020-E1023 PolarHBondContact O-N 3.09Å; D1020-E1023 PolarHBondContact OD1-N 2.91Å; E1023-I1026 PolarHBondContact O-N 3.42Å; E1023-A1027 WeakPolarHBondContact O-CB 3.48Å; E1023-A1027 PolarHBondContact O-N 3.25Å
1024T66.2Low62.6Low19 Ų1986.6 Ų86.612%0.11747%0.465CS..Hα-helixtrans-70.1-37.1172.327.90000112.4Y1010 D1020 V1021 A1027 V1028Y1010-T1024 HydrophobicContact CE2-CG2 4.31Å; D1020-T1024 PolarHBondContact O-OG1 3.29Å; V1021-T1024 PolarHBondContact O-OG1 3.5Å; T1024-A1027 PolarHBondContact O-N 3.31Å; T1024-V1028 WeakPolarHBondContact O-CG2 3.3Å; T1024-V1028 PolarHBondContact O-N 3.16Å
1025E65.4Low64.5Low40 Ų4078.8 Ų78.819%0.18742%0.423CS..Hα-helixtrans-61.2-43.8171.4180178.9-139.400111.9V1021 V1028 Q1029 R1077V1021-E1025 WeakPolarHBondContact O-CB 3.29Å; V1021-E1025 PolarHBondContact O-N 2.85Å; E1025-V1028 PolarHBondContact O-N 3.33Å; E1025-Q1029 WeakPolarHBondContact O-CB 3.34Å; E1025-Q1029 WeakPolarHBondContact O-CG 3.48Å; E1025-Q1029 PolarHBondContact O-N 2.83Å; E1025-R1077 VanDerWaalsContact CD-NH2 3.32Å; E1025-R1077 IonicContact OE1-CZ 3.82Å; E1025-R1077 IonicContact OE1-NE 2.7Å; E1025-R1077 PolarHBondContact OE1-NE 3.28Å; E1025-R1077 IonicContact OE1-NH2 2.67Å; E1025-R1077 PolarHBondContact OE1-NH2 2.94Å
1026I70.1Confident66.2Low105 Ų10577.9 Ų77.954%0.53842%0.419SS..Hα-helixtrans-62.9-44173.9-72.5162.3000110.9K1022 E1023 V1028 Q1029 A1030K1022-I1026 WeakPolarHBondContact O-CB 3.45Å; K1022-I1026 WeakPolarHBondContact O-CD1 3.46Å; K1022-I1026 WeakPolarHBondContact O-CG1 3.39Å; K1022-I1026 PolarHBondContact O-N 2.65Å; E1023-I1026 PolarHBondContact O-N 3.42Å; I1026-V1028 VanDerWaalsContact C-N 3.32Å; I1026-V1028 PolarHBondContact O-N 3.29Å; I1026-Q1029 PolarHBondContact O-N 3.28Å; I1026-A1030 WeakPolarHBondContact O-CB 3.5Å; I1026-A1030 PolarHBondContact O-N 3.07Å
1027A73.9Confident68.2Low46 Ų4672.7 Ų72.738%0.3839%0.394SS..Hα-helixtrans-62.6-37.4177.900000112.6E1023 T1024E1023-A1027 WeakPolarHBondContact O-CB 3.48Å; E1023-A1027 PolarHBondContact O-N 3.25Å; T1024-A1027 PolarHBondContact O-N 3.31Å
1028V77.5Confident70Confident2 Ų271.7 Ų71.71%0.01238%0.381CS..Hα-helixtrans-72.8-43.3174.5175.50000111.8I1003 T1024 E1025 I1026 A1030 K1031 Q1032 W1066 V1069 L1073I1003-V1028 HydrophobicContact CD1-CG2 4.23Å; I1003-V1028 HydrophobicContact CG2-CG2 3.56Å; T1024-V1028 WeakPolarHBondContact O-CG2 3.3Å; T1024-V1028 PolarHBondContact O-N 3.16Å; E1025-V1028 PolarHBondContact O-N 3.33Å; I1026-V1028 VanDerWaalsContact C-N 3.32Å; I1026-V1028 PolarHBondContact O-N 3.29Å; V1028-A1030 VanDerWaalsContact C-N 3.29Å; V1028-A1030 PolarHBondContact O-N 3.41Å; V1028-K1031 CarbonylContact O-C 3.6Å; V1028-K1031 PolarHBondContact O-N 3.35Å; V1028-K1031 VanDerWaalsContact O-N 3.1Å; V1028-Q1032 PolarHBondContact O-N 3.22Å; V1028-W1066 HydrophobicContact CG1-CH2 3.61Å; V1028-W1066 HydrophobicContact CG1-CZ3 3.81Å; V1028-V1069 HydrophobicContact CG1-CG1 4.06Å; V1028-V1069 HydrophobicContact CG2-CG1 4.24Å; V1028-L1073 HydrophobicContact CB-CD1 3.9Å; V1028-L1073 HydrophobicContact CG1-CD1 3.58Å; V1028-L1073 HydrophobicContact CG2-CD1 4.13Å
1029Q72.4Confident71.7Confident89 Ų8966 Ų6642%0.41634%0.342SS..Hα-helixtrans-61.9-35176.2-76.9-172.3-48.800112.7E1025 I1026 K1031 Q1032 P1033E1025-Q1029 WeakPolarHBondContact O-CB 3.34Å; E1025-Q1029 WeakPolarHBondContact O-CG 3.48Å; E1025-Q1029 PolarHBondContact O-N 2.83Å; I1026-Q1029 PolarHBondContact O-N 3.28Å; Q1029-K1031 PolarHBondContact O-N 3.22Å; Q1029-Q1032 PolarHBondContact O-N 3.17Å; Q1029-P1033 WeakPolarHBondContact O-CD 3.42Å
1030A77.8Confident72.9Confident68 Ų6864.5 Ų64.556%0.56235%0.345SS*.THydrogen-bonded Turntrans-64.7-22.7176.100000113.5I1026 V1028I1026-A1030 WeakPolarHBondContact O-CB 3.5Å; I1026-A1030 PolarHBondContact O-N 3.07Å; V1028-A1030 VanDerWaalsContact C-N 3.29Å; V1028-A1030 PolarHBondContact O-N 3.41Å
1031K80.1Confident74Confident77 Ų7764.2 Ų64.234%0.33534%0.339SS..THydrogen-bonded Turntrans-109.1-7.2178.6-76.3-56.8-162.7-175.70114.6W999 V1028 Q1029 D1034 V1035W999-K1031 HydrophobicContact CD2-CG 4.29Å; W999-K1031 HydrophobicContact CE3-CB 4.29Å; W999-K1031 HydrophobicContact CE3-CG 4.44Å; W999-K1031 HydrophobicContact CH2-CB 3.25Å; W999-K1031 HydrophobicContact CH2-CG 3.76Å; W999-K1031 HydrophobicContact CZ2-CB 3.54Å; W999-K1031 HydrophobicContact CZ2-CG 3.47Å; W999-K1031 VanDerWaalsContact CZ2-CG 3.47Å; W999-K1031 HydrophobicContact CZ3-CB 3.64Å; W999-K1031 HydrophobicContact CZ3-CG 4.2Å; V1028-K1031 CarbonylContact O-C 3.6Å; V1028-K1031 PolarHBondContact O-N 3.35Å; V1028-K1031 VanDerWaalsContact O-N 3.1Å; Q1029-K1031 PolarHBondContact O-N 3.22Å; K1031-D1034 HydrophobicContact CD-CB 4.36Å; K1031-D1034 WeakPolarHBondContact CD-OD2 3.25Å; K1031-D1034 WeakPolarHBondContact CE-OD2 3.31Å; K1031-D1034 IonicContact NZ-OD2 2.72Å; K1031-D1034 PolarHBondContact NZ-OD2 3.03Å; K1031-D1034 PolarHBondContact O-N 2.8Å; K1031-V1035 WeakPolarHBondContact O-CG2 3.49Å; K1031-V1035 PolarHBondContact O-N 3.45Å; K1031-V1035 VanDerWaalsContact O-N 3.1Å
1032Q80.7Confident74.7Confident50 Ų5061.7 Ų61.723%0.23432%0.324CS..Hα-helixtrans-50.7-47170.6178.8150.717.600114.1V1028 Q1029 D1034 V1035 E1036 W1066V1028-Q1032 PolarHBondContact O-N 3.22Å; Q1029-Q1032 PolarHBondContact O-N 3.17Å; Q1032-D1034 PolarHBondContact O-N 3.05Å; Q1032-V1035 PolarHBondContact O-N 3.15Å; Q1032-E1036 HydrophobicContact CG-CG 4.34Å; Q1032-E1036 WeakPolarHBondContact CG-OE1 3.3Å; Q1032-E1036 PolarHBondContact NE2-OE1 2.89Å; Q1032-E1036 WeakPolarHBondContact O-CB 3.38Å; Q1032-E1036 WeakPolarHBondContact O-CG 3.2Å; Q1032-E1036 PolarHBondContact O-N 3.09Å; Q1032-W1066 HydrophobicContact CB-CH2 3.97Å; Q1032-W1066 HydrophobicContact CB-CZ2 3.78Å; Q1032-W1066 HydrophobicContact CG-CH2 4.49Å; Q1032-W1066 HydrophobicContact CG-CZ2 3.82Å
1033P79.2Confident75.3Confident72 Ų7261.4 Ų61.447%0.46833%0.325SS..Hα-helixtrans-61.5-43.617723.2-33.6000112.5Q1029 V1035 E1036 E1037Q1029-P1033 WeakPolarHBondContact O-CD 3.42Å; P1033-V1035 PolarHBondContact O-N 3.49Å; P1033-E1036 PolarHBondContact O-N 3.32Å; P1033-E1037 WeakPolarHBondContact O-CB 3.41Å; P1033-E1037 PolarHBondContact O-N 3.13Å
1034D79.8Confident75.6Confident54 Ų5460.2 Ų60.229%0.28932%0.319SS..Hα-helixtrans-58.5-45.7178.6-59.911.9000111.7L996 K1031 Q1032 I1038L996-D1034 HydrophobicContact CD2-CB 4.41Å; K1031-D1034 HydrophobicContact CD-CB 4.36Å; K1031-D1034 WeakPolarHBondContact CD-OD2 3.25Å; K1031-D1034 WeakPolarHBondContact CE-OD2 3.31Å; K1031-D1034 IonicContact NZ-OD2 2.72Å; K1031-D1034 PolarHBondContact NZ-OD2 3.03Å; K1031-D1034 PolarHBondContact O-N 2.8Å; Q1032-D1034 PolarHBondContact O-N 3.05Å; D1034-I1038 WeakPolarHBondContact O-CB 3.39Å; D1034-I1038 WeakPolarHBondContact O-CD1 3.38Å; D1034-I1038 WeakPolarHBondContact O-CG1 3.48Å; D1034-I1038 PolarHBondContact O-N 3.08Å
1035V82.1Confident75.6Confident0 Ų060.4 Ų60.40%032%0.319CS..Hα-helixtrans-70.2-41.4-178.9-177.30000111.4L996 W999 K1031 Q1032 P1033 I1038 L1039 L1062 W1066L996-V1035 HydrophobicContact CD1-CB 4.3Å; L996-V1035 HydrophobicContact CD1-CG2 3.91Å; L996-V1035 HydrophobicContact CD2-CG2 3.96Å; L996-V1035 HydrophobicContact CG-CG2 4.47Å; W999-V1035 HydrophobicContact CZ3-CG2 4.39Å; K1031-V1035 WeakPolarHBondContact O-CG2 3.49Å; K1031-V1035 PolarHBondContact O-N 3.45Å; K1031-V1035 VanDerWaalsContact O-N 3.1Å; Q1032-V1035 PolarHBondContact O-N 3.15Å; P1033-V1035 PolarHBondContact O-N 3.49Å; V1035-I1038 PolarHBondContact O-N 2.92Å; V1035-L1039 HydrophobicContact CG1-CD1 3.92Å; V1035-L1039 HydrophobicContact CG1-CG 4.33Å; V1035-L1039 WeakPolarHBondContact O-CB 3.48Å; V1035-L1039 VanDerWaalsContact O-CG 3.26Å; V1035-L1039 WeakPolarHBondContact O-CG 3.39Å; V1035-L1039 PolarHBondContact O-N 3.45Å; V1035-L1062 HydrophobicContact CG1-CD1 4.42Å; V1035-L1062 HydrophobicContact CG1-CD2 4.42Å; V1035-L1062 HydrophobicContact CG1-CG 4.4Å; V1035-W1066 HydrophobicContact CB-CD2 4.02Å; V1035-W1066 HydrophobicContact CB-CE3 4.27Å; V1035-W1066 HydrophobicContact CB-CG 4.5Å; V1035-W1066 HydrophobicContact CB-CZ2 4.28Å; V1035-W1066 HydrophobicContact CB-CZ3 4.5Å; V1035-W1066 HydrophobicContact CG1-CB 4.02Å; V1035-W1066 HydrophobicContact CG1-CD2 3.5Å; V1035-W1066 HydrophobicContact CG1-CE3 3.99Å; V1035-W1066 HydrophobicContact CG1-CG 3.51Å; V1035-W1066 HydrophobicContact CG2-CD2 4.27Å; V1035-W1066 HydrophobicContact CG2-CE3 4Å; V1035-W1066 HydrophobicContact CG2-CH2 4.34Å; V1035-W1066 HydrophobicContact CG2-CZ3 4.03Å
1036E80.5Confident75.6Confident96 Ų9661.5 Ų61.545%0.44932%0.322SS..Hα-helixtrans-69.1-37.9177.8-72.2177.8179.600112.2Q1032 P1033 S1040Q1032-E1036 HydrophobicContact CG-CG 4.34Å; Q1032-E1036 WeakPolarHBondContact CG-OE1 3.3Å; Q1032-E1036 PolarHBondContact NE2-OE1 2.89Å; Q1032-E1036 WeakPolarHBondContact O-CB 3.38Å; Q1032-E1036 WeakPolarHBondContact O-CG 3.2Å; Q1032-E1036 PolarHBondContact O-N 3.09Å; P1033-E1036 PolarHBondContact O-N 3.32Å; E1036-S1040 WeakPolarHBondContact O-CB 3.29Å; E1036-S1040 PolarHBondContact O-N 3.07Å
1037E79.3Confident75.3Confident100 Ų10065 Ų6547%0.46733%0.333SS..Hα-helixtrans-62.4-45.8173.6-172.3-177.1163.900111.1P1033 S1040 K1041P1033-E1037 WeakPolarHBondContact O-CB 3.41Å; P1033-E1037 PolarHBondContact O-N 3.13Å; E1037-S1040 PolarHBondContact O-N 2.95Å; E1037-K1041 HydrophobicContact CG-CD 4.09Å; E1037-K1041 HydrophobicContact CG-CG 4.5Å; E1037-K1041 VanDerWaalsContact O-CB 3.3Å; E1037-K1041 WeakPolarHBondContact O-CB 3.43Å; E1037-K1041 WeakPolarHBondContact O-CG 3.33Å; E1037-K1041 PolarHBondContact O-N 3.45Å; E1037-K1041 WeakPolarHBondContact OE1-CE 3.46Å; E1037-K1041 IonicContact OE1-NZ 3.2Å; E1037-K1041 PolarHBondContact OE1-NZ 2.88Å
1038I81.2Confident74.6Confident15 Ų1567.9 Ų67.98%0.07734%0.339CS..Hα-helixtrans-70.7-38.3179.9-75.6160.1000112L989 Q992 L993 L996 D1034 V1035 G1042 L1062L989-I1038 HydrophobicContact CD1-CG2 4.2Å; Q992-I1038 HydrophobicContact CB-CD1 3.78Å; Q992-I1038 HydrophobicContact CB-CG1 4.35Å; Q992-I1038 HydrophobicContact CG-CD1 4.43Å; L993-I1038 HydrophobicContact CD2-CG2 4.43Å; L993-I1038 HydrophobicContact CG-CG2 4.17Å; L996-I1038 HydrophobicContact CD1-CB 4.04Å; L996-I1038 HydrophobicContact CD1-CD1 3.45Å; L996-I1038 VanDerWaalsContact CD1-CD1 3.45Å; L996-I1038 HydrophobicContact CD1-CG1 4.32Å; L996-I1038 HydrophobicContact CD1-CG2 4.15Å; L996-I1038 HydrophobicContact CG-CD1 4.17Å; D1034-I1038 WeakPolarHBondContact O-CB 3.39Å; D1034-I1038 WeakPolarHBondContact O-CD1 3.38Å; D1034-I1038 WeakPolarHBondContact O-CG1 3.48Å; D1034-I1038 PolarHBondContact O-N 3.08Å; V1035-I1038 PolarHBondContact O-N 2.92Å; I1038-G1042 PolarHBondContact O-N 3.08Å; I1038-L1062 HydrophobicContact CG2-CD2 4.06Å
1039L79Confident73.5Confident20 Ų2070.4 Ų70.411%0.10535%0.35CS..Hα-helixtrans-65-39.2172.1-73.9173000111.9V1035 Q1043 L1059 L1062V1035-L1039 HydrophobicContact CG1-CD1 3.92Å; V1035-L1039 HydrophobicContact CG1-CG 4.33Å; V1035-L1039 WeakPolarHBondContact O-CB 3.48Å; V1035-L1039 VanDerWaalsContact O-CG 3.26Å; V1035-L1039 WeakPolarHBondContact O-CG 3.39Å; V1035-L1039 PolarHBondContact O-N 3.45Å; L1039-Q1043 WeakPolarHBondContact O-CB 3.49Å; L1039-Q1043 WeakPolarHBondContact O-CG 3.41Å; L1039-Q1043 PolarHBondContact O-N 3.42Å; L1039-L1059 HydrophobicContact CD2-CD2 4.14Å; L1039-L1062 HydrophobicContact CD2-CD2 4.17Å; L1039-L1062 HydrophobicContact CD2-CG 4.3Å; L1039-L1062 HydrophobicContact CG-CD2 4.32Å
1040S76.2Confident72.5Confident74 Ų7470.1 Ų70.152%0.51736%0.356SS..Hα-helixtrans-67.6-50.7176.8-175.20000111.7E1036 E1037 G1042 Q1043 H1044E1036-S1040 WeakPolarHBondContact O-CB 3.29Å; E1036-S1040 PolarHBondContact O-N 3.07Å; E1037-S1040 PolarHBondContact O-N 2.95Å; S1040-G1042 VanDerWaalsContact C-N 3.32Å; S1040-G1042 PolarHBondContact O-N 3.15Å; S1040-Q1043 PolarHBondContact O-N 3.27Å; S1040-H1044 PolarHBondContact O-N 3.14Å
1041K74.7Confident71.1Confident89 Ų8970.9 Ų70.939%0.38736%0.362SS..Hα-helixtrans-54.5-47.2172.7-79.5173.6170.1170.10111.3L989 E1037 H1044 L1045L989-K1041 HydrophobicContact CD1-CB 4.17Å; E1037-K1041 HydrophobicContact CG-CD 4.09Å; E1037-K1041 HydrophobicContact CG-CG 4.5Å; E1037-K1041 VanDerWaalsContact O-CB 3.3Å; E1037-K1041 WeakPolarHBondContact O-CB 3.43Å; E1037-K1041 WeakPolarHBondContact O-CG 3.33Å; E1037-K1041 PolarHBondContact O-N 3.45Å; E1037-K1041 WeakPolarHBondContact OE1-CE 3.46Å; E1037-K1041 IonicContact OE1-NZ 3.2Å; E1037-K1041 PolarHBondContact OE1-NZ 2.88Å; K1041-H1044 PolarHBondContact O-N 2.85Å; K1041-L1045 WeakPolarHBondContact O-CB 3.44Å; K1041-L1045 WeakPolarHBondContact O-CG 3.39Å; K1041-L1045 PolarHBondContact O-N 3.36Å
1042G72.8Confident69.9Low1 Ų170.2 Ų70.21%0.0137%0.365CS..Hα-helixtrans-63.8-40.3178.600000113.5I1038 S1040 Y1046I1038-G1042 PolarHBondContact O-N 3.08Å; S1040-G1042 VanDerWaalsContact C-N 3.32Å; S1040-G1042 PolarHBondContact O-N 3.15Å; G1042-Y1046 WeakPolarHBondContact O-CB 3.2Å; G1042-Y1046 PolarHBondContact O-N 3.19Å
1043Q70.7Confident68.8Low131 Ų13174.2 Ų74.261%0.61238%0.383SS*.Hα-helixtrans-67.1-34.9173.4-76.3-178.215.200112.9L1039 S1040 K1047L1039-Q1043 WeakPolarHBondContact O-CB 3.49Å; L1039-Q1043 WeakPolarHBondContact O-CG 3.41Å; L1039-Q1043 PolarHBondContact O-N 3.42Å; S1040-Q1043 PolarHBondContact O-N 3.27Å; Q1043-K1047 WeakPolarHBondContact O-CG 2.86Å; Q1043-K1047 PolarHBondContact O-N 3.39Å
1044H68.9Low68.1Low116 Ų11674.6 Ų74.654%0.53739%0.386SS..Hα-helixtrans-69.7-50.1176.6-141.3-74000111.4S1040 K1041 Y1046 K1047 E1048S1040-H1044 PolarHBondContact O-N 3.14Å; K1041-H1044 PolarHBondContact O-N 2.85Å; H1044-Y1046 VanDerWaalsContact C-N 3.32Å; H1044-Y1046 PolarHBondContact O-N 3.03Å; H1044-K1047 WeakPolarHBondContact O-CB 3.46Å; H1044-K1047 PolarHBondContact O-N 2.85Å; H1044-E1048 IonicContact CE1-OE1 3.02Å; H1044-E1048 IonicContact ND1-OE1 2.68Å; H1044-E1048 PolarHBondContact ND1-OE1 3.06Å; H1044-E1048 VanDerWaalsContact ND1-OE1 3.14Å; H1044-E1048 PolarHBondContact O-N 3.46Å
1045L65.3Low67.6Low23 Ų2372.4 Ų72.412%0.1237%0.374CS..Hα-helixtrans-63.5-35.6177.9-69.4165.8000112.2L982 K985 L986 L989 K1041 E1048 K1049L982-L1045 HydrophobicContact CD1-CD2 4Å; K985-L1045 HydrophobicContact CB-CD2 4.24Å; K985-L1045 HydrophobicContact CD-CD2 4.38Å; L986-L1045 HydrophobicContact CD2-CB 4.37Å; L989-L1045 HydrophobicContact CD2-CD1 4.04Å; K1041-L1045 WeakPolarHBondContact O-CB 3.44Å; K1041-L1045 WeakPolarHBondContact O-CG 3.39Å; K1041-L1045 PolarHBondContact O-N 3.36Å; L1045-E1048 PolarHBondContact O-N 3.15Å; L1045-E1048 VanDerWaalsContact O-N 3.13Å; L1045-K1049 PolarHBondContact O-N 3.42Å; L1045-K1049 VanDerWaalsContact O-N 3.14Å
1046Y66.5Low67Low64 Ų6475.9 Ų75.925%0.25139%0.389SS..Hα-helixtrans-73.9-25.8176.6-165.9-100.2000113.5G1042 H1044 P1050 K1056G1042-Y1046 WeakPolarHBondContact O-CB 3.2Å; G1042-Y1046 PolarHBondContact O-N 3.19Å; H1044-Y1046 VanDerWaalsContact C-N 3.32Å; H1044-Y1046 PolarHBondContact O-N 3.03Å; Y1046-P1050 HydrophobicContact CE1-CB 4.24Å; Y1046-P1050 HydrophobicContact CE2-CB 4.41Å; Y1046-P1050 VanDerWaalsContact CE2-O 3.31Å; Y1046-P1050 WeakPolarHBondContact CE2-O 3.49Å; Y1046-P1050 VanDerWaalsContact CZ-O 3.28Å; Y1046-P1050 PolarHBondContact OH-O 3.31Å; Y1046-K1056 HydrophobicContact CE1-CD 4.21Å; Y1046-K1056 HydrophobicContact CE1-CG 4.17Å; Y1046-K1056 HydrophobicContact CE2-CB 3.95Å; Y1046-K1056 HydrophobicContact CE2-CD 4.39Å; Y1046-K1056 HydrophobicContact CE2-CG 3.98Å; Y1046-K1056 WeakPolarHBondContact OH-CD 3.37Å
1047K62.6Low66.6Low178 Ų17878.6 Ų78.677%0.77440%0.396SS*.Hα-helixtrans-66.2-28.2166.6-83.4179.1176.1177.60112.2Q1043 H1044Q1043-K1047 WeakPolarHBondContact O-CG 2.86Å; Q1043-K1047 PolarHBondContact O-N 3.39Å; H1044-K1047 WeakPolarHBondContact O-CB 3.46Å; H1044-K1047 PolarHBondContact O-N 2.85Å
1048E58.9Low66.5Low107 Ų10776.1 Ų76.150%0.538%0.383SS..Hα-helixtrans-83-31.7-179.7-70.9165.8-161.300112.9L982 H1044 L1045L982-E1048 HydrophobicContact CD1-CB 4.49Å; H1044-E1048 IonicContact CE1-OE1 3.02Å; H1044-E1048 IonicContact ND1-OE1 2.68Å; H1044-E1048 PolarHBondContact ND1-OE1 3.06Å; H1044-E1048 VanDerWaalsContact ND1-OE1 3.14Å; H1044-E1048 PolarHBondContact O-N 3.46Å; L1045-E1048 PolarHBondContact O-N 3.15Å; L1045-E1048 VanDerWaalsContact O-N 3.13Å
1049K54.3Low66.3Low54 Ų5476.4 Ų76.424%0.23539%0.385CS..  trans-150.996.9175.7-157.4171.8-179.1-178.50113.2L982 E983 L1045 A1051L982-K1049 HydrophobicContact CD2-CB 4.1Å; L982-K1049 HydrophobicContact CD2-CD 3.96Å; E983-K1049 IonicContact OE1-NZ 2.83Å; E983-K1049 PolarHBondContact OE1-NZ 2.93Å; L1045-K1049 PolarHBondContact O-N 3.42Å; L1045-K1049 VanDerWaalsContact O-N 3.14Å; K1049-A1051 VanDerWaalsContact C-N 3.27Å; K1049-A1051 PolarHBondContact O-N 2.91Å
1050P51.3Low66.3Low84 Ų8479.6 Ų79.655%0.54540%0.399SS..THydrogen-bonded Turntrans-71.96.6-171.3-22.634.4000118.5Y1046Y1046-P1050 HydrophobicContact CE1-CB 4.24Å; Y1046-P1050 HydrophobicContact CE2-CB 4.41Å; Y1046-P1050 VanDerWaalsContact CE2-O 3.31Å; Y1046-P1050 WeakPolarHBondContact CE2-O 3.49Å; Y1046-P1050 VanDerWaalsContact CZ-O 3.28Å; Y1046-P1050 PolarHBondContact OH-O 3.31Å
1051A48.5Very low66.5Low84 Ų8480 Ų8069%0.69440%0.395SS*.THydrogen-bonded Turntrans-86.5-18.4-152.600000117.4K1049K1049-A1051 VanDerWaalsContact C-N 3.27Å; K1049-A1051 PolarHBondContact O-N 2.91Å
1052T56.2Low66.8Low63 Ų6375.8 Ų75.839%0.38738%0.377SS..  trans-99.196.1-175.638.40000113P1054 V1055 K1056T1052-P1054 VanDerWaalsContact C-N 3.32Å; T1052-V1055 PolarHBondContact O-N 2.71Å; T1052-K1056 PolarHBondContact O-N 2.76Å
1053Q56Low67.1Low133 Ų13376.5 Ų76.562%0.62138%0.382SS*.Hα-helixtrans-51.5-35.7174.6-74.3-167.93.300115.6K1056 R1057Q1053-K1056 PolarHBondContact O-N 3.37Å; Q1053-R1057 PolarHBondContact O-N 3.41Å
1054P66.1Low67.5Low80 Ų8073.7 Ų73.752%0.51938%0.377SS..Hα-helixtrans-64.4-46.5-179-23.634.8000113.5T1052 K1056 R1057 K1058T1052-P1054 VanDerWaalsContact C-N 3.32Å; P1054-K1056 VanDerWaalsContact C-N 3.33Å; P1054-K1056 PolarHBondContact O-N 3.36Å; P1054-R1057 PolarHBondContact O-N 3.01Å; P1054-K1058 PolarHBondContact O-N 3.4Å
1055V67.9Low68Low8 Ų870.7 Ų70.75%0.04836%0.363CS..Hα-helixtrans-67.1-37.5179.5-175.20000110.5L989 E990 L993 T1052 K1058 L1059L989-V1055 HydrophobicContact CD2-CG1 4.45Å; E990-V1055 WeakPolarHBondContact OE2-CG2 3.46Å; L993-V1055 HydrophobicContact CD1-CG1 4.06Å; T1052-V1055 PolarHBondContact O-N 2.71Å; V1055-K1058 PolarHBondContact O-N 2.91Å; V1055-L1059 HydrophobicContact CG1-CD1 4.25Å; V1055-L1059 WeakPolarHBondContact O-CB 3.5Å; V1055-L1059 PolarHBondContact O-N 3.24Å
1056K69.3Low68.9Low74 Ų7470.3 Ų70.332%0.32236%0.36SS..Hα-helixtrans-59.9-46.4173.1-160.6-156.8-167.5-131.40111.8Y1046 T1052 Q1053 P1054 L1059 E1060Y1046-K1056 HydrophobicContact CE1-CD 4.21Å; Y1046-K1056 HydrophobicContact CE1-CG 4.17Å; Y1046-K1056 HydrophobicContact CE2-CB 3.95Å; Y1046-K1056 HydrophobicContact CE2-CD 4.39Å; Y1046-K1056 HydrophobicContact CE2-CG 3.98Å; Y1046-K1056 WeakPolarHBondContact OH-CD 3.37Å; T1052-K1056 PolarHBondContact O-N 2.76Å; Q1053-K1056 PolarHBondContact O-N 3.37Å; P1054-K1056 VanDerWaalsContact C-N 3.33Å; P1054-K1056 PolarHBondContact O-N 3.36Å; K1056-L1059 PolarHBondContact O-N 3.14Å; K1056-E1060 WeakPolarHBondContact CE-OE1 3.46Å; K1056-E1060 IonicContact NZ-OE1 3.69Å; K1056-E1060 PolarHBondContact NZ-OE1 2.97Å; K1056-E1060 WeakPolarHBondContact O-CB 3.39Å; K1056-E1060 WeakPolarHBondContact O-CG 3.34Å; K1056-E1060 PolarHBondContact O-N 3.49Å
1057R74Confident69.5Low153 Ų15372.2 Ų72.258%0.57737%0.37SS*.Hα-helixtrans-58.9-49.2174.2-76.3-176.9-176.1162.74.4111Q1053 P1054 L1059 E1060 D1061Q1053-R1057 PolarHBondContact O-N 3.41Å; P1054-R1057 PolarHBondContact O-N 3.01Å; R1057-L1059 VanDerWaalsContact C-N 3.29Å; R1057-L1059 PolarHBondContact O-N 2.92Å; R1057-E1060 CarbonylContact O-C 3.43Å; R1057-E1060 WeakPolarHBondContact O-CA 3.27Å; R1057-E1060 WeakPolarHBondContact O-CB 3.34Å; R1057-E1060 PolarHBondContact O-N 3.07Å; R1057-D1061 WeakPolarHBondContact O-CB 3.34Å; R1057-D1061 PolarHBondContact O-N 3.4Å; R1057-D1061 VanDerWaalsContact O-OD2 3.13Å
1058K75.7Confident70.1Confident48 Ų4865.2 Ų65.221%0.20935%0.345CS..Hα-helixtrans-59.2-35.7177.3-70.1-178.9177.3-174.60113.5E990 L993 N994 L997 P1054 V1055 L1062E990-K1058 HydrophobicContact CG-CD 4.24Å; E990-K1058 WeakPolarHBondContact OE1-CE 3.43Å; E990-K1058 IonicContact OE1-NZ 2.67Å; E990-K1058 PolarHBondContact OE1-NZ 3.02Å; L993-K1058 HydrophobicContact CD2-CB 4.44Å; N994-K1058 WeakPolarHBondContact OD1-CE 3.36Å; N994-K1058 PolarHBondContact OD1-NZ 3.45Å; L997-K1058 HydrophobicContact CD1-CB 4.42Å; P1054-K1058 PolarHBondContact O-N 3.4Å; V1055-K1058 PolarHBondContact O-N 2.91Å; K1058-L1062 VanDerWaalsContact O-CB 3.26Å; K1058-L1062 WeakPolarHBondContact O-CB 3.32Å; K1058-L1062 PolarHBondContact O-N 3.43Å
1059L78.2Confident71.1Confident20 Ų2060.1 Ų60.111%0.10532%0.321CS..Hα-helixtrans-70-40.2172.7-85162.1000112.5L993 L1039 V1055 K1056 R1057 S1063L993-L1059 HydrophobicContact CD1-CD1 4.5Å; L993-L1059 HydrophobicContact CD1-CD2 4.2Å; L993-L1059 HydrophobicContact CD1-CG 3.86Å; L993-L1059 HydrophobicContact CD2-CD2 3.91Å; L993-L1059 HydrophobicContact CD2-CG 4.01Å; L1039-L1059 HydrophobicContact CD2-CD2 4.14Å; V1055-L1059 HydrophobicContact CG1-CD1 4.25Å; V1055-L1059 WeakPolarHBondContact O-CB 3.5Å; V1055-L1059 PolarHBondContact O-N 3.24Å; K1056-L1059 PolarHBondContact O-N 3.14Å; R1057-L1059 VanDerWaalsContact C-N 3.29Å; R1057-L1059 PolarHBondContact O-N 2.92Å; L1059-S1063 WeakPolarHBondContact O-CB 3.44Å; L1059-S1063 PolarHBondContact O-N 2.68Å
1060E78.4Confident72.1Confident87 Ų8759.1 Ų59.141%0.40732%0.318SS..Hα-helixtrans-66.5-39.6174.6-73.4171169.600111.2K1056 R1057 S1064K1056-E1060 WeakPolarHBondContact CE-OE1 3.46Å; K1056-E1060 IonicContact NZ-OE1 3.69Å; K1056-E1060 PolarHBondContact NZ-OE1 2.97Å; K1056-E1060 WeakPolarHBondContact O-CB 3.39Å; K1056-E1060 WeakPolarHBondContact O-CG 3.34Å; K1056-E1060 PolarHBondContact O-N 3.49Å; R1057-E1060 CarbonylContact O-C 3.43Å; R1057-E1060 WeakPolarHBondContact O-CA 3.27Å; R1057-E1060 WeakPolarHBondContact O-CB 3.34Å; R1057-E1060 PolarHBondContact O-N 3.07Å; E1060-S1064 VanDerWaalsContact O-CB 3.22Å; E1060-S1064 WeakPolarHBondContact O-CB 3.29Å; E1060-S1064 PolarHBondContact O-N 2.63Å; E1060-S1064 PolarHBondContact O-OG 2.75Å
1061D79.9Confident73.1Confident83 Ų8362.4 Ų62.444%0.44432%0.32SS..Hα-helixtrans-65.6-52.9174.5-64.3-29.7000110.1L997 R1057 S1063 S1064 E1065L997-D1061 HydrophobicContact CD2-CB 4.32Å; R1057-D1061 WeakPolarHBondContact O-CB 3.34Å; R1057-D1061 PolarHBondContact O-N 3.4Å; R1057-D1061 VanDerWaalsContact O-OD2 3.13Å; D1061-S1063 VanDerWaalsContact C-N 3.29Å; D1061-S1063 PolarHBondContact O-N 3.01Å; D1061-S1064 CarbonylContact O-C 3.27Å; D1061-S1064 PolarHBondContact O-N 2.71Å; D1061-E1065 WeakPolarHBondContact O-CB 3.29Å; D1061-E1065 WeakPolarHBondContact O-CG 3.25Å; D1061-E1065 PolarHBondContact O-N 3.42Å
1062L82.5Confident74.4Confident0 Ų059.4 Ų59.40%029%0.292CS..Hα-helixtrans-58.7-42.7176.4179.667.1000110.7L993 L996 L997 L1000 V1035 I1038 L1039 K1058 S1064 W1066L993-L1062 HydrophobicContact CD2-CB 3.88Å; L993-L1062 HydrophobicContact CD2-CD2 3.53Å; L993-L1062 HydrophobicContact CD2-CG 4.3Å; L996-L1062 HydrophobicContact CB-CD1 3.8Å; L996-L1062 HydrophobicContact CB-CD2 4.4Å; L996-L1062 HydrophobicContact CD1-CD2 3.99Å; L997-L1062 HydrophobicContact CD2-CB 4.09Å; L997-L1062 HydrophobicContact CD2-CD1 4.24Å; L997-L1062 HydrophobicContact CG-CB 4.24Å; L997-L1062 HydrophobicContact CG-CD1 4.21Å; L1000-L1062 HydrophobicContact CD1-CD1 3.44Å; L1000-L1062 VanDerWaalsContact CD1-CD1 3.44Å; V1035-L1062 HydrophobicContact CG1-CD1 4.42Å; V1035-L1062 HydrophobicContact CG1-CD2 4.42Å; V1035-L1062 HydrophobicContact CG1-CG 4.4Å; I1038-L1062 HydrophobicContact CG2-CD2 4.06Å; L1039-L1062 HydrophobicContact CD2-CD2 4.17Å; L1039-L1062 HydrophobicContact CD2-CG 4.3Å; L1039-L1062 HydrophobicContact CG-CD2 4.32Å; K1058-L1062 VanDerWaalsContact O-CB 3.26Å; K1058-L1062 WeakPolarHBondContact O-CB 3.32Å; K1058-L1062 PolarHBondContact O-N 3.43Å; L1062-S1064 VanDerWaalsContact C-N 3.31Å; L1062-S1064 PolarHBondContact O-N 3.47Å; L1062-W1066 WeakPolarHBondContact O-CB 3.23Å; L1062-W1066 PolarHBondContact O-N 3.12Å
1063S79.1Confident75.1Confident17 Ų1756.9 Ų56.912%0.11928%0.276CS..Hα-helixtrans-64.9-35.5176-1650000112L1059 D1061 K1067L1059-S1063 WeakPolarHBondContact O-CB 3.44Å; L1059-S1063 PolarHBondContact O-N 2.68Å; D1061-S1063 VanDerWaalsContact C-N 3.29Å; D1061-S1063 PolarHBondContact O-N 3.01Å; S1063-K1067 WeakPolarHBondContact O-CB 3.46Å; S1063-K1067 VanDerWaalsContact O-CD 3.23Å; S1063-K1067 WeakPolarHBondContact O-CD 3.48Å; S1063-K1067 WeakPolarHBondContact O-CG 3.38Å; S1063-K1067 PolarHBondContact O-N 3.36Å; S1063-K1067 WeakPolarHBondContact OG-CE 3.48Å; S1063-K1067 PolarHBondContact OG-NZ 3.49Å
1064S77.9Confident75.1Confident71 Ų7156.1 Ų56.150%0.49727%0.272SS..Hα-helixtrans-75.2-44.9-179.8-62.30000112E1060 D1061 L1062 K1067 A1068E1060-S1064 VanDerWaalsContact O-CB 3.22Å; E1060-S1064 WeakPolarHBondContact O-CB 3.29Å; E1060-S1064 PolarHBondContact O-N 2.63Å; E1060-S1064 PolarHBondContact O-OG 2.75Å; D1061-S1064 CarbonylContact O-C 3.27Å; D1061-S1064 PolarHBondContact O-N 2.71Å; L1062-S1064 VanDerWaalsContact C-N 3.31Å; L1062-S1064 PolarHBondContact O-N 3.47Å; S1064-K1067 CarbonylContact O-C 3.53Å; S1064-K1067 PolarHBondContact O-N 2.9Å; S1064-A1068 WeakPolarHBondContact O-CB 3.37Å; S1064-A1068 PolarHBondContact O-N 3.25Å
1065E79.7Confident74.9Confident54 Ų5458 Ų5825%0.25227%0.274SS..Hα-helixtrans-62.5-46172.9-69.7-70.3175.800111L997 R1004 D1061 K1067 A1068 V1069L997-E1065 HydrophobicContact CD2-CG 4.27Å; R1004-E1065 WeakPolarHBondContact CD-OE2 3.36Å; R1004-E1065 IonicContact CZ-OE2 2.97Å; R1004-E1065 IonicContact NE-OE2 2.66Å; R1004-E1065 IonicContact NH1-OE1 2.72Å; R1004-E1065 PolarHBondContact NH1-OE1 3.47Å; R1004-E1065 IonicContact NH1-OE2 3.33Å; R1004-E1065 PolarHBondContact NH1-OE2 3.01Å; D1061-E1065 WeakPolarHBondContact O-CB 3.29Å; D1061-E1065 WeakPolarHBondContact O-CG 3.25Å; D1061-E1065 PolarHBondContact O-N 3.42Å; E1065-K1067 VanDerWaalsContact C-N 3.34Å; E1065-K1067 PolarHBondContact O-N 2.91Å; E1065-A1068 WeakPolarHBondContact O-CB 3.47Å; E1065-A1068 PolarHBondContact O-N 2.99Å; E1065-V1069 PolarHBondContact O-N 3.47Å
1066W85.2Confident74.4Confident14 Ų1461.2 Ų61.25%0.05329%0.291CS..Hα-helixtrans-62.8-39.4174.8-173-122.2000112.1W999 L1000 V1028 Q1032 V1035 L1062 A1068 V1069 N1070W999-W1066 HydrophobicContact CH2-CZ3 4.43Å; W999-W1066 HydrophobicContact CZ3-CZ3 4.14Å; L1000-W1066 HydrophobicContact CD1-CB 4.4Å; L1000-W1066 HydrophobicContact CD1-CE3 4.11Å; L1000-W1066 HydrophobicContact CD2-CE3 3.55Å; L1000-W1066 HydrophobicContact CD2-CZ3 3.86Å; L1000-W1066 HydrophobicContact CG-CE3 4.41Å; V1028-W1066 HydrophobicContact CG1-CH2 3.61Å; V1028-W1066 HydrophobicContact CG1-CZ3 3.81Å; Q1032-W1066 HydrophobicContact CB-CH2 3.97Å; Q1032-W1066 HydrophobicContact CB-CZ2 3.78Å; Q1032-W1066 HydrophobicContact CG-CH2 4.49Å; Q1032-W1066 HydrophobicContact CG-CZ2 3.82Å; V1035-W1066 HydrophobicContact CB-CD2 4.02Å; V1035-W1066 HydrophobicContact CB-CE3 4.27Å; V1035-W1066 HydrophobicContact CB-CG 4.5Å; V1035-W1066 HydrophobicContact CB-CZ2 4.28Å; V1035-W1066 HydrophobicContact CB-CZ3 4.5Å; V1035-W1066 HydrophobicContact CG1-CB 4.02Å; V1035-W1066 HydrophobicContact CG1-CD2 3.5Å; V1035-W1066 HydrophobicContact CG1-CE3 3.99Å; V1035-W1066 HydrophobicContact CG1-CG 3.51Å; V1035-W1066 HydrophobicContact CG2-CD2 4.27Å; V1035-W1066 HydrophobicContact CG2-CE3 4Å; V1035-W1066 HydrophobicContact CG2-CH2 4.34Å; V1035-W1066 HydrophobicContact CG2-CZ3 4.03Å; L1062-W1066 WeakPolarHBondContact O-CB 3.23Å; L1062-W1066 PolarHBondContact O-N 3.12Å; W1066-A1068 VanDerWaalsContact C-N 3.33Å; W1066-V1069 HydrophobicContact CZ3-CG1 4.4Å; W1066-N1070 VanDerWaalsContact CZ2-ND2 3.34Å; W1066-N1070 WeakPolarHBondContact CZ2-ND2 3.44Å; W1066-N1070 PolarHBondContact NE1-ND2 2.98Å; W1066-N1070 VanDerWaalsContact O-CB 3.27Å; W1066-N1070 WeakPolarHBondContact O-CB 3.48Å; W1066-N1070 PolarHBondContact O-N 2.98Å; W1066-N1070 PolarHBondContact O-ND2 3.38Å
1067K77.6Confident73.3Confident104 Ų10462.7 Ų62.745%0.45229%0.294SS..Hα-helixtrans-69.2-27.5172-77.6164.7-175.1148.70112.8S1063 S1064 E1065 R1071S1063-K1067 WeakPolarHBondContact O-CB 3.46Å; S1063-K1067 VanDerWaalsContact O-CD 3.23Å; S1063-K1067 WeakPolarHBondContact O-CD 3.48Å; S1063-K1067 WeakPolarHBondContact O-CG 3.38Å; S1063-K1067 PolarHBondContact O-N 3.36Å; S1063-K1067 WeakPolarHBondContact OG-CE 3.48Å; S1063-K1067 PolarHBondContact OG-NZ 3.49Å; S1064-K1067 CarbonylContact O-C 3.53Å; S1064-K1067 PolarHBondContact O-N 2.9Å; E1065-K1067 VanDerWaalsContact C-N 3.34Å; E1065-K1067 PolarHBondContact O-N 2.91Å; K1067-R1071 WeakPolarHBondContact O-CB 3.26Å; K1067-R1071 WeakPolarHBondContact O-CG 3.4Å; K1067-R1071 PolarHBondContact O-N 3.05Å
1068A76.2Confident71.5Confident31 Ų3158.7 Ų58.726%0.25629%0.294SS..Hα-helixtrans-73.4-50.5174.900000110.4R1004 S1064 E1065 W1066 N1070 R1071 L1072R1004-A1068 HydrophobicContact CG-CB 4.49Å; S1064-A1068 WeakPolarHBondContact O-CB 3.37Å; S1064-A1068 PolarHBondContact O-N 3.25Å; E1065-A1068 WeakPolarHBondContact O-CB 3.47Å; E1065-A1068 PolarHBondContact O-N 2.99Å; W1066-A1068 VanDerWaalsContact C-N 3.33Å; A1068-N1070 PolarHBondContact O-N 2.96Å; A1068-R1071 PolarHBondContact O-N 3.26Å; A1068-R1071 VanDerWaalsContact O-N 3.11Å; A1068-L1072 WeakPolarHBondContact O-CG 3.37Å; A1068-L1072 PolarHBondContact O-N 2.94Å
1069V79.3Confident69.5Low0 Ų064.9 Ų64.90%032%0.321CS..Hα-helixtrans-55.9-48.3173165.20000111.4L1000 I1003 R1004 L1007 V1028 E1065 W1066 L1072 L1073L1000-V1069 HydrophobicContact CD2-CB 4.24Å; L1000-V1069 HydrophobicContact CD2-CG1 4.28Å; L1000-V1069 HydrophobicContact CD2-CG2 3.83Å; I1003-V1069 HydrophobicContact CG2-CG1 4.24Å; I1003-V1069 HydrophobicContact CG2-CG2 4.5Å; R1004-V1069 HydrophobicContact CB-CG2 3.68Å; R1004-V1069 HydrophobicContact CG-CG2 4.12Å; L1007-V1069 HydrophobicContact CD1-CB 4.39Å; L1007-V1069 HydrophobicContact CD1-CG1 3.8Å; L1007-V1069 HydrophobicContact CD1-CG2 4.49Å; V1028-V1069 HydrophobicContact CG1-CG1 4.06Å; V1028-V1069 HydrophobicContact CG2-CG1 4.24Å; E1065-V1069 PolarHBondContact O-N 3.47Å; W1066-V1069 HydrophobicContact CZ3-CG1 4.4Å; V1069-L1072 PolarHBondContact O-N 2.71Å; V1069-L1073 HydrophobicContact CG1-CD1 4.29Å; V1069-L1073 PolarHBondContact O-N 3.01Å
1070N76.3Confident67.1Low33 Ų3372.1 Ų72.118%0.17635%0.354CS..Hα-helixtrans-67.6-35.5175.4-80.6-75.9000112.6W1066 A1068 L1073 Q1074W1066-N1070 VanDerWaalsContact CZ2-ND2 3.34Å; W1066-N1070 WeakPolarHBondContact CZ2-ND2 3.44Å; W1066-N1070 PolarHBondContact NE1-ND2 2.98Å; W1066-N1070 VanDerWaalsContact O-CB 3.27Å; W1066-N1070 WeakPolarHBondContact O-CB 3.48Å; W1066-N1070 PolarHBondContact O-N 2.98Å; W1066-N1070 PolarHBondContact O-ND2 3.38Å; A1068-N1070 PolarHBondContact O-N 2.96Å; N1070-L1073 CarbonylContact O-C 3.58Å; N1070-L1073 PolarHBondContact O-N 3.18Å; N1070-Q1074 WeakPolarHBondContact O-CA 3.23Å; N1070-Q1074 WeakPolarHBondContact O-CB 3.41Å; N1070-Q1074 PolarHBondContact O-N 3.08Å
1071R71Confident64.9Low154 Ų15473.3 Ų73.358%0.58137%0.37SS*.Hα-helixtrans-64.8-38.1173.2-86.3-175.6-120.2-151.12.8112.3K1067 A1068 Q1074 E1075K1067-R1071 WeakPolarHBondContact O-CB 3.26Å; K1067-R1071 WeakPolarHBondContact O-CG 3.4Å; K1067-R1071 PolarHBondContact O-N 3.05Å; A1068-R1071 PolarHBondContact O-N 3.26Å; A1068-R1071 VanDerWaalsContact O-N 3.11Å; R1071-Q1074 CarbonylContact O-C 3.49Å; R1071-Q1074 PolarHBondContact O-N 2.76Å; R1071-E1075 VanDerWaalsContact O-CB 3.31Å; R1071-E1075 WeakPolarHBondContact O-CB 3.19Å; R1071-E1075 VanDerWaalsContact O-CG 3.27Å; R1071-E1075 WeakPolarHBondContact O-CG 3.43Å; R1071-E1075 PolarHBondContact O-N 2.7Å
1072L75.3Confident62.3Low21 Ų2176.6 Ų76.611%0.1139%0.387CS..Hα-helixtrans-64.6-45.6174.7-65.9161.8000110.6R1004 L1007 E1008 N1011 A1068 V1069 Q1074 L1076R1004-L1072 HydrophobicContact CG-CD1 4.04Å; L1007-L1072 HydrophobicContact CB-CB 3.93Å; L1007-L1072 HydrophobicContact CB-CD1 3.81Å; L1007-L1072 HydrophobicContact CB-CG 4.45Å; L1007-L1072 HydrophobicContact CD1-CB 4.44Å; E1008-L1072 HydrophobicContact CG-CD1 3.69Å; E1008-L1072 HydrophobicContact CG-CD2 4.33Å; N1011-L1072 HydrophobicContact CB-CD2 4.23Å; A1068-L1072 WeakPolarHBondContact O-CG 3.37Å; A1068-L1072 PolarHBondContact O-N 2.94Å; V1069-L1072 PolarHBondContact O-N 2.71Å; L1072-Q1074 VanDerWaalsContact C-N 3.29Å; L1072-Q1074 PolarHBondContact O-N 3.33Å; L1072-L1076 WeakPolarHBondContact O-CD1 3.25Å; L1072-L1076 VanDerWaalsContact O-CG 3.29Å; L1072-L1076 WeakPolarHBondContact O-CG 3.28Å; L1072-L1076 PolarHBondContact O-N 3.48Å
1073L71.2Confident59.5Low9 Ų983.5 Ų83.55%0.04742%0.424CS..Hα-helixtrans-66.3-26.7172.5-72.6170000113.7L1007 V1028 V1069 N1070 L1076 R1077L1007-L1073 HydrophobicContact CD1-CD1 4.31Å; L1007-L1073 HydrophobicContact CD1-CD2 4.43Å; L1007-L1073 HydrophobicContact CD1-CG 3.96Å; L1007-L1073 HydrophobicContact CD2-CD2 3.83Å; L1007-L1073 HydrophobicContact CD2-CG 4.2Å; V1028-L1073 HydrophobicContact CB-CD1 3.9Å; V1028-L1073 HydrophobicContact CG1-CD1 3.58Å; V1028-L1073 HydrophobicContact CG2-CD1 4.13Å; V1069-L1073 HydrophobicContact CG1-CD1 4.29Å; V1069-L1073 PolarHBondContact O-N 3.01Å; N1070-L1073 CarbonylContact O-C 3.58Å; N1070-L1073 PolarHBondContact O-N 3.18Å; L1073-L1076 WeakPolarHBondContact O-CB 3.31Å; L1073-R1077 VanDerWaalsContact O-CB 3.3Å; L1073-R1077 WeakPolarHBondContact O-CB 3.38Å; L1073-R1077 VanDerWaalsContact O-CG 3.25Å; L1073-R1077 WeakPolarHBondContact O-CG 3.32Å; L1073-R1077 PolarHBondContact O-N 3.43Å
1074Q57.1Low57.3Low117 Ų11787.1 Ų87.155%0.54745%0.454SS..Hα-helixtrans-94.2-20.8-177.1-168.3169.64000112.2N1070 R1071 L1072 L1076 R1077 A1078N1070-Q1074 WeakPolarHBondContact O-CA 3.23Å; N1070-Q1074 WeakPolarHBondContact O-CB 3.41Å; N1070-Q1074 PolarHBondContact O-N 3.08Å; R1071-Q1074 CarbonylContact O-C 3.49Å; R1071-Q1074 PolarHBondContact O-N 2.76Å; L1072-Q1074 VanDerWaalsContact C-N 3.29Å; L1072-Q1074 PolarHBondContact O-N 3.33Å; Q1074-L1076 VanDerWaalsContact C-N 3.28Å; Q1074-R1077 PolarHBondContact O-N 3.47Å; Q1074-A1078 HydrophobicContact CG-CB 3.99Å; Q1074-A1078 WeakPolarHBondContact O-CA 3.33Å; Q1074-A1078 WeakPolarHBondContact O-CB 3.37Å; Q1074-A1078 PolarHBondContact O-N 3.22Å
1075E60.7Low55.6Low119 Ų11989.9 Ų89.956%0.55647%0.471SS*.Hα-helixtrans-70.5-32.6161.4-75.4168.7-168.600109.7N1011 R1071N1011-E1075 PolarHBondContact ND2-OE2 2.94Å; R1071-E1075 VanDerWaalsContact O-CB 3.31Å; R1071-E1075 WeakPolarHBondContact O-CB 3.19Å; R1071-E1075 VanDerWaalsContact O-CG 3.27Å; R1071-E1075 WeakPolarHBondContact O-CG 3.43Å; R1071-E1075 PolarHBondContact O-N 2.7Å
1076L57.4Low52.9Low76 Ų7690.2 Ų90.240%0.39849%0.489SS..Hα-helixtrans-69.6-35.5166.8-67.6166.2000113V1021 L1072 L1073 Q1074V1021-L1076 HydrophobicContact CG1-CD1 4.28Å; L1072-L1076 WeakPolarHBondContact O-CD1 3.25Å; L1072-L1076 VanDerWaalsContact O-CG 3.29Å; L1072-L1076 WeakPolarHBondContact O-CG 3.28Å; L1072-L1076 PolarHBondContact O-N 3.48Å; L1073-L1076 WeakPolarHBondContact O-CB 3.31Å; Q1074-L1076 VanDerWaalsContact C-N 3.28Å
1077R47.1Very low50Low105 Ų10597.6 Ų97.640%0.39653%0.528SS..Hα-helixtrans-98.3-26.9-175.8-74.7172.4168.6-172-5.5117.5E1025 L1073 Q1074 K1079E1025-R1077 VanDerWaalsContact CD-NH2 3.32Å; E1025-R1077 IonicContact OE1-CZ 3.82Å; E1025-R1077 IonicContact OE1-NE 2.7Å; E1025-R1077 PolarHBondContact OE1-NE 3.28Å; E1025-R1077 IonicContact OE1-NH2 2.67Å; E1025-R1077 PolarHBondContact OE1-NH2 2.94Å; L1073-R1077 VanDerWaalsContact O-CB 3.3Å; L1073-R1077 WeakPolarHBondContact O-CB 3.38Å; L1073-R1077 VanDerWaalsContact O-CG 3.25Å; L1073-R1077 WeakPolarHBondContact O-CG 3.32Å; L1073-R1077 PolarHBondContact O-N 3.43Å; Q1074-R1077 PolarHBondContact O-N 3.47Å; R1077-K1079 PolarHBondContact O-N 3.26Å
1078A36.3Very low47.4Very low69 Ų6998.5 Ų98.557%0.5754%0.543SS*.  trans-77.233.8-167.100000115Q1074 Q1080Q1074-A1078 HydrophobicContact CG-CB 3.99Å; Q1074-A1078 WeakPolarHBondContact O-CA 3.33Å; Q1074-A1078 WeakPolarHBondContact O-CB 3.37Å; Q1074-A1078 PolarHBondContact O-N 3.22Å; A1078-Q1080 PolarHBondContact O-N 2.91Å
1079K33.1Very low45Very low179 Ų179103 Ų10378%0.77857%0.567SS**SBendtrans-82.215.4164.3-69.3175.5175.91680112.3R1077R1077-K1079 PolarHBondContact O-N 3.26Å
1080Q28.9Very low42.3Very low171 Ų171111 Ų11180%0.79961%0.608SS**  trans-147.9125.8-174.9-68-70.7-92.400112.7A1078A1078-Q1080 PolarHBondContact O-N 2.91Å
1081P32.1Very low39.9Very low113 Ų113113.3 Ų113.373%0.73464%0.639SS**  trans-116.7156.5173.939.4-30.1000115.2
1082D23.9Very low37.7Very low152 Ų152110.8 Ų110.881%0.81365%0.651SS**  trans146.3166.7157.4-89.6-1.2000113.9
1083L23.5Very low35.4Very low145 Ų145115.1 Ų115.176%0.75968%0.684SS**  cis-172.9112.7-31-17978.1000113.5
1084A32.8Very low34.2Very low93 Ų93119.8 Ų119.877%0.76971%0.714SS**  trans54.7-156.9160.900000118
1085P43.1Very low32.6Very low129 Ų129119.9 Ų119.984%0.83872%0.723SS**  -130.3-177.2-5236.8-20.1000115.4
1086G23.5Very low31.1Very low61 Ų61122.8 Ų122.863%0.62974%0.737SS**  trans126.6121.6155.600000117.1
1087L23.1Very low29.7Very low169 Ų169125 Ų12589%0.88575%0.753SS**  72.6137.574.2-64.5168.6000113.4
1088T23.8Very low28.7Very low123 Ų123126.9 Ų126.976%0.75578%0.776SS**  cis-164.4-177.110.5-100000113.1
1089T24.8Very low28.2Very low126 Ų126129.1 Ų129.177%0.77378%0.783SS**  trans100.2171.3154.1-46.80000119.1
1090I23.9Very low28Very low168 Ų168128 Ų12886%0.86278%0.784SS**  trans-159.4156.1-133.9-82.1147.3000111.7
1091G24.5Very low27.8Very low80 Ų80125.9 Ų125.983%0.82578%0.783SS**  trans-179.6145.9167.400000118.8
1092A25.7Very low27.6Very low101 Ų101126.7 Ų126.784%0.83579%0.786SS**  trans-107.5177-164.700000114.8
1093S27Very low27.8Very low113 Ų113128 Ų12879%0.7979%0.787SS**  cis-174-175.3-25.668.70000108.5
1094P45.8Very low28.5Very low106 Ų106127.3 Ų127.369%0.68879%0.792SS**  trans-123-165.1-155.644.5-33.4000118.5
1095T24.6Very low28.2Very low120 Ų120129.3 Ų129.374%0.73679%0.794SS**  trans80152.6162.251.60000118.8
1096Q27.5Very low27.4Very low180 Ų180129.7 Ų129.784%0.84179%0.794SS**  cis-159.7177.99.5-133160.518.300115.2
1097T27.9Very low27.6Very low122 Ų122131.3 Ų131.375%0.74879%0.791SS**  trans-93.4173.2-178.3-310000114.3
1098V27.6Very low28.1Very low144 Ų144129.5 Ų129.587%0.87378%0.777SS**  trans-180160.8136.3144.10000113.3
1099T25.8Very low28.3Very low117 Ų117129.2 Ų129.272%0.71877%0.767SS**  trans-142.7157.3-159.8-18.10000115.1
1100L27.4Very low28.6Very low154 Ų154126.3 Ų126.381%0.80675%0.749SS**  trans64.7135.8142.5-146.179.5000123
1101V25.9Very low28.9Very low128 Ų128121.2 Ų121.278%0.77673%0.732SS**  167.9141.8118.31580000111.7
1102T27.2Very low29.3Very low129 Ų129120.5 Ų120.579%0.79171%0.708SS**  trans-131.2158.7-176.7-27.90000111.1
1103Q27.7Very low29.5Very low179 Ų179120.9 Ų120.984%0.83671%0.705SS**  trans-135.1150.8168.5-72.5-173.2-14.200110.3
1104P38.2Very low29.6Very low132 Ų132119.7 Ų119.786%0.85769%0.686SS**  trans-143.6-171.3133.935.5-17.6000115.2
1105V26.8Very low29.1Very low135 Ų135121.7 Ų121.782%0.81869%0.689SS**  trans-104157.4-1571710000114
1106V25.5Very low29.6Very low136 Ų136124.9 Ų124.982%0.82470%0.696SS**  trans-141.1152.1170.7174.20000112.6
1107T29Very low30.3Very low95 Ų95118 Ų11858%0.58366%0.664SS**  trans-129.9152.116343.90000109.7V2267T1107-V2267 HydrophobicContact CG2-CG1 3.91Å
1108K32.8Very low31.1Very low132 Ų132115.7 Ų115.757%0.57465%0.652SS**  cis102.696.417.5-172.9-163.2170.1-158.80113.7V2267 S2268K1108-V2267 PolarHBondContact NZ-O 3.3Å; K1108-S2268 VanDerWaalsContact O-CB 3.23Å; K1108-S2268 WeakPolarHBondContact O-CB 3.45Å; K1108-S2268 PolarHBondContact O-OG 2.88Å; K1108-S2268 VanDerWaalsContact O-OG 3.12Å
1109E28.9Very low32Very low117 Ų117113.3 Ų113.355%0.54764%0.641SS.*  trans-153.1162.2172.4-81.3-142.2148.300113.9P2270 S2271E1109-P2270 HydrophobicContact CB-CB 3.54Å; E1109-P2270 HydrophobicContact CG-CB 3.5Å; E1109-P2270 WeakPolarHBondContact OE1-CA 3.3Å; E1109-P2270 WeakPolarHBondContact OE1-CB 3.33Å; E1109-P2270 WeakPolarHBondContact OE2-CB 3.4Å; E1109-S2271 VanDerWaalsContact CD-N 3.3Å; E1109-S2271 PolarHBondContact OE1-N 3.22Å; E1109-S2271 WeakPolarHBondContact OE2-CA 3.38Å; E1109-S2271 WeakPolarHBondContact OE2-CB 3.2Å; E1109-S2271 PolarHBondContact OE2-N 3.2Å; E1109-S2271 PolarHBondContact OE2-OG 3.46Å
1110T30.8Very low33.1Very low65 Ų65111.9 Ų111.940%0.39964%0.636SS.*  trans84.3149.5154.6-56.40000121.9P2270 S2271T1110-P2270 VanDerWaalsContact CA-CG 3.42Å; T1110-P2270 VanDerWaalsContact N-CB 3.35Å; T1110-P2270 WeakPolarHBondContact OG1-CB 3.38Å; T1110-P2270 WeakPolarHBondContact OG1-CG 3.49Å; T1110-S2271 PolarHBondContact OG1-OG 3.45Å
1111A30.7Very low34.4Very low60 Ų60104.9 Ų104.950%0.49660%0.599SS.*  trans-164.4156-151.100000110.9
1112I32Very low35.7Very low66 Ų66101.1 Ų101.134%0.33857%0.574SS.*  trans-147.4117.4179.4-59.6-179000114D1140 L1144I1112-D1140 WeakPolarHBondContact O-CB 3.44Å; I1112-L1144 HydrophobicContact CD1-CD1 4.25Å
1113S30Very low37.3Very low109 Ų109102.3 Ų102.376%0.76258%0.575SS**  trans46.6119.7146.3-149.90000123.9
1114K29.4Very low38.6Very low88 Ų8899.9 Ų99.938%0.38356%0.563SS.*  trans-107.9156.1179.8-57.5-170.8175.2-135.30114.9R1133 T1136 D1140K1114-R1133 PolarHBondContact NZ-O 2.69Å; K1114-T1136 HydrophobicContact CB-CG2 4.19Å; K1114-T1136 HydrophobicContact CD-CG2 4.27Å; K1114-T1136 VanDerWaalsContact CD-OG1 3.27Å; K1114-T1136 WeakPolarHBondContact CD-OG1 3.5Å; K1114-T1136 VanDerWaalsContact CE-CB 3.41Å; K1114-T1136 WeakPolarHBondContact CE-OG1 3.45Å; K1114-T1136 HydrophobicContact CG-CG2 3.79Å; K1114-T1136 PolarHBondContact NZ-OG1 3.33Å; K1114-D1140 WeakPolarHBondContact CE-OD2 3.06Å
1115L34.8Very low39.8Very low147 Ų14795 Ų9577%0.7753%0.531SS*.  trans-106.5126.3167.2-157.880.8000111.3R1209L1115-R1209 PolarHBondContact O-NH2 3.19Å; L1115-R1209 VanDerWaalsContact O-NH2 3.13Å
1116E36.3Very low41.8Very low188 Ų18893.2 Ų93.288%0.87952%0.522SS*.  trans-83.8167.8-166.9-65.9-168.2132.300115.8
1117M41.7Very low44.1Very low34 Ų3489.2 Ų89.217%0.16750%0.503CS..  trans-128.8134.9-170.9-108.9-63.7-51.400110.6S1119 L1121 I1205M1117-S1119 PolarHBondContact O-N 2.95Å; M1117-L1121 HydrophobicContact CE-CB 3.95Å; M1117-L1121 HydrophobicContact CE-CD1 3.68Å; M1117-L1121 HydrophobicContact CE-CG 4.46Å; M1117-I1205 HydrophobicContact CE-CD1 3.79Å; M1117-I1205 HydrophobicContact CG-CG2 4.44Å; M1117-I1205 HydrophobicContact SD-CD1 3.65Å; M1117-I1205 HydrophobicContact SD-CG1 4.2Å; M1117-I1205 HydrophobicContact SD-CG2 3.76Å
1118P44.3Very low46.4Very low75 Ų7584.9 Ų84.949%0.48748%0.477SS..  trans-59.1132.6-178.619.5-33.3000114.6S1120 L1121P1118-S1120 VanDerWaalsContact C-N 3.27Å; P1118-S1120 PolarHBondContact O-N 3.1Å; P1118-S1120 VanDerWaalsContact O-N 3.15Å; P1118-L1121 PolarHBondContact O-N 3.45Å
1119S47.4Very low48.3Very low94 Ų9480.3 Ų80.366%0.65746%0.463SS*.THydrogen-bonded Turntrans-64.2-21.2-167.7-40.20000115.6M1117 L1121 M1122M1117-S1119 PolarHBondContact O-N 2.95Å; S1119-L1121 VanDerWaalsContact C-N 3.29Å; S1119-L1121 PolarHBondContact O-N 3.17Å; S1119-M1122 PolarHBondContact O-N 2.99Å
1120S49.4Very low50.5Low86 Ų8678.7 Ų78.760%0.60146%0.458SS*.Hα-helixtrans-60.7-37.717849.10000112.6P1118P1118-S1120 VanDerWaalsContact C-N 3.27Å; P1118-S1120 PolarHBondContact O-N 3.1Å; P1118-S1120 VanDerWaalsContact O-N 3.15Å
1121L52.7Low53Low7 Ų775.9 Ų75.94%0.03744%0.44CS..Hα-helixtrans-77.2-19.2-179.4-78.2166.6000113.5M1117 P1118 S1119 N1199 E1201 A1202 I1205M1117-L1121 HydrophobicContact CE-CB 3.95Å; M1117-L1121 HydrophobicContact CE-CD1 3.68Å; M1117-L1121 HydrophobicContact CE-CG 4.46Å; P1118-L1121 PolarHBondContact O-N 3.45Å; S1119-L1121 VanDerWaalsContact C-N 3.29Å; S1119-L1121 PolarHBondContact O-N 3.17Å; L1121-N1199 WeakPolarHBondContact CD2-ND2 3.35Å; L1121-E1201 HydrophobicContact CD1-CG 4.25Å; L1121-A1202 HydrophobicContact CD2-CB 4.14Å; L1121-I1205 HydrophobicContact CD1-CD1 3.87Å
1122M54.9Low55.4Low50 Ų5073.7 Ų73.725%0.24642%0.42CS..Hα-helixtrans-76.3-29.7177.7-63-87.966.500112.4S1119 L1128 A1129 N1132S1119-M1122 PolarHBondContact O-N 2.99Å; M1122-L1128 HydrophobicContact CE-CB 3.62Å; M1122-L1128 HydrophobicContact CE-CD2 3.82Å; M1122-L1128 HydrophobicContact CE-CG 3.55Å; M1122-A1129 HydrophobicContact CE-CB 4.01Å; M1122-A1129 HydrophobicContact SD-CB 3.94Å; M1122-N1132 WeakPolarHBondContact CE-ND2 3.42Å
1123L59.3Low57.7Low154 Ų15476.5 Ų76.581%0.80643%0.427SS*.Hα-helixtrans-75.2-30.3-179.1-73.2166.8000113.4
1124E56.8Low60.3Low128 Ų12873.1 Ų73.160%0.59841%0.406SS*.Hα-helixtrans-71.9-33.2177.9-74.9-164.6128.700113.1N1199E1124-N1199 PolarHBondContact OE2-ND2 2.72Å
1125V63.1Low63Low29 Ų2969.8 Ų69.818%0.17639%0.391CS..  trans-140.489.3-173.4-171.30000110.7A1127 L1128 L1193V1125-A1127 VanDerWaalsContact C-N 3.27Å; V1125-A1127 PolarHBondContact O-N 2.83Å; V1125-A1127 VanDerWaalsContact O-N 3.16Å; V1125-L1128 HydrophobicContact CB-CB 4.25Å; V1125-L1128 HydrophobicContact CG1-CB 4.31Å; V1125-L1128 WeakPolarHBondContact O-CB 3.17Å; V1125-L1128 PolarHBondContact O-N 3.42Å; V1125-L1193 HydrophobicContact CG1-CD2 3.82Å
1126P68.5Low65.3Low98 Ų9863.2 Ų63.264%0.63636%0.356SS*.THydrogen-bonded Turntrans-54.7-37.8-177.4-29.836.2000114.5L1128 A1129P1126-L1128 PolarHBondContact O-N 2.8Å; P1126-L1128 VanDerWaalsContact O-N 3.08Å; P1126-A1129 WeakPolarHBondContact O-CB 3.34Å; P1126-A1129 PolarHBondContact O-N 3.45Å
1127A73.8Confident67.5Low51 Ų5159.5 Ų59.542%0.42134%0.339SS..Hα-helixtrans-63.5-14.2177.500000114.1V1125 A1129 F1131 L1193V1125-A1127 VanDerWaalsContact C-N 3.27Å; V1125-A1127 PolarHBondContact O-N 2.83Å; V1125-A1127 VanDerWaalsContact O-N 3.16Å; A1127-A1129 VanDerWaalsContact C-N 3.31Å; A1127-F1131 PolarHBondContact O-N 3.46Å; A1127-L1193 HydrophobicContact CB-CD2 3.8Å
1128L76.6Confident69.8Low5 Ų558.2 Ų58.23%0.02633%0.333CS..Hα-helixtrans-70.4-28.8171.6-172.461.7000111.6M1122 V1125 P1126 F1131 N1132 L1193 I1206M1122-L1128 HydrophobicContact CE-CB 3.62Å; M1122-L1128 HydrophobicContact CE-CD2 3.82Å; M1122-L1128 HydrophobicContact CE-CG 3.55Å; V1125-L1128 HydrophobicContact CB-CB 4.25Å; V1125-L1128 HydrophobicContact CG1-CB 4.31Å; V1125-L1128 WeakPolarHBondContact O-CB 3.17Å; V1125-L1128 PolarHBondContact O-N 3.42Å; P1126-L1128 PolarHBondContact O-N 2.8Å; P1126-L1128 VanDerWaalsContact O-N 3.08Å; L1128-F1131 HydrophobicContact CD1-CD1 3.97Å; L1128-N1132 WeakPolarHBondContact O-CB 3.49Å; L1128-N1132 PolarHBondContact O-N 3.01Å; L1128-N1132 PolarHBondContact O-ND2 2.88Å; L1128-L1193 HydrophobicContact CD1-CD1 4.18Å; L1128-I1206 HydrophobicContact CD1-CD1 3.74Å; L1128-I1206 HydrophobicContact CD1-CG1 3.57Å
1129A73.3Confident71.8Confident35 Ų3555.2 Ų55.229%0.28931%0.313SS..Hα-helixtrans-69.7-40.7177.200000111.3M1122 P1126 A1127 N1132 R1133M1122-A1129 HydrophobicContact CE-CB 4.01Å; M1122-A1129 HydrophobicContact SD-CB 3.94Å; P1126-A1129 WeakPolarHBondContact O-CB 3.34Å; P1126-A1129 PolarHBondContact O-N 3.45Å; A1127-A1129 VanDerWaalsContact C-N 3.31Å; A1129-N1132 PolarHBondContact O-N 2.91Å; A1129-R1133 WeakPolarHBondContact O-CB 3.37Å; A1129-R1133 PolarHBondContact O-N 3.38Å
1130D75.4Confident73.4Confident83 Ų8351.5 Ų51.544%0.44429%0.286SS..Hα-helixtrans-65-43.6176-60.5-36.3000111.7R1133 A1134D1130-R1133 PolarHBondContact O-N 3.32Å; D1130-R1133 IonicContact OD1-CZ 3.03Å; D1130-R1133 VanDerWaalsContact OD1-CZ 3.31Å; D1130-R1133 IonicContact OD1-NH1 3.68Å; D1130-R1133 PolarHBondContact OD1-NH1 2.8Å; D1130-R1133 IonicContact OD1-NH2 3.84Å; D1130-R1133 PolarHBondContact OD1-NH2 2.86Å; D1130-A1134 PolarHBondContact O-N 2.73Å
1131F83.4Confident75.4Confident6 Ų649.3 Ų49.33%0.02627%0.265CS..Hα-helixtrans-59.3-46.6171.6166.5-99.4000112.4A1127 L1128 R1133 A1134 W1135 L1186 A1189 A1190 L1193 I1206 R1209 I1210A1127-F1131 PolarHBondContact O-N 3.46Å; L1128-F1131 HydrophobicContact CD1-CD1 3.97Å; F1131-R1133 VanDerWaalsContact C-N 3.29Å; F1131-R1133 PolarHBondContact O-N 2.85Å; F1131-A1134 PolarHBondContact O-N 3.33Å; F1131-W1135 WeakPolarHBondContact O-CB 3.39Å; F1131-W1135 PolarHBondContact O-N 2.74Å; F1131-L1186 HydrophobicContact CD2-CD1 4.25Å; F1131-L1186 HydrophobicContact CD2-CG 4.14Å; F1131-L1186 HydrophobicContact CE2-CD1 4.37Å; F1131-L1186 HydrophobicContact CE2-CD2 4.13Å; F1131-L1186 HydrophobicContact CE2-CG 3.84Å; F1131-A1189 HydrophobicContact CD2-CB 4.42Å; F1131-A1190 HydrophobicContact CD2-CB 4.28Å; F1131-A1190 HydrophobicContact CE2-CB 3.6Å; F1131-A1190 HydrophobicContact CZ-CB 3.99Å; F1131-L1193 HydrophobicContact CB-CD1 3.33Å; F1131-L1193 HydrophobicContact CD1-CD1 4.18Å; F1131-L1193 HydrophobicContact CD2-CD1 4.29Å; F1131-L1193 HydrophobicContact CG-CD1 3.67Å; F1131-I1206 HydrophobicContact CE1-CG1 4.33Å; F1131-I1206 HydrophobicContact CE1-CG2 4.24Å; F1131-I1206 HydrophobicContact CZ-CG2 4.19Å; F1131-R1209 HydrophobicContact CE1-CB 4.5Å; F1131-R1209 HydrophobicContact CZ-CB 4.46Å; F1131-I1210 HydrophobicContact CE2-CD1 3.83Å; F1131-I1210 HydrophobicContact CE2-CG1 4.26Å; F1131-I1210 HydrophobicContact CZ-CD1 4.04Å; F1131-I1210 HydrophobicContact CZ-CG1 4.09Å
1132N80.8Confident77.3Confident14 Ų1449 Ų498%0.07526%0.263CS..Hα-helixtrans-62.9-35.7178.7-77.9-22.4000112.5M1122 L1128 A1129 T1136 R1209M1122-N1132 WeakPolarHBondContact CE-ND2 3.42Å; L1128-N1132 WeakPolarHBondContact O-CB 3.49Å; L1128-N1132 PolarHBondContact O-N 3.01Å; L1128-N1132 PolarHBondContact O-ND2 2.88Å; A1129-N1132 PolarHBondContact O-N 2.91Å; N1132-T1136 PolarHBondContact O-N 3.2Å; N1132-T1136 PolarHBondContact O-OG1 3.28Å; N1132-T1136 VanDerWaalsContact O-OG1 3.05Å; N1132-R1209 PolarHBondContact OD1-NH1 2.71Å
1133R80.3Confident78.7Confident125 Ų12548.7 Ų48.747%0.47227%0.266SS..Hα-helixtrans-64.6-56.4176.2177.916966.1-101.6-3.3110.8K1114 A1129 D1130 F1131 W1135 T1136 E1137K1114-R1133 PolarHBondContact NZ-O 2.69Å; A1129-R1133 WeakPolarHBondContact O-CB 3.37Å; A1129-R1133 PolarHBondContact O-N 3.38Å; D1130-R1133 PolarHBondContact O-N 3.32Å; D1130-R1133 IonicContact OD1-CZ 3.03Å; D1130-R1133 VanDerWaalsContact OD1-CZ 3.31Å; D1130-R1133 IonicContact OD1-NH1 3.68Å; D1130-R1133 PolarHBondContact OD1-NH1 2.8Å; D1130-R1133 IonicContact OD1-NH2 3.84Å; D1130-R1133 PolarHBondContact OD1-NH2 2.86Å; F1131-R1133 VanDerWaalsContact C-N 3.29Å; F1131-R1133 PolarHBondContact O-N 2.85Å; R1133-W1135 VanDerWaalsContact C-N 3.31Å; R1133-W1135 PolarHBondContact O-N 3.26Å; R1133-T1136 PolarHBondContact O-N 2.96Å; R1133-E1137 WeakPolarHBondContact CG-OE1 3.5Å; R1133-E1137 WeakPolarHBondContact O-CG 3.33Å; R1133-E1137 PolarHBondContact O-N 3.31Å
1134A83.4Confident79.7Confident39 Ų3943.5 Ų43.532%0.32224%0.239SC..Hα-helixtrans-62.1-36.6178.900000112.6D1130 F1131 E1137 L1138 L1186D1130-A1134 PolarHBondContact O-N 2.73Å; F1131-A1134 PolarHBondContact O-N 3.33Å; A1134-E1137 PolarHBondContact O-N 2.85Å; A1134-L1138 PolarHBondContact O-N 2.94Å; A1134-L1138 VanDerWaalsContact O-N 3.16Å; A1134-L1186 HydrophobicContact CB-CD1 3.48Å; A1134-L1186 VanDerWaalsContact CB-CD1 3.48Å
1135W87.3Confident81Confident18 Ų1838.1 Ų38.17%0.06821%0.214CC..Hα-helixtrans-56-56177.717071.1000110.7F1131 R1133 L1138 T1139 L1186 R1209 I1213F1131-W1135 WeakPolarHBondContact O-CB 3.39Å; F1131-W1135 PolarHBondContact O-N 2.74Å; R1133-W1135 VanDerWaalsContact C-N 3.31Å; R1133-W1135 PolarHBondContact O-N 3.26Å; W1135-L1138 PolarHBondContact O-N 3.49Å; W1135-T1139 PolarHBondContact O-N 2.85Å; W1135-T1139 PolarHBondContact O-OG1 3.03Å; W1135-L1186 HydrophobicContact CB-CD1 4.33Å; W1135-L1186 HydrophobicContact CB-CD2 3.95Å; W1135-L1186 HydrophobicContact CG-CD2 4.34Å; W1135-R1209 HydrophobicContact CD2-CB 4.09Å; W1135-R1209 HydrophobicContact CD2-CG 4.1Å; W1135-R1209 HydrophobicContact CE3-CG 4.32Å; W1135-R1209 HydrophobicContact CG-CB 4.31Å; W1135-R1209 HydrophobicContact CH2-CG 4.16Å; W1135-R1209 HydrophobicContact CZ2-CB 4.2Å; W1135-R1209 HydrophobicContact CZ2-CG 3.88Å; W1135-R1209 HydrophobicContact CZ3-CG 4.35Å; W1135-R1209 PolarHBondContact NE1-O 2.98Å; W1135-I1213 VanDerWaalsContact O-CD1 3.23Å; W1135-I1213 WeakPolarHBondContact O-CD1 3.35Å
1136T82.6Confident82.1Confident8 Ų838.1 Ų38.15%0.04921%0.213CC..Hα-helixtrans-78.5-25.4-179.510.20000113.7K1114 N1132 R1133 L1138 T1139 D1140K1114-T1136 HydrophobicContact CB-CG2 4.19Å; K1114-T1136 HydrophobicContact CD-CG2 4.27Å; K1114-T1136 VanDerWaalsContact CD-OG1 3.27Å; K1114-T1136 WeakPolarHBondContact CD-OG1 3.5Å; K1114-T1136 VanDerWaalsContact CE-CB 3.41Å; K1114-T1136 WeakPolarHBondContact CE-OG1 3.45Å; K1114-T1136 HydrophobicContact CG-CG2 3.79Å; K1114-T1136 PolarHBondContact NZ-OG1 3.33Å; N1132-T1136 PolarHBondContact O-N 3.2Å; N1132-T1136 PolarHBondContact O-OG1 3.28Å; N1132-T1136 VanDerWaalsContact O-OG1 3.05Å; R1133-T1136 PolarHBondContact O-N 2.96Å; T1136-L1138 PolarHBondContact O-N 3.36Å; T1136-L1138 VanDerWaalsContact O-N 3.16Å; T1136-T1139 HydrophobicContact CG2-CG2 4.17Å; T1136-T1139 PolarHBondContact O-N 3.45Å; T1136-T1139 VanDerWaalsContact O-N 3.16Å; T1136-D1140 WeakPolarHBondContact CG2-OD1 3.19Å; T1136-D1140 WeakPolarHBondContact O-CB 3.4Å; T1136-D1140 PolarHBondContact O-N 3.05Å
1137E83.2Confident82.6Confident110 Ų11039.1 Ų39.151%0.51421%0.209SC..Hα-helixtrans-55.7-34.8169.6-77.3168.1-167.500111.9R1133 A1134 W1141R1133-E1137 WeakPolarHBondContact CG-OE1 3.5Å; R1133-E1137 WeakPolarHBondContact O-CG 3.33Å; R1133-E1137 PolarHBondContact O-N 3.31Å; A1134-E1137 PolarHBondContact O-N 2.85Å; E1137-W1141 WeakPolarHBondContact O-CB 3.28Å; E1137-W1141 PolarHBondContact O-N 3.23Å
1138L88.2Confident82.8Confident7 Ų739.4 Ų39.44%0.03721%0.205CC..Hα-helixtrans-81.3-37.3174.9-171.663.3000112.9A1134 W1135 T1136 W1141 L1142 L1183 I1213 W1217A1134-L1138 PolarHBondContact O-N 2.94Å; A1134-L1138 VanDerWaalsContact O-N 3.16Å; W1135-L1138 PolarHBondContact O-N 3.49Å; T1136-L1138 PolarHBondContact O-N 3.36Å; T1136-L1138 VanDerWaalsContact O-N 3.16Å; L1138-W1141 HydrophobicContact CD1-CE3 4.07Å; L1138-W1141 PolarHBondContact O-N 2.86Å; L1138-L1142 WeakPolarHBondContact O-CB 3.42Å; L1138-L1142 WeakPolarHBondContact O-CG 3.26Å; L1138-L1142 PolarHBondContact O-N 3.11Å; L1138-L1183 HydrophobicContact CD2-CB 3.97Å; L1138-L1183 HydrophobicContact CD2-CD1 4.04Å; L1138-I1213 HydrophobicContact CB-CD1 3.7Å; L1138-I1213 HydrophobicContact CD2-CD1 3.82Å; L1138-I1213 HydrophobicContact CG-CD1 3.78Å; L1138-W1217 HydrophobicContact CD1-CZ3 4.22Å
1139T87Confident83.2Confident13 Ų1339.7 Ų39.78%0.0821%0.207CC..Hα-helixtrans-63.2-45.7172.9-62.30000113W1135 T1136 W1141 L1142 S1143 I1213W1135-T1139 PolarHBondContact O-N 2.85Å; W1135-T1139 PolarHBondContact O-OG1 3.03Å; T1136-T1139 HydrophobicContact CG2-CG2 4.17Å; T1136-T1139 PolarHBondContact O-N 3.45Å; T1136-T1139 VanDerWaalsContact O-N 3.16Å; T1139-W1141 VanDerWaalsContact C-N 3.27Å; T1139-W1141 PolarHBondContact O-N 2.85Å; T1139-L1142 PolarHBondContact O-N 2.9Å; T1139-S1143 WeakPolarHBondContact O-CB 3.08Å; T1139-S1143 PolarHBondContact O-N 2.6Å; T1139-S1143 PolarHBondContact O-OG 3.4Å; T1139-I1213 WeakPolarHBondContact OG1-CD1 3.38Å
1140D82.3Confident83.5Confident15 Ų1544.3 Ų44.38%0.0822%0.22CC..Hα-helixtrans-62.3-40.3179.4-600.2000109I1112 K1114 T1136 L1144I1112-D1140 WeakPolarHBondContact O-CB 3.44Å; K1114-D1140 WeakPolarHBondContact CE-OD2 3.06Å; T1136-D1140 WeakPolarHBondContact CG2-OD1 3.19Å; T1136-D1140 WeakPolarHBondContact O-CB 3.4Å; T1136-D1140 PolarHBondContact O-N 3.05Å; D1140-L1144 WeakPolarHBondContact O-CB 3.44Å; D1140-L1144 PolarHBondContact O-N 3.31Å
1141W91.2Very high83.6Confident40 Ų4044.2 Ų44.215%0.15223%0.226CC..Hα-helixtrans-69.2-42.5174.8179.278.3000113.2E1137 L1138 T1139 S1143 L1144 L1145 L1176 R1179 W1217E1137-W1141 WeakPolarHBondContact O-CB 3.28Å; E1137-W1141 PolarHBondContact O-N 3.23Å; L1138-W1141 HydrophobicContact CD1-CE3 4.07Å; L1138-W1141 PolarHBondContact O-N 2.86Å; T1139-W1141 VanDerWaalsContact C-N 3.27Å; T1139-W1141 PolarHBondContact O-N 2.85Å; W1141-S1143 VanDerWaalsContact C-N 3.32Å; W1141-S1143 PolarHBondContact O-N 2.82Å; W1141-L1144 PolarHBondContact O-N 3.06Å; W1141-L1145 HydrophobicContact CH2-CD2 3.57Å; W1141-L1145 HydrophobicContact CZ2-CD1 4.12Å; W1141-L1145 HydrophobicContact CZ2-CD2 3.96Å; W1141-L1145 HydrophobicContact CZ3-CD2 4.16Å; W1141-L1145 WeakPolarHBondContact O-CB 3.46Å; W1141-L1145 PolarHBondContact O-N 3.2Å; W1141-L1176 HydrophobicContact CH2-CB 4.3Å; W1141-L1176 HydrophobicContact CH2-CD1 3.7Å; W1141-L1176 HydrophobicContact CZ3-CD1 3.68Å; W1141-R1179 VanDerWaalsContact CE2-NE 3.33Å; W1141-R1179 HydrophobicContact CZ3-CB 4.43Å; W1141-W1217 HydrophobicContact CZ3-CZ3 4.27Å
1142L91.2Very high83.7Confident1 Ų144.8 Ų44.81%0.00523%0.229CC..Hα-helixtrans-61.9-40.2173.5-77.4169.9000111.8L1138 T1139 L1145 D1146 L1176 I1213 Q1216 W1217 V1220L1138-L1142 WeakPolarHBondContact O-CB 3.42Å; L1138-L1142 WeakPolarHBondContact O-CG 3.26Å; L1138-L1142 PolarHBondContact O-N 3.11Å; T1139-L1142 PolarHBondContact O-N 2.9Å; L1142-L1145 WeakPolarHBondContact O-CB 3.37Å; L1142-L1145 PolarHBondContact O-N 3.39Å; L1142-D1146 PolarHBondContact O-N 3.01Å; L1142-L1176 HydrophobicContact CD2-CD1 4.03Å; L1142-I1213 HydrophobicContact CD1-CG1 3.86Å; L1142-Q1216 HydrophobicContact CD1-CB 4.19Å; L1142-W1217 HydrophobicContact CD1-CB 4.23Å; L1142-W1217 HydrophobicContact CD1-CE3 4.19Å; L1142-W1217 HydrophobicContact CD2-CD2 4.38Å; L1142-W1217 HydrophobicContact CD2-CE3 3.85Å; L1142-W1217 HydrophobicContact CD2-CZ3 4.42Å; L1142-W1217 HydrophobicContact CG-CE3 4.41Å; L1142-V1220 HydrophobicContact CD2-CB 4.28Å; L1142-V1220 HydrophobicContact CD2-CG1 4.32Å
1143S84.8Confident83.9Confident44 Ų4452.4 Ų52.431%0.30826%0.257SS..Hα-helixtrans-66-40.1177.6-55.70000111.6T1139 W1141 Q1147T1139-S1143 WeakPolarHBondContact O-CB 3.08Å; T1139-S1143 PolarHBondContact O-N 2.6Å; T1139-S1143 PolarHBondContact O-OG 3.4Å; W1141-S1143 VanDerWaalsContact C-N 3.32Å; W1141-S1143 PolarHBondContact O-N 2.82Å; S1143-Q1147 WeakPolarHBondContact O-CB 3.42Å; S1143-Q1147 PolarHBondContact O-N 2.93Å; S1143-Q1147 VanDerWaalsContact O-N 3.07Å
1144L80.1Confident84.4Confident44 Ų4446.7 Ų46.723%0.2324%0.236CC..Hα-helixtrans-62.9-41.6171.2-176.568.4000111.4I1112 D1140 W1141 Q1147 V1148I1112-L1144 HydrophobicContact CD1-CD1 4.25Å; D1140-L1144 WeakPolarHBondContact O-CB 3.44Å; D1140-L1144 PolarHBondContact O-N 3.31Å; W1141-L1144 PolarHBondContact O-N 3.06Å; L1144-Q1147 PolarHBondContact O-N 3.42Å; L1144-V1148 WeakPolarHBondContact O-CG2 2.79Å; L1144-V1148 PolarHBondContact O-N 2.88Å
1145L85.2Confident84.8Confident15 Ų1548.2 Ų48.28%0.07924%0.237CC..Hα-helixtrans-64.3-44.4178.9-158.369.1000112W1141 L1142 Q1147 V1148 I1149 T1172 L1176 V1220W1141-L1145 HydrophobicContact CH2-CD2 3.57Å; W1141-L1145 HydrophobicContact CZ2-CD1 4.12Å; W1141-L1145 HydrophobicContact CZ2-CD2 3.96Å; W1141-L1145 HydrophobicContact CZ3-CD2 4.16Å; W1141-L1145 WeakPolarHBondContact O-CB 3.46Å; W1141-L1145 PolarHBondContact O-N 3.2Å; L1142-L1145 WeakPolarHBondContact O-CB 3.37Å; L1142-L1145 PolarHBondContact O-N 3.39Å; L1145-Q1147 VanDerWaalsContact C-N 3.3Å; L1145-Q1147 PolarHBondContact O-N 3.08Å; L1145-V1148 WeakPolarHBondContact O-CB 3.48Å; L1145-V1148 PolarHBondContact O-N 3.32Å; L1145-I1149 VanDerWaalsContact O-CG1 3.29Å; L1145-I1149 WeakPolarHBondContact O-CG1 3.29Å; L1145-I1149 PolarHBondContact O-N 2.84Å; L1145-T1172 HydrophobicContact CD1-CG2 3.45Å; L1145-T1172 VanDerWaalsContact CD1-CG2 3.45Å; L1145-T1172 HydrophobicContact CD2-CG2 4.41Å; L1145-T1172 HydrophobicContact CG-CG2 4.11Å; L1145-L1176 HydrophobicContact CD2-CB 4.39Å; L1145-L1176 HydrophobicContact CD2-CD1 4.03Å; L1145-V1220 HydrophobicContact CB-CG1 4.12Å; L1145-V1220 HydrophobicContact CD2-CG1 3.73Å; L1145-V1220 HydrophobicContact CG-CG1 4.14Å
1146D86.5Confident84.9Confident30 Ų3047.3 Ų47.316%0.1623%0.234CC..Hα-helixtrans-58.3-41.6173-17451.1000112L1142 I1149 K1150 V1220 H1223L1142-D1146 PolarHBondContact O-N 3.01Å; D1146-I1149 PolarHBondContact O-N 3.5Å; D1146-K1150 VanDerWaalsContact O-CG 3.32Å; D1146-K1150 WeakPolarHBondContact O-CG 3.38Å; D1146-K1150 PolarHBondContact O-N 3.43Å; D1146-K1150 WeakPolarHBondContact OD1-CE 3.27Å; D1146-K1150 IonicContact OD1-NZ 2.9Å; D1146-K1150 PolarHBondContact OD1-NZ 3.32Å; D1146-K1150 VanDerWaalsContact OD2-CE 3.31Å; D1146-K1150 WeakPolarHBondContact OD2-CE 3.36Å; D1146-K1150 IonicContact OD2-NZ 3.56Å; D1146-K1150 PolarHBondContact OD2-NZ 3.18Å; D1146-V1220 HydrophobicContact CB-CG2 3.83Å; D1146-H1223 IonicContact OD1-CE1 3.94Å; D1146-H1223 IonicContact OD1-CG 2.87Å; D1146-H1223 IonicContact OD1-ND1 2.67Å; D1146-H1223 PolarHBondContact OD1-ND1 3.06Å
1147Q77.2Confident85Confident119 Ų11947 Ų4756%0.55623%0.231SC*.Hα-helixtrans-68.3-34.8176.8-169.7164.53.900112.5S1143 L1144 L1145 K1150 S1151S1143-Q1147 WeakPolarHBondContact O-CB 3.42Å; S1143-Q1147 PolarHBondContact O-N 2.93Å; S1143-Q1147 VanDerWaalsContact O-N 3.07Å; L1144-Q1147 PolarHBondContact O-N 3.42Å; L1145-Q1147 VanDerWaalsContact C-N 3.3Å; L1145-Q1147 PolarHBondContact O-N 3.08Å; Q1147-K1150 PolarHBondContact O-N 3.07Å; Q1147-S1151 PolarHBondContact O-N 3.3Å; Q1147-S1151 VanDerWaalsContact O-N 3.12Å
1148V79.8Confident85.3Confident56 Ų5643 Ų4334%0.33921%0.213SC..Hα-helixtrans-65.9-45.21711680000110.9L1144 L1145 K1150 S1151 Q1152L1144-V1148 WeakPolarHBondContact O-CG2 2.79Å; L1144-V1148 PolarHBondContact O-N 2.88Å; L1145-V1148 WeakPolarHBondContact O-CB 3.48Å; L1145-V1148 PolarHBondContact O-N 3.32Å; V1148-K1150 PolarHBondContact O-N 3.3Å; V1148-S1151 PolarHBondContact O-N 2.97Å; V1148-S1151 VanDerWaalsContact O-N 3.07Å; V1148-S1151 PolarHBondContact O-OG 3.4Å; V1148-Q1152 VanDerWaalsContact O-CG 3.29Å; V1148-Q1152 WeakPolarHBondContact O-CG 2.97Å; V1148-Q1152 PolarHBondContact O-N 3.29Å
1149I83.9Confident85.2Confident12 Ų1244.6 Ų44.66%0.06222%0.222CC..Hα-helixtrans-58.3-38.8176.3-64.4162.1000110.9L1145 D1146 V1220 H1223 L1224 R1227L1145-I1149 VanDerWaalsContact O-CG1 3.29Å; L1145-I1149 WeakPolarHBondContact O-CG1 3.29Å; L1145-I1149 PolarHBondContact O-N 2.84Å; D1146-I1149 PolarHBondContact O-N 3.5Å; I1149-V1220 HydrophobicContact CD1-CG1 3.94Å; I1149-H1223 HydrophobicContact CD1-CB 4.3Å; I1149-H1223 HydrophobicContact CG2-CB 4.31Å; I1149-L1224 HydrophobicContact CD1-CB 3.85Å; I1149-L1224 HydrophobicContact CD1-CD1 3.68Å; I1149-L1224 HydrophobicContact CD1-CG 4.36Å; I1149-L1224 HydrophobicContact CG1-CD1 3.64Å; I1149-R1227 HydrophobicContact CG2-CB 4.09Å; I1149-R1227 HydrophobicContact CG2-CG 4.42Å
1150K78.9Confident85.1Confident131 Ų13148.9 Ų48.957%0.5724%0.241SC*.Hα-helixtrans-73.6-19.6177.9-71.9166.7-179.3171.50114.5D1146 Q1147 V1148D1146-K1150 VanDerWaalsContact O-CG 3.32Å; D1146-K1150 WeakPolarHBondContact O-CG 3.38Å; D1146-K1150 PolarHBondContact O-N 3.43Å; D1146-K1150 WeakPolarHBondContact OD1-CE 3.27Å; D1146-K1150 IonicContact OD1-NZ 2.9Å; D1146-K1150 PolarHBondContact OD1-NZ 3.32Å; D1146-K1150 VanDerWaalsContact OD2-CE 3.31Å; D1146-K1150 WeakPolarHBondContact OD2-CE 3.36Å; D1146-K1150 IonicContact OD2-NZ 3.56Å; D1146-K1150 PolarHBondContact OD2-NZ 3.18Å; Q1147-K1150 PolarHBondContact O-N 3.07Å; V1148-K1150 PolarHBondContact O-N 3.3Å
1151S77.7Confident85.4Confident81 Ų8149.3 Ų49.357%0.56624%0.244SC*.Hα-helixtrans-92.7-16.3177.867.80000114.1Q1147 V1148 R1153Q1147-S1151 PolarHBondContact O-N 3.3Å; Q1147-S1151 VanDerWaalsContact O-N 3.12Å; V1148-S1151 PolarHBondContact O-N 2.97Å; V1148-S1151 VanDerWaalsContact O-N 3.07Å; V1148-S1151 PolarHBondContact O-OG 3.4Å; S1151-R1153 PolarHBondContact O-N 2.97Å
1152Q86.2Confident85.4Confident19 Ų1947.4 Ų47.49%0.08924%0.236CC..  trans-7061.9178.9-73.9173.15.200113.6V1148 M1165 R1227V1148-Q1152 VanDerWaalsContact O-CG 3.29Å; V1148-Q1152 WeakPolarHBondContact O-CG 2.97Å; V1148-Q1152 PolarHBondContact O-N 3.29Å; Q1152-M1165 HydrophobicContact CB-CE 4.02Å; Q1152-M1165 HydrophobicContact CB-CG 4.33Å; Q1152-M1165 HydrophobicContact CB-SD 3.59Å; Q1152-M1165 VanDerWaalsContact CB-SD 3.59Å; Q1152-M1165 HydrophobicContact CG-CE 4.14Å; Q1152-M1165 HydrophobicContact CG-SD 3.46Å; Q1152-M1165 WeakPolarHBondContact CG-SD 3.49Å; Q1152-R1227 PolarHBondContact O-NE 3.23Å; Q1152-R1227 PolarHBondContact O-NH2 3.38Å
1153R85.1Confident85.3Confident174 Ų17450.8 Ų50.866%0.65725%0.254SS*.  trans-81.7146.7168.9-56.5-173.3-157-155.68.6110.3S1151 D1310S1151-R1153 PolarHBondContact O-N 2.97Å; R1153-D1310 VanDerWaalsContact CA-OD1 3.23Å; R1153-D1310 WeakPolarHBondContact CA-OD1 3.34Å
1154V90.9Very high85.3Confident4 Ų452 Ų522%0.02426%0.255CS..  trans-125.5164.1178.4-64.80000110.6D1161 I1162 M1165 L1231 M1234 D1310 D1311V1154-D1161 VanDerWaalsContact CA-OD2 3.23Å; V1154-D1161 WeakPolarHBondContact CA-OD2 3.09Å; V1154-D1161 WeakPolarHBondContact CB-OD2 3.43Å; V1154-I1162 HydrophobicContact CB-CG1 4.35Å; V1154-I1162 HydrophobicContact CG2-CG1 4.03Å; V1154-M1165 HydrophobicContact CG1-CB 3.49Å; V1154-M1165 VanDerWaalsContact CG1-CB 3.49Å; V1154-M1165 HydrophobicContact CG1-CE 4.02Å; V1154-M1165 HydrophobicContact CG1-CG 3.69Å; V1154-L1231 HydrophobicContact CG1-CD2 3.99Å; V1154-L1231 HydrophobicContact CG2-CD2 3.68Å; V1154-M1234 HydrophobicContact CG2-CE 3.69Å; V1154-M1234 HydrophobicContact CG2-SD 3.45Å; V1154-M1234 WeakPolarHBondContact CG2-SD 3.36Å; V1154-D1310 PolarHBondContact N-OD1 2.93Å; V1154-D1310 WeakPolarHBondContact O-CB 3.45Å; V1154-D1311 PolarHBondContact O-N 3.43Å
1155M90.6Very high85.8Confident71 Ų7150.9 Ų50.935%0.3525%0.249SC..BIsolated β-bridgetrans-85.7112.9172.4-163.6175.7-57.700110.3G1157 D1158 D1161 D1311 K1314M1155-G1157 PolarHBondContact O-N 3.39Å; M1155-D1158 HydrophobicContact CB-CB 4.16Å; M1155-D1158 WeakPolarHBondContact O-CB 3.38Å; M1155-D1158 PolarHBondContact O-N 3.47Å; M1155-D1161 PolarHBondContact N-OD2 3.35Å; M1155-D1311 WeakPolarHBondContact CA-O 3.25Å; M1155-K1314 HydrophobicContact CG-CB 4.09Å; M1155-K1314 HydrophobicContact CG-CD 4.35Å; M1155-K1314 HydrophobicContact SD-CB 3.88Å; M1155-K1314 HydrophobicContact SD-CD 3.89Å; M1155-K1314 HydrophobicContact SD-CG 4.35Å
1156V89.6Confident85.9Confident0 Ų050.3 Ų50.30%025%0.246CC..THydrogen-bonded Turntrans-64.7130.8179.8-170.30000108.9M1234 L1303 Y1307 D1310 D1311 T1312 V1315V1156-M1234 HydrophobicContact CB-SD 4.45Å; V1156-M1234 HydrophobicContact CG1-CG 4.21Å; V1156-M1234 HydrophobicContact CG1-SD 4.41Å; V1156-M1234 HydrophobicContact CG2-CE 4.39Å; V1156-M1234 HydrophobicContact CG2-SD 3.97Å; V1156-L1303 HydrophobicContact CG1-CB 4.03Å; V1156-L1303 HydrophobicContact CG1-CD1 4.31Å; V1156-L1303 HydrophobicContact CG1-CD2 3.9Å; V1156-L1303 HydrophobicContact CG1-CG 4.32Å; V1156-Y1307 HydrophobicContact CG1-CD2 4.13Å; V1156-Y1307 HydrophobicContact CG1-CG 4.45Å; V1156-D1310 HydrophobicContact CG2-CB 3.66Å; V1156-D1311 PolarHBondContact N-O 2.97Å; V1156-T1312 HydrophobicContact CB-CG2 4.27Å; V1156-T1312 HydrophobicContact CG2-CG2 3.83Å; V1156-V1315 HydrophobicContact CB-CG2 4.39Å; V1156-V1315 HydrophobicContact CG1-CG2 4.2Å; V1156-V1315 WeakPolarHBondContact O-CG2 3.29Å
1157G86.4Confident85.9Confident0 Ų054.1 Ų54.10%027%0.265CS..THydrogen-bonded Turntrans84.710-170.600000115.2M1155 S1238 K1314M1155-G1157 PolarHBondContact O-N 3.39Å; G1157-S1238 PolarHBondContact N-OG 2.84Å; G1157-K1314 PolarHBondContact O-NZ 3.13Å
1158D89.1Confident86.2Confident26 Ų2652.1 Ų52.114%0.13925%0.254CS..  trans-110.6104.8167.7-156.8-76.3000110.8K946 M1155 E1160 D1161 I1162 K1314K946-D1158 IonicContact NZ-OD1 2.71Å; M1155-D1158 HydrophobicContact CB-CB 4.16Å; M1155-D1158 WeakPolarHBondContact O-CB 3.38Å; M1155-D1158 PolarHBondContact O-N 3.47Å; D1158-E1160 VanDerWaalsContact C-N 3.31Å; D1158-E1160 PolarHBondContact O-N 2.87Å; D1158-E1160 PolarHBondContact OD1-N 3.49Å; D1158-D1161 HydrophobicContact CB-CB 4.11Å; D1158-D1161 PolarHBondContact OD1-N 3.41Å; D1158-D1161 VanDerWaalsContact OD1-N 3.14Å; D1158-I1162 WeakPolarHBondContact O-CB 3.35Å; D1158-I1162 VanDerWaalsContact O-CD1 3.3Å; D1158-I1162 WeakPolarHBondContact O-CD1 3.48Å; D1158-I1162 WeakPolarHBondContact O-CG1 3.27Å; D1158-I1162 PolarHBondContact O-N 3.48Å; D1158-I1162 VanDerWaalsContact O-N 3.16Å; D1158-K1314 HydrophobicContact CB-CD 4.47Å; D1158-K1314 IonicContact OD2-NZ 3.92Å; D1158-K1314 PolarHBondContact OD2-NZ 3.06Å
1159L86.4Confident86.5Confident41 Ų4149.5 Ų49.522%0.21524%0.239CC..Hα-helixtrans-71.5-28.4-173.5-58.5-177000112N1163 L1235 T1239 L1242L1159-N1163 VanDerWaalsContact O-CB 3.27Å; L1159-N1163 WeakPolarHBondContact O-CB 3.27Å; L1159-N1163 PolarHBondContact O-N 3Å; L1159-N1163 VanDerWaalsContact O-N 3.11Å; L1159-N1163 PolarHBondContact O-ND2 3.44Å; L1159-L1235 HydrophobicContact CB-CD1 4.24Å; L1159-L1235 HydrophobicContact CD2-CD1 3.8Å; L1159-T1239 WeakPolarHBondContact CD2-OG1 3.4Å; L1159-L1242 HydrophobicContact CD1-CD1 3.76Å; L1159-L1242 HydrophobicContact CD2-CD1 3.99Å; L1159-L1242 HydrophobicContact CG-CD1 3.63Å
1160E84.7Confident86.4Confident103 Ų10353.1 Ų53.148%0.48125%0.254SS..Hα-helixtrans-70.3-52.3176.7-69.473.5-132.900110.9K946 D1158 I1162 N1163 E1164K946-E1160 IonicContact NZ-OE2 3.9Å; D1158-E1160 VanDerWaalsContact C-N 3.31Å; D1158-E1160 PolarHBondContact O-N 2.87Å; D1158-E1160 PolarHBondContact OD1-N 3.49Å; E1160-I1162 PolarHBondContact O-N 3.37Å; E1160-N1163 PolarHBondContact O-N 3Å; E1160-N1163 VanDerWaalsContact O-N 3.13Å; E1160-E1164 PolarHBondContact O-N 3.36Å
1161D87.2Confident86.7Confident25 Ų2549.1 Ų49.113%0.13425%0.245CC..Hα-helixtrans-58.6-46.1179178.321.2000111.8V1154 M1155 D1158 N1163 E1164 M1165V1154-D1161 VanDerWaalsContact CA-OD2 3.23Å; V1154-D1161 WeakPolarHBondContact CA-OD2 3.09Å; V1154-D1161 WeakPolarHBondContact CB-OD2 3.43Å; M1155-D1161 PolarHBondContact N-OD2 3.35Å; D1158-D1161 HydrophobicContact CB-CB 4.11Å; D1158-D1161 PolarHBondContact OD1-N 3.41Å; D1158-D1161 VanDerWaalsContact OD1-N 3.14Å; D1161-N1163 VanDerWaalsContact C-N 3.34Å; D1161-N1163 PolarHBondContact O-N 3.42Å; D1161-E1164 PolarHBondContact O-N 3.02Å; D1161-M1165 WeakPolarHBondContact O-CB 3.4Å; D1161-M1165 PolarHBondContact O-N 3.21Å
1162I91.9Very high87Confident0 Ų046 Ų460%022%0.223CC..Hα-helixtrans-60.5-42.5176.1-61.4164.2000111.2V1154 D1158 E1160 M1165 I1166 L1231 M1234 L1235V1154-I1162 HydrophobicContact CB-CG1 4.35Å; V1154-I1162 HydrophobicContact CG2-CG1 4.03Å; D1158-I1162 WeakPolarHBondContact O-CB 3.35Å; D1158-I1162 VanDerWaalsContact O-CD1 3.3Å; D1158-I1162 WeakPolarHBondContact O-CD1 3.48Å; D1158-I1162 WeakPolarHBondContact O-CG1 3.27Å; D1158-I1162 PolarHBondContact O-N 3.48Å; D1158-I1162 VanDerWaalsContact O-N 3.16Å; E1160-I1162 PolarHBondContact O-N 3.37Å; I1162-M1165 PolarHBondContact O-N 3Å; I1162-I1166 HydrophobicContact CG2-CD1 4.04Å; I1162-I1166 WeakPolarHBondContact O-CD1 3.42Å; I1162-I1166 VanDerWaalsContact O-CG1 3.25Å; I1162-I1166 WeakPolarHBondContact O-CG1 3.49Å; I1162-I1166 PolarHBondContact O-N 3.08Å; I1162-L1231 HydrophobicContact CG2-CB 4.49Å; I1162-L1231 HydrophobicContact CG2-CD2 4.36Å; I1162-L1231 WeakPolarHBondContact CG2-O 3.5Å; I1162-M1234 HydrophobicContact CD1-CG 3.91Å; I1162-M1234 HydrophobicContact CD1-SD 3.72Å; I1162-M1234 HydrophobicContact CG1-SD 3.85Å; I1162-L1235 HydrophobicContact CB-CD1 4.11Å; I1162-L1235 HydrophobicContact CG2-CB 3.72Å; I1162-L1235 HydrophobicContact CG2-CD1 3.95Å; I1162-L1235 HydrophobicContact CG2-CG 4.41Å
1163N88.2Confident87Confident71 Ų7148 Ų4838%0.3823%0.233SC..Hα-helixtrans-67.9-43.5177.8-87.4-59.4000112.7L1159 E1160 D1161 M1165 I1166 I1167 L1235L1159-N1163 VanDerWaalsContact O-CB 3.27Å; L1159-N1163 WeakPolarHBondContact O-CB 3.27Å; L1159-N1163 PolarHBondContact O-N 3Å; L1159-N1163 VanDerWaalsContact O-N 3.11Å; L1159-N1163 PolarHBondContact O-ND2 3.44Å; E1160-N1163 PolarHBondContact O-N 3Å; E1160-N1163 VanDerWaalsContact O-N 3.13Å; D1161-N1163 VanDerWaalsContact C-N 3.34Å; D1161-N1163 PolarHBondContact O-N 3.42Å; N1163-M1165 VanDerWaalsContact C-N 3.29Å; N1163-M1165 PolarHBondContact O-N 2.92Å; N1163-I1166 WeakPolarHBondContact O-CB 3.26Å; N1163-I1166 PolarHBondContact O-N 3.44Å; N1163-I1167 WeakPolarHBondContact O-CG1 3.44Å; N1163-I1167 PolarHBondContact O-N 3.19Å; N1163-L1235 WeakPolarHBondContact ND2-CD1 3.44Å; N1163-L1235 WeakPolarHBondContact OD1-CD2 3.24Å
1164E86.1Confident86.8Confident71 Ų7145.5 Ų45.533%0.33223%0.229SC..Hα-helixtrans-59.2-43.1174.5-80-163.1-152.100111E1160 D1161 I1166 I1167 K1168E1160-E1164 PolarHBondContact O-N 3.36Å; D1161-E1164 PolarHBondContact O-N 3.02Å; E1164-I1166 VanDerWaalsContact C-N 3.33Å; E1164-I1166 PolarHBondContact O-N 3.42Å; E1164-I1167 WeakPolarHBondContact O-CB 3.43Å; E1164-I1167 PolarHBondContact O-N 2.68Å; E1164-I1167 VanDerWaalsContact O-N 3.1Å; E1164-K1168 WeakPolarHBondContact O-CB 3.43Å; E1164-K1168 VanDerWaalsContact O-CG 3.26Å; E1164-K1168 WeakPolarHBondContact O-CG 3.43Å; E1164-K1168 PolarHBondContact O-N 2.86Å; E1164-K1168 IonicContact OE2-NZ 2.65Å; E1164-K1168 PolarHBondContact OE2-NZ 2.99Å
1165M90.8Very high86.3Confident19 Ų1949 Ų499%0.09425%0.247CC..Hα-helixtrans-65-36.5176.1-16558.470.300112.2Q1152 V1154 D1161 I1162 N1163 I1167 K1168 Q1169 L1231Q1152-M1165 HydrophobicContact CB-CE 4.02Å; Q1152-M1165 HydrophobicContact CB-CG 4.33Å; Q1152-M1165 HydrophobicContact CB-SD 3.59Å; Q1152-M1165 VanDerWaalsContact CB-SD 3.59Å; Q1152-M1165 HydrophobicContact CG-CE 4.14Å; Q1152-M1165 HydrophobicContact CG-SD 3.46Å; Q1152-M1165 WeakPolarHBondContact CG-SD 3.49Å; V1154-M1165 HydrophobicContact CG1-CB 3.49Å; V1154-M1165 VanDerWaalsContact CG1-CB 3.49Å; V1154-M1165 HydrophobicContact CG1-CE 4.02Å; V1154-M1165 HydrophobicContact CG1-CG 3.69Å; D1161-M1165 WeakPolarHBondContact O-CB 3.4Å; D1161-M1165 PolarHBondContact O-N 3.21Å; I1162-M1165 PolarHBondContact O-N 3Å; N1163-M1165 VanDerWaalsContact C-N 3.29Å; N1163-M1165 PolarHBondContact O-N 2.92Å; M1165-I1167 VanDerWaalsContact C-N 3.3Å; M1165-I1167 PolarHBondContact O-N 3.49Å; M1165-K1168 PolarHBondContact O-N 2.78Å; M1165-K1168 HydrophobicContact SD-CB 4.26Å; M1165-K1168 HydrophobicContact SD-CD 4.33Å; M1165-Q1169 WeakPolarHBondContact O-CB 3.42Å; M1165-Q1169 WeakPolarHBondContact O-CG 3.38Å; M1165-Q1169 PolarHBondContact O-N 2.84Å; M1165-L1231 HydrophobicContact CB-CD1 4.17Å; M1165-L1231 HydrophobicContact CB-CD2 4.34Å; M1165-L1231 HydrophobicContact CG-CD1 3.64Å; M1165-L1231 HydrophobicContact CG-CD2 4.21Å
1166I87.6Confident86.2Confident4 Ų445.8 Ų45.82%0.02123%0.231CC..Hα-helixtrans-63.3-35.2171.7-70163.6000111.5I1162 N1163 E1164 K1170 L1231 L1235I1162-I1166 HydrophobicContact CG2-CD1 4.04Å; I1162-I1166 WeakPolarHBondContact O-CD1 3.42Å; I1162-I1166 VanDerWaalsContact O-CG1 3.25Å; I1162-I1166 WeakPolarHBondContact O-CG1 3.49Å; I1162-I1166 PolarHBondContact O-N 3.08Å; N1163-I1166 WeakPolarHBondContact O-CB 3.26Å; N1163-I1166 PolarHBondContact O-N 3.44Å; E1164-I1166 VanDerWaalsContact C-N 3.33Å; E1164-I1166 PolarHBondContact O-N 3.42Å; I1166-K1170 HydrophobicContact CG2-CD 4.42Å; I1166-K1170 VanDerWaalsContact O-CG 3.29Å; I1166-K1170 WeakPolarHBondContact O-CG 3.32Å; I1166-K1170 PolarHBondContact O-N 3.49Å; I1166-L1231 HydrophobicContact CD1-CB 4.13Å; I1166-L1231 HydrophobicContact CG1-CB 3.64Å; I1166-L1231 HydrophobicContact CG1-CD1 4.41Å; I1166-L1235 HydrophobicContact CD1-CB 4.38Å; I1166-L1235 HydrophobicContact CD1-CD2 4.15Å
1167I85.4Confident86Confident109 Ų10950.6 Ų50.656%0.55925%0.254SS*.Hα-helixtrans-71.1-49.1175.1-66.2164.5000110.4N1163 E1164 M1165 Q1169 K1170 A1171N1163-I1167 WeakPolarHBondContact O-CG1 3.44Å; N1163-I1167 PolarHBondContact O-N 3.19Å; E1164-I1167 WeakPolarHBondContact O-CB 3.43Å; E1164-I1167 PolarHBondContact O-N 2.68Å; E1164-I1167 VanDerWaalsContact O-N 3.1Å; M1165-I1167 VanDerWaalsContact C-N 3.3Å; M1165-I1167 PolarHBondContact O-N 3.49Å; I1167-Q1169 VanDerWaalsContact C-N 3.32Å; I1167-Q1169 PolarHBondContact O-N 3.38Å; I1167-K1170 WeakPolarHBondContact O-CB 3.46Å; I1167-K1170 PolarHBondContact O-N 2.74Å; I1167-K1170 VanDerWaalsContact O-N 3.09Å; I1167-A1171 PolarHBondContact O-N 3.13Å
1168K84.1Confident85.9Confident77 Ų7757.2 Ų57.234%0.33529%0.285SS..Hα-helixtrans-52.7-49.8174.8-68.9161.1-175.3160.40109.5E942 E1164 M1165 K1170 A1171 T1172E942-K1168 IonicContact OE1-NZ 2.8Å; E942-K1168 PolarHBondContact OE1-NZ 3.06Å; E1164-K1168 WeakPolarHBondContact O-CB 3.43Å; E1164-K1168 VanDerWaalsContact O-CG 3.26Å; E1164-K1168 WeakPolarHBondContact O-CG 3.43Å; E1164-K1168 PolarHBondContact O-N 2.86Å; E1164-K1168 IonicContact OE2-NZ 2.65Å; E1164-K1168 PolarHBondContact OE2-NZ 2.99Å; M1165-K1168 PolarHBondContact O-N 2.78Å; M1165-K1168 HydrophobicContact SD-CB 4.26Å; M1165-K1168 HydrophobicContact SD-CD 4.33Å; K1168-K1170 PolarHBondContact O-N 2.78Å; K1168-A1171 WeakPolarHBondContact O-CB 3.45Å; K1168-A1171 PolarHBondContact O-N 2.94Å; K1168-T1172 PolarHBondContact O-N 3.33Å; K1168-T1172 PolarHBondContact O-OG1 3.13Å
1169Q85.9Confident85.8Confident1 Ų159.9 Ų59.91%0.00529%0.293CS..Hα-helixtrans-57.3-43.1173.1-89.8-85-13.100114.9M1165 I1167 A1171 T1172 M1173 L1224 L1231M1165-Q1169 WeakPolarHBondContact O-CB 3.42Å; M1165-Q1169 WeakPolarHBondContact O-CG 3.38Å; M1165-Q1169 PolarHBondContact O-N 2.84Å; I1167-Q1169 VanDerWaalsContact C-N 3.32Å; I1167-Q1169 PolarHBondContact O-N 3.38Å; Q1169-A1171 VanDerWaalsContact C-N 3.31Å; Q1169-A1171 PolarHBondContact O-N 3.02Å; Q1169-T1172 PolarHBondContact O-N 3.29Å; Q1169-M1173 WeakPolarHBondContact O-CB 3.44Å; Q1169-M1173 PolarHBondContact O-N 3.02Å; Q1169-L1224 PolarHBondContact OE1-O 2.94Å; Q1169-L1231 HydrophobicContact CG-CD1 3.99Å
1170K82.7Confident86Confident89 Ų8961 Ų6139%0.38729%0.294SS..Hα-helixtrans-62.7-38.1176.2-78.3167.7-175.6168.30111.8I1166 I1167 K1168 M1173 Q1174I1166-K1170 HydrophobicContact CG2-CD 4.42Å; I1166-K1170 VanDerWaalsContact O-CG 3.29Å; I1166-K1170 WeakPolarHBondContact O-CG 3.32Å; I1166-K1170 PolarHBondContact O-N 3.49Å; I1167-K1170 WeakPolarHBondContact O-CB 3.46Å; I1167-K1170 PolarHBondContact O-N 2.74Å; I1167-K1170 VanDerWaalsContact O-N 3.09Å; K1168-K1170 PolarHBondContact O-N 2.78Å; K1170-M1173 PolarHBondContact O-N 3.22Å; K1170-Q1174 PolarHBondContact O-N 3.04Å
1171A83.9Confident86.2Confident46 Ų4659.3 Ų59.338%0.3829%0.293SS..Hα-helixtrans-67-48.6174.900000111.1I1167 K1168 Q1169 M1173 Q1174 D1175I1167-A1171 PolarHBondContact O-N 3.13Å; K1168-A1171 WeakPolarHBondContact O-CB 3.45Å; K1168-A1171 PolarHBondContact O-N 2.94Å; Q1169-A1171 VanDerWaalsContact C-N 3.31Å; Q1169-A1171 PolarHBondContact O-N 3.02Å; A1171-M1173 PolarHBondContact O-N 3.22Å; A1171-M1173 VanDerWaalsContact O-N 3.13Å; A1171-Q1174 WeakPolarHBondContact O-CA 3.25Å; A1171-Q1174 WeakPolarHBondContact O-CB 3.41Å; A1171-Q1174 PolarHBondContact O-N 2.98Å; A1171-D1175 PolarHBondContact O-N 3.27Å
1172T84.4Confident86.1Confident17 Ų1762.3 Ų62.310%0.10431%0.306CS..Hα-helixtrans-53.6-36.7174.9-48.80000112.6L1145 K1168 Q1169 D1175 L1176 L1224L1145-T1172 HydrophobicContact CD1-CG2 3.45Å; L1145-T1172 VanDerWaalsContact CD1-CG2 3.45Å; L1145-T1172 HydrophobicContact CD2-CG2 4.41Å; L1145-T1172 HydrophobicContact CG-CG2 4.11Å; K1168-T1172 PolarHBondContact O-N 3.33Å; K1168-T1172 PolarHBondContact O-OG1 3.13Å; Q1169-T1172 PolarHBondContact O-N 3.29Å; T1172-D1175 PolarHBondContact O-N 3.13Å; T1172-L1176 PolarHBondContact O-N 3.22Å; T1172-L1224 HydrophobicContact CG2-CD1 3.71Å; T1172-L1224 HydrophobicContact CG2-CD2 4.43Å
1173M85.5Confident86Confident59 Ų5962.9 Ų62.929%0.29131%0.309SS..Hα-helixtrans-72.7-31.5176.7-164.9-171.17400113Q1169 K1170 A1171 E1177 L1224 R1228Q1169-M1173 WeakPolarHBondContact O-CB 3.44Å; Q1169-M1173 PolarHBondContact O-N 3.02Å; K1170-M1173 PolarHBondContact O-N 3.22Å; A1171-M1173 PolarHBondContact O-N 3.22Å; A1171-M1173 VanDerWaalsContact O-N 3.13Å; M1173-E1177 PolarHBondContact O-N 3.05Å; M1173-E1177 VanDerWaalsContact O-N 3.15Å; M1173-L1224 HydrophobicContact CB-CD2 3.68Å; M1173-L1224 HydrophobicContact CB-CG 4.48Å; M1173-L1224 HydrophobicContact CG-CD2 3.94Å; M1173-R1228 VanDerWaalsContact CE-NH1 3.33Å; M1173-R1228 PolarHBondContact SD-NH1 3.35Å
1174Q81Confident86.1Confident122 Ų12265.1 Ų65.157%0.5732%0.317SS*.Hα-helixtrans-70.8-37.6170.1-70.9-179.4-3.100111.7K1170 A1171 L1176 E1177 Q1178K1170-Q1174 PolarHBondContact O-N 3.04Å; A1171-Q1174 WeakPolarHBondContact O-CA 3.25Å; A1171-Q1174 WeakPolarHBondContact O-CB 3.41Å; A1171-Q1174 PolarHBondContact O-N 2.98Å; Q1174-L1176 VanDerWaalsContact C-N 3.34Å; Q1174-E1177 PolarHBondContact O-N 2.97Å; Q1174-Q1178 WeakPolarHBondContact O-CB 3.33Å; Q1174-Q1178 WeakPolarHBondContact O-CG 3.15Å; Q1174-Q1178 PolarHBondContact O-N 2.81Å
1175D81.2Confident86.1Confident79 Ų7968.5 Ų68.542%0.42233%0.333SS..Hα-helixtrans-64.5-39.2176.6-63.8-28.6000111.9A1171 T1172 Q1178 R1179A1171-D1175 PolarHBondContact O-N 3.27Å; T1172-D1175 PolarHBondContact O-N 3.13Å; D1175-Q1178 PolarHBondContact O-N 3.4Å; D1175-R1179 PolarHBondContact O-N 3.37Å
1176L87.4Confident85.9Confident2 Ų268 Ų681%0.0133%0.33CS..Hα-helixtrans-61.4-49.4170.8-173.564.1000111W1141 L1142 L1145 T1172 Q1174 Q1178 R1179 R1180 W1217 Q1221 L1224W1141-L1176 HydrophobicContact CH2-CB 4.3Å; W1141-L1176 HydrophobicContact CH2-CD1 3.7Å; W1141-L1176 HydrophobicContact CZ3-CD1 3.68Å; L1142-L1176 HydrophobicContact CD2-CD1 4.03Å; L1145-L1176 HydrophobicContact CD2-CB 4.39Å; L1145-L1176 HydrophobicContact CD2-CD1 4.03Å; T1172-L1176 PolarHBondContact O-N 3.22Å; Q1174-L1176 VanDerWaalsContact C-N 3.34Å; L1176-Q1178 VanDerWaalsContact C-N 3.32Å; L1176-Q1178 PolarHBondContact O-N 3.43Å; L1176-R1179 PolarHBondContact O-N 3.41Å; L1176-R1179 VanDerWaalsContact O-N 3.08Å; L1176-R1180 PolarHBondContact O-N 3.21Å; L1176-W1217 HydrophobicContact CD1-CD2 4.06Å; L1176-W1217 HydrophobicContact CD1-CE3 4.07Å; L1176-W1217 HydrophobicContact CD1-CH2 3.57Å; L1176-W1217 HydrophobicContact CD1-CZ2 3.55Å; L1176-W1217 HydrophobicContact CD1-CZ3 3.84Å; L1176-W1217 HydrophobicContact CG-CH2 4.14Å; L1176-W1217 HydrophobicContact CG-CZ2 3.74Å; L1176-W1217 WeakPolarHBondContact O-CH2 3.45Å; L1176-W1217 VanDerWaalsContact O-CZ2 3.25Å; L1176-W1217 WeakPolarHBondContact O-CZ2 3.43Å; L1176-Q1221 HydrophobicContact CD2-CB 3.88Å; L1176-Q1221 HydrophobicContact CD2-CG 3.89Å; L1176-L1224 HydrophobicContact CD2-CD2 4.11Å
1177E85.5Confident86Confident101 Ų10169.2 Ų69.247%0.47234%0.336SS..Hα-helixtrans-63.4-36.4179.2-162.359.6-152.200112.7M1173 Q1174 R1179 R1180M1173-E1177 PolarHBondContact O-N 3.05Å; M1173-E1177 VanDerWaalsContact O-N 3.15Å; Q1174-E1177 PolarHBondContact O-N 2.97Å; E1177-R1179 PolarHBondContact O-N 3.07Å; E1177-R1180 VanDerWaalsContact CD-NE 3.33Å; E1177-R1180 WeakPolarHBondContact O-CB 3.36Å; E1177-R1180 PolarHBondContact O-N 2.98Å; E1177-R1180 IonicContact OE1-CZ 3.21Å; E1177-R1180 IonicContact OE1-NE 3.26Å; E1177-R1180 PolarHBondContact OE1-NE 2.93Å; E1177-R1180 IonicContact OE1-NH2 2.68Å; E1177-R1180 IonicContact OE2-CZ 3.67Å; E1177-R1180 IonicContact OE2-NE 2.81Å; E1177-R1180 PolarHBondContact OE2-NE 3.21Å; E1177-R1180 IonicContact OE2-NH2 3.43Å; E1177-R1180 PolarHBondContact OE2-NH2 3.34Å
1178Q84.4Confident86Confident140 Ų14067.4 Ų67.465%0.65433%0.331SS*.Hα-helixtrans-63-24.8174.7-77.5-17845.400113.7Q1174 D1175 L1176 P1181Q1174-Q1178 WeakPolarHBondContact O-CB 3.33Å; Q1174-Q1178 WeakPolarHBondContact O-CG 3.15Å; Q1174-Q1178 PolarHBondContact O-N 2.81Å; D1175-Q1178 PolarHBondContact O-N 3.4Å; L1176-Q1178 VanDerWaalsContact C-N 3.32Å; L1176-Q1178 PolarHBondContact O-N 3.43Å; Q1178-P1181 WeakPolarHBondContact O-CD 3.35Å
1179R87.9Confident86.1Confident81 Ų8165.5 Ų65.531%0.30633%0.329SS..Hα-helixtrans-91.3-7.3176.7-72.9-175.8-179.7-100.515.3114.2W1141 D1175 L1176 E1177 P1181 Q1182 L1183 W1217W1141-R1179 VanDerWaalsContact CE2-NE 3.33Å; W1141-R1179 HydrophobicContact CZ3-CB 4.43Å; D1175-R1179 PolarHBondContact O-N 3.37Å; L1176-R1179 PolarHBondContact O-N 3.41Å; L1176-R1179 VanDerWaalsContact O-N 3.08Å; E1177-R1179 PolarHBondContact O-N 3.07Å; R1179-P1181 VanDerWaalsContact C-N 3.29Å; R1179-Q1182 VanDerWaalsContact O-CB 3.32Å; R1179-Q1182 WeakPolarHBondContact O-CB 3.31Å; R1179-Q1182 PolarHBondContact O-N 2.97Å; R1179-L1183 PolarHBondContact O-N 2.86Å; R1179-W1217 HydrophobicContact CB-CH2 3.92Å; R1179-W1217 HydrophobicContact CB-CZ3 4.2Å
1180R89.7Confident86.1Confident64 Ų6465.6 Ų65.624%0.24233%0.33CS..Hα-helixtrans-51.1-40.1176.9-172.5179.9-60.6-72.2-4.8113.3L1176 E1177 Q1182 L1183 E1184 W1217L1176-R1180 PolarHBondContact O-N 3.21Å; E1177-R1180 VanDerWaalsContact CD-NE 3.33Å; E1177-R1180 WeakPolarHBondContact O-CB 3.36Å; E1177-R1180 PolarHBondContact O-N 2.98Å; E1177-R1180 IonicContact OE1-CZ 3.21Å; E1177-R1180 IonicContact OE1-NE 3.26Å; E1177-R1180 PolarHBondContact OE1-NE 2.93Å; E1177-R1180 IonicContact OE1-NH2 2.68Å; E1177-R1180 IonicContact OE2-CZ 3.67Å; E1177-R1180 IonicContact OE2-NE 2.81Å; E1177-R1180 PolarHBondContact OE2-NE 3.21Å; E1177-R1180 IonicContact OE2-NH2 3.43Å; E1177-R1180 PolarHBondContact OE2-NH2 3.34Å; R1180-Q1182 VanDerWaalsContact C-N 3.27Å; R1180-Q1182 PolarHBondContact O-N 3.38Å; R1180-L1183 WeakPolarHBondContact O-CB 3.31Å; R1180-L1183 PolarHBondContact O-N 3.03Å; R1180-L1183 VanDerWaalsContact O-N 3.14Å; R1180-E1184 PolarHBondContact O-N 2.68Å; R1180-E1184 VanDerWaalsContact O-N 3.1Å; R1180-W1217 HydrophobicContact CB-CH2 4.34Å; R1180-W1217 HydrophobicContact CB-CZ2 4.05Å
1181P88.5Confident86.2Confident69 Ų6966.6 Ų66.645%0.44834%0.336SS..Hα-helixtrans-59.8-33175.2-25.336.1000114Q1178 R1179 L1183 E1184 E1185Q1178-P1181 WeakPolarHBondContact O-CD 3.35Å; R1179-P1181 VanDerWaalsContact C-N 3.29Å; P1181-L1183 VanDerWaalsContact C-N 3.34Å; P1181-E1184 PolarHBondContact O-N 2.67Å; P1181-E1185 WeakPolarHBondContact O-CB 3.47Å; P1181-E1185 WeakPolarHBondContact O-CG 3.38Å; P1181-E1185 PolarHBondContact O-N 2.9Å
1182Q85.3Confident86.1Confident88 Ų8868.4 Ų68.441%0.41134%0.34SS..Hα-helixtrans-67.3-36.9178-59.8176.2-7.800111R1179 R1180 L1186R1179-Q1182 VanDerWaalsContact O-CB 3.32Å; R1179-Q1182 WeakPolarHBondContact O-CB 3.31Å; R1179-Q1182 PolarHBondContact O-N 2.97Å; R1180-Q1182 VanDerWaalsContact C-N 3.27Å; R1180-Q1182 PolarHBondContact O-N 3.38Å; Q1182-L1186 WeakPolarHBondContact O-CB 3.45Å; Q1182-L1186 PolarHBondContact O-N 3.16Å
1183L90.6Very high86.1Confident12 Ų1268.1 Ų68.16%0.06334%0.337CS..Hα-helixtrans-66.2-43.6173-178.462.4000111.4L1138 R1179 R1180 P1181 L1186 I1187 I1213 Q1214 W1217L1138-L1183 HydrophobicContact CD2-CB 3.97Å; L1138-L1183 HydrophobicContact CD2-CD1 4.04Å; R1179-L1183 PolarHBondContact O-N 2.86Å; R1180-L1183 WeakPolarHBondContact O-CB 3.31Å; R1180-L1183 PolarHBondContact O-N 3.03Å; R1180-L1183 VanDerWaalsContact O-N 3.14Å; P1181-L1183 VanDerWaalsContact C-N 3.34Å; L1183-L1186 WeakPolarHBondContact O-CB 3.25Å; L1183-L1186 PolarHBondContact O-N 3.41Å; L1183-I1187 HydrophobicContact CD1-CD1 4.25Å; L1183-I1187 HydrophobicContact CD1-CG1 4.5Å; L1183-I1187 HydrophobicContact CG-CD1 3.92Å; L1183-I1187 WeakPolarHBondContact O-CD1 3.45Å; L1183-I1187 VanDerWaalsContact O-CG1 3.27Å; L1183-I1187 WeakPolarHBondContact O-CG1 3.29Å; L1183-I1187 PolarHBondContact O-N 3.03Å; L1183-I1213 HydrophobicContact CD1-CG1 4.47Å; L1183-I1213 HydrophobicContact CD1-CG2 3.99Å; L1183-Q1214 HydrophobicContact CD1-CG 4.48Å; L1183-W1217 HydrophobicContact CB-CE3 4.37Å; L1183-W1217 HydrophobicContact CB-CZ3 4.42Å; L1183-W1217 HydrophobicContact CD2-CB 4.01Å; L1183-W1217 HydrophobicContact CD2-CD2 3.65Å; L1183-W1217 HydrophobicContact CD2-CE3 3.85Å; L1183-W1217 HydrophobicContact CD2-CG 3.7Å
1184E90.2Very high85.9Confident117 Ų11768.5 Ų68.555%0.54734%0.337SS..Hα-helixtrans-65.2-40.7177.9-69-173.9-173.500112.8R1180 P1181 L1186 I1187 T1188R1180-E1184 PolarHBondContact O-N 2.68Å; R1180-E1184 VanDerWaalsContact O-N 3.1Å; P1181-E1184 PolarHBondContact O-N 2.67Å; E1184-L1186 VanDerWaalsContact C-N 3.33Å; E1184-L1186 PolarHBondContact O-N 2.99Å; E1184-I1187 PolarHBondContact O-N 3.38Å; E1184-T1188 WeakPolarHBondContact O-CB 3.41Å; E1184-T1188 PolarHBondContact O-N 2.73Å; E1184-T1188 PolarHBondContact O-OG1 2.7Å
1185E85.3Confident86Confident142 Ų14268.4 Ų68.466%0.66434%0.341SS*.Hα-helixtrans-60-42.9170.9-77.5-177-179.100111.3P1181 T1188 A1189P1181-E1185 WeakPolarHBondContact O-CB 3.47Å; P1181-E1185 WeakPolarHBondContact O-CG 3.38Å; P1181-E1185 PolarHBondContact O-N 2.9Å; E1185-T1188 PolarHBondContact O-N 3.33Å; E1185-A1189 WeakPolarHBondContact O-CB 3.33Å; E1185-A1189 PolarHBondContact O-N 2.85Å
1186L88.4Confident85.9Confident9 Ų973 Ų735%0.04736%0.357CS..Hα-helixtrans-64.6-44.3178.9-157.590.4000112.4F1131 A1134 W1135 Q1182 L1183 E1184 T1188 A1189 A1190 I1210 I1213F1131-L1186 HydrophobicContact CD2-CD1 4.25Å; F1131-L1186 HydrophobicContact CD2-CG 4.14Å; F1131-L1186 HydrophobicContact CE2-CD1 4.37Å; F1131-L1186 HydrophobicContact CE2-CD2 4.13Å; F1131-L1186 HydrophobicContact CE2-CG 3.84Å; A1134-L1186 HydrophobicContact CB-CD1 3.48Å; A1134-L1186 VanDerWaalsContact CB-CD1 3.48Å; W1135-L1186 HydrophobicContact CB-CD1 4.33Å; W1135-L1186 HydrophobicContact CB-CD2 3.95Å; W1135-L1186 HydrophobicContact CG-CD2 4.34Å; Q1182-L1186 WeakPolarHBondContact O-CB 3.45Å; Q1182-L1186 PolarHBondContact O-N 3.16Å; L1183-L1186 WeakPolarHBondContact O-CB 3.25Å; L1183-L1186 PolarHBondContact O-N 3.41Å; E1184-L1186 VanDerWaalsContact C-N 3.33Å; E1184-L1186 PolarHBondContact O-N 2.99Å; L1186-T1188 VanDerWaalsContact C-N 3.32Å; L1186-T1188 PolarHBondContact O-N 2.88Å; L1186-A1189 PolarHBondContact O-N 3.3Å; L1186-A1190 WeakPolarHBondContact O-CB 3.37Å; L1186-A1190 PolarHBondContact O-N 3.22Å; L1186-I1210 HydrophobicContact CD2-CD1 3.88Å; L1186-I1210 HydrophobicContact CG-CD1 4.3Å; L1186-I1213 HydrophobicContact CD2-CD1 4.13Å; L1186-I1213 HydrophobicContact CD2-CG2 4.15Å
1187I87.8Confident85.4Confident29 Ų2973.3 Ų73.315%0.14936%0.359CS..Hα-helixtrans-60.5-43.8174.5-69.1162000110.2L1183 E1184 A1190 Q1191 I1210 Q1214L1183-I1187 HydrophobicContact CD1-CD1 4.25Å; L1183-I1187 HydrophobicContact CD1-CG1 4.5Å; L1183-I1187 HydrophobicContact CG-CD1 3.92Å; L1183-I1187 WeakPolarHBondContact O-CD1 3.45Å; L1183-I1187 VanDerWaalsContact O-CG1 3.27Å; L1183-I1187 WeakPolarHBondContact O-CG1 3.29Å; L1183-I1187 PolarHBondContact O-N 3.03Å; E1184-I1187 PolarHBondContact O-N 3.38Å; I1187-A1190 WeakPolarHBondContact O-CB 3.48Å; I1187-A1190 PolarHBondContact O-N 3.14Å; I1187-Q1191 VanDerWaalsContact O-CG 3.26Å; I1187-Q1191 WeakPolarHBondContact O-CG 3.47Å; I1187-Q1191 PolarHBondContact O-N 3.36Å; I1187-I1210 HydrophobicContact CG1-CD1 4.19Å; I1187-I1210 HydrophobicContact CG1-CG2 4.25Å; I1187-Q1214 HydrophobicContact CD1-CG 4.09Å; I1187-Q1214 HydrophobicContact CG1-CG 4.49Å
1188T87Confident85Confident72 Ų7274.1 Ų74.144%0.44238%0.376SS..Hα-helixtrans-65.3-41.9178-58.10000111.5E1184 E1185 L1186 Q1191 N1192E1184-T1188 WeakPolarHBondContact O-CB 3.41Å; E1184-T1188 PolarHBondContact O-N 2.73Å; E1184-T1188 PolarHBondContact O-OG1 2.7Å; E1185-T1188 PolarHBondContact O-N 3.33Å; L1186-T1188 VanDerWaalsContact C-N 3.32Å; L1186-T1188 PolarHBondContact O-N 2.88Å; T1188-Q1191 PolarHBondContact O-N 3.39Å; T1188-N1192 WeakPolarHBondContact O-CB 3.43Å; T1188-N1192 PolarHBondContact O-N 2.92Å; T1188-N1192 PolarHBondContact O-ND2 3.24Å
1189A85.1Confident84.7Confident37 Ų3769.5 Ų69.531%0.30636%0.356SS..Hα-helixtrans-62.7-44.2174.800000111.7F1131 E1185 L1186 N1192 L1193F1131-A1189 HydrophobicContact CD2-CB 4.42Å; E1185-A1189 WeakPolarHBondContact O-CB 3.33Å; E1185-A1189 PolarHBondContact O-N 2.85Å; L1186-A1189 PolarHBondContact O-N 3.3Å; A1189-N1192 PolarHBondContact O-N 3.41Å; A1189-L1193 WeakPolarHBondContact O-CB 3.41Å; A1189-L1193 WeakPolarHBondContact O-CG 3.46Å; A1189-L1193 PolarHBondContact O-N 3.41Å
1190A86.6Confident84.3Confident3 Ų371.9 Ų71.93%0.02537%0.37CS..Hα-helixtrans-60.6-44.1175.500000113.2F1131 L1186 I1187 L1193 K1194 I1206 I1210F1131-A1190 HydrophobicContact CD2-CB 4.28Å; F1131-A1190 HydrophobicContact CE2-CB 3.6Å; F1131-A1190 HydrophobicContact CZ-CB 3.99Å; L1186-A1190 WeakPolarHBondContact O-CB 3.37Å; L1186-A1190 PolarHBondContact O-N 3.22Å; I1187-A1190 WeakPolarHBondContact O-CB 3.48Å; I1187-A1190 PolarHBondContact O-N 3.14Å; A1190-L1193 PolarHBondContact O-N 3Å; A1190-K1194 WeakPolarHBondContact O-CB 3.33Å; A1190-K1194 PolarHBondContact O-N 3.01Å; A1190-I1206 HydrophobicContact CB-CG2 3.55Å; A1190-I1210 HydrophobicContact CB-CD1 3.7Å; A1190-I1210 HydrophobicContact CB-CG1 3.32Å
1191Q84.3Confident83.6Confident109 Ų10974.4 Ų74.451%0.50939%0.385SS..Hα-helixtrans-62.7-44176.3-71.1169.16.400111I1187 T1188 L1193 K1194 N1195I1187-Q1191 VanDerWaalsContact O-CG 3.26Å; I1187-Q1191 WeakPolarHBondContact O-CG 3.47Å; I1187-Q1191 PolarHBondContact O-N 3.36Å; T1188-Q1191 PolarHBondContact O-N 3.39Å; Q1191-L1193 PolarHBondContact O-N 3.43Å; Q1191-K1194 PolarHBondContact O-N 3.18Å; Q1191-N1195 WeakPolarHBondContact O-CB 3.43Å; Q1191-N1195 PolarHBondContact O-N 3.09Å; Q1191-N1195 PolarHBondContact O-ND2 3.48Å
1192N82.9Confident83.1Confident84 Ų8471.3 Ų71.345%0.44937%0.365SS..Hα-helixtrans-63-39.2174.9-77.3-45000113T1188 A1189 N1195 K1196T1188-N1192 WeakPolarHBondContact O-CB 3.43Å; T1188-N1192 PolarHBondContact O-N 2.92Å; T1188-N1192 PolarHBondContact O-ND2 3.24Å; A1189-N1192 PolarHBondContact O-N 3.41Å; N1192-N1195 PolarHBondContact O-N 2.84Å; N1192-K1196 WeakPolarHBondContact O-CG 3.34Å; N1192-K1196 PolarHBondContact O-N 2.72Å; N1192-K1196 VanDerWaalsContact O-N 3.14Å
1193L83.7Confident82.9Confident11 Ų1170.8 Ų70.86%0.05836%0.359CS..Hα-helixtrans-68-46175.2-76.1167.9000112V1125 A1127 L1128 F1131 A1189 A1190 Q1191 N1195 K1196 T1197 I1206V1125-L1193 HydrophobicContact CG1-CD2 3.82Å; A1127-L1193 HydrophobicContact CB-CD2 3.8Å; L1128-L1193 HydrophobicContact CD1-CD1 4.18Å; F1131-L1193 HydrophobicContact CB-CD1 3.33Å; F1131-L1193 HydrophobicContact CD1-CD1 4.18Å; F1131-L1193 HydrophobicContact CD2-CD1 4.29Å; F1131-L1193 HydrophobicContact CG-CD1 3.67Å; A1189-L1193 WeakPolarHBondContact O-CB 3.41Å; A1189-L1193 WeakPolarHBondContact O-CG 3.46Å; A1189-L1193 PolarHBondContact O-N 3.41Å; A1190-L1193 PolarHBondContact O-N 3Å; Q1191-L1193 PolarHBondContact O-N 3.43Å; L1193-N1195 PolarHBondContact O-N 2.96Å; L1193-K1196 PolarHBondContact O-N 3.5Å; L1193-K1196 VanDerWaalsContact O-N 3.07Å; L1193-T1197 WeakPolarHBondContact O-CG2 3.35Å; L1193-T1197 PolarHBondContact O-N 2.92Å; L1193-I1206 HydrophobicContact CB-CD1 3.94Å
1194K81.8Confident82.4Confident67 Ų6773.8 Ų73.829%0.29138%0.378SS..Hα-helixtrans-54.1-41.9171.5-85.9172.971.7169.10110.8A1190 Q1191 K1196 R1203 I1206 T1207A1190-K1194 WeakPolarHBondContact O-CB 3.33Å; A1190-K1194 PolarHBondContact O-N 3.01Å; Q1191-K1194 PolarHBondContact O-N 3.18Å; K1194-K1196 VanDerWaalsContact C-N 3.34Å; K1194-K1196 PolarHBondContact O-N 3.49Å; K1194-R1203 HydrophobicContact CG-CB 4.4Å; K1194-R1203 HydrophobicContact CG-CG 4.49Å; K1194-R1203 PolarHBondContact O-NE 3.23Å; K1194-R1203 PolarHBondContact O-NH1 2.96Å; K1194-R1203 PolarHBondContact O-NH2 3.42Å; K1194-R1203 VanDerWaalsContact O-NH2 3.08Å; K1194-I1206 HydrophobicContact CD-CG2 4.1Å; K1194-I1206 HydrophobicContact CG-CB 4.2Å; K1194-I1206 HydrophobicContact CG-CD1 4.39Å; K1194-I1206 HydrophobicContact CG-CG2 3.93Å; K1194-T1207 WeakPolarHBondContact CD-OG1 3.37Å; K1194-T1207 VanDerWaalsContact CE-OG1 3.27Å; K1194-T1207 WeakPolarHBondContact CE-OG1 3.33Å; K1194-T1207 PolarHBondContact NZ-OG1 3.29Å
1195N82Confident81.9Confident121 Ų12169.7 Ų69.765%0.64736%0.36SS*.Hα-helixtrans-69-28.8179.4-70.3-20.8000113.7Q1191 N1192 L1193Q1191-N1195 WeakPolarHBondContact O-CB 3.43Å; Q1191-N1195 PolarHBondContact O-N 3.09Å; Q1191-N1195 PolarHBondContact O-ND2 3.48Å; N1192-N1195 PolarHBondContact O-N 2.84Å; L1193-N1195 PolarHBondContact O-N 2.96Å
1196K78.8Confident81.9Confident174 Ų17463 Ų6376%0.75733%0.329SS*.Hα-helixtrans-88-31.8-178.8-73.2176.4-179.9178.10114.7N1192 L1193 K1194N1192-K1196 WeakPolarHBondContact O-CG 3.34Å; N1192-K1196 PolarHBondContact O-N 2.72Å; N1192-K1196 VanDerWaalsContact O-N 3.14Å; L1193-K1196 PolarHBondContact O-N 3.5Å; L1193-K1196 VanDerWaalsContact O-N 3.07Å; K1194-K1196 VanDerWaalsContact C-N 3.34Å; K1194-K1196 PolarHBondContact O-N 3.49Å
1197T78Confident81.8Confident9 Ų964.3 Ų64.36%0.05534%0.337CS..  trans-89128.6-175.6-171.30000113.1L1193 N1199 A1202 R1203 I1206L1193-T1197 WeakPolarHBondContact O-CG2 3.35Å; L1193-T1197 PolarHBondContact O-N 2.92Å; T1197-N1199 VanDerWaalsContact C-N 3.31Å; T1197-N1199 PolarHBondContact OG1-N 2.67Å; T1197-A1202 HydrophobicContact CG2-CB 4.05Å; T1197-R1203 HydrophobicContact CG2-CG 3.68Å; T1197-R1203 PolarHBondContact O-NH1 3.07Å; T1197-I1206 HydrophobicContact CG2-CD1 4.4Å
1198S77Confident81.5Confident118 Ų11866 Ų6683%0.82535%0.346SS*.  trans-80.4-11.4170.849.70000113.3Q1200S1198-Q1200 PolarHBondContact O-N 2.94Å
1199N77.4Confident81.5Confident43 Ų4363.6 Ų63.623%0.2333%0.329CS..  trans-78.5113.9-176-169.4-38.2000110.6L1121 E1124 T1197 E1201 A1202 R1203L1121-N1199 WeakPolarHBondContact CD2-ND2 3.35Å; E1124-N1199 PolarHBondContact OE2-ND2 2.72Å; T1197-N1199 VanDerWaalsContact C-N 3.31Å; T1197-N1199 PolarHBondContact OG1-N 2.67Å; N1199-E1201 VanDerWaalsContact C-N 3.32Å; N1199-E1201 PolarHBondContact O-N 3.43Å; N1199-E1201 WeakPolarHBondContact OD1-CB 2.94Å; N1199-E1201 PolarHBondContact OD1-N 3.06Å; N1199-E1201 VanDerWaalsContact OD1-N 3.15Å; N1199-A1202 HydrophobicContact CB-CB 4.09Å; N1199-A1202 WeakPolarHBondContact O-CB 3.4Å; N1199-A1202 PolarHBondContact O-N 3.45Å; N1199-R1203 WeakPolarHBondContact O-CG 3.33Å; N1199-R1203 PolarHBondContact O-N 2.84Å; N1199-R1203 VanDerWaalsContact O-N 3.16Å
1200Q81.1Confident81.7Confident132 Ų13262.7 Ų62.762%0.61732%0.319SS*.Hα-helixtrans-63.7-36.5-175.2-177.361.219.800112.5S1198 R1203 T1204S1198-Q1200 PolarHBondContact O-N 2.94Å; Q1200-R1203 PolarHBondContact O-N 3.37Å; Q1200-T1204 PolarHBondContact O-N 3.28Å; Q1200-T1204 PolarHBondContact O-OG1 3.27Å
1201E74.6Confident81.8Confident116 Ų11667.7 Ų67.754%0.54234%0.342SS..Hα-helixtrans-63.5-45.6179.6-170.9174.1-160.400110.6L1121 N1199 R1203 T1204 I1205L1121-E1201 HydrophobicContact CD1-CG 4.25Å; N1199-E1201 VanDerWaalsContact C-N 3.32Å; N1199-E1201 PolarHBondContact O-N 3.43Å; N1199-E1201 WeakPolarHBondContact OD1-CB 2.94Å; N1199-E1201 PolarHBondContact OD1-N 3.06Å; N1199-E1201 VanDerWaalsContact OD1-N 3.15Å; E1201-R1203 VanDerWaalsContact C-N 3.32Å; E1201-R1203 PolarHBondContact O-N 3.33Å; E1201-T1204 WeakPolarHBondContact CA-OG1 3.44Å; E1201-T1204 PolarHBondContact O-N 3.43Å; E1201-T1204 PolarHBondContact O-OG1 3.31Å; E1201-I1205 HydrophobicContact CG-CD1 3.95Å; E1201-I1205 WeakPolarHBondContact O-CD1 3.38Å; E1201-I1205 WeakPolarHBondContact O-CG1 3.49Å; E1201-I1205 PolarHBondContact O-N 3.24Å
1202A77Confident81.9Confident4 Ų468.9 Ų68.93%0.03334%0.342CS..Hα-helixtrans-56.9-44172.300000112L1121 T1197 N1199 T1204 I1205 I1206L1121-A1202 HydrophobicContact CD2-CB 4.14Å; T1197-A1202 HydrophobicContact CG2-CB 4.05Å; N1199-A1202 HydrophobicContact CB-CB 4.09Å; N1199-A1202 WeakPolarHBondContact O-CB 3.4Å; N1199-A1202 PolarHBondContact O-N 3.45Å; A1202-T1204 VanDerWaalsContact C-N 3.33Å; A1202-T1204 PolarHBondContact O-N 2.99Å; A1202-I1205 PolarHBondContact O-N 3.48Å; A1202-I1206 WeakPolarHBondContact O-CB 3.41Å; A1202-I1206 VanDerWaalsContact O-CD1 3.32Å; A1202-I1206 WeakPolarHBondContact O-CD1 3.44Å; A1202-I1206 WeakPolarHBondContact O-CG1 3.36Å; A1202-I1206 PolarHBondContact O-N 3.06Å
1203R82Confident82.3Confident77 Ų7764.9 Ų64.929%0.29132%0.32SS..Hα-helixtrans-62.7-39.1178.6-63.5173.690.9112.80.9111.7K1194 T1197 N1199 Q1200 E1201 T1207K1194-R1203 HydrophobicContact CG-CB 4.4Å; K1194-R1203 HydrophobicContact CG-CG 4.49Å; K1194-R1203 PolarHBondContact O-NE 3.23Å; K1194-R1203 PolarHBondContact O-NH1 2.96Å; K1194-R1203 PolarHBondContact O-NH2 3.42Å; K1194-R1203 VanDerWaalsContact O-NH2 3.08Å; T1197-R1203 HydrophobicContact CG2-CG 3.68Å; T1197-R1203 PolarHBondContact O-NH1 3.07Å; N1199-R1203 WeakPolarHBondContact O-CG 3.33Å; N1199-R1203 PolarHBondContact O-N 2.84Å; N1199-R1203 VanDerWaalsContact O-N 3.16Å; Q1200-R1203 PolarHBondContact O-N 3.37Å; E1201-R1203 VanDerWaalsContact C-N 3.32Å; E1201-R1203 PolarHBondContact O-N 3.33Å; R1203-T1207 WeakPolarHBondContact O-CB 3.42Å; R1203-T1207 PolarHBondContact O-N 3.17Å; R1203-T1207 PolarHBondContact O-OG1 3.23Å
1204T78.9Confident82.6Confident75 Ų7567.7 Ų67.746%0.4633%0.333SS..Hα-helixtrans-65.1-49.1173.226.70000112.1Q1200 E1201 A1202 I1206 T1207 D1208Q1200-T1204 PolarHBondContact O-N 3.28Å; Q1200-T1204 PolarHBondContact O-OG1 3.27Å; E1201-T1204 WeakPolarHBondContact CA-OG1 3.44Å; E1201-T1204 PolarHBondContact O-N 3.43Å; E1201-T1204 PolarHBondContact O-OG1 3.31Å; A1202-T1204 VanDerWaalsContact C-N 3.33Å; A1202-T1204 PolarHBondContact O-N 2.99Å; T1204-I1206 PolarHBondContact O-N 2.91Å; T1204-T1207 WeakPolarHBondContact O-CB 3.2Å; T1204-T1207 PolarHBondContact O-N 2.9Å; T1204-T1207 VanDerWaalsContact O-N 3.09Å; T1204-D1208 WeakPolarHBondContact O-CB 3.46Å; T1204-D1208 PolarHBondContact O-N 3.22Å
1205I81Confident82.9Confident32 Ų3268.9 Ų68.916%0.16434%0.343CS..Hα-helixtrans-58.8-44.6179.6-68.7154000111.8M1117 L1121 E1201 A1202 T1207 R1209M1117-I1205 HydrophobicContact CE-CD1 3.79Å; M1117-I1205 HydrophobicContact CG-CG2 4.44Å; M1117-I1205 HydrophobicContact SD-CD1 3.65Å; M1117-I1205 HydrophobicContact SD-CG1 4.2Å; M1117-I1205 HydrophobicContact SD-CG2 3.76Å; L1121-I1205 HydrophobicContact CD1-CD1 3.87Å; E1201-I1205 HydrophobicContact CG-CD1 3.95Å; E1201-I1205 WeakPolarHBondContact O-CD1 3.38Å; E1201-I1205 WeakPolarHBondContact O-CG1 3.49Å; E1201-I1205 PolarHBondContact O-N 3.24Å; A1202-I1205 PolarHBondContact O-N 3.48Å; I1205-T1207 VanDerWaalsContact C-N 3.3Å; I1205-T1207 PolarHBondContact O-N 2.98Å; I1205-R1209 HydrophobicContact CG2-CG 4.48Å; I1205-R1209 WeakPolarHBondContact O-CB 3.46Å; I1205-R1209 WeakPolarHBondContact O-CG 3.22Å; I1205-R1209 PolarHBondContact O-N 3.33Å
1206I84.7Confident83.3Confident2 Ų265.8 Ų65.81%0.0132%0.324CS..Hα-helixtrans-62.6-39.5177.3-65.5159.4000111L1128 F1131 A1190 L1193 K1194 T1197 A1202 T1204 I1210L1128-I1206 HydrophobicContact CD1-CD1 3.74Å; L1128-I1206 HydrophobicContact CD1-CG1 3.57Å; F1131-I1206 HydrophobicContact CE1-CG1 4.33Å; F1131-I1206 HydrophobicContact CE1-CG2 4.24Å; F1131-I1206 HydrophobicContact CZ-CG2 4.19Å; A1190-I1206 HydrophobicContact CB-CG2 3.55Å; L1193-I1206 HydrophobicContact CB-CD1 3.94Å; K1194-I1206 HydrophobicContact CD-CG2 4.1Å; K1194-I1206 HydrophobicContact CG-CB 4.2Å; K1194-I1206 HydrophobicContact CG-CD1 4.39Å; K1194-I1206 HydrophobicContact CG-CG2 3.93Å; T1197-I1206 HydrophobicContact CG2-CD1 4.4Å; A1202-I1206 WeakPolarHBondContact O-CB 3.41Å; A1202-I1206 VanDerWaalsContact O-CD1 3.32Å; A1202-I1206 WeakPolarHBondContact O-CD1 3.44Å; A1202-I1206 WeakPolarHBondContact O-CG1 3.36Å; A1202-I1206 PolarHBondContact O-N 3.06Å; T1204-I1206 PolarHBondContact O-N 2.91Å; I1206-I1210 WeakPolarHBondContact O-CG1 3.46Å; I1206-I1210 PolarHBondContact O-N 3.49Å; I1206-I1210 VanDerWaalsContact O-N 3.14Å
1207T86.1Confident84Confident36 Ų3657.6 Ų57.622%0.22129%0.289CS..Hα-helixtrans-67.2-51.3179.5-51.70000110.9K1194 R1203 T1204 I1205 R1209 I1210 E1211K1194-T1207 WeakPolarHBondContact CD-OG1 3.37Å; K1194-T1207 VanDerWaalsContact CE-OG1 3.27Å; K1194-T1207 WeakPolarHBondContact CE-OG1 3.33Å; K1194-T1207 PolarHBondContact NZ-OG1 3.29Å; R1203-T1207 WeakPolarHBondContact O-CB 3.42Å; R1203-T1207 PolarHBondContact O-N 3.17Å; R1203-T1207 PolarHBondContact O-OG1 3.23Å; T1204-T1207 WeakPolarHBondContact O-CB 3.2Å; T1204-T1207 PolarHBondContact O-N 2.9Å; T1204-T1207 VanDerWaalsContact O-N 3.09Å; I1205-T1207 VanDerWaalsContact C-N 3.3Å; I1205-T1207 PolarHBondContact O-N 2.98Å; T1207-R1209 VanDerWaalsContact C-N 3.34Å; T1207-R1209 PolarHBondContact O-N 3.13Å; T1207-I1210 PolarHBondContact O-N 2.65Å; T1207-I1210 VanDerWaalsContact O-N 3.16Å; T1207-E1211 WeakPolarHBondContact CG2-OE1 3.46Å; T1207-E1211 PolarHBondContact O-N 2.89Å
1208D81.6Confident84.6Confident64 Ų6461.4 Ų61.434%0.34231%0.309SS..Hα-helixtrans-59.5-40.8179.1170.888.3000112.1T1204 E1211 R1212T1204-D1208 WeakPolarHBondContact O-CB 3.46Å; T1204-D1208 PolarHBondContact O-N 3.22Å; D1208-E1211 PolarHBondContact O-N 2.98Å; D1208-R1212 VanDerWaalsContact CG-NE 3.31Å; D1208-R1212 WeakPolarHBondContact O-CB 3.41Å; D1208-R1212 VanDerWaalsContact O-CG 3.23Å; D1208-R1212 WeakPolarHBondContact O-CG 3.49Å; D1208-R1212 PolarHBondContact O-N 3.38Å; D1208-R1212 IonicContact OD1-CZ 3.04Å; D1208-R1212 IonicContact OD1-NE 2.71Å; D1208-R1212 PolarHBondContact OD1-NE 3.48Å; D1208-R1212 IonicContact OD1-NH2 3.86Å; D1208-R1212 PolarHBondContact OD1-NH2 2.94Å; D1208-R1212 IonicContact OD2-CZ 2.76Å; D1208-R1212 VanDerWaalsContact OD2-CZ 3.27Å; D1208-R1212 IonicContact OD2-NE 2.67Å; D1208-R1212 PolarHBondContact OD2-NE 3.39Å; D1208-R1212 IonicContact OD2-NH2 2.61Å; D1208-R1212 PolarHBondContact OD2-NH2 2.96Å
1209R87.5Confident85.3Confident22 Ų2260.8 Ų60.88%0.08329%0.293CS..Hα-helixtrans-64.8-41.4174.2-76.4-178.8173.5-144.8-18.8112.8L1115 F1131 N1132 W1135 I1205 T1207 I1213L1115-R1209 PolarHBondContact O-NH2 3.19Å; L1115-R1209 VanDerWaalsContact O-NH2 3.13Å; F1131-R1209 HydrophobicContact CE1-CB 4.5Å; F1131-R1209 HydrophobicContact CZ-CB 4.46Å; N1132-R1209 PolarHBondContact OD1-NH1 2.71Å; W1135-R1209 HydrophobicContact CD2-CB 4.09Å; W1135-R1209 HydrophobicContact CD2-CG 4.1Å; W1135-R1209 HydrophobicContact CE3-CG 4.32Å; W1135-R1209 HydrophobicContact CG-CB 4.31Å; W1135-R1209 HydrophobicContact CH2-CG 4.16Å; W1135-R1209 HydrophobicContact CZ2-CB 4.2Å; W1135-R1209 HydrophobicContact CZ2-CG 3.88Å; W1135-R1209 HydrophobicContact CZ3-CG 4.35Å; W1135-R1209 PolarHBondContact NE1-O 2.98Å; I1205-R1209 HydrophobicContact CG2-CG 4.48Å; I1205-R1209 WeakPolarHBondContact O-CB 3.46Å; I1205-R1209 WeakPolarHBondContact O-CG 3.22Å; I1205-R1209 PolarHBondContact O-N 3.33Å; T1207-R1209 VanDerWaalsContact C-N 3.34Å; T1207-R1209 PolarHBondContact O-N 3.13Å; R1209-I1213 PolarHBondContact O-N 3.12Å; R1209-I1213 VanDerWaalsContact O-N 3.14Å
1210I89.7Confident85.9Confident17 Ų1759 Ų599%0.08728%0.284CS..Hα-helixtrans-66.1-46.7175.2-75.2-57.7000111.8F1131 L1186 I1187 A1190 I1206 T1207 R1212 I1213 Q1214F1131-I1210 HydrophobicContact CE2-CD1 3.83Å; F1131-I1210 HydrophobicContact CE2-CG1 4.26Å; F1131-I1210 HydrophobicContact CZ-CD1 4.04Å; F1131-I1210 HydrophobicContact CZ-CG1 4.09Å; L1186-I1210 HydrophobicContact CD2-CD1 3.88Å; L1186-I1210 HydrophobicContact CG-CD1 4.3Å; I1187-I1210 HydrophobicContact CG1-CD1 4.19Å; I1187-I1210 HydrophobicContact CG1-CG2 4.25Å; A1190-I1210 HydrophobicContact CB-CD1 3.7Å; A1190-I1210 HydrophobicContact CB-CG1 3.32Å; I1206-I1210 WeakPolarHBondContact O-CG1 3.46Å; I1206-I1210 PolarHBondContact O-N 3.49Å; I1206-I1210 VanDerWaalsContact O-N 3.14Å; T1207-I1210 PolarHBondContact O-N 2.65Å; T1207-I1210 VanDerWaalsContact O-N 3.16Å; I1210-R1212 VanDerWaalsContact C-N 3.33Å; I1210-R1212 PolarHBondContact O-N 3.45Å; I1210-I1213 HydrophobicContact CD1-CG2 4.4Å; I1210-I1213 WeakPolarHBondContact O-CG2 3.2Å; I1210-I1213 PolarHBondContact O-N 3.09Å; I1210-Q1214 HydrophobicContact CG2-CG 4.3Å; I1210-Q1214 WeakPolarHBondContact O-CB 3.36Å; I1210-Q1214 WeakPolarHBondContact O-CG 3.5Å; I1210-Q1214 PolarHBondContact O-N 3.19Å
1211E87Confident86.4Confident109 Ų10955 Ų5551%0.50927%0.265SS..Hα-helixtrans-60.6-42.7178.2-73174.8-172.700111.1T1207 D1208 I1213 N1215T1207-E1211 WeakPolarHBondContact CG2-OE1 3.46Å; T1207-E1211 PolarHBondContact O-N 2.89Å; D1208-E1211 PolarHBondContact O-N 2.98Å; E1211-I1213 PolarHBondContact O-N 3.07Å; E1211-N1215 WeakPolarHBondContact O-CB 3.41Å; E1211-N1215 PolarHBondContact O-N 3.36Å; E1211-N1215 PolarHBondContact O-ND2 3.24Å; E1211-N1215 PolarHBondContact O-OD1 3.14Å
1212R86.8Confident87.2Confident133 Ų13354.9 Ų54.950%0.50226%0.264SS..Hα-helixtrans-57.6-48.4174.5-74.7174.4-155.3-92.9-5113.1D1208 I1210 N1215 Q1216D1208-R1212 VanDerWaalsContact CG-NE 3.31Å; D1208-R1212 WeakPolarHBondContact O-CB 3.41Å; D1208-R1212 VanDerWaalsContact O-CG 3.23Å; D1208-R1212 WeakPolarHBondContact O-CG 3.49Å; D1208-R1212 PolarHBondContact O-N 3.38Å; D1208-R1212 IonicContact OD1-CZ 3.04Å; D1208-R1212 IonicContact OD1-NE 2.71Å; D1208-R1212 PolarHBondContact OD1-NE 3.48Å; D1208-R1212 IonicContact OD1-NH2 3.86Å; D1208-R1212 PolarHBondContact OD1-NH2 2.94Å; D1208-R1212 IonicContact OD2-CZ 2.76Å; D1208-R1212 VanDerWaalsContact OD2-CZ 3.27Å; D1208-R1212 IonicContact OD2-NE 2.67Å; D1208-R1212 PolarHBondContact OD2-NE 3.39Å; D1208-R1212 IonicContact OD2-NH2 2.61Å; D1208-R1212 PolarHBondContact OD2-NH2 2.96Å; I1210-R1212 VanDerWaalsContact C-N 3.33Å; I1210-R1212 PolarHBondContact O-N 3.45Å; R1212-N1215 PolarHBondContact O-N 3.12Å; R1212-Q1216 WeakPolarHBondContact O-CB 3.37Å; R1212-Q1216 WeakPolarHBondContact O-CG 3.41Å; R1212-Q1216 PolarHBondContact O-N 3.45Å
1213I90.9Very high87.9Confident0 Ų058 Ų580%028%0.278CS..Hα-helixtrans-75.6-29.8-174.9-161.8169000112.7W1135 L1138 T1139 L1142 L1183 L1186 R1209 I1210 E1211 W1217W1135-I1213 VanDerWaalsContact O-CD1 3.23Å; W1135-I1213 WeakPolarHBondContact O-CD1 3.35Å; L1138-I1213 HydrophobicContact CB-CD1 3.7Å; L1138-I1213 HydrophobicContact CD2-CD1 3.82Å; L1138-I1213 HydrophobicContact CG-CD1 3.78Å; T1139-I1213 WeakPolarHBondContact OG1-CD1 3.38Å; L1142-I1213 HydrophobicContact CD1-CG1 3.86Å; L1183-I1213 HydrophobicContact CD1-CG1 4.47Å; L1183-I1213 HydrophobicContact CD1-CG2 3.99Å; L1186-I1213 HydrophobicContact CD2-CD1 4.13Å; L1186-I1213 HydrophobicContact CD2-CG2 4.15Å; R1209-I1213 PolarHBondContact O-N 3.12Å; R1209-I1213 VanDerWaalsContact O-N 3.14Å; I1210-I1213 HydrophobicContact CD1-CG2 4.4Å; I1210-I1213 WeakPolarHBondContact O-CG2 3.2Å; I1210-I1213 PolarHBondContact O-N 3.09Å; E1211-I1213 PolarHBondContact O-N 3.07Å; I1213-W1217 WeakPolarHBondContact O-CB 3.43Å; I1213-W1217 PolarHBondContact O-N 2.95Å
1214Q90.2Very high88.2Confident71 Ų7154.5 Ų54.533%0.33227%0.265SS..Hα-helixtrans-66.3-46.9170.1-69.8-174.6-79.800110.9L1183 I1187 I1210 Q1216 W1217 D1218L1183-Q1214 HydrophobicContact CD1-CG 4.48Å; I1187-Q1214 HydrophobicContact CD1-CG 4.09Å; I1187-Q1214 HydrophobicContact CG1-CG 4.49Å; I1210-Q1214 HydrophobicContact CG2-CG 4.3Å; I1210-Q1214 WeakPolarHBondContact O-CB 3.36Å; I1210-Q1214 WeakPolarHBondContact O-CG 3.5Å; I1210-Q1214 PolarHBondContact O-N 3.19Å; Q1214-Q1216 PolarHBondContact O-N 3.39Å; Q1214-W1217 WeakPolarHBondContact O-CB 3.4Å; Q1214-W1217 PolarHBondContact O-N 2.79Å; Q1214-D1218 PolarHBondContact O-N 3.03Å
1215N89.2Confident88.7Confident92 Ų9255.7 Ų55.749%0.49227%0.265SS..Hα-helixtrans-60.2-45.2176.2-65.7-14000111.6E1211 R1212 W1217 D1218 E1219E1211-N1215 WeakPolarHBondContact O-CB 3.41Å; E1211-N1215 PolarHBondContact O-N 3.36Å; E1211-N1215 PolarHBondContact O-ND2 3.24Å; E1211-N1215 PolarHBondContact O-OD1 3.14Å; R1212-N1215 PolarHBondContact O-N 3.12Å; N1215-W1217 VanDerWaalsContact C-N 3.33Å; N1215-W1217 PolarHBondContact O-N 2.91Å; N1215-D1218 PolarHBondContact O-N 3.41Å; N1215-E1219 WeakPolarHBondContact O-CB 3.45Å; N1215-E1219 VanDerWaalsContact O-CG 3.28Å; N1215-E1219 WeakPolarHBondContact O-CG 3.41Å; N1215-E1219 PolarHBondContact O-N 3.45Å
1216Q89.8Confident89.1Confident56 Ų5658.4 Ų58.426%0.26228%0.28SS..Hα-helixtrans-62.7-37.3175.4-76.2179.7-39.800112.8L1142 R1212 Q1214 V1220L1142-Q1216 HydrophobicContact CD1-CB 4.19Å; R1212-Q1216 WeakPolarHBondContact O-CB 3.37Å; R1212-Q1216 WeakPolarHBondContact O-CG 3.41Å; R1212-Q1216 PolarHBondContact O-N 3.45Å; Q1214-Q1216 PolarHBondContact O-N 3.39Å; Q1216-V1220 WeakPolarHBondContact O-CB 3.49Å; Q1216-V1220 WeakPolarHBondContact O-CG2 3.47Å; Q1216-V1220 PolarHBondContact O-N 3.34Å
1217W94.2Very high89.5Confident1 Ų159.4 Ų59.40%0.00428%0.284CS..Hα-helixtrans-61.2-48.9174.5-177.2-76.1000111L1138 W1141 L1142 L1176 R1179 R1180 L1183 I1213 Q1214 N1215 V1220 Q1221L1138-W1217 HydrophobicContact CD1-CZ3 4.22Å; W1141-W1217 HydrophobicContact CZ3-CZ3 4.27Å; L1142-W1217 HydrophobicContact CD1-CB 4.23Å; L1142-W1217 HydrophobicContact CD1-CE3 4.19Å; L1142-W1217 HydrophobicContact CD2-CD2 4.38Å; L1142-W1217 HydrophobicContact CD2-CE3 3.85Å; L1142-W1217 HydrophobicContact CD2-CZ3 4.42Å; L1142-W1217 HydrophobicContact CG-CE3 4.41Å; L1176-W1217 HydrophobicContact CD1-CD2 4.06Å; L1176-W1217 HydrophobicContact CD1-CE3 4.07Å; L1176-W1217 HydrophobicContact CD1-CH2 3.57Å; L1176-W1217 HydrophobicContact CD1-CZ2 3.55Å; L1176-W1217 HydrophobicContact CD1-CZ3 3.84Å; L1176-W1217 HydrophobicContact CG-CH2 4.14Å; L1176-W1217 HydrophobicContact CG-CZ2 3.74Å; L1176-W1217 WeakPolarHBondContact O-CH2 3.45Å; L1176-W1217 VanDerWaalsContact O-CZ2 3.25Å; L1176-W1217 WeakPolarHBondContact O-CZ2 3.43Å; R1179-W1217 HydrophobicContact CB-CH2 3.92Å; R1179-W1217 HydrophobicContact CB-CZ3 4.2Å; R1180-W1217 HydrophobicContact CB-CH2 4.34Å; R1180-W1217 HydrophobicContact CB-CZ2 4.05Å; L1183-W1217 HydrophobicContact CB-CE3 4.37Å; L1183-W1217 HydrophobicContact CB-CZ3 4.42Å; L1183-W1217 HydrophobicContact CD2-CB 4.01Å; L1183-W1217 HydrophobicContact CD2-CD2 3.65Å; L1183-W1217 HydrophobicContact CD2-CE3 3.85Å; L1183-W1217 HydrophobicContact CD2-CG 3.7Å; I1213-W1217 WeakPolarHBondContact O-CB 3.43Å; I1213-W1217 PolarHBondContact O-N 2.95Å; Q1214-W1217 WeakPolarHBondContact O-CB 3.4Å; Q1214-W1217 PolarHBondContact O-N 2.79Å; N1215-W1217 VanDerWaalsContact C-N 3.33Å; N1215-W1217 PolarHBondContact O-N 2.91Å; W1217-V1220 PolarHBondContact O-N 3.44Å; W1217-Q1221 VanDerWaalsContact O-CB 3.27Å; W1217-Q1221 WeakPolarHBondContact O-CB 3.39Å; W1217-Q1221 PolarHBondContact O-N 3.03Å
1218D90.5Very high89.7Confident89 Ų8961.4 Ų61.448%0.47629%0.287SS..Hα-helixtrans-66.8-42.3-178.7-68.9-22.9000111.6Q1214 N1215 Q1221 E1222Q1214-D1218 PolarHBondContact O-N 3.03Å; N1215-D1218 PolarHBondContact O-N 3.41Å; D1218-Q1221 PolarHBondContact O-N 3.44Å; D1218-E1222 WeakPolarHBondContact O-CB 3.16Å; D1218-E1222 PolarHBondContact O-N 2.91Å
1219E90.3Very high90.1Very high105 Ų10563.3 Ų63.349%0.49129%0.294SS..Hα-helixtrans-57.4-49.1173.1-77171.8-170.900111.7N1215 E1222 H1223N1215-E1219 WeakPolarHBondContact O-CB 3.45Å; N1215-E1219 VanDerWaalsContact O-CG 3.28Å; N1215-E1219 WeakPolarHBondContact O-CG 3.41Å; N1215-E1219 PolarHBondContact O-N 3.45Å; E1219-E1222 PolarHBondContact O-N 3.03Å; E1219-H1223 WeakPolarHBondContact O-CB 3.32Å; E1219-H1223 PolarHBondContact O-CD2 2.92Å; E1219-H1223 PolarHBondContact O-N 3.34Å
1220V91.5Very high90.3Very high6 Ų665.2 Ų65.24%0.03630%0.304CS..Hα-helixtrans-68.4-37.2-179.9172.60000111.6L1142 L1145 D1146 I1149 Q1216 W1217 H1223 L1224L1142-V1220 HydrophobicContact CD2-CB 4.28Å; L1142-V1220 HydrophobicContact CD2-CG1 4.32Å; L1145-V1220 HydrophobicContact CB-CG1 4.12Å; L1145-V1220 HydrophobicContact CD2-CG1 3.73Å; L1145-V1220 HydrophobicContact CG-CG1 4.14Å; D1146-V1220 HydrophobicContact CB-CG2 3.83Å; I1149-V1220 HydrophobicContact CD1-CG1 3.94Å; Q1216-V1220 WeakPolarHBondContact O-CB 3.49Å; Q1216-V1220 WeakPolarHBondContact O-CG2 3.47Å; Q1216-V1220 PolarHBondContact O-N 3.34Å; W1217-V1220 PolarHBondContact O-N 3.44Å; V1220-H1223 PolarHBondContact O-N 3.48Å; V1220-L1224 VanDerWaalsContact O-CB 3.28Å; V1220-L1224 WeakPolarHBondContact O-CB 3.15Å; V1220-L1224 PolarHBondContact O-N 3.41Å
1221Q91.2Very high90.4Very high47 Ų4764.4 Ų64.422%0.2230%0.3CS..Hα-helixtrans-64.3-40.6174.1-163.1-174.9-82.500111.3L1176 W1217 D1218 Q1225L1176-Q1221 HydrophobicContact CD2-CB 3.88Å; L1176-Q1221 HydrophobicContact CD2-CG 3.89Å; W1217-Q1221 VanDerWaalsContact O-CB 3.27Å; W1217-Q1221 WeakPolarHBondContact O-CB 3.39Å; W1217-Q1221 PolarHBondContact O-N 3.03Å; D1218-Q1221 PolarHBondContact O-N 3.44Å; Q1221-Q1225 WeakPolarHBondContact O-CG 3.36Å; Q1221-Q1225 PolarHBondContact O-N 2.9Å
1222E90.4Very high90.7Very high114 Ų11462.3 Ų62.353%0.53329%0.292SS..Hα-helixtrans-66.5-46.8174.5-179.9175.2176.200111.7D1218 E1219 L1224 Q1225 N1226D1218-E1222 WeakPolarHBondContact O-CB 3.16Å; D1218-E1222 PolarHBondContact O-N 2.91Å; E1219-E1222 PolarHBondContact O-N 3.03Å; E1222-L1224 VanDerWaalsContact C-N 3.28Å; E1222-L1224 PolarHBondContact O-N 2.94Å; E1222-Q1225 PolarHBondContact O-N 3.09Å; E1222-N1226 WeakPolarHBondContact CG-ND2 3.44Å; E1222-N1226 WeakPolarHBondContact O-CB 3.22Å; E1222-N1226 PolarHBondContact O-N 3Å; E1222-N1226 PolarHBondContact O-ND2 3.13Å; E1222-N1226 PolarHBondContact OE1-ND2 2.86Å
1223H92.5Very high90.9Very high71 Ų7160.3 Ų60.333%0.32929%0.289SS..Hα-helixtrans-56.4-42.7176-69.2173.5000111.8D1146 I1149 E1219 V1220 R1227D1146-H1223 IonicContact OD1-CE1 3.94Å; D1146-H1223 IonicContact OD1-CG 2.87Å; D1146-H1223 IonicContact OD1-ND1 2.67Å; D1146-H1223 PolarHBondContact OD1-ND1 3.06Å; I1149-H1223 HydrophobicContact CD1-CB 4.3Å; I1149-H1223 HydrophobicContact CG2-CB 4.31Å; E1219-H1223 WeakPolarHBondContact O-CB 3.32Å; E1219-H1223 PolarHBondContact O-CD2 2.92Å; E1219-H1223 PolarHBondContact O-N 3.34Å; V1220-H1223 PolarHBondContact O-N 3.48Å; H1223-R1227 WeakPolarHBondContact O-CB 3.36Å; H1223-R1227 PolarHBondContact O-N 3.3Å
1224L88.8Confident91.2Very high2 Ų260.3 Ų60.31%0.0129%0.289CS..Hα-helixtrans-65.2-45.5178.3-164.972.2000111.6I1149 Q1169 T1172 M1173 L1176 V1220 E1222 R1228I1149-L1224 HydrophobicContact CD1-CB 3.85Å; I1149-L1224 HydrophobicContact CD1-CD1 3.68Å; I1149-L1224 HydrophobicContact CD1-CG 4.36Å; I1149-L1224 HydrophobicContact CG1-CD1 3.64Å; Q1169-L1224 PolarHBondContact OE1-O 2.94Å; T1172-L1224 HydrophobicContact CG2-CD1 3.71Å; T1172-L1224 HydrophobicContact CG2-CD2 4.43Å; M1173-L1224 HydrophobicContact CB-CD2 3.68Å; M1173-L1224 HydrophobicContact CB-CG 4.48Å; M1173-L1224 HydrophobicContact CG-CD2 3.94Å; L1176-L1224 HydrophobicContact CD2-CD2 4.11Å; V1220-L1224 VanDerWaalsContact O-CB 3.28Å; V1220-L1224 WeakPolarHBondContact O-CB 3.15Å; V1220-L1224 PolarHBondContact O-N 3.41Å; E1222-L1224 VanDerWaalsContact C-N 3.28Å; E1222-L1224 PolarHBondContact O-N 2.94Å; L1224-R1228 WeakPolarHBondContact O-CB 3.33Å; L1224-R1228 PolarHBondContact O-N 3.05Å
1225Q88.3Confident91.3Very high101 Ų10158.5 Ų58.547%0.47228%0.281SS..Hα-helixtrans-64-44.2176-72.818013.200112.2Q1221 E1222 R1228 Q1229Q1221-Q1225 WeakPolarHBondContact O-CG 3.36Å; Q1221-Q1225 PolarHBondContact O-N 2.9Å; E1222-Q1225 PolarHBondContact O-N 3.09Å; Q1225-R1228 PolarHBondContact O-N 3.37Å; Q1225-Q1229 PolarHBondContact O-N 3.33Å
1226N90.8Very high91.5Very high88 Ų8860.2 Ų60.247%0.47128%0.284SS..Hα-helixtrans-64.1-45178.2-75.3-22.7000111.8E1222 R1228 Q1229 Q1230E1222-N1226 WeakPolarHBondContact CG-ND2 3.44Å; E1222-N1226 WeakPolarHBondContact O-CB 3.22Å; E1222-N1226 PolarHBondContact O-N 3Å; E1222-N1226 PolarHBondContact O-ND2 3.13Å; E1222-N1226 PolarHBondContact OE1-ND2 2.86Å; N1226-R1228 PolarHBondContact O-N 3.09Å; N1226-Q1229 PolarHBondContact O-N 3.36Å; N1226-Q1230 WeakPolarHBondContact O-CB 3.41Å; N1226-Q1230 PolarHBondContact O-N 3.02Å
1227R93.2Very high91.7Very high23 Ų2358.1 Ų58.19%0.08728%0.275CS..Hα-helixtrans-64.7-40.1176.4-17755.8178.9169.52.4111.6I1149 Q1152 H1223 Q1230 L1231 D1310I1149-R1227 HydrophobicContact CG2-CB 4.09Å; I1149-R1227 HydrophobicContact CG2-CG 4.42Å; Q1152-R1227 PolarHBondContact O-NE 3.23Å; Q1152-R1227 PolarHBondContact O-NH2 3.38Å; H1223-R1227 WeakPolarHBondContact O-CB 3.36Å; H1223-R1227 PolarHBondContact O-N 3.3Å; R1227-Q1230 PolarHBondContact O-N 2.86Å; R1227-L1231 HydrophobicContact CG-CD1 4.21Å; R1227-L1231 WeakPolarHBondContact O-CG 3.48Å; R1227-L1231 PolarHBondContact O-N 3.08Å; R1227-D1310 IonicContact CZ-OD1 3.35Å; R1227-D1310 IonicContact CZ-OD2 2.73Å; R1227-D1310 IonicContact NH1-OD1 3.32Å; R1227-D1310 IonicContact NH1-OD2 2.71Å; R1227-D1310 PolarHBondContact NH1-OD2 3.19Å; R1227-D1310 IonicContact NH2-OD1 3.2Å; R1227-D1310 PolarHBondContact NH2-OD1 3.22Å; R1227-D1310 IonicContact NH2-OD2 3.4Å; R1227-D1310 PolarHBondContact NH2-OD2 3.35Å
1228R89.2Confident91.7Very high79 Ų7958.1 Ų58.130%0.29827%0.274SS..Hα-helixtrans-61.4-43.5173.1179.7177164.2-165-7.3111.9M1173 L1224 Q1225 N1226 L1231 N1232M1173-R1228 VanDerWaalsContact CE-NH1 3.33Å; M1173-R1228 PolarHBondContact SD-NH1 3.35Å; L1224-R1228 WeakPolarHBondContact O-CB 3.33Å; L1224-R1228 PolarHBondContact O-N 3.05Å; Q1225-R1228 PolarHBondContact O-N 3.37Å; N1226-R1228 PolarHBondContact O-N 3.09Å; R1228-L1231 PolarHBondContact O-N 3.42Å; R1228-N1232 PolarHBondContact O-N 3Å; R1228-N1232 VanDerWaalsContact O-N 3.12Å; R1228-N1232 PolarHBondContact O-ND2 3.48Å
1229Q89.8Confident91.9Very high104 Ų10456 Ų5649%0.48627%0.265SS..Hα-helixtrans-61.1-48.1175.7-179.162.421.400110.9Q1225 N1226 L1231 N1232 E1233Q1225-Q1229 PolarHBondContact O-N 3.33Å; N1226-Q1229 PolarHBondContact O-N 3.36Å; Q1229-L1231 VanDerWaalsContact C-N 3.31Å; Q1229-L1231 PolarHBondContact O-N 2.93Å; Q1229-N1232 PolarHBondContact O-N 3.26Å; Q1229-N1232 VanDerWaalsContact O-N 3.08Å; Q1229-E1233 PolarHBondContact NE2-OE1 3.33Å; Q1229-E1233 PolarHBondContact O-N 2.97Å
1230Q91.2Very high92Very high61 Ų6154.5 Ų54.529%0.28526%0.258SS..Hα-helixtrans-56.7-42.1177.8-169.3-173.721.500112.3N1226 R1227 E1233 M1234 Y1307N1226-Q1230 WeakPolarHBondContact O-CB 3.41Å; N1226-Q1230 PolarHBondContact O-N 3.02Å; R1227-Q1230 PolarHBondContact O-N 2.86Å; Q1230-E1233 PolarHBondContact O-N 3.42Å; Q1230-M1234 VanDerWaalsContact O-CB 3.29Å; Q1230-M1234 WeakPolarHBondContact O-CB 3.38Å; Q1230-M1234 PolarHBondContact O-N 3.08Å; Q1230-Y1307 HydrophobicContact CG-CD1 4.36Å; Q1230-Y1307 HydrophobicContact CG-CE1 4.18Å
1231L93Very high92.2Very high0 Ų054.3 Ų54.30%026%0.256CS..Hα-helixtrans-66.9-37176.3-71.5164.6000112.8V1154 I1162 M1165 I1166 Q1169 R1227 R1228 Q1229 M1234 L1235V1154-L1231 HydrophobicContact CG1-CD2 3.99Å; V1154-L1231 HydrophobicContact CG2-CD2 3.68Å; I1162-L1231 HydrophobicContact CG2-CB 4.49Å; I1162-L1231 HydrophobicContact CG2-CD2 4.36Å; I1162-L1231 WeakPolarHBondContact CG2-O 3.5Å; M1165-L1231 HydrophobicContact CB-CD1 4.17Å; M1165-L1231 HydrophobicContact CB-CD2 4.34Å; M1165-L1231 HydrophobicContact CG-CD1 3.64Å; M1165-L1231 HydrophobicContact CG-CD2 4.21Å; I1166-L1231 HydrophobicContact CD1-CB 4.13Å; I1166-L1231 HydrophobicContact CG1-CB 3.64Å; I1166-L1231 HydrophobicContact CG1-CD1 4.41Å; Q1169-L1231 HydrophobicContact CG-CD1 3.99Å; R1227-L1231 HydrophobicContact CG-CD1 4.21Å; R1227-L1231 WeakPolarHBondContact O-CG 3.48Å; R1227-L1231 PolarHBondContact O-N 3.08Å; R1228-L1231 PolarHBondContact O-N 3.42Å; Q1229-L1231 VanDerWaalsContact C-N 3.31Å; Q1229-L1231 PolarHBondContact O-N 2.93Å; L1231-M1234 HydrophobicContact CD2-CE 4.43Å; L1231-M1234 PolarHBondContact O-N 3.41Å; L1231-L1235 WeakPolarHBondContact O-CB 3.41Å; L1231-L1235 PolarHBondContact O-N 3.32Å
1232N92.4Very high92.3Very high65 Ų6554.2 Ų54.235%0.34826%0.257SS..Hα-helixtrans-70.3-35.1176.4-77.1-94.4000111.8R1228 Q1229 K1236R1228-N1232 PolarHBondContact O-N 3Å; R1228-N1232 VanDerWaalsContact O-N 3.12Å; R1228-N1232 PolarHBondContact O-ND2 3.48Å; Q1229-N1232 PolarHBondContact O-N 3.26Å; Q1229-N1232 VanDerWaalsContact O-N 3.08Å; N1232-K1236 PolarHBondContact O-N 3.15Å
1233E92.4Very high92.3Very high92 Ų9254.2 Ų54.243%0.4326%0.257SS..Hα-helixtrans-68-44.3171.8-70.6174.9-178.100111.2Q1229 Q1230 L1235 K1236 D1237 Y1307Q1229-E1233 PolarHBondContact NE2-OE1 3.33Å; Q1229-E1233 PolarHBondContact O-N 2.97Å; Q1230-E1233 PolarHBondContact O-N 3.42Å; E1233-L1235 VanDerWaalsContact C-N 3.33Å; E1233-L1235 PolarHBondContact O-N 3.39Å; E1233-K1236 PolarHBondContact O-N 3.29Å; E1233-D1237 WeakPolarHBondContact O-CB 3.49Å; E1233-D1237 PolarHBondContact O-N 3.48Å; E1233-Y1307 VanDerWaalsContact C-OH 3.24Å; E1233-Y1307 PolarHBondContact O-OH 3.23Å
1234M95.6Very high92.3Very high0 Ų051.2 Ų51.20%025%0.245CC..Hα-helixtrans-61.4-39.7176.2-168.8-164-60.900112.2V1154 V1156 I1162 Q1230 L1231 S1238 Y1307 D1310V1154-M1234 HydrophobicContact CG2-CE 3.69Å; V1154-M1234 HydrophobicContact CG2-SD 3.45Å; V1154-M1234 WeakPolarHBondContact CG2-SD 3.36Å; V1156-M1234 HydrophobicContact CB-SD 4.45Å; V1156-M1234 HydrophobicContact CG1-CG 4.21Å; V1156-M1234 HydrophobicContact CG1-SD 4.41Å; V1156-M1234 HydrophobicContact CG2-CE 4.39Å; V1156-M1234 HydrophobicContact CG2-SD 3.97Å; I1162-M1234 HydrophobicContact CD1-CG 3.91Å; I1162-M1234 HydrophobicContact CD1-SD 3.72Å; I1162-M1234 HydrophobicContact CG1-SD 3.85Å; Q1230-M1234 VanDerWaalsContact O-CB 3.29Å; Q1230-M1234 WeakPolarHBondContact O-CB 3.38Å; Q1230-M1234 PolarHBondContact O-N 3.08Å; L1231-M1234 HydrophobicContact CD2-CE 4.43Å; L1231-M1234 PolarHBondContact O-N 3.41Å; M1234-S1238 WeakPolarHBondContact O-CB 3.5Å; M1234-S1238 PolarHBondContact O-N 3.16Å; M1234-S1238 PolarHBondContact O-OG 2.88Å; M1234-Y1307 VanDerWaalsContact CA-CZ 3.46Å; M1234-Y1307 WeakPolarHBondContact CA-OH 3.49Å; M1234-Y1307 HydrophobicContact CB-CD1 3.94Å; M1234-Y1307 HydrophobicContact CB-CD2 4.44Å; M1234-Y1307 HydrophobicContact CB-CE1 3.64Å; M1234-Y1307 HydrophobicContact CB-CE2 4.17Å; M1234-Y1307 HydrophobicContact CB-CG 4.34Å; M1234-Y1307 HydrophobicContact CE-CD1 3.69Å; M1234-Y1307 HydrophobicContact CE-CE1 4.42Å; M1234-Y1307 HydrophobicContact CE-CG 4.02Å; M1234-Y1307 HydrophobicContact CG-CD1 3.9Å; M1234-Y1307 HydrophobicContact CG-CD2 3.9Å; M1234-Y1307 HydrophobicContact CG-CE1 4.06Å; M1234-Y1307 HydrophobicContact CG-CE2 4.06Å; M1234-Y1307 HydrophobicContact CG-CG 3.83Å; M1234-Y1307 PolarHBondContact N-OH 3.09Å; M1234-D1310 HydrophobicContact CE-CB 4.08Å; M1234-D1310 VanDerWaalsContact CE-OD2 3.24Å; M1234-D1310 WeakPolarHBondContact CE-OD2 3.23Å
1235L93Very high92.5Very high32 Ų3253 Ų5317%0.16825%0.252CS..Hα-helixtrans-58.6-51.6174.8-174.669.2000110.2L1159 I1162 N1163 I1166 L1231 E1233 S1238 T1239L1159-L1235 HydrophobicContact CB-CD1 4.24Å; L1159-L1235 HydrophobicContact CD2-CD1 3.8Å; I1162-L1235 HydrophobicContact CB-CD1 4.11Å; I1162-L1235 HydrophobicContact CG2-CB 3.72Å; I1162-L1235 HydrophobicContact CG2-CD1 3.95Å; I1162-L1235 HydrophobicContact CG2-CG 4.41Å; N1163-L1235 WeakPolarHBondContact ND2-CD1 3.44Å; N1163-L1235 WeakPolarHBondContact OD1-CD2 3.24Å; I1166-L1235 HydrophobicContact CD1-CB 4.38Å; I1166-L1235 HydrophobicContact CD1-CD2 4.15Å; L1231-L1235 WeakPolarHBondContact O-CB 3.41Å; L1231-L1235 PolarHBondContact O-N 3.32Å; E1233-L1235 VanDerWaalsContact C-N 3.33Å; E1233-L1235 PolarHBondContact O-N 3.39Å; L1235-S1238 PolarHBondContact O-N 3.34Å; L1235-T1239 PolarHBondContact O-N 3.24Å; L1235-T1239 PolarHBondContact O-OG1 3.3Å
1236K92.8Very high92.5Very high128 Ų12854.6 Ų54.656%0.55726%0.26SS*.Hα-helixtrans-59.9-49.4179.6-179.7-170.5172.8-1690112N1232 E1233 S1238 T1239 Q1240N1232-K1236 PolarHBondContact O-N 3.15Å; E1233-K1236 PolarHBondContact O-N 3.29Å; K1236-S1238 VanDerWaalsContact C-N 3.32Å; K1236-S1238 PolarHBondContact O-N 3.03Å; K1236-T1239 PolarHBondContact O-N 2.92Å; K1236-Q1240 WeakPolarHBondContact O-CG 3.38Å; K1236-Q1240 PolarHBondContact O-N 3.45Å
1237D94.3Very high92.4Very high13 Ų1355.6 Ų55.67%0.0726%0.262CS..Hα-helixtrans-66.9-35.8-179-78-4000111.7E1233 Q1240 W1241 K1302 L1303 Y1307E1233-D1237 WeakPolarHBondContact O-CB 3.49Å; E1233-D1237 PolarHBondContact O-N 3.48Å; D1237-Q1240 PolarHBondContact O-N 2.97Å; D1237-W1241 WeakPolarHBondContact O-CB 3.32Å; D1237-W1241 PolarHBondContact O-N 3.03Å; D1237-K1302 IonicContact OD1-NZ 3.7Å; D1237-K1302 PolarHBondContact OD1-NZ 2.97Å; D1237-K1302 WeakPolarHBondContact OD2-CE 3.32Å; D1237-K1302 IonicContact OD2-NZ 3.91Å; D1237-K1302 PolarHBondContact OD2-NZ 3.41Å; D1237-L1303 HydrophobicContact CB-CD2 3.68Å; D1237-Y1307 HydrophobicContact CB-CE2 4.02Å; D1237-Y1307 PolarHBondContact OD2-OH 3.3Å
1238S95.6Very high92.3Very high0 Ų054.5 Ų54.50%026%0.258CS..Hα-helixtrans-66.3-40.7174.1-62.90000111.5G1157 M1234 L1235 K1236 W1241 L1242G1157-S1238 PolarHBondContact N-OG 2.84Å; M1234-S1238 WeakPolarHBondContact O-CB 3.5Å; M1234-S1238 PolarHBondContact O-N 3.16Å; M1234-S1238 PolarHBondContact O-OG 2.88Å; L1235-S1238 PolarHBondContact O-N 3.34Å; K1236-S1238 VanDerWaalsContact C-N 3.32Å; K1236-S1238 PolarHBondContact O-N 3.03Å; S1238-W1241 PolarHBondContact O-N 2.86Å; S1238-L1242 WeakPolarHBondContact O-CB 3.48Å; S1238-L1242 VanDerWaalsContact O-CG 3.26Å; S1238-L1242 WeakPolarHBondContact O-CG 3.35Å; S1238-L1242 PolarHBondContact O-N 2.96Å
1239T93.2Very high92.3Very high44 Ų4454.6 Ų54.627%0.2726%0.262SS..Hα-helixtrans-61.4-48.6174.2-55.70000111L1159 L1235 K1236 W1241 L1242 E1243L1159-T1239 WeakPolarHBondContact CD2-OG1 3.4Å; L1235-T1239 PolarHBondContact O-N 3.24Å; L1235-T1239 PolarHBondContact O-OG1 3.3Å; K1236-T1239 PolarHBondContact O-N 2.92Å; T1239-W1241 VanDerWaalsContact C-N 3.3Å; T1239-W1241 PolarHBondContact O-N 3.13Å; T1239-L1242 PolarHBondContact O-N 3.48Å; T1239-L1242 VanDerWaalsContact O-N 3.13Å; T1239-E1243 WeakPolarHBondContact O-CG 3.45Å; T1239-E1243 PolarHBondContact O-N 2.93Å
1240Q92.6Very high92.3Very high75 Ų7555.7 Ų55.735%0.3527%0.267SS..Hα-helixtrans-60.2-39.1178.4-71.1-174.9-20.600112.7K1236 D1237 A1244K1236-Q1240 WeakPolarHBondContact O-CG 3.38Å; K1236-Q1240 PolarHBondContact O-N 3.45Å; D1237-Q1240 PolarHBondContact O-N 2.97Å; Q1240-A1244 WeakPolarHBondContact O-CB 3.24Å; Q1240-A1244 PolarHBondContact O-N 3.19Å; Q1240-A1244 VanDerWaalsContact O-N 3.11Å
1241W96.4Very high92.1Very high1 Ų153.1 Ų53.10%0.00426%0.255CS..Hα-helixtrans-68.2-39.9174.6174.569.2000112.6D1237 S1238 T1239 A1244 K1245 A1296 L1299 L1303 V1315 I1318D1237-W1241 WeakPolarHBondContact O-CB 3.32Å; D1237-W1241 PolarHBondContact O-N 3.03Å; S1238-W1241 PolarHBondContact O-N 2.86Å; T1239-W1241 VanDerWaalsContact C-N 3.3Å; T1239-W1241 PolarHBondContact O-N 3.13Å; W1241-A1244 PolarHBondContact O-N 3.34Å; W1241-K1245 WeakPolarHBondContact O-CB 3.42Å; W1241-K1245 PolarHBondContact O-N 2.82Å; W1241-A1296 PolarHBondContact NE1-O 3.39Å; W1241-L1299 HydrophobicContact CB-CB 4.1Å; W1241-L1299 HydrophobicContact CG-CB 4.41Å; W1241-L1303 HydrophobicContact CB-CD1 3.53Å; W1241-L1303 HydrophobicContact CB-CG 4.38Å; W1241-L1303 HydrophobicContact CD2-CD1 3.75Å; W1241-L1303 HydrophobicContact CE3-CD1 3.89Å; W1241-L1303 HydrophobicContact CG-CD1 3.58Å; W1241-V1315 HydrophobicContact CD2-CG1 4.47Å; W1241-V1315 HydrophobicContact CE3-CG2 4.29Å; W1241-V1315 HydrophobicContact CH2-CB 4.3Å; W1241-V1315 HydrophobicContact CH2-CG1 4.41Å; W1241-V1315 HydrophobicContact CH2-CG2 4.2Å; W1241-V1315 HydrophobicContact CZ2-CB 4.34Å; W1241-V1315 HydrophobicContact CZ2-CG1 3.98Å; W1241-V1315 HydrophobicContact CZ3-CG2 4.07Å; W1241-I1318 HydrophobicContact CH2-CB 3.88Å; W1241-I1318 HydrophobicContact CH2-CD1 3.85Å; W1241-I1318 HydrophobicContact CH2-CG1 4.45Å; W1241-I1318 HydrophobicContact CH2-CG2 3.76Å; W1241-I1318 HydrophobicContact CZ2-CB 4.01Å; W1241-I1318 HydrophobicContact CZ2-CG2 3.68Å
1242L92Very high91.8Very high46 Ų4653.4 Ų53.424%0.24126%0.257CS..Hα-helixtrans-64.9-40.2177.2-74168.4000111.9L1159 S1238 T1239 K1245 E1246L1159-L1242 HydrophobicContact CD1-CD1 3.76Å; L1159-L1242 HydrophobicContact CD2-CD1 3.99Å; L1159-L1242 HydrophobicContact CG-CD1 3.63Å; S1238-L1242 WeakPolarHBondContact O-CB 3.48Å; S1238-L1242 VanDerWaalsContact O-CG 3.26Å; S1238-L1242 WeakPolarHBondContact O-CG 3.35Å; S1238-L1242 PolarHBondContact O-N 2.96Å; T1239-L1242 PolarHBondContact O-N 3.48Å; T1239-L1242 VanDerWaalsContact O-N 3.13Å; L1242-K1245 HydrophobicContact CD2-CD 4.24Å; L1242-K1245 WeakPolarHBondContact O-CB 3.34Å; L1242-K1245 PolarHBondContact O-N 3.07Å; L1242-E1246 PolarHBondContact O-N 3.16Å
1243E91.8Very high91.5Very high113 Ų11352 Ų5253%0.52826%0.257SS..Hα-helixtrans-59.6-52.1172.3-70.1168.7170.800111T1239 K1245 E1246 E1247T1239-E1243 WeakPolarHBondContact O-CG 3.45Å; T1239-E1243 PolarHBondContact O-N 2.93Å; E1243-K1245 VanDerWaalsContact C-N 3.31Å; E1243-K1245 PolarHBondContact O-N 3.01Å; E1243-E1246 PolarHBondContact O-N 3.19Å; E1243-E1247 PolarHBondContact O-N 2.92Å
1244A91.4Very high91.1Very high8 Ų851.6 Ų51.67%0.06626%0.255CS..Hα-helixtrans-64.1-33.6178.200000113.3Q1240 W1241 E1247 A1248 V1295 A1296 L1299Q1240-A1244 WeakPolarHBondContact O-CB 3.24Å; Q1240-A1244 PolarHBondContact O-N 3.19Å; Q1240-A1244 VanDerWaalsContact O-N 3.11Å; W1241-A1244 PolarHBondContact O-N 3.34Å; A1244-E1247 PolarHBondContact O-N 3.38Å; A1244-A1248 WeakPolarHBondContact O-CB 3.42Å; A1244-A1248 PolarHBondContact O-N 3.06Å; A1244-V1295 HydrophobicContact CB-CG1 4.16Å; A1244-A1296 HydrophobicContact CB-CB 4.22Å; A1244-L1299 HydrophobicContact CB-CD1 3.71Å
1245K93.4Very high90.6Very high39 Ų3951.6 Ų51.617%0.1726%0.256CS..Hα-helixtrans-64.5-43.6173.7175.3-127.9177.9-121.30111W1241 L1242 E1243 A1248 E1249 I1318 I1322W1241-K1245 WeakPolarHBondContact O-CB 3.42Å; W1241-K1245 PolarHBondContact O-N 2.82Å; L1242-K1245 HydrophobicContact CD2-CD 4.24Å; L1242-K1245 WeakPolarHBondContact O-CB 3.34Å; L1242-K1245 PolarHBondContact O-N 3.07Å; E1243-K1245 VanDerWaalsContact C-N 3.31Å; E1243-K1245 PolarHBondContact O-N 3.01Å; K1245-A1248 PolarHBondContact O-N 2.9Å; K1245-E1249 WeakPolarHBondContact CE-OE1 3.27Å; K1245-E1249 WeakPolarHBondContact CE-OE2 3.38Å; K1245-E1249 IonicContact NZ-OE1 2.64Å; K1245-E1249 PolarHBondContact NZ-OE1 3.29Å; K1245-E1249 IonicContact NZ-OE2 2.71Å; K1245-E1249 PolarHBondContact NZ-OE2 3.45Å; K1245-E1249 WeakPolarHBondContact O-CB 3.37Å; K1245-E1249 WeakPolarHBondContact O-CG 3.22Å; K1245-E1249 PolarHBondContact O-N 2.97Å; K1245-I1318 HydrophobicContact CD-CG2 3.95Å; K1245-I1318 VanDerWaalsContact CE-CG2 3.41Å; K1245-I1318 HydrophobicContact CG-CG2 3.77Å; K1245-I1322 HydrophobicContact CB-CD1 4.42Å; K1245-I1322 HydrophobicContact CG-CD1 3.69Å
1246E88.4Confident90.2Very high136 Ų13655.9 Ų55.964%0.63627%0.27SS*.Hα-helixtrans-64.7-42176.1-170.9174.9175.400111.6L1242 E1243 A1248 E1249 Q1250L1242-E1246 PolarHBondContact O-N 3.16Å; E1243-E1246 PolarHBondContact O-N 3.19Å; E1246-A1248 PolarHBondContact O-N 3.47Å; E1246-E1249 PolarHBondContact O-N 2.63Å; E1246-Q1250 WeakPolarHBondContact O-CB 3.38Å; E1246-Q1250 PolarHBondContact O-N 3.19Å
1247E88.9Confident89.7Confident109 Ų10952.8 Ų52.851%0.50927%0.268SS..Hα-helixtrans-59.8-43.6172.6-70.1-173.8178.200112.3E1243 A1244 V1251E1243-E1247 PolarHBondContact O-N 2.92Å; A1244-E1247 PolarHBondContact O-N 3.38Å; E1247-V1251 WeakPolarHBondContact O-CB 3.26Å; E1247-V1251 WeakPolarHBondContact O-CG2 3.5Å; E1247-V1251 PolarHBondContact O-N 3.22Å; E1247-V1251 VanDerWaalsContact O-N 3.08Å
1248A90Very high89.1Confident0 Ų055.6 Ų55.60%028%0.28CS..Hα-helixtrans-65.9-41.5176.800000112.3A1244 K1245 E1246 V1251 L1252 V1293 A1296 I1322A1244-A1248 WeakPolarHBondContact O-CB 3.42Å; A1244-A1248 PolarHBondContact O-N 3.06Å; K1245-A1248 PolarHBondContact O-N 2.9Å; E1246-A1248 PolarHBondContact O-N 3.47Å; A1248-V1251 PolarHBondContact O-N 3.25Å; A1248-L1252 WeakPolarHBondContact O-CB 3.44Å; A1248-L1252 VanDerWaalsContact O-CG 3.25Å; A1248-L1252 WeakPolarHBondContact O-CG 3.23Å; A1248-L1252 PolarHBondContact O-N 3.36Å; A1248-V1293 HydrophobicContact CB-CG2 4.32Å; A1248-A1296 HydrophobicContact CB-CB 4.06Å; A1248-I1322 HydrophobicContact CB-CG2 4.4Å
1249E90.5Very high88.4Confident81 Ų8156.1 Ų56.138%0.37928%0.282SS..Hα-helixtrans-67.6-39.1176.4-77.2177.5164.400112.5K1245 E1246 V1251 L1252 G1253 I1322K1245-E1249 WeakPolarHBondContact CE-OE1 3.27Å; K1245-E1249 WeakPolarHBondContact CE-OE2 3.38Å; K1245-E1249 IonicContact NZ-OE1 2.64Å; K1245-E1249 PolarHBondContact NZ-OE1 3.29Å; K1245-E1249 IonicContact NZ-OE2 2.71Å; K1245-E1249 PolarHBondContact NZ-OE2 3.45Å; K1245-E1249 WeakPolarHBondContact O-CB 3.37Å; K1245-E1249 WeakPolarHBondContact O-CG 3.22Å; K1245-E1249 PolarHBondContact O-N 2.97Å; E1246-E1249 PolarHBondContact O-N 2.63Å; E1249-V1251 VanDerWaalsContact C-N 3.35Å; E1249-V1251 PolarHBondContact O-N 3.33Å; E1249-L1252 PolarHBondContact O-N 3.08Å; E1249-G1253 PolarHBondContact O-N 3.41Å; E1249-I1322 HydrophobicContact CG-CD1 4.39Å; E1249-I1322 HydrophobicContact CG-CG1 4.33Å
1250Q88.6Confident87.6Confident126 Ų12660.2 Ų60.259%0.58930%0.298SS*.Hα-helixtrans-61.4-44.7174.2-171.2-170.577.400111E1246 G1253 Q1254E1246-Q1250 WeakPolarHBondContact O-CB 3.38Å; E1246-Q1250 PolarHBondContact O-N 3.19Å; Q1250-G1253 PolarHBondContact O-N 3.42Å; Q1250-Q1254 WeakPolarHBondContact O-CG 3.45Å; Q1250-Q1254 PolarHBondContact O-N 3Å
1251V87.6Confident86.8Confident7 Ų760.5 Ų60.54%0.04231%0.308CS..Hα-helixtrans-67.1-41.2177.7164.80000112E1247 A1248 E1249 G1253 Q1254 A1255 W1289 W1326E1247-V1251 WeakPolarHBondContact O-CB 3.26Å; E1247-V1251 WeakPolarHBondContact O-CG2 3.5Å; E1247-V1251 PolarHBondContact O-N 3.22Å; E1247-V1251 VanDerWaalsContact O-N 3.08Å; A1248-V1251 PolarHBondContact O-N 3.25Å; E1249-V1251 VanDerWaalsContact C-N 3.35Å; E1249-V1251 PolarHBondContact O-N 3.33Å; V1251-G1253 VanDerWaalsContact C-N 3.3Å; V1251-G1253 PolarHBondContact O-N 2.88Å; V1251-Q1254 PolarHBondContact O-N 3.15Å; V1251-A1255 WeakPolarHBondContact O-CB 3.43Å; V1251-A1255 PolarHBondContact O-N 3.35Å; V1251-W1289 HydrophobicContact CG1-CB 3.4Å; V1251-W1289 VanDerWaalsContact CG1-CB 3.4Å; V1251-W1289 HydrophobicContact CG1-CD2 3.7Å; V1251-W1289 HydrophobicContact CG1-CE3 4.12Å; V1251-W1289 HydrophobicContact CG1-CG 3.39Å; V1251-W1326 HydrophobicContact CG1-CZ3 4.5Å
1252L87.6Confident85.6Confident7 Ų763.4 Ų63.44%0.03732%0.319CS..Hα-helixtrans-58.6-41.8169.9-77.4169.6000111.5A1248 E1249 A1255 R1256 I1322 W1326 I1329A1248-L1252 WeakPolarHBondContact O-CB 3.44Å; A1248-L1252 VanDerWaalsContact O-CG 3.25Å; A1248-L1252 WeakPolarHBondContact O-CG 3.23Å; A1248-L1252 PolarHBondContact O-N 3.36Å; E1249-L1252 PolarHBondContact O-N 3.08Å; L1252-A1255 PolarHBondContact O-N 2.66Å; L1252-R1256 VanDerWaalsContact O-CG 3.3Å; L1252-R1256 WeakPolarHBondContact O-CG 3.13Å; L1252-R1256 PolarHBondContact O-N 3.11Å; L1252-I1322 HydrophobicContact CD1-CB 4.37Å; L1252-I1322 HydrophobicContact CD1-CG1 4.39Å; L1252-I1322 HydrophobicContact CD1-CG2 4.01Å; L1252-W1326 HydrophobicContact CD2-CB 4.17Å; L1252-W1326 HydrophobicContact CD2-CE3 3.75Å; L1252-I1329 HydrophobicContact CD2-CD1 3.51Å
1253G85.1Confident83.8Confident35 Ų3569.9 Ų69.936%0.36135%0.346SS..Hα-helixtrans-61.3-47.1174.900000112.6E1249 Q1250 V1251 A1255 R1256 A1257E1249-G1253 PolarHBondContact O-N 3.41Å; Q1250-G1253 PolarHBondContact O-N 3.42Å; V1251-G1253 VanDerWaalsContact C-N 3.3Å; V1251-G1253 PolarHBondContact O-N 2.88Å; G1253-A1255 VanDerWaalsContact C-N 3.34Å; G1253-A1255 PolarHBondContact O-N 3.31Å; G1253-R1256 PolarHBondContact O-N 3Å; G1253-A1257 WeakPolarHBondContact O-CB 3.42Å; G1253-A1257 PolarHBondContact O-N 3.15Å
1254Q84.7Confident82Confident83 Ų8372 Ų7239%0.38836%0.356SS..Hα-helixtrans-60.9-40.8174.9-69.9177.130.400112.1Q1250 V1251 A1257 K1258 W1289Q1250-Q1254 WeakPolarHBondContact O-CG 3.45Å; Q1250-Q1254 PolarHBondContact O-N 3Å; V1251-Q1254 PolarHBondContact O-N 3.15Å; Q1254-A1257 PolarHBondContact O-N 3.36Å; Q1254-K1258 WeakPolarHBondContact O-CG 3.49Å; Q1254-K1258 PolarHBondContact O-N 3.07Å; Q1254-W1289 HydrophobicContact CB-CH2 3.97Å; Q1254-W1289 HydrophobicContact CB-CZ2 4.32Å
1255A85Confident80.2Confident1 Ų173 Ų731%0.00837%0.366CS..Hα-helixtrans-66.7-42.2177.400000112.5V1251 L1252 G1253 K1258 L1259 L1286 W1289 I1329V1251-A1255 WeakPolarHBondContact O-CB 3.43Å; V1251-A1255 PolarHBondContact O-N 3.35Å; L1252-A1255 PolarHBondContact O-N 2.66Å; G1253-A1255 VanDerWaalsContact C-N 3.34Å; G1253-A1255 PolarHBondContact O-N 3.31Å; A1255-K1258 PolarHBondContact O-N 3.46Å; A1255-L1259 PolarHBondContact O-N 3.3Å; A1255-L1286 HydrophobicContact CB-CD2 4.12Å; A1255-W1289 HydrophobicContact CB-CE3 4.1Å; A1255-W1289 HydrophobicContact CB-CZ3 3.68Å; A1255-I1329 HydrophobicContact CB-CD1 4.23Å; A1255-I1329 HydrophobicContact CB-CG2 3.85Å
1256R83.9Confident78.3Confident121 Ų12176 Ų7646%0.45739%0.39SS..Hα-helixtrans-61.2-49.2172.3-71.9174.2-177.8-168.13.1111.1L1252 G1253 K1258 L1259 E1260 S1325 I1329L1252-R1256 VanDerWaalsContact O-CG 3.3Å; L1252-R1256 WeakPolarHBondContact O-CG 3.13Å; L1252-R1256 PolarHBondContact O-N 3.11Å; G1253-R1256 PolarHBondContact O-N 3Å; R1256-K1258 VanDerWaalsContact C-N 3.34Å; R1256-K1258 PolarHBondContact O-N 2.99Å; R1256-L1259 CarbonylContact O-C 3.51Å; R1256-L1259 WeakPolarHBondContact O-CA 3.39Å; R1256-L1259 WeakPolarHBondContact O-CB 3.47Å; R1256-L1259 PolarHBondContact O-N 3.36Å; R1256-E1260 PolarHBondContact O-N 3.07Å; R1256-S1325 PolarHBondContact NH2-OG 3.41Å; R1256-I1329 HydrophobicContact CG-CD1 3.78Å; R1256-I1329 HydrophobicContact CG-CG1 4.2Å
1257A83.3Confident77.1Confident63 Ų6372.2 Ų72.252%0.52137%0.37SS..Hα-helixtrans-60.2-40.5178.900000112.7G1253 Q1254 E1260 S1261G1253-A1257 WeakPolarHBondContact O-CB 3.42Å; G1253-A1257 PolarHBondContact O-N 3.15Å; Q1254-A1257 PolarHBondContact O-N 3.36Å; A1257-E1260 PolarHBondContact O-N 3.49Å; A1257-S1261 WeakPolarHBondContact O-CB 3.42Å; A1257-S1261 PolarHBondContact O-N 3.2Å
1258K80.3Confident76Confident73 Ų7370.5 Ų70.532%0.31737%0.367SS..Hα-helixtrans-61.2-45.1171.8-76.8-176.2-178.4170.20111.5Q1254 A1255 R1256 S1261 L1282 D1285 W1289Q1254-K1258 WeakPolarHBondContact O-CG 3.49Å; Q1254-K1258 PolarHBondContact O-N 3.07Å; A1255-K1258 PolarHBondContact O-N 3.46Å; R1256-K1258 VanDerWaalsContact C-N 3.34Å; R1256-K1258 PolarHBondContact O-N 2.99Å; K1258-S1261 PolarHBondContact O-N 3.35Å; K1258-S1261 PolarHBondContact O-OG 3.38Å; K1258-L1282 HydrophobicContact CB-CD1 4.36Å; K1258-L1282 HydrophobicContact CB-CD2 4.17Å; K1258-L1282 HydrophobicContact CD-CD1 3.55Å; K1258-D1285 IonicContact NZ-OD2 2.98Å; K1258-D1285 PolarHBondContact NZ-OD2 3Å; K1258-W1289 HydrophobicContact CD-CH2 3.96Å; K1258-W1289 HydrophobicContact CD-CZ3 4.48Å; K1258-W1289 VanDerWaalsContact NZ-CH2 3.26Å
1259L81.2Confident75Confident11 Ų1173.3 Ų73.36%0.05838%0.384CS..Hα-helixtrans-61.7-44175.5-87.3164.8000113.1A1255 R1256 S1261 W1262 I1329 R1332 V1333A1255-L1259 PolarHBondContact O-N 3.3Å; R1256-L1259 CarbonylContact O-C 3.51Å; R1256-L1259 WeakPolarHBondContact O-CA 3.39Å; R1256-L1259 WeakPolarHBondContact O-CB 3.47Å; R1256-L1259 PolarHBondContact O-N 3.36Å; L1259-S1261 VanDerWaalsContact C-N 3.28Å; L1259-S1261 PolarHBondContact O-N 3.01Å; L1259-W1262 HydrophobicContact CD2-CE3 3.87Å; L1259-W1262 HydrophobicContact CD2-CH2 4.5Å; L1259-W1262 HydrophobicContact CD2-CZ3 3.7Å; L1259-W1262 PolarHBondContact O-N 2.88Å; L1259-I1329 HydrophobicContact CD1-CB 4.27Å; L1259-I1329 HydrophobicContact CD1-CG1 4.2Å; L1259-I1329 HydrophobicContact CD1-CG2 3.9Å; L1259-R1332 HydrophobicContact CD1-CB 4.31Å; L1259-R1332 HydrophobicContact CD2-CB 4.13Å; L1259-V1333 HydrophobicContact CD1-CG2 4.27Å; L1259-V1333 HydrophobicContact CD2-CG2 3.85Å; L1259-V1333 HydrophobicContact CG-CG2 4.19Å
1260E76.7Confident74.2Confident130 Ų13075.9 Ų75.961%0.60740%0.401SS*.Hα-helixtrans-65.2-31.1177.7-123.867.1-122.600112.2R1256 A1257 W1262R1256-E1260 PolarHBondContact O-N 3.07Å; A1257-E1260 PolarHBondContact O-N 3.49Å; E1260-W1262 PolarHBondContact O-N 3.28Å
1261S75Confident73.4Confident80 Ų8071.1 Ų71.156%0.55938%0.383SS*.THydrogen-bonded Turntrans-69.6-15.1-18078.30000114.3A1257 K1258 L1259 K1263A1257-S1261 WeakPolarHBondContact O-CB 3.42Å; A1257-S1261 PolarHBondContact O-N 3.2Å; K1258-S1261 PolarHBondContact O-N 3.35Å; K1258-S1261 PolarHBondContact O-OG 3.38Å; L1259-S1261 VanDerWaalsContact C-N 3.28Å; L1259-S1261 PolarHBondContact O-N 3.01Å; S1261-K1263 VanDerWaalsContact C-N 3.29Å; S1261-K1263 PolarHBondContact O-N 3.47Å
1262W72.7Confident72.9Confident62 Ų6270.8 Ų70.824%0.23538%0.381CS..  trans-7769.5-175.8-71.1-8.5000113.5L1259 E1260 T1279 L1282 V1333 R1336L1259-W1262 HydrophobicContact CD2-CE3 3.87Å; L1259-W1262 HydrophobicContact CD2-CH2 4.5Å; L1259-W1262 HydrophobicContact CD2-CZ3 3.7Å; L1259-W1262 PolarHBondContact O-N 2.88Å; E1260-W1262 PolarHBondContact O-N 3.28Å; W1262-T1279 HydrophobicContact CH2-CG2 3.87Å; W1262-T1279 HydrophobicContact CZ3-CG2 4.42Å; W1262-L1282 HydrophobicContact CH2-CB 4.34Å; W1262-L1282 HydrophobicContact CH2-CD2 3.54Å; W1262-L1282 HydrophobicContact CH2-CG 4.49Å; W1262-L1282 HydrophobicContact CZ2-CB 4.08Å; W1262-L1282 HydrophobicContact CZ2-CD2 3.46Å; W1262-L1282 VanDerWaalsContact CZ2-CD2 3.46Å; W1262-L1282 HydrophobicContact CZ2-CG 4.41Å; W1262-L1282 HydrophobicContact CZ3-CD2 4.43Å; W1262-V1333 HydrophobicContact CH2-CG2 4.3Å; W1262-V1333 HydrophobicContact CZ3-CG2 4.45Å; W1262-R1336 HydrophobicContact CE3-CG 3.95Å; W1262-R1336 HydrophobicContact CZ3-CB 4.11Å; W1262-R1336 HydrophobicContact CZ3-CG 3.69Å
1263K54.5Low72.6Confident183 Ų18374.3 Ų74.380%0.79640%0.397SS*.  trans-69153.5172-67.6-172.2176.5-176.40112.8S1261 G1265S1261-K1263 VanDerWaalsContact C-N 3.29Å; S1261-K1263 PolarHBondContact O-N 3.47Å; K1263-G1265 PolarHBondContact O-N 3.02Å
1264E52.3Low72.5Confident157 Ų15778.6 Ų78.673%0.73441%0.406SS*.  trans-7482-178.1-60.1-168.2140.900112.4
1265G53.5Low72.3Confident28 Ų2876.1 Ų76.129%0.28939%0.394SS..  trans-75.6163.8167.800000113.1K1263 K1275K1263-G1265 PolarHBondContact O-N 3.02Å; G1265-K1275 PolarHBondContact O-NZ 3.48Å
1266P54.1Low72.2Confident103 Ų10376.3 Ų76.367%0.66940%0.395SS*.  trans-58.4152-171.422.6-34.4000115T1268P1266-T1268 PolarHBondContact O-N 3.35Å
1267Y62.5Low72.3Confident57 Ų5774.2 Ų74.222%0.22440%0.396CS..  trans-95.359.7-173.4-68.7-94.8000113I1272 T1343Y1267-I1272 HydrophobicContact CD1-CD1 3.91Å; Y1267-I1272 HydrophobicContact CD1-CG1 4.18Å; Y1267-T1343 HydrophobicContact CD1-CG2 4.23Å; Y1267-T1343 HydrophobicContact CE1-CG2 4.49Å
1268T66.1Low72.4Confident73 Ų7375 Ų7545%0.44839%0.388SS..  trans-83153163.467.90000110.3P1266 D1270 A1271 I1272P1266-T1268 PolarHBondContact O-N 3.35Å; T1268-D1270 VanDerWaalsContact C-N 3.28Å; T1268-D1270 PolarHBondContact O-N 2.93Å; T1268-A1271 PolarHBondContact O-N 3.15Å; T1268-A1271 WeakPolarHBondContact OG1-CB 3.27Å; T1268-A1271 PolarHBondContact OG1-N 3.25Å; T1268-I1272 WeakPolarHBondContact O-CG1 3.47Å; T1268-I1272 PolarHBondContact O-N 3.02Å
1269V69.4Low72.7Confident59 Ų5971.7 Ų71.736%0.35837%0.374SS..Hα-helixtrans-55.5-45.2179.3177.90000110.9A1271 I1272 Q1273 L1347V1269-A1271 PolarHBondContact O-N 3.42Å; V1269-I1272 PolarHBondContact O-N 3.2Å; V1269-Q1273 WeakPolarHBondContact O-CB 3.44Å; V1269-Q1273 PolarHBondContact O-N 3.34Å; V1269-L1347 HydrophobicContact CG2-CB 4.08Å
1270D73.5Confident73Confident135 Ų13574.8 Ų74.872%0.72239%0.387SS*.Hα-helixtrans-64.1-38.3176.3-65.5-37.1000112.9T1268 K1274T1268-D1270 VanDerWaalsContact C-N 3.28Å; T1268-D1270 PolarHBondContact O-N 2.93Å; D1270-K1274 VanDerWaalsContact O-CB 3.29Å; D1270-K1274 WeakPolarHBondContact O-CB 3.39Å; D1270-K1274 PolarHBondContact O-N 3.47Å
1271A73.1Confident73.5Confident26 Ų2673 Ų7322%0.21538%0.379CS..Hα-helixtrans-69.9-36.7177.700000112.3T1268 V1269 K1275T1268-A1271 PolarHBondContact O-N 3.15Å; T1268-A1271 WeakPolarHBondContact OG1-CB 3.27Å; T1268-A1271 PolarHBondContact OG1-N 3.25Å; V1269-A1271 PolarHBondContact O-N 3.42Å; A1271-K1275 VanDerWaalsContact O-CG 3.32Å; A1271-K1275 WeakPolarHBondContact O-CG 3.24Å; A1271-K1275 PolarHBondContact O-N 3.46Å
1272I77.2Confident74Confident0 Ų069.5 Ų69.50%035%0.354CS..Hα-helixtrans-70.4-44174.5-63.6163.1000109.9Y1267 T1268 V1269 K1274 K1275 I1276 L1340 T1343 H1344 L1347Y1267-I1272 HydrophobicContact CD1-CD1 3.91Å; Y1267-I1272 HydrophobicContact CD1-CG1 4.18Å; T1268-I1272 WeakPolarHBondContact O-CG1 3.47Å; T1268-I1272 PolarHBondContact O-N 3.02Å; V1269-I1272 PolarHBondContact O-N 3.2Å; I1272-K1274 VanDerWaalsContact C-N 3.28Å; I1272-K1274 PolarHBondContact O-N 3.48Å; I1272-K1275 CarbonylContact O-C 3.56Å; I1272-K1275 WeakPolarHBondContact O-CB 3.37Å; I1272-K1275 PolarHBondContact O-N 2.96Å; I1272-K1275 VanDerWaalsContact O-N 3.12Å; I1272-I1276 HydrophobicContact CG2-CD1 4.06Å; I1272-I1276 HydrophobicContact CG2-CG1 4.42Å; I1272-I1276 WeakPolarHBondContact O-CG1 3.49Å; I1272-I1276 PolarHBondContact O-N 3.48Å; I1272-L1340 HydrophobicContact CG2-CD2 4.29Å; I1272-T1343 HydrophobicContact CD1-CG2 3.98Å; I1272-H1344 HydrophobicContact CG2-CB 3.9Å; I1272-L1347 HydrophobicContact CD1-CD1 3.2Å
1273Q80.2Confident74.7Confident81 Ų8167.3 Ų67.338%0.37935%0.349SS..Hα-helixtrans-59.7-40.1175-175.561.710.700111.4V1269 I1276 T1277V1269-Q1273 WeakPolarHBondContact O-CB 3.44Å; V1269-Q1273 PolarHBondContact O-N 3.34Å; Q1273-I1276 PolarHBondContact O-N 3.18Å; Q1273-T1277 WeakPolarHBondContact O-CG2 3.32Å; Q1273-T1277 PolarHBondContact O-N 2.91Å; Q1273-T1277 PolarHBondContact O-OG1 2.88Å
1274K82.6Confident76.1Confident124 Ų12464.7 Ų64.754%0.53934%0.338SS..Hα-helixtrans-60.4-49.9171.4-172.9175.4-174.9-84.60111.6D1270 I1272 I1276 T1277 E1278D1270-K1274 VanDerWaalsContact O-CB 3.29Å; D1270-K1274 WeakPolarHBondContact O-CB 3.39Å; D1270-K1274 PolarHBondContact O-N 3.47Å; I1272-K1274 VanDerWaalsContact C-N 3.28Å; I1272-K1274 PolarHBondContact O-N 3.48Å; K1274-I1276 VanDerWaalsContact C-N 3.32Å; K1274-I1276 PolarHBondContact O-N 3.39Å; K1274-T1277 PolarHBondContact O-N 2.74Å; K1274-T1277 PolarHBondContact O-OG1 3.47Å; K1274-E1278 WeakPolarHBondContact CE-OE1 3.5Å; K1274-E1278 IonicContact NZ-OE1 3.74Å; K1274-E1278 PolarHBondContact NZ-OE1 2.85Å; K1274-E1278 WeakPolarHBondContact O-CG 3.43Å; K1274-E1278 PolarHBondContact O-N 3.06Å
1275K81.3Confident77.8Confident31 Ų3158.8 Ų58.814%0.13531%0.311CS..Hα-helixtrans-58.4-40.3175.3-73.1169.8-179169.90112.3G1265 A1271 I1272 T1277 E1278 T1279 L1340G1265-K1275 PolarHBondContact O-NZ 3.48Å; A1271-K1275 VanDerWaalsContact O-CG 3.32Å; A1271-K1275 WeakPolarHBondContact O-CG 3.24Å; A1271-K1275 PolarHBondContact O-N 3.46Å; I1272-K1275 CarbonylContact O-C 3.56Å; I1272-K1275 WeakPolarHBondContact O-CB 3.37Å; I1272-K1275 PolarHBondContact O-N 2.96Å; I1272-K1275 VanDerWaalsContact O-N 3.12Å; K1275-T1277 VanDerWaalsContact C-N 3.35Å; K1275-T1277 PolarHBondContact O-N 3.06Å; K1275-E1278 PolarHBondContact O-N 3.39Å; K1275-T1279 WeakPolarHBondContact O-CB 3.49Å; K1275-T1279 PolarHBondContact O-N 3.21Å; K1275-T1279 PolarHBondContact O-OG1 2.98Å; K1275-L1340 HydrophobicContact CB-CD1 3.93Å; K1275-L1340 HydrophobicContact CB-CD2 4.21Å; K1275-L1340 HydrophobicContact CD-CD2 4.25Å
1276I83.2Confident79.4Confident6 Ų657.6 Ų57.63%0.03130%0.298CS..Hα-helixtrans-59.8-44.9173.5-68.6166.9000110.3I1272 Q1273 K1274 T1279 K1280 L1340 E1341 H1344I1272-I1276 HydrophobicContact CG2-CD1 4.06Å; I1272-I1276 HydrophobicContact CG2-CG1 4.42Å; I1272-I1276 WeakPolarHBondContact O-CG1 3.49Å; I1272-I1276 PolarHBondContact O-N 3.48Å; Q1273-I1276 PolarHBondContact O-N 3.18Å; K1274-I1276 VanDerWaalsContact C-N 3.32Å; K1274-I1276 PolarHBondContact O-N 3.39Å; I1276-T1279 PolarHBondContact O-N 3.32Å; I1276-K1280 HydrophobicContact CG2-CD 3.9Å; I1276-K1280 VanDerWaalsContact O-CB 3.3Å; I1276-K1280 WeakPolarHBondContact O-CB 3.48Å; I1276-K1280 WeakPolarHBondContact O-CG 3.27Å; I1276-K1280 PolarHBondContact O-N 3.32Å; I1276-L1340 HydrophobicContact CD1-CB 4.34Å; I1276-L1340 HydrophobicContact CG1-CB 3.62Å; I1276-E1341 HydrophobicContact CD1-CG 4.25Å; I1276-E1341 HydrophobicContact CG2-CG 4.45Å; I1276-H1344 HydrophobicContact CD1-CB 3.77Å
1277T85.9Confident80.7Confident77 Ų7761.1 Ų61.147%0.47230%0.298SS..Hα-helixtrans-66.3-35.8176.958.40000113.2Q1273 K1274 K1275 Q1281Q1273-T1277 WeakPolarHBondContact O-CG2 3.32Å; Q1273-T1277 PolarHBondContact O-N 2.91Å; Q1273-T1277 PolarHBondContact O-OG1 2.88Å; K1274-T1277 PolarHBondContact O-N 2.74Å; K1274-T1277 PolarHBondContact O-OG1 3.47Å; K1275-T1277 VanDerWaalsContact C-N 3.35Å; K1275-T1277 PolarHBondContact O-N 3.06Å; T1277-Q1281 WeakPolarHBondContact O-CB 3.49Å; T1277-Q1281 PolarHBondContact O-N 3.26Å
1278E84.5Confident81.7Confident79 Ų7965.4 Ų65.437%0.36932%0.32SS..Hα-helixtrans-68-44.3175.1-70.7168.9176.300111.6K1274 K1275 Q1281 L1282K1274-E1278 WeakPolarHBondContact CE-OE1 3.5Å; K1274-E1278 IonicContact NZ-OE1 3.74Å; K1274-E1278 PolarHBondContact NZ-OE1 2.85Å; K1274-E1278 WeakPolarHBondContact O-CG 3.43Å; K1274-E1278 PolarHBondContact O-N 3.06Å; K1275-E1278 PolarHBondContact O-N 3.39Å; E1278-Q1281 PolarHBondContact O-N 3.25Å; E1278-L1282 PolarHBondContact O-N 2.96Å
1279T86.8Confident82.8Confident3 Ų363.5 Ų63.52%0.01831%0.305CS..Hα-helixtrans-63.1-44.1174.5-60.30000111.4W1262 K1275 I1276 Q1281 L1282 A1283 V1333 E1337W1262-T1279 HydrophobicContact CH2-CG2 3.87Å; W1262-T1279 HydrophobicContact CZ3-CG2 4.42Å; K1275-T1279 WeakPolarHBondContact O-CB 3.49Å; K1275-T1279 PolarHBondContact O-N 3.21Å; K1275-T1279 PolarHBondContact O-OG1 2.98Å; I1276-T1279 PolarHBondContact O-N 3.32Å; T1279-Q1281 VanDerWaalsContact C-N 3.28Å; T1279-Q1281 PolarHBondContact O-N 3.14Å; T1279-L1282 PolarHBondContact O-N 3.36Å; T1279-L1282 VanDerWaalsContact O-N 3.16Å; T1279-A1283 PolarHBondContact O-N 3.21Å; T1279-V1333 HydrophobicContact CG2-CG1 4.08Å; T1279-E1337 HydrophobicContact CG2-CB 3.79Å; T1279-E1337 HydrophobicContact CG2-CG 4.37Å
1280K87.4Confident83.8Confident76 Ų7664.2 Ų64.233%0.3330%0.304SS..Hα-helixtrans-65-29.5174.5-79.2176.4176.3171.90113.3I1276 K1284 E1337 E1341I1276-K1280 HydrophobicContact CG2-CD 3.9Å; I1276-K1280 VanDerWaalsContact O-CB 3.3Å; I1276-K1280 WeakPolarHBondContact O-CB 3.48Å; I1276-K1280 WeakPolarHBondContact O-CG 3.27Å; I1276-K1280 PolarHBondContact O-N 3.32Å; K1280-K1284 WeakPolarHBondContact O-CG 3.41Å; K1280-K1284 PolarHBondContact O-N 2.98Å; K1280-E1337 WeakPolarHBondContact CE-OE1 3.47Å; K1280-E1337 HydrophobicContact CG-CG 4.43Å; K1280-E1337 WeakPolarHBondContact CG-OE1 3.39Å; K1280-E1337 IonicContact NZ-OE1 2.78Å; K1280-E1341 WeakPolarHBondContact CE-OE1 3.49Å; K1280-E1341 IonicContact NZ-OE1 2.86Å; K1280-E1341 PolarHBondContact NZ-OE1 2.88Å
1281Q88.3Confident84.5Confident92 Ų9261.7 Ų61.743%0.4329%0.294SS..Hα-helixtrans-71.6-43.7171.1-17354.747.300110.9T1277 E1278 T1279 A1283 K1284 D1285T1277-Q1281 WeakPolarHBondContact O-CB 3.49Å; T1277-Q1281 PolarHBondContact O-N 3.26Å; E1278-Q1281 PolarHBondContact O-N 3.25Å; T1279-Q1281 VanDerWaalsContact C-N 3.28Å; T1279-Q1281 PolarHBondContact O-N 3.14Å; Q1281-A1283 VanDerWaalsContact C-N 3.28Å; Q1281-A1283 PolarHBondContact O-N 3.35Å; Q1281-K1284 WeakPolarHBondContact O-CA 3.28Å; Q1281-K1284 WeakPolarHBondContact O-CB 3.28Å; Q1281-K1284 PolarHBondContact O-N 3Å; Q1281-D1285 PolarHBondContact NE2-OD1 3.32Å; Q1281-D1285 PolarHBondContact O-N 3.11Å; Q1281-D1285 VanDerWaalsContact O-OD1 3.13Å
1282L85.4Confident85.2Confident7 Ų762.8 Ų62.84%0.03730%0.296CS..Hα-helixtrans-60.9-36173.3-175.255.7000112.3K1258 W1262 E1278 T1279 K1284 D1285 L1286 W1289 V1333K1258-L1282 HydrophobicContact CB-CD1 4.36Å; K1258-L1282 HydrophobicContact CB-CD2 4.17Å; K1258-L1282 HydrophobicContact CD-CD1 3.55Å; W1262-L1282 HydrophobicContact CH2-CB 4.34Å; W1262-L1282 HydrophobicContact CH2-CD2 3.54Å; W1262-L1282 HydrophobicContact CH2-CG 4.49Å; W1262-L1282 HydrophobicContact CZ2-CB 4.08Å; W1262-L1282 HydrophobicContact CZ2-CD2 3.46Å; W1262-L1282 VanDerWaalsContact CZ2-CD2 3.46Å; W1262-L1282 HydrophobicContact CZ2-CG 4.41Å; W1262-L1282 HydrophobicContact CZ3-CD2 4.43Å; E1278-L1282 PolarHBondContact O-N 2.96Å; T1279-L1282 PolarHBondContact O-N 3.36Å; T1279-L1282 VanDerWaalsContact O-N 3.16Å; L1282-K1284 VanDerWaalsContact C-N 3.29Å; L1282-K1284 PolarHBondContact O-N 3.42Å; L1282-D1285 HydrophobicContact CD1-CB 4.28Å; L1282-D1285 PolarHBondContact O-N 3.46Å; L1282-L1286 HydrophobicContact CD1-CG 4.47Å; L1282-L1286 HydrophobicContact CG-CD1 4.4Å; L1282-L1286 WeakPolarHBondContact O-CB 3.32Å; L1282-L1286 WeakPolarHBondContact O-CG 3.33Å; L1282-L1286 PolarHBondContact O-N 3.48Å; L1282-W1289 HydrophobicContact CD1-CH2 4.47Å; L1282-W1289 HydrophobicContact CD1-CZ3 3.93Å; L1282-V1333 HydrophobicContact CD2-CG2 3.84Å; L1282-V1333 HydrophobicContact CG-CG2 4.27Å
1283A86.5Confident85.9Confident17 Ų1762.9 Ų62.914%0.1430%0.296CS..Hα-helixtrans-64.4-30.9173.600000113T1279 Q1281 R1287 V1333T1279-A1283 PolarHBondContact O-N 3.21Å; Q1281-A1283 VanDerWaalsContact C-N 3.28Å; Q1281-A1283 PolarHBondContact O-N 3.35Å; A1283-R1287 WeakPolarHBondContact O-CG 3.42Å; A1283-R1287 PolarHBondContact O-N 3.35Å; A1283-V1333 HydrophobicContact CB-CG1 4.25Å
1284K84.9Confident86.3Confident127 Ų12762.1 Ų62.155%0.55230%0.295SS*.Hα-helixtrans-73.7-45.1170.7-70.5172.5-176.9173.70111.8K1280 Q1281 L1282 L1286 R1287 Q1288K1280-K1284 WeakPolarHBondContact O-CG 3.41Å; K1280-K1284 PolarHBondContact O-N 2.98Å; Q1281-K1284 WeakPolarHBondContact O-CA 3.28Å; Q1281-K1284 WeakPolarHBondContact O-CB 3.28Å; Q1281-K1284 PolarHBondContact O-N 3Å; L1282-K1284 VanDerWaalsContact C-N 3.29Å; L1282-K1284 PolarHBondContact O-N 3.42Å; K1284-L1286 VanDerWaalsContact C-N 3.27Å; K1284-L1286 PolarHBondContact O-N 3.06Å; K1284-R1287 PolarHBondContact O-N 2.92Å; K1284-R1287 VanDerWaalsContact O-N 3.11Å; K1284-Q1288 PolarHBondContact O-N 3.38Å
1285D87.1Confident86.7Confident33 Ų3359.3 Ų59.318%0.17629%0.288CS..Hα-helixtrans-55.7-46.4175.8-62.70.9000109.6K1258 Q1281 L1282 R1287 Q1288 W1289K1258-D1285 IonicContact NZ-OD2 2.98Å; K1258-D1285 PolarHBondContact NZ-OD2 3Å; Q1281-D1285 PolarHBondContact NE2-OD1 3.32Å; Q1281-D1285 PolarHBondContact O-N 3.11Å; Q1281-D1285 VanDerWaalsContact O-OD1 3.13Å; L1282-D1285 HydrophobicContact CD1-CB 4.28Å; L1282-D1285 PolarHBondContact O-N 3.46Å; D1285-R1287 PolarHBondContact O-N 3.11Å; D1285-Q1288 WeakPolarHBondContact O-CB 3.34Å; D1285-Q1288 PolarHBondContact O-N 3.49Å; D1285-Q1288 VanDerWaalsContact O-N 3.1Å; D1285-W1289 HydrophobicContact CB-CD2 4.34Å; D1285-W1289 HydrophobicContact CB-CE3 4.32Å; D1285-W1289 HydrophobicContact CB-CZ2 4.49Å; D1285-W1289 HydrophobicContact CB-CZ3 4.4Å; D1285-W1289 VanDerWaalsContact O-CB 3.29Å; D1285-W1289 WeakPolarHBondContact O-CB 3.31Å; D1285-W1289 PolarHBondContact O-N 3.1Å
1286L86.3Confident87.2Confident3 Ų357.9 Ų57.92%0.01628%0.282CS..Hα-helixtrans-57.8-41.1175.5-78171.2000112.9A1255 L1282 K1284 Q1288 W1289 Q1290 W1326 I1329 V1333A1255-L1286 HydrophobicContact CB-CD2 4.12Å; L1282-L1286 HydrophobicContact CD1-CG 4.47Å; L1282-L1286 HydrophobicContact CG-CD1 4.4Å; L1282-L1286 WeakPolarHBondContact O-CB 3.32Å; L1282-L1286 WeakPolarHBondContact O-CG 3.33Å; L1282-L1286 PolarHBondContact O-N 3.48Å; K1284-L1286 VanDerWaalsContact C-N 3.27Å; K1284-L1286 PolarHBondContact O-N 3.06Å; L1286-Q1288 VanDerWaalsContact C-N 3.29Å; L1286-Q1288 PolarHBondContact O-N 3.22Å; L1286-W1289 HydrophobicContact CD2-CE3 4.06Å; L1286-W1289 HydrophobicContact CG-CE3 4.48Å; L1286-W1289 PolarHBondContact O-N 3.3Å; L1286-Q1290 PolarHBondContact O-N 2.88Å; L1286-W1326 HydrophobicContact CB-CH2 4.21Å; L1286-W1326 HydrophobicContact CB-CZ2 4.45Å; L1286-W1326 HydrophobicContact CD2-CH2 3.5Å; L1286-W1326 HydrophobicContact CD2-CZ2 4.2Å; L1286-W1326 HydrophobicContact CD2-CZ3 3.75Å; L1286-W1326 HydrophobicContact CG-CH2 4.47Å; L1286-W1326 WeakPolarHBondContact O-CH2 3.42Å; L1286-W1326 VanDerWaalsContact O-CZ2 3.23Å; L1286-W1326 WeakPolarHBondContact O-CZ2 3.43Å; L1286-I1329 HydrophobicContact CD1-CG2 4.27Å; L1286-I1329 HydrophobicContact CD2-CG2 3.69Å; L1286-V1333 HydrophobicContact CD1-CB 4.01Å; L1286-V1333 HydrophobicContact CD1-CG1 4.16Å; L1286-V1333 HydrophobicContact CD1-CG2 3.73Å
1287R83.3Confident87.7Confident178 Ų17858.7 Ų58.767%0.67229%0.287SS*.Hα-helixtrans-65.6-31.5176.4-72175.1-169.2176.15.2113.1A1283 K1284 D1285A1283-R1287 WeakPolarHBondContact O-CG 3.42Å; A1283-R1287 PolarHBondContact O-N 3.35Å; K1284-R1287 PolarHBondContact O-N 2.92Å; K1284-R1287 VanDerWaalsContact O-N 3.11Å; D1285-R1287 PolarHBondContact O-N 3.11Å
1288Q83.3Confident88Confident146 Ų14660.3 Ų60.368%0.68229%0.292SS*.Hα-helixtrans-74.9-42.1173.6-176.3177.3-1.900111.2K1284 D1285 L1286 Q1290 T1291K1284-Q1288 PolarHBondContact O-N 3.38Å; D1285-Q1288 WeakPolarHBondContact O-CB 3.34Å; D1285-Q1288 PolarHBondContact O-N 3.49Å; D1285-Q1288 VanDerWaalsContact O-N 3.1Å; L1286-Q1288 VanDerWaalsContact C-N 3.29Å; L1286-Q1288 PolarHBondContact O-N 3.22Å; Q1288-Q1290 VanDerWaalsContact C-N 3.26Å; Q1288-Q1290 PolarHBondContact O-N 3.16Å; Q1288-T1291 PolarHBondContact O-N 2.8Å; Q1288-T1291 PolarHBondContact O-OG1 3.2Å
1289W89.1Confident88.4Confident34 Ų3458.2 Ų58.213%0.12928%0.283CS..Hα-helixtrans-65.9-24.5177.6-74.7-11.6000114V1251 Q1254 A1255 K1258 L1282 D1285 L1286 T1291 N1292 W1326V1251-W1289 HydrophobicContact CG1-CB 3.4Å; V1251-W1289 VanDerWaalsContact CG1-CB 3.4Å; V1251-W1289 HydrophobicContact CG1-CD2 3.7Å; V1251-W1289 HydrophobicContact CG1-CE3 4.12Å; V1251-W1289 HydrophobicContact CG1-CG 3.39Å; Q1254-W1289 HydrophobicContact CB-CH2 3.97Å; Q1254-W1289 HydrophobicContact CB-CZ2 4.32Å; A1255-W1289 HydrophobicContact CB-CE3 4.1Å; A1255-W1289 HydrophobicContact CB-CZ3 3.68Å; K1258-W1289 HydrophobicContact CD-CH2 3.96Å; K1258-W1289 HydrophobicContact CD-CZ3 4.48Å; K1258-W1289 VanDerWaalsContact NZ-CH2 3.26Å; L1282-W1289 HydrophobicContact CD1-CH2 4.47Å; L1282-W1289 HydrophobicContact CD1-CZ3 3.93Å; D1285-W1289 HydrophobicContact CB-CD2 4.34Å; D1285-W1289 HydrophobicContact CB-CE3 4.32Å; D1285-W1289 HydrophobicContact CB-CZ2 4.49Å; D1285-W1289 HydrophobicContact CB-CZ3 4.4Å; D1285-W1289 VanDerWaalsContact O-CB 3.29Å; D1285-W1289 WeakPolarHBondContact O-CB 3.31Å; D1285-W1289 PolarHBondContact O-N 3.1Å; L1286-W1289 HydrophobicContact CD2-CE3 4.06Å; L1286-W1289 HydrophobicContact CG-CE3 4.48Å; L1286-W1289 PolarHBondContact O-N 3.3Å; W1289-T1291 PolarHBondContact O-N 3.46Å; W1289-N1292 PolarHBondContact O-N 3.45Å; W1289-N1292 VanDerWaalsContact O-N 3.14Å; W1289-W1326 HydrophobicContact CB-CH2 3.74Å; W1289-W1326 HydrophobicContact CB-CZ3 4.16Å
1290Q89.1Confident88.7Confident74 Ų7458 Ų5835%0.34628%0.282SS..Hα-helixtrans-55.6-36.6174.6-166.8177.1-26.700112L1286 Q1288 N1292 V1293 D1294 W1326L1286-Q1290 PolarHBondContact O-N 2.88Å; Q1288-Q1290 VanDerWaalsContact C-N 3.26Å; Q1288-Q1290 PolarHBondContact O-N 3.16Å; Q1290-N1292 PolarHBondContact O-N 3.29Å; Q1290-V1293 WeakPolarHBondContact O-CB 3.48Å; Q1290-V1293 PolarHBondContact O-N 2.83Å; Q1290-D1294 VanDerWaalsContact O-CG 3.27Å; Q1290-D1294 PolarHBondContact O-N 3.13Å; Q1290-W1326 HydrophobicContact CB-CH2 4.39Å; Q1290-W1326 HydrophobicContact CB-CZ2 3.67Å; Q1290-W1326 HydrophobicContact CG-CZ2 4.06Å
1291T88Confident88.9Confident82 Ų8259 Ų5950%0.50329%0.291SS..Hα-helixtrans-58.9-33179.7-54.30000112.9Q1288 W1289 D1294 V1295Q1288-T1291 PolarHBondContact O-N 2.8Å; Q1288-T1291 PolarHBondContact O-OG1 3.2Å; W1289-T1291 PolarHBondContact O-N 3.46Å; T1291-D1294 PolarHBondContact O-N 2.95Å; T1291-V1295 WeakPolarHBondContact O-CB 3.29Å; T1291-V1295 VanDerWaalsContact O-CG2 3.28Å; T1291-V1295 WeakPolarHBondContact O-CG2 3.29Å; T1291-V1295 PolarHBondContact O-N 3.08Å
1292N88.3Confident89.2Confident49 Ų4957.4 Ų57.426%0.26228%0.282SS..Hα-helixtrans-71.4-38.9177.5-65.323.6000111.1W1289 Q1290 A1296W1289-N1292 PolarHBondContact O-N 3.45Å; W1289-N1292 VanDerWaalsContact O-N 3.14Å; Q1290-N1292 PolarHBondContact O-N 3.29Å; N1292-A1296 WeakPolarHBondContact O-CB 3.41Å; N1292-A1296 PolarHBondContact O-N 3.41Å
1293V91.5Very high89.5Confident1 Ų157.1 Ų57.11%0.00628%0.281CS..Hα-helixtrans-66.6-41.6174.1177.90000110.7A1248 Q1290 A1296 N1297 I1322 W1326A1248-V1293 HydrophobicContact CB-CG2 4.32Å; Q1290-V1293 WeakPolarHBondContact O-CB 3.48Å; Q1290-V1293 PolarHBondContact O-N 2.83Å; V1293-A1296 PolarHBondContact O-N 3.29Å; V1293-N1297 WeakPolarHBondContact O-CB 3.42Å; V1293-N1297 PolarHBondContact O-N 3.19Å; V1293-N1297 PolarHBondContact O-ND2 2.97Å; V1293-I1322 HydrophobicContact CG1-CG2 3.99Å; V1293-W1326 HydrophobicContact CG1-CG 4.36Å; V1293-W1326 HydrophobicContact CG2-CD2 3.98Å; V1293-W1326 HydrophobicContact CG2-CE3 3.7Å; V1293-W1326 HydrophobicContact CG2-CG 4.42Å; V1293-W1326 HydrophobicContact CG2-CZ3 4.15Å
1294D89.3Confident89.7Confident65 Ų6558.2 Ų58.235%0.34828%0.284SS..Hα-helixtrans-63.8-42.1176.8-64.7-24.1000111.5Q1290 T1291 N1297 D1298Q1290-D1294 VanDerWaalsContact O-CG 3.27Å; Q1290-D1294 PolarHBondContact O-N 3.13Å; T1291-D1294 PolarHBondContact O-N 2.95Å; D1294-N1297 WeakPolarHBondContact O-CB 3.42Å; D1294-N1297 PolarHBondContact O-N 2.95Å; D1294-D1298 WeakPolarHBondContact O-CB 3.16Å; D1294-D1298 PolarHBondContact O-N 2.72Å
1295V91.6Very high90Very high66 Ų6659.2 Ų59.240%0.428%0.284SS..Hα-helixtrans-64-43.1174.9168.30000111.8A1244 T1291 N1297 D1298 L1299A1244-V1295 HydrophobicContact CB-CG1 4.16Å; T1291-V1295 WeakPolarHBondContact O-CB 3.29Å; T1291-V1295 VanDerWaalsContact O-CG2 3.28Å; T1291-V1295 WeakPolarHBondContact O-CG2 3.29Å; T1291-V1295 PolarHBondContact O-N 3.08Å; V1295-N1297 VanDerWaalsContact C-N 3.3Å; V1295-N1297 PolarHBondContact O-N 2.93Å; V1295-D1298 PolarHBondContact O-N 2.87Å; V1295-L1299 HydrophobicContact CG1-CD1 4.06Å; V1295-L1299 WeakPolarHBondContact O-CB 3.49Å; V1295-L1299 WeakPolarHBondContact O-CG 3.21Å; V1295-L1299 PolarHBondContact O-N 2.82Å
1296A91.9Very high90.1Very high1 Ų160.9 Ų60.91%0.00829%0.293CS..Hα-helixtrans-62.7-38174.600000111.9W1241 A1244 A1248 N1292 V1293 A1300W1241-A1296 PolarHBondContact NE1-O 3.39Å; A1244-A1296 HydrophobicContact CB-CB 4.22Å; A1248-A1296 HydrophobicContact CB-CB 4.06Å; N1292-A1296 WeakPolarHBondContact O-CB 3.41Å; N1292-A1296 PolarHBondContact O-N 3.41Å; V1293-A1296 PolarHBondContact O-N 3.29Å; A1296-A1300 WeakPolarHBondContact O-CB 3.39Å; A1296-A1300 PolarHBondContact O-N 3.45Å
1297N93.2Very high90.4Very high23 Ų2361.2 Ų61.212%0.12330%0.295CS..Hα-helixtrans-67.5-44174.8-75.5-27.9000112.7V1293 D1294 V1295 L1299 A1300 L1301 T1319 N1323V1293-N1297 WeakPolarHBondContact O-CB 3.42Å; V1293-N1297 PolarHBondContact O-N 3.19Å; V1293-N1297 PolarHBondContact O-ND2 2.97Å; D1294-N1297 WeakPolarHBondContact O-CB 3.42Å; D1294-N1297 PolarHBondContact O-N 2.95Å; V1295-N1297 VanDerWaalsContact C-N 3.3Å; V1295-N1297 PolarHBondContact O-N 2.93Å; N1297-L1299 VanDerWaalsContact C-N 3.35Å; N1297-L1299 PolarHBondContact O-N 3.06Å; N1297-A1300 WeakPolarHBondContact O-CB 3.12Å; N1297-A1300 PolarHBondContact O-N 2.9Å; N1297-L1301 WeakPolarHBondContact O-CB 3.03Å; N1297-L1301 VanDerWaalsContact O-CG 3.3Å; N1297-L1301 WeakPolarHBondContact O-CG 3.35Å; N1297-L1301 PolarHBondContact O-N 3.33Å; N1297-T1319 VanDerWaalsContact OD1-CG2 3.31Å; N1297-T1319 WeakPolarHBondContact OD1-CG2 3.43Å; N1297-N1323 PolarHBondContact ND2-OD1 3.37Å; N1297-N1323 PolarHBondContact OD1-ND2 2.96Å; N1297-N1323 PolarHBondContact OD1-OD1 2.78Å
1298D92.4Very high90.5Very high111 Ų11157 Ų5759%0.59429%0.292SS*.Hα-helixtrans-64.7-39.9178.5-83.9-15.4000111.5D1294 V1295 L1301 K1302D1294-D1298 WeakPolarHBondContact O-CB 3.16Å; D1294-D1298 PolarHBondContact O-N 2.72Å; V1295-D1298 PolarHBondContact O-N 2.87Å; D1298-L1301 PolarHBondContact O-N 3.3Å; D1298-K1302 WeakPolarHBondContact O-CB 3.26Å; D1298-K1302 PolarHBondContact O-N 2.84Å
1299L93Very high90.4Very high34 Ų3453.1 Ų53.118%0.17829%0.285CS..Hα-helixtrans-69-37.3173.2-71.3171.6000112W1241 A1244 V1295 N1297 K1302 L1303W1241-L1299 HydrophobicContact CB-CB 4.1Å; W1241-L1299 HydrophobicContact CG-CB 4.41Å; A1244-L1299 HydrophobicContact CB-CD1 3.71Å; V1295-L1299 HydrophobicContact CG1-CD1 4.06Å; V1295-L1299 WeakPolarHBondContact O-CB 3.49Å; V1295-L1299 WeakPolarHBondContact O-CG 3.21Å; V1295-L1299 PolarHBondContact O-N 2.82Å; N1297-L1299 VanDerWaalsContact C-N 3.35Å; N1297-L1299 PolarHBondContact O-N 3.06Å; L1299-K1302 HydrophobicContact CD2-CD 4.49Å; L1299-K1302 WeakPolarHBondContact O-CB 3.49Å; L1299-K1302 PolarHBondContact O-N 3.46Å; L1299-L1303 WeakPolarHBondContact O-CG 3.47Å; L1299-L1303 PolarHBondContact O-N 3.36Å
1300A92.8Very high90.5Very high0 Ų052 Ų520%028%0.282CS..Hα-helixtrans-60.3-50.6171.200000111.1A1296 N1297 K1302 L1303 L1304 V1315 T1319A1296-A1300 WeakPolarHBondContact O-CB 3.39Å; A1296-A1300 PolarHBondContact O-N 3.45Å; N1297-A1300 WeakPolarHBondContact O-CB 3.12Å; N1297-A1300 PolarHBondContact O-N 2.9Å; A1300-K1302 PolarHBondContact O-N 2.99Å; A1300-L1303 WeakPolarHBondContact O-CB 3.46Å; A1300-L1303 PolarHBondContact O-N 3.35Å; A1300-L1303 VanDerWaalsContact O-N 3.08Å; A1300-L1304 VanDerWaalsContact O-CG 3.29Å; A1300-L1304 WeakPolarHBondContact O-CG 3.48Å; A1300-L1304 PolarHBondContact O-N 3.39Å; A1300-V1315 HydrophobicContact CB-CG1 3.8Å; A1300-T1319 HydrophobicContact CB-CG2 3.81Å; A1300-T1319 WeakPolarHBondContact CB-OG1 3.28Å
1301L92.5Very high90.4Very high96 Ų9650.7 Ų50.750%0.50328%0.277SS..Hα-helixtrans-61.6-32.2177.9-71.9170.3000112.3N1297 D1298 R1305N1297-L1301 WeakPolarHBondContact O-CB 3.03Å; N1297-L1301 VanDerWaalsContact O-CG 3.3Å; N1297-L1301 WeakPolarHBondContact O-CG 3.35Å; N1297-L1301 PolarHBondContact O-N 3.33Å; D1298-L1301 PolarHBondContact O-N 3.3Å; L1301-R1305 WeakPolarHBondContact O-CB 3.32Å; L1301-R1305 PolarHBondContact O-N 2.94Å; L1301-R1305 VanDerWaalsContact O-N 3.17Å
1302K92.9Very high90.6Very high58 Ų5848.4 Ų48.425%0.25226%0.263SS..Hα-helixtrans-61.6-54.2169.1-172.7-168-179.2-164.80110.8D1237 D1298 L1299 A1300 L1304 R1305 D1306D1237-K1302 IonicContact OD1-NZ 3.7Å; D1237-K1302 PolarHBondContact OD1-NZ 2.97Å; D1237-K1302 WeakPolarHBondContact OD2-CE 3.32Å; D1237-K1302 IonicContact OD2-NZ 3.91Å; D1237-K1302 PolarHBondContact OD2-NZ 3.41Å; D1298-K1302 WeakPolarHBondContact O-CB 3.26Å; D1298-K1302 PolarHBondContact O-N 2.84Å; L1299-K1302 HydrophobicContact CD2-CD 4.49Å; L1299-K1302 WeakPolarHBondContact O-CB 3.49Å; L1299-K1302 PolarHBondContact O-N 3.46Å; A1300-K1302 PolarHBondContact O-N 2.99Å; K1302-L1304 PolarHBondContact O-N 3.44Å; K1302-R1305 PolarHBondContact O-N 2.83Å; K1302-D1306 WeakPolarHBondContact CG-OD2 3.37Å; K1302-D1306 WeakPolarHBondContact O-CB 3.48Å; K1302-D1306 PolarHBondContact O-N 3.15Å
1303L93.5Very high90.5Very high1 Ų154.2 Ų54.21%0.00528%0.281CS..Hα-helixtrans-58.1-48.1178.8-71.5-179.6000112.7V1156 D1237 W1241 L1299 A1300 R1305 Y1307 V1315V1156-L1303 HydrophobicContact CG1-CB 4.03Å; V1156-L1303 HydrophobicContact CG1-CD1 4.31Å; V1156-L1303 HydrophobicContact CG1-CD2 3.9Å; V1156-L1303 HydrophobicContact CG1-CG 4.32Å; D1237-L1303 HydrophobicContact CB-CD2 3.68Å; W1241-L1303 HydrophobicContact CB-CD1 3.53Å; W1241-L1303 HydrophobicContact CB-CG 4.38Å; W1241-L1303 HydrophobicContact CD2-CD1 3.75Å; W1241-L1303 HydrophobicContact CE3-CD1 3.89Å; W1241-L1303 HydrophobicContact CG-CD1 3.58Å; L1299-L1303 WeakPolarHBondContact O-CG 3.47Å; L1299-L1303 PolarHBondContact O-N 3.36Å; A1300-L1303 WeakPolarHBondContact O-CB 3.46Å; A1300-L1303 PolarHBondContact O-N 3.35Å; A1300-L1303 VanDerWaalsContact O-N 3.08Å; L1303-R1305 VanDerWaalsContact C-N 3.25Å; L1303-R1305 PolarHBondContact O-N 2.69Å; L1303-Y1307 HydrophobicContact CD2-CD2 3.7Å; L1303-Y1307 HydrophobicContact CD2-CE2 3.71Å; L1303-Y1307 PolarHBondContact O-N 3.26Å; L1303-Y1307 VanDerWaalsContact O-N 3.11Å; L1303-V1315 HydrophobicContact CB-CG1 4.21Å; L1303-V1315 HydrophobicContact CB-CG2 4.31Å; L1303-V1315 HydrophobicContact CD1-CG1 4.23Å; L1303-V1315 HydrophobicContact CD1-CG2 3.77Å
1304L89.7Confident90.1Very high40 Ų4056.9 Ų56.921%0.20929%0.293CS..Hα-helixtrans-60.2-35-179.9-67-177.5000112.4A1300 K1302 S1308 T1312 V1315 H1316A1300-L1304 VanDerWaalsContact O-CG 3.29Å; A1300-L1304 WeakPolarHBondContact O-CG 3.48Å; A1300-L1304 PolarHBondContact O-N 3.39Å; K1302-L1304 PolarHBondContact O-N 3.44Å; L1304-S1308 WeakPolarHBondContact O-CB 3.37Å; L1304-T1312 HydrophobicContact CD2-CG2 4.37Å; L1304-V1315 HydrophobicContact CD2-CB 3.95Å; L1304-V1315 HydrophobicContact CD2-CG1 3.93Å; L1304-V1315 HydrophobicContact CG-CG1 4.08Å; L1304-H1316 HydrophobicContact CD2-CB 4.29Å
1305R92.3Very high90.3Very high148 Ų14853.8 Ų53.856%0.55828%0.276SS*.Hα-helixtrans-80.7-55.1-179.7-178.5-172.465.9-117.6-8.1111.8L1301 K1302 L1303 Y1307 S1308L1301-R1305 WeakPolarHBondContact O-CB 3.32Å; L1301-R1305 PolarHBondContact O-N 2.94Å; L1301-R1305 VanDerWaalsContact O-N 3.17Å; K1302-R1305 PolarHBondContact O-N 2.83Å; L1303-R1305 VanDerWaalsContact C-N 3.25Å; L1303-R1305 PolarHBondContact O-N 2.69Å; R1305-Y1307 VanDerWaalsContact C-N 3.34Å; R1305-Y1307 PolarHBondContact O-N 3.49Å; R1305-S1308 PolarHBondContact O-OG 2.62Å
1306D88.4Confident90Very high69 Ų6954.9 Ų54.937%0.36928%0.277SS..Hα-helixtrans-77.9-21.5-166.4-60.9-17.5000112K1302K1302-D1306 WeakPolarHBondContact CG-OD2 3.37Å; K1302-D1306 WeakPolarHBondContact O-CB 3.48Å; K1302-D1306 PolarHBondContact O-N 3.15Å
1307Y92.5Very high89.7Confident10 Ų1060.1 Ų60.14%0.03930%0.302CS..THydrogen-bonded Turntrans-117.227.1177.4-53.2-64.3000113.8V1156 Q1230 E1233 M1234 D1237 L1303 R1305 A1309 D1310V1156-Y1307 HydrophobicContact CG1-CD2 4.13Å; V1156-Y1307 HydrophobicContact CG1-CG 4.45Å; Q1230-Y1307 HydrophobicContact CG-CD1 4.36Å; Q1230-Y1307 HydrophobicContact CG-CE1 4.18Å; E1233-Y1307 VanDerWaalsContact C-OH 3.24Å; E1233-Y1307 PolarHBondContact O-OH 3.23Å; M1234-Y1307 VanDerWaalsContact CA-CZ 3.46Å; M1234-Y1307 WeakPolarHBondContact CA-OH 3.49Å; M1234-Y1307 HydrophobicContact CB-CD1 3.94Å; M1234-Y1307 HydrophobicContact CB-CD2 4.44Å; M1234-Y1307 HydrophobicContact CB-CE1 3.64Å; M1234-Y1307 HydrophobicContact CB-CE2 4.17Å; M1234-Y1307 HydrophobicContact CB-CG 4.34Å; M1234-Y1307 HydrophobicContact CE-CD1 3.69Å; M1234-Y1307 HydrophobicContact CE-CE1 4.42Å; M1234-Y1307 HydrophobicContact CE-CG 4.02Å; M1234-Y1307 HydrophobicContact CG-CD1 3.9Å; M1234-Y1307 HydrophobicContact CG-CD2 3.9Å; M1234-Y1307 HydrophobicContact CG-CE1 4.06Å; M1234-Y1307 HydrophobicContact CG-CE2 4.06Å; M1234-Y1307 HydrophobicContact CG-CG 3.83Å; M1234-Y1307 PolarHBondContact N-OH 3.09Å; D1237-Y1307 HydrophobicContact CB-CE2 4.02Å; D1237-Y1307 PolarHBondContact OD2-OH 3.3Å; L1303-Y1307 HydrophobicContact CD2-CD2 3.7Å; L1303-Y1307 HydrophobicContact CD2-CE2 3.71Å; L1303-Y1307 PolarHBondContact O-N 3.26Å; L1303-Y1307 VanDerWaalsContact O-N 3.11Å; R1305-Y1307 VanDerWaalsContact C-N 3.34Å; R1305-Y1307 PolarHBondContact O-N 3.49Å; Y1307-A1309 PolarHBondContact O-N 3.46Å; Y1307-D1310 PolarHBondContact O-N 3.11Å
1308S85.9Confident89.4Confident89 Ų8960.4 Ų60.462%0.62230%0.304SS*.THydrogen-bonded Turntrans-61.1-7.1-178.848.90000116.5L1304 R1305L1304-S1308 WeakPolarHBondContact O-CB 3.37Å; R1305-S1308 PolarHBondContact O-OG 2.62Å
1309A80.9Confident89.3Confident64 Ų6456 Ų5653%0.52928%0.281SS..THydrogen-bonded Turntrans-84.5-18.9172.200000113.8Y1307Y1307-A1309 PolarHBondContact O-N 3.46Å
1310D90.8Very high88.9Confident11 Ų1159.4 Ų59.46%0.05930%0.296CS..SBendtrans-99.8173.4-179.6-77.7-70.9000111.3R1153 V1154 V1156 R1227 M1234 Y1307 T1312R1153-D1310 VanDerWaalsContact CA-OD1 3.23Å; R1153-D1310 WeakPolarHBondContact CA-OD1 3.34Å; V1154-D1310 PolarHBondContact N-OD1 2.93Å; V1154-D1310 WeakPolarHBondContact O-CB 3.45Å; V1156-D1310 HydrophobicContact CG2-CB 3.66Å; R1227-D1310 IonicContact CZ-OD1 3.35Å; R1227-D1310 IonicContact CZ-OD2 2.73Å; R1227-D1310 IonicContact NH1-OD1 3.32Å; R1227-D1310 IonicContact NH1-OD2 2.71Å; R1227-D1310 PolarHBondContact NH1-OD2 3.19Å; R1227-D1310 IonicContact NH2-OD1 3.2Å; R1227-D1310 PolarHBondContact NH2-OD1 3.22Å; R1227-D1310 IonicContact NH2-OD2 3.4Å; R1227-D1310 PolarHBondContact NH2-OD2 3.35Å; M1234-D1310 HydrophobicContact CE-CB 4.08Å; M1234-D1310 VanDerWaalsContact CE-OD2 3.24Å; M1234-D1310 WeakPolarHBondContact CE-OD2 3.23Å; Y1307-D1310 PolarHBondContact O-N 3.11Å; D1310-T1312 PolarHBondContact O-N 3.41Å
1311D87.4Confident88.7Confident47 Ų4764 Ų6425%0.25132%0.32SS..BIsolated β-bridgetrans-79.4105.9-179.6-164.4-27.2000110.7V1154 M1155 V1156 R1313V1154-D1311 PolarHBondContact O-N 3.43Å; M1155-D1311 WeakPolarHBondContact CA-O 3.25Å; V1156-D1311 PolarHBondContact N-O 2.97Å; D1311-R1313 VanDerWaalsContact OD1-CB 3.24Å; D1311-R1313 WeakPolarHBondContact OD1-CB 3.45Å; D1311-R1313 VanDerWaalsContact OD1-CD 3.24Å; D1311-R1313 WeakPolarHBondContact OD1-CD 3.45Å; D1311-R1313 WeakPolarHBondContact OD1-CG 3.32Å; D1311-R1313 PolarHBondContact OD1-N 2.9Å; D1311-R1313 IonicContact OD1-NE 2.72Å; D1311-R1313 IonicContact OD2-CZ 3.45Å; D1311-R1313 IonicContact OD2-NE 2.71Å; D1311-R1313 IonicContact OD2-NH1 3.5Å; D1311-R1313 PolarHBondContact OD2-NH1 2.79Å
1312T92.5Very high88.5Confident34 Ų3459.6 Ų59.621%0.20930%0.297CS..  trans-94.73.3-175.848.60000114.2V1156 L1304 D1310 K1314 V1315 H1316V1156-T1312 HydrophobicContact CB-CG2 4.27Å; V1156-T1312 HydrophobicContact CG2-CG2 3.83Å; L1304-T1312 HydrophobicContact CD2-CG2 4.37Å; D1310-T1312 PolarHBondContact O-N 3.41Å; T1312-K1314 PolarHBondContact O-N 2.92Å; T1312-V1315 PolarHBondContact O-N 2.99Å; T1312-H1316 PolarHBondContact O-N 3.35Å
1313R85.1Confident88.4Confident170 Ų17058.7 Ų58.764%0.64230%0.295SS*.Hα-helixtrans-60.8-37.9-172-71.1166.8-179.2151.1-6.5114.2D1311 V1315 H1316 M1317D1311-R1313 VanDerWaalsContact OD1-CB 3.24Å; D1311-R1313 WeakPolarHBondContact OD1-CB 3.45Å; D1311-R1313 VanDerWaalsContact OD1-CD 3.24Å; D1311-R1313 WeakPolarHBondContact OD1-CD 3.45Å; D1311-R1313 WeakPolarHBondContact OD1-CG 3.32Å; D1311-R1313 PolarHBondContact OD1-N 2.9Å; D1311-R1313 IonicContact OD1-NE 2.72Å; D1311-R1313 IonicContact OD2-CZ 3.45Å; D1311-R1313 IonicContact OD2-NE 2.71Å; D1311-R1313 IonicContact OD2-NH1 3.5Å; D1311-R1313 PolarHBondContact OD2-NH1 2.79Å; R1313-V1315 PolarHBondContact O-N 2.94Å; R1313-H1316 PolarHBondContact O-N 3.19Å; R1313-M1317 PolarHBondContact O-N 3.26Å
1314K83.4Confident88.1Confident57 Ų5760.8 Ų60.825%0.24831%0.312CS..Hα-helixtrans-59.5-46-179.5-168.7-179.6-176.1-1700111.1M1155 G1157 D1158 T1312 I1318M1155-K1314 HydrophobicContact CG-CB 4.09Å; M1155-K1314 HydrophobicContact CG-CD 4.35Å; M1155-K1314 HydrophobicContact SD-CB 3.88Å; M1155-K1314 HydrophobicContact SD-CD 3.89Å; M1155-K1314 HydrophobicContact SD-CG 4.35Å; G1157-K1314 PolarHBondContact O-NZ 3.13Å; D1158-K1314 HydrophobicContact CB-CD 4.47Å; D1158-K1314 IonicContact OD2-NZ 3.92Å; D1158-K1314 PolarHBondContact OD2-NZ 3.06Å; T1312-K1314 PolarHBondContact O-N 2.92Å; K1314-I1318 HydrophobicContact CG-CD1 4.1Å; K1314-I1318 WeakPolarHBondContact O-CB 3.45Å; K1314-I1318 WeakPolarHBondContact O-CG1 3.44Å; K1314-I1318 PolarHBondContact O-N 3.03Å
1315V92.6Very high88Confident0 Ų060 Ų600%031%0.311CS..Hα-helixtrans-61.2-48.7175.4-179.80000111V1156 W1241 A1300 L1303 L1304 T1312 R1313 T1319V1156-V1315 HydrophobicContact CB-CG2 4.39Å; V1156-V1315 HydrophobicContact CG1-CG2 4.2Å; V1156-V1315 WeakPolarHBondContact O-CG2 3.29Å; W1241-V1315 HydrophobicContact CD2-CG1 4.47Å; W1241-V1315 HydrophobicContact CE3-CG2 4.29Å; W1241-V1315 HydrophobicContact CH2-CB 4.3Å; W1241-V1315 HydrophobicContact CH2-CG1 4.41Å; W1241-V1315 HydrophobicContact CH2-CG2 4.2Å; W1241-V1315 HydrophobicContact CZ2-CB 4.34Å; W1241-V1315 HydrophobicContact CZ2-CG1 3.98Å; W1241-V1315 HydrophobicContact CZ3-CG2 4.07Å; A1300-V1315 HydrophobicContact CB-CG1 3.8Å; L1303-V1315 HydrophobicContact CB-CG1 4.21Å; L1303-V1315 HydrophobicContact CB-CG2 4.31Å; L1303-V1315 HydrophobicContact CD1-CG1 4.23Å; L1303-V1315 HydrophobicContact CD1-CG2 3.77Å; L1304-V1315 HydrophobicContact CD2-CB 3.95Å; L1304-V1315 HydrophobicContact CD2-CG1 3.93Å; L1304-V1315 HydrophobicContact CG-CG1 4.08Å; T1312-V1315 PolarHBondContact O-N 2.99Å; R1313-V1315 PolarHBondContact O-N 2.94Å; V1315-T1319 VanDerWaalsContact O-CB 3.28Å; V1315-T1319 WeakPolarHBondContact O-CB 3.45Å; V1315-T1319 PolarHBondContact O-N 2.87Å; V1315-T1319 PolarHBondContact O-OG1 3.19Å
1316H86.9Confident88Confident89 Ų8954 Ų5441%0.41229%0.288SS..Hα-helixtrans-58.3-52.8-178.8-167.4-75.4000112.2L1304 T1312 R1313 I1318 T1319 E1320L1304-H1316 HydrophobicContact CD2-CB 4.29Å; T1312-H1316 PolarHBondContact O-N 3.35Å; R1313-H1316 PolarHBondContact O-N 3.19Å; H1316-I1318 PolarHBondContact O-N 2.99Å; H1316-T1319 PolarHBondContact O-N 3.21Å; H1316-E1320 IonicContact CE1-OE1 2.63Å; H1316-E1320 PolarHBondContact CE1-OE1 3.07Å; H1316-E1320 IonicContact CE1-OE2 3.76Å; H1316-E1320 PolarHBondContact CE1-OE2 3.12Å; H1316-E1320 VanDerWaalsContact ND1-CD 3.32Å; H1316-E1320 IonicContact ND1-OE1 2.56Å; H1316-E1320 IonicContact ND1-OE2 3.73Å; H1316-E1320 PolarHBondContact ND1-OE2 3.42Å; H1316-E1320 PolarHBondContact O-N 3.14Å
1317M85.5Confident88Confident111 Ų11158.3 Ų58.355%0.54730%0.299SS..Hα-helixtrans-62.1-43.2-176.3-176.3-176.870.900112.5R1313 T1319 E1320 N1321R1313-M1317 PolarHBondContact O-N 3.26Å; M1317-T1319 VanDerWaalsContact C-N 3.35Å; M1317-E1320 PolarHBondContact O-N 3.25Å; M1317-N1321 VanDerWaalsContact O-CG 3.29Å; M1317-N1321 PolarHBondContact O-N 2.95Å; M1317-N1321 VanDerWaalsContact O-N 3.11Å; M1317-N1321 PolarHBondContact O-ND2 3.44Å
1318I86.5Confident87.7Confident29 Ų2961 Ų6115%0.14932%0.32CS..Hα-helixtrans-65.1-41.8177.5-72.5169.2000110.5W1241 K1245 K1314 H1316 N1321 I1322W1241-I1318 HydrophobicContact CH2-CB 3.88Å; W1241-I1318 HydrophobicContact CH2-CD1 3.85Å; W1241-I1318 HydrophobicContact CH2-CG1 4.45Å; W1241-I1318 HydrophobicContact CH2-CG2 3.76Å; W1241-I1318 HydrophobicContact CZ2-CB 4.01Å; W1241-I1318 HydrophobicContact CZ2-CG2 3.68Å; K1245-I1318 HydrophobicContact CD-CG2 3.95Å; K1245-I1318 VanDerWaalsContact CE-CG2 3.41Å; K1245-I1318 HydrophobicContact CG-CG2 3.77Å; K1314-I1318 HydrophobicContact CG-CD1 4.1Å; K1314-I1318 WeakPolarHBondContact O-CB 3.45Å; K1314-I1318 WeakPolarHBondContact O-CG1 3.44Å; K1314-I1318 PolarHBondContact O-N 3.03Å; H1316-I1318 PolarHBondContact O-N 2.99Å; I1318-N1321 PolarHBondContact O-N 3.45Å; I1318-I1322 HydrophobicContact CG2-CD1 3.99Å; I1318-I1322 WeakPolarHBondContact O-CG1 3.44Å; I1318-I1322 PolarHBondContact O-N 3.5Å
1319T89.7Confident87.8Confident18 Ų1857.1 Ų57.111%0.1129%0.291CS..Hα-helixtrans-64.3-41.4178.6-55.10000111.7N1297 A1300 V1315 H1316 M1317 N1323N1297-T1319 VanDerWaalsContact OD1-CG2 3.31Å; N1297-T1319 WeakPolarHBondContact OD1-CG2 3.43Å; A1300-T1319 HydrophobicContact CB-CG2 3.81Å; A1300-T1319 WeakPolarHBondContact CB-OG1 3.28Å; V1315-T1319 VanDerWaalsContact O-CB 3.28Å; V1315-T1319 WeakPolarHBondContact O-CB 3.45Å; V1315-T1319 PolarHBondContact O-N 2.87Å; V1315-T1319 PolarHBondContact O-OG1 3.19Å; H1316-T1319 PolarHBondContact O-N 3.21Å; M1317-T1319 VanDerWaalsContact C-N 3.35Å; T1319-N1323 WeakPolarHBondContact O-CB 3.34Å; T1319-N1323 PolarHBondContact O-N 2.99Å; T1319-N1323 VanDerWaalsContact O-N 3.07Å; T1319-N1323 PolarHBondContact O-ND2 2.85Å
1320E85.6Confident88Confident106 Ų10657.9 Ų57.950%0.49528%0.284SS..Hα-helixtrans-62.7-41.7173.7-74.6-177121.200112.5H1316 M1317 N1323 A1324H1316-E1320 IonicContact CE1-OE1 2.63Å; H1316-E1320 PolarHBondContact CE1-OE1 3.07Å; H1316-E1320 IonicContact CE1-OE2 3.76Å; H1316-E1320 PolarHBondContact CE1-OE2 3.12Å; H1316-E1320 VanDerWaalsContact ND1-CD 3.32Å; H1316-E1320 IonicContact ND1-OE1 2.56Å; H1316-E1320 IonicContact ND1-OE2 3.73Å; H1316-E1320 PolarHBondContact ND1-OE2 3.42Å; H1316-E1320 PolarHBondContact O-N 3.14Å; M1317-E1320 PolarHBondContact O-N 3.25Å; E1320-N1323 PolarHBondContact O-N 3.5Å; E1320-A1324 VanDerWaalsContact O-CB 3.32Å; E1320-A1324 WeakPolarHBondContact O-CB 3.38Å; E1320-A1324 PolarHBondContact O-N 2.7Å
1321N88.1Confident87.8Confident96 Ų9663.4 Ų63.451%0.51331%0.308SS..Hα-helixtrans-64.9-41.1179-74.3-18.4000112.9M1317 I1318 S1325M1317-N1321 VanDerWaalsContact O-CG 3.29Å; M1317-N1321 PolarHBondContact O-N 2.95Å; M1317-N1321 VanDerWaalsContact O-N 3.11Å; M1317-N1321 PolarHBondContact O-ND2 3.44Å; I1318-N1321 PolarHBondContact O-N 3.45Å; N1321-S1325 WeakPolarHBondContact O-CB 3.36Å; N1321-S1325 PolarHBondContact O-N 3.43Å; N1321-S1325 PolarHBondContact O-OG 2.91Å
1322I87.7Confident87.6Confident5 Ų566.4 Ų66.43%0.02632%0.315CS..Hα-helixtrans-61.2-49.3173.4-72171000109.8K1245 A1248 E1249 L1252 V1293 I1318 A1324 S1325 W1326K1245-I1322 HydrophobicContact CB-CD1 4.42Å; K1245-I1322 HydrophobicContact CG-CD1 3.69Å; A1248-I1322 HydrophobicContact CB-CG2 4.4Å; E1249-I1322 HydrophobicContact CG-CD1 4.39Å; E1249-I1322 HydrophobicContact CG-CG1 4.33Å; L1252-I1322 HydrophobicContact CD1-CB 4.37Å; L1252-I1322 HydrophobicContact CD1-CG1 4.39Å; L1252-I1322 HydrophobicContact CD1-CG2 4.01Å; V1293-I1322 HydrophobicContact CG1-CG2 3.99Å; I1318-I1322 HydrophobicContact CG2-CD1 3.99Å; I1318-I1322 WeakPolarHBondContact O-CG1 3.44Å; I1318-I1322 PolarHBondContact O-N 3.5Å; I1322-A1324 PolarHBondContact O-N 3.21Å; I1322-S1325 WeakPolarHBondContact O-CB 3.41Å; I1322-S1325 PolarHBondContact O-N 2.89Å; I1322-W1326 WeakPolarHBondContact O-CB 3.46Å; I1322-W1326 PolarHBondContact O-N 3Å
1323N91.3Very high87.4Confident39 Ų3965 Ų6521%0.20931%0.306CS..Hα-helixtrans-68.1-35.7-178.8-75.5-59.3000113.9N1297 T1319 E1320 R1327N1297-N1323 PolarHBondContact ND2-OD1 3.37Å; N1297-N1323 PolarHBondContact OD1-ND2 2.96Å; N1297-N1323 PolarHBondContact OD1-OD1 2.78Å; T1319-N1323 WeakPolarHBondContact O-CB 3.34Å; T1319-N1323 PolarHBondContact O-N 2.99Å; T1319-N1323 VanDerWaalsContact O-N 3.07Å; T1319-N1323 PolarHBondContact O-ND2 2.85Å; E1320-N1323 PolarHBondContact O-N 3.5Å; N1323-R1327 WeakPolarHBondContact O-CB 3.3Å; N1323-R1327 WeakPolarHBondContact O-CG 3.33Å; N1323-R1327 PolarHBondContact O-N 2.64Å; N1323-R1327 PolarHBondContact O-NE 3.16Å; N1323-R1327 VanDerWaalsContact O-NE 3.11Å
1324A87.9Confident87.2Confident44 Ų4459.3 Ų59.336%0.36429%0.293SS..Hα-helixtrans-66.3-41.617400000111.2E1320 I1322 R1327 S1328E1320-A1324 VanDerWaalsContact O-CB 3.32Å; E1320-A1324 WeakPolarHBondContact O-CB 3.38Å; E1320-A1324 PolarHBondContact O-N 2.7Å; I1322-A1324 PolarHBondContact O-N 3.21Å; A1324-R1327 PolarHBondContact O-N 3.18Å; A1324-S1328 WeakPolarHBondContact O-CB 3.39Å; A1324-S1328 PolarHBondContact O-N 3.13Å
1325S86.5Confident87.2Confident25 Ų2561.5 Ų61.518%0.17530%0.304CS..Hα-helixtrans-61.3-46.6174.4-62.90000111.9R1256 N1321 I1322 S1328 I1329R1256-S1325 PolarHBondContact NH2-OG 3.41Å; N1321-S1325 WeakPolarHBondContact O-CB 3.36Å; N1321-S1325 PolarHBondContact O-N 3.43Å; N1321-S1325 PolarHBondContact O-OG 2.91Å; I1322-S1325 WeakPolarHBondContact O-CB 3.41Å; I1322-S1325 PolarHBondContact O-N 2.89Å; S1325-S1328 PolarHBondContact O-N 2.92Å; S1325-I1329 WeakPolarHBondContact O-CD1 3.37Å; S1325-I1329 WeakPolarHBondContact O-CG1 3.45Å; S1325-I1329 PolarHBondContact O-N 3.39Å; S1325-I1329 VanDerWaalsContact O-N 3.07Å
1326W92.6Very high86.7Confident21 Ų2164.4 Ų64.48%0.0832%0.315CS..Hα-helixtrans-60.3-48.8178-173.2-107.5000112.1V1251 L1252 L1286 W1289 Q1290 V1293 I1322 S1328 I1329 H1330V1251-W1326 HydrophobicContact CG1-CZ3 4.5Å; L1252-W1326 HydrophobicContact CD2-CB 4.17Å; L1252-W1326 HydrophobicContact CD2-CE3 3.75Å; L1286-W1326 HydrophobicContact CB-CH2 4.21Å; L1286-W1326 HydrophobicContact CB-CZ2 4.45Å; L1286-W1326 HydrophobicContact CD2-CH2 3.5Å; L1286-W1326 HydrophobicContact CD2-CZ2 4.2Å; L1286-W1326 HydrophobicContact CD2-CZ3 3.75Å; L1286-W1326 HydrophobicContact CG-CH2 4.47Å; L1286-W1326 WeakPolarHBondContact O-CH2 3.42Å; L1286-W1326 VanDerWaalsContact O-CZ2 3.23Å; L1286-W1326 WeakPolarHBondContact O-CZ2 3.43Å; W1289-W1326 HydrophobicContact CB-CH2 3.74Å; W1289-W1326 HydrophobicContact CB-CZ3 4.16Å; Q1290-W1326 HydrophobicContact CB-CH2 4.39Å; Q1290-W1326 HydrophobicContact CB-CZ2 3.67Å; Q1290-W1326 HydrophobicContact CG-CZ2 4.06Å; V1293-W1326 HydrophobicContact CG1-CG 4.36Å; V1293-W1326 HydrophobicContact CG2-CD2 3.98Å; V1293-W1326 HydrophobicContact CG2-CE3 3.7Å; V1293-W1326 HydrophobicContact CG2-CG 4.42Å; V1293-W1326 HydrophobicContact CG2-CZ3 4.15Å; I1322-W1326 WeakPolarHBondContact O-CB 3.46Å; I1322-W1326 PolarHBondContact O-N 3Å; W1326-S1328 VanDerWaalsContact C-N 3.33Å; W1326-S1328 PolarHBondContact O-N 3.45Å; W1326-I1329 PolarHBondContact O-N 2.92Å; W1326-H1330 PolarHBondContact O-N 3.48Å
1327R88.6Confident86.6Confident160 Ų16062.4 Ų62.460%0.60431%0.306SS*.Hα-helixtrans-58-42.5176.2-79.7178-82.1135.5-8.9112.6N1323 A1324 K1331N1323-R1327 WeakPolarHBondContact O-CB 3.3Å; N1323-R1327 WeakPolarHBondContact O-CG 3.33Å; N1323-R1327 PolarHBondContact O-N 2.64Å; N1323-R1327 PolarHBondContact O-NE 3.16Å; N1323-R1327 VanDerWaalsContact O-NE 3.11Å; A1324-R1327 PolarHBondContact O-N 3.18Å; R1327-K1331 WeakPolarHBondContact O-CB 3.42Å; R1327-K1331 PolarHBondContact O-N 3.32Å
1328S85.2Confident86.3Confident67 Ų6760 Ų6047%0.46930%0.303SS..Hα-helixtrans-63-45.7177.6-176.30000112.4A1324 S1325 W1326 K1331 R1332A1324-S1328 WeakPolarHBondContact O-CB 3.39Å; A1324-S1328 PolarHBondContact O-N 3.13Å; S1325-S1328 PolarHBondContact O-N 2.92Å; W1326-S1328 VanDerWaalsContact C-N 3.33Å; W1326-S1328 PolarHBondContact O-N 3.45Å; S1328-K1331 PolarHBondContact O-N 3.32Å; S1328-R1332 WeakPolarHBondContact O-CG 3.46Å; S1328-R1332 PolarHBondContact O-N 2.9Å
1329I88.4Confident85.9Confident6 Ų661 Ų613%0.03132%0.316CS..Hα-helixtrans-63.5-47.8178.5-71.4162.8000111L1252 A1255 R1256 L1259 L1286 S1325 W1326 K1331 R1332 V1333L1252-I1329 HydrophobicContact CD2-CD1 3.51Å; A1255-I1329 HydrophobicContact CB-CD1 4.23Å; A1255-I1329 HydrophobicContact CB-CG2 3.85Å; R1256-I1329 HydrophobicContact CG-CD1 3.78Å; R1256-I1329 HydrophobicContact CG-CG1 4.2Å; L1259-I1329 HydrophobicContact CD1-CB 4.27Å; L1259-I1329 HydrophobicContact CD1-CG1 4.2Å; L1259-I1329 HydrophobicContact CD1-CG2 3.9Å; L1286-I1329 HydrophobicContact CD1-CG2 4.27Å; L1286-I1329 HydrophobicContact CD2-CG2 3.69Å; S1325-I1329 WeakPolarHBondContact O-CD1 3.37Å; S1325-I1329 WeakPolarHBondContact O-CG1 3.45Å; S1325-I1329 PolarHBondContact O-N 3.39Å; S1325-I1329 VanDerWaalsContact O-N 3.07Å; W1326-I1329 PolarHBondContact O-N 2.92Å; I1329-K1331 VanDerWaalsContact C-N 3.32Å; I1329-K1331 PolarHBondContact O-N 2.92Å; I1329-R1332 PolarHBondContact O-N 2.92Å; I1329-V1333 PolarHBondContact O-N 3.01Å
1330H85.5Confident85.5Confident81 Ų8160.2 Ų60.238%0.37531%0.311SS..Hα-helixtrans-60.6-41.8178.6-169.8-74.5000111.7W1326 S1334W1326-H1330 PolarHBondContact O-N 3.48Å; H1330-S1334 PolarHBondContact ND1-OG 2.84Å; H1330-S1334 WeakPolarHBondContact O-CB 3.33Å; H1330-S1334 PolarHBondContact O-N 2.69Å; H1330-S1334 PolarHBondContact O-OG 3.2Å
1331K86.3Confident85.3Confident127 Ų12759.2 Ų59.255%0.55231%0.307SS*.Hα-helixtrans-60.7-51.7174.8179.9172.6173.7175.30111.7R1327 S1328 I1329 V1333 S1334 E1335R1327-K1331 WeakPolarHBondContact O-CB 3.42Å; R1327-K1331 PolarHBondContact O-N 3.32Å; S1328-K1331 PolarHBondContact O-N 3.32Å; I1329-K1331 VanDerWaalsContact C-N 3.32Å; I1329-K1331 PolarHBondContact O-N 2.92Å; K1331-V1333 VanDerWaalsContact C-N 3.32Å; K1331-V1333 PolarHBondContact O-N 3.06Å; K1331-S1334 PolarHBondContact O-N 2.94Å; K1331-S1334 VanDerWaalsContact O-N 3.12Å; K1331-E1335 VanDerWaalsContact CE-CD 3.49Å; K1331-E1335 WeakPolarHBondContact CE-OE1 3.34Å; K1331-E1335 HydrophobicContact CG-CG 4.27Å; K1331-E1335 IonicContact NZ-OE1 3.79Å; K1331-E1335 WeakPolarHBondContact O-CG 3.4Å; K1331-E1335 PolarHBondContact O-N 3.15Å
1332R84.6Confident84.8Confident110 Ų11060.2 Ų60.242%0.41531%0.308SS..Hα-helixtrans-58.3-39.6179.6-75.3-178.170.5-171.10.9113L1259 S1328 I1329 R1336L1259-R1332 HydrophobicContact CD1-CB 4.31Å; L1259-R1332 HydrophobicContact CD2-CB 4.13Å; S1328-R1332 WeakPolarHBondContact O-CG 3.46Å; S1328-R1332 PolarHBondContact O-N 2.9Å; I1329-R1332 PolarHBondContact O-N 2.92Å; R1332-R1336 VanDerWaalsContact O-CB 3.29Å; R1332-R1336 WeakPolarHBondContact O-CB 3.48Å; R1332-R1336 PolarHBondContact O-N 3.48Å; R1332-R1336 VanDerWaalsContact O-N 3.09Å
1333V88.3Confident84.2Confident3 Ų362 Ų622%0.01832%0.319CS..Hα-helixtrans-68.1-42.2176.3173.60000111.4L1259 W1262 T1279 L1282 A1283 L1286 I1329 K1331 R1336 E1337L1259-V1333 HydrophobicContact CD1-CG2 4.27Å; L1259-V1333 HydrophobicContact CD2-CG2 3.85Å; L1259-V1333 HydrophobicContact CG-CG2 4.19Å; W1262-V1333 HydrophobicContact CH2-CG2 4.3Å; W1262-V1333 HydrophobicContact CZ3-CG2 4.45Å; T1279-V1333 HydrophobicContact CG2-CG1 4.08Å; L1282-V1333 HydrophobicContact CD2-CG2 3.84Å; L1282-V1333 HydrophobicContact CG-CG2 4.27Å; A1283-V1333 HydrophobicContact CB-CG1 4.25Å; L1286-V1333 HydrophobicContact CD1-CB 4.01Å; L1286-V1333 HydrophobicContact CD1-CG1 4.16Å; L1286-V1333 HydrophobicContact CD1-CG2 3.73Å; I1329-V1333 PolarHBondContact O-N 3.01Å; K1331-V1333 VanDerWaalsContact C-N 3.32Å; K1331-V1333 PolarHBondContact O-N 3.06Å; V1333-R1336 PolarHBondContact O-N 3.03Å; V1333-E1337 PolarHBondContact O-N 3.33Å
1334S80.9Confident83.6Confident52 Ų5261.5 Ų61.536%0.36432%0.316SS..Hα-helixtrans-64.9-44.1179.2-53.20000112.2H1330 K1331 R1336 E1337 A1338H1330-S1334 PolarHBondContact ND1-OG 2.84Å; H1330-S1334 WeakPolarHBondContact O-CB 3.33Å; H1330-S1334 PolarHBondContact O-N 2.69Å; H1330-S1334 PolarHBondContact O-OG 3.2Å; K1331-S1334 PolarHBondContact O-N 2.94Å; K1331-S1334 VanDerWaalsContact O-N 3.12Å; S1334-R1336 VanDerWaalsContact C-N 3.33Å; S1334-R1336 PolarHBondContact O-N 3.45Å; S1334-E1337 PolarHBondContact O-N 3.17Å; S1334-A1338 PolarHBondContact O-N 3.4Å; S1334-A1338 VanDerWaalsContact O-N 3.08Å
1335E83Confident83.2Confident103 Ų10367.5 Ų67.548%0.48133%0.329SS..Hα-helixtrans-63.2-38.9175.3-70.7173.2150.200111.6K1331 A1339K1331-E1335 VanDerWaalsContact CE-CD 3.49Å; K1331-E1335 WeakPolarHBondContact CE-OE1 3.34Å; K1331-E1335 HydrophobicContact CG-CG 4.27Å; K1331-E1335 IonicContact NZ-OE1 3.79Å; K1331-E1335 WeakPolarHBondContact O-CG 3.4Å; K1331-E1335 PolarHBondContact O-N 3.15Å; E1335-A1339 WeakPolarHBondContact O-CB 3.42Å; E1335-A1339 PolarHBondContact O-N 2.87Å
1336R82.5Confident82.9Confident60 Ų6068.1 Ų68.123%0.22633%0.33CS..Hα-helixtrans-67.9-38.8176.5-173.955.3159.3179.2-11112.4W1262 R1332 V1333 S1334 L1340W1262-R1336 HydrophobicContact CE3-CG 3.95Å; W1262-R1336 HydrophobicContact CZ3-CB 4.11Å; W1262-R1336 HydrophobicContact CZ3-CG 3.69Å; R1332-R1336 VanDerWaalsContact O-CB 3.29Å; R1332-R1336 WeakPolarHBondContact O-CB 3.48Å; R1332-R1336 PolarHBondContact O-N 3.48Å; R1332-R1336 VanDerWaalsContact O-N 3.09Å; V1333-R1336 PolarHBondContact O-N 3.03Å; S1334-R1336 VanDerWaalsContact C-N 3.33Å; S1334-R1336 PolarHBondContact O-N 3.45Å; R1336-L1340 HydrophobicContact CG-CD1 4.05Å; R1336-L1340 WeakPolarHBondContact O-CB 3.39Å; R1336-L1340 VanDerWaalsContact O-CG 3.25Å; R1336-L1340 WeakPolarHBondContact O-CG 3.28Å; R1336-L1340 PolarHBondContact O-N 2.86Å; R1336-L1340 VanDerWaalsContact O-N 3.08Å
1337E83Confident82.1Confident47 Ų4768.1 Ų68.122%0.2233%0.331CS..Hα-helixtrans-61.3-53.4175.2-169.8172173.900110.5T1279 K1280 V1333 S1334 A1339 L1340 E1341T1279-E1337 HydrophobicContact CG2-CB 3.79Å; T1279-E1337 HydrophobicContact CG2-CG 4.37Å; K1280-E1337 WeakPolarHBondContact CE-OE1 3.47Å; K1280-E1337 HydrophobicContact CG-CG 4.43Å; K1280-E1337 WeakPolarHBondContact CG-OE1 3.39Å; K1280-E1337 IonicContact NZ-OE1 2.78Å; V1333-E1337 PolarHBondContact O-N 3.33Å; S1334-E1337 PolarHBondContact O-N 3.17Å; E1337-A1339 PolarHBondContact O-N 2.93Å; E1337-L1340 PolarHBondContact O-N 2.87Å; E1337-E1341 WeakPolarHBondContact O-CG 3.44Å; E1337-E1341 PolarHBondContact O-N 2.98Å
1338A80.3Confident81.6Confident60 Ų6065.7 Ų65.750%0.49633%0.327SS..Hα-helixtrans-58.5-43.6179.100000112.8S1334 L1340 E1341 E1342S1334-A1338 PolarHBondContact O-N 3.4Å; S1334-A1338 VanDerWaalsContact O-N 3.08Å; A1338-L1340 PolarHBondContact O-N 3.37Å; A1338-E1341 PolarHBondContact O-N 2.87Å; A1338-E1342 PolarHBondContact O-N 3.39Å
1339A78.8Confident81.4Confident50 Ų5066.7 Ų66.741%0.41332%0.324SS..Hα-helixtrans-64.7-39.3178.200000112.8E1335 E1337 T1343E1335-A1339 WeakPolarHBondContact O-CB 3.42Å; E1335-A1339 PolarHBondContact O-N 2.87Å; E1337-A1339 PolarHBondContact O-N 2.93Å; A1339-T1343 WeakPolarHBondContact O-CB 3.48Å; A1339-T1343 PolarHBondContact O-N 2.94Å; A1339-T1343 VanDerWaalsContact O-N 3.09Å; A1339-T1343 PolarHBondContact O-OG1 3.06Å
1340L80.8Confident81.2Confident3 Ų366.8 Ų66.82%0.01632%0.324CS..Hα-helixtrans-70.3-40177.3-71.6169.4000111.8I1272 K1275 I1276 R1336 E1337 A1338 T1343 H1344I1272-L1340 HydrophobicContact CG2-CD2 4.29Å; K1275-L1340 HydrophobicContact CB-CD1 3.93Å; K1275-L1340 HydrophobicContact CB-CD2 4.21Å; K1275-L1340 HydrophobicContact CD-CD2 4.25Å; I1276-L1340 HydrophobicContact CD1-CB 4.34Å; I1276-L1340 HydrophobicContact CG1-CB 3.62Å; R1336-L1340 HydrophobicContact CG-CD1 4.05Å; R1336-L1340 WeakPolarHBondContact O-CB 3.39Å; R1336-L1340 VanDerWaalsContact O-CG 3.25Å; R1336-L1340 WeakPolarHBondContact O-CG 3.28Å; R1336-L1340 PolarHBondContact O-N 2.86Å; R1336-L1340 VanDerWaalsContact O-N 3.08Å; E1337-L1340 PolarHBondContact O-N 2.87Å; A1338-L1340 PolarHBondContact O-N 3.37Å; L1340-T1343 PolarHBondContact O-N 3.48Å; L1340-H1344 WeakPolarHBondContact O-CB 3.49Å; L1340-H1344 PolarHBondContact O-N 2.92Å
1341E80.7Confident80.9Confident85 Ų8565.7 Ų65.740%0.39733%0.325SS..Hα-helixtrans-63.6-42.9176.4-71.3-163.8142.200112.5I1276 K1280 E1337 A1338 H1344 R1345I1276-E1341 HydrophobicContact CD1-CG 4.25Å; I1276-E1341 HydrophobicContact CG2-CG 4.45Å; K1280-E1341 WeakPolarHBondContact CE-OE1 3.49Å; K1280-E1341 IonicContact NZ-OE1 2.86Å; K1280-E1341 PolarHBondContact NZ-OE1 2.88Å; E1337-E1341 WeakPolarHBondContact O-CG 3.44Å; E1337-E1341 PolarHBondContact O-N 2.98Å; A1338-E1341 PolarHBondContact O-N 2.87Å; E1341-H1344 PolarHBondContact O-N 3.33Å; E1341-R1345 WeakPolarHBondContact O-CB 3.22Å; E1341-R1345 PolarHBondContact O-N 2.97Å
1342E77.1Confident80.8Confident116 Ų11664.3 Ų64.354%0.54232%0.323SS..Hα-helixtrans-65.6-40.5175.9-174.960-16600111.6A1338 H1344 R1345 L1346A1338-E1342 PolarHBondContact O-N 3.39Å; E1342-H1344 PolarHBondContact O-N 3.29Å; E1342-R1345 PolarHBondContact O-N 3.11Å; E1342-L1346 WeakPolarHBondContact O-CB 3.41Å; E1342-L1346 PolarHBondContact O-N 3.48Å
1343T75.6Confident80.8Confident42 Ų4261.4 Ų61.426%0.25832%0.315SS..Hα-helixtrans-63.1-41.1175.8-50.50000111.7Y1267 I1272 A1339 L1340 L1346 L1347Y1267-T1343 HydrophobicContact CD1-CG2 4.23Å; Y1267-T1343 HydrophobicContact CE1-CG2 4.49Å; I1272-T1343 HydrophobicContact CD1-CG2 3.98Å; A1339-T1343 WeakPolarHBondContact O-CB 3.48Å; A1339-T1343 PolarHBondContact O-N 2.94Å; A1339-T1343 VanDerWaalsContact O-N 3.09Å; A1339-T1343 PolarHBondContact O-OG1 3.06Å; L1340-T1343 PolarHBondContact O-N 3.48Å; T1343-L1346 PolarHBondContact O-N 3.4Å; T1343-L1347 HydrophobicContact CG2-CD1 4.28Å; T1343-L1347 WeakPolarHBondContact O-CG 3.49Å; T1343-L1347 PolarHBondContact O-N 2.96Å; T1343-L1347 VanDerWaalsContact O-N 3.15Å
1344H79.7Confident80.6Confident30 Ų3061.3 Ų61.314%0.13932%0.315CS..Hα-helixtrans-63.4-43175.4177.4-98.2000111.8I1272 I1276 L1340 E1341 E1342 L1347 Q1348I1272-H1344 HydrophobicContact CG2-CB 3.9Å; I1276-H1344 HydrophobicContact CD1-CB 3.77Å; L1340-H1344 WeakPolarHBondContact O-CB 3.49Å; L1340-H1344 PolarHBondContact O-N 2.92Å; E1341-H1344 PolarHBondContact O-N 3.33Å; E1342-H1344 PolarHBondContact O-N 3.29Å; H1344-L1347 PolarHBondContact O-N 3.21Å; H1344-Q1348 PolarHBondContact CE1-NE2 3.37Å; H1344-Q1348 PolarHBondContact NE2-NE2 2.93Å; H1344-Q1348 WeakPolarHBondContact O-CG 3.44Å; H1344-Q1348 PolarHBondContact O-N 2.7Å; H1344-Q1348 VanDerWaalsContact O-N 3.15Å
1345R79.2Confident80.8Confident170 Ų17063.7 Ų63.764%0.64232%0.32SS*.Hα-helixtrans-62.1-43.6176.8-168.2-177-167.9-176.34.2112.2E1341 E1342 L1347 Q1348 Q1349E1341-R1345 WeakPolarHBondContact O-CB 3.22Å; E1341-R1345 PolarHBondContact O-N 2.97Å; E1342-R1345 PolarHBondContact O-N 3.11Å; R1345-L1347 PolarHBondContact O-N 2.71Å; R1345-Q1348 PolarHBondContact O-N 3.27Å; R1345-Q1349 WeakPolarHBondContact O-CB 3.35Å; R1345-Q1349 PolarHBondContact O-N 3.12Å
1346L79.1Confident80.9Confident38 Ų3865 Ų6520%0.19932%0.324CS..Hα-helixtrans-58.5-47.6177.4-17664.7000111.7E1342 T1343 Q1348 Q1349 F1350 N1414 K1417 I1418E1342-L1346 WeakPolarHBondContact O-CB 3.41Å; E1342-L1346 PolarHBondContact O-N 3.48Å; T1343-L1346 PolarHBondContact O-N 3.4Å; L1346-Q1348 VanDerWaalsContact C-N 3.33Å; L1346-Q1348 PolarHBondContact O-N 2.93Å; L1346-Q1349 PolarHBondContact O-N 3.32Å; L1346-F1350 VanDerWaalsContact O-CB 3.28Å; L1346-F1350 WeakPolarHBondContact O-CB 3.24Å; L1346-F1350 PolarHBondContact O-N 3.49Å; L1346-F1350 VanDerWaalsContact O-N 3.07Å; L1346-N1414 HydrophobicContact CD1-CB 3.89Å; L1346-K1417 HydrophobicContact CD2-CB 4.29Å; L1346-I1418 HydrophobicContact CD2-CG1 4.39Å; L1346-I1418 HydrophobicContact CG-CD1 4.27Å; L1346-I1418 HydrophobicContact CG-CG1 4.43Å
1347L76.2Confident81.3Confident20 Ų2062.3 Ų62.311%0.10531%0.314CS..Hα-helixtrans-66.7-29.7179.6-74.9163.7000113.6V1269 I1272 T1343 H1344 R1345 P1351 I1418V1269-L1347 HydrophobicContact CG2-CB 4.08Å; I1272-L1347 HydrophobicContact CD1-CD1 3.2Å; T1343-L1347 HydrophobicContact CG2-CD1 4.28Å; T1343-L1347 WeakPolarHBondContact O-CG 3.49Å; T1343-L1347 PolarHBondContact O-N 2.96Å; T1343-L1347 VanDerWaalsContact O-N 3.15Å; H1344-L1347 PolarHBondContact O-N 3.21Å; R1345-L1347 PolarHBondContact O-N 2.71Å; L1347-P1351 VanDerWaalsContact O-CD 3.29Å; L1347-P1351 WeakPolarHBondContact O-CD 3.48Å; L1347-I1418 HydrophobicContact CD2-CB 4.41Å; L1347-I1418 HydrophobicContact CD2-CD1 4.16Å; L1347-I1418 HydrophobicContact CD2-CG1 3.83Å; L1347-I1418 HydrophobicContact CD2-CG2 3.83Å
1348Q79.7Confident81.4Confident109 Ų10961.2 Ų61.251%0.50931%0.31SS..Hα-helixtrans-76.4-39.3174.9-72.7-170.9-31.300113.1H1344 R1345 L1346H1344-Q1348 PolarHBondContact CE1-NE2 3.37Å; H1344-Q1348 PolarHBondContact NE2-NE2 2.93Å; H1344-Q1348 WeakPolarHBondContact O-CG 3.44Å; H1344-Q1348 PolarHBondContact O-N 2.7Å; H1344-Q1348 VanDerWaalsContact O-N 3.15Å; R1345-Q1348 PolarHBondContact O-N 3.27Å; L1346-Q1348 VanDerWaalsContact C-N 3.33Å; L1346-Q1348 PolarHBondContact O-N 2.93Å
1349Q80.9Confident81.7Confident88 Ų8861.3 Ų61.341%0.41131%0.311SS..Hα-helixtrans-81.6-41.5-172.5-17660.732.700112.8R1345 L1346 L1352 D1353R1345-Q1349 WeakPolarHBondContact O-CB 3.35Å; R1345-Q1349 PolarHBondContact O-N 3.12Å; L1346-Q1349 PolarHBondContact O-N 3.32Å; Q1349-L1352 WeakPolarHBondContact O-CB 3.12Å; Q1349-L1352 PolarHBondContact O-N 3.01Å; Q1349-L1352 VanDerWaalsContact O-N 3.16Å; Q1349-D1353 WeakPolarHBondContact CG-OD2 3.45Å; Q1349-D1353 VanDerWaalsContact NE2-CG 3.29Å; Q1349-D1353 PolarHBondContact NE2-OD1 3.15Å; Q1349-D1353 PolarHBondContact NE2-OD2 2.79Å; Q1349-D1353 PolarHBondContact O-N 2.7Å
1350F84Confident82.4Confident8 Ų860.2 Ų60.24%0.03530%0.296CS..Hα-helixtrans-56.3-43-171.3167.1-99.4000115.3L1346 L1352 D1353 L1354 L1411 N1414 S1415 I1418 L1431 L1435L1346-F1350 VanDerWaalsContact O-CB 3.28Å; L1346-F1350 WeakPolarHBondContact O-CB 3.24Å; L1346-F1350 PolarHBondContact O-N 3.49Å; L1346-F1350 VanDerWaalsContact O-N 3.07Å; F1350-L1352 VanDerWaalsContact C-N 3.29Å; F1350-L1352 PolarHBondContact O-N 3.4Å; F1350-D1353 PolarHBondContact O-N 3.47Å; F1350-L1354 HydrophobicContact CE1-CD2 4.29Å; F1350-L1354 HydrophobicContact CZ-CD2 4.07Å; F1350-L1354 WeakPolarHBondContact O-CB 3.4Å; F1350-L1354 PolarHBondContact O-N 3.26Å; F1350-L1411 HydrophobicContact CD2-CD2 3.83Å; F1350-L1411 HydrophobicContact CE2-CD2 3.84Å; F1350-L1411 WeakPolarHBondContact CE2-O 3.45Å; F1350-N1414 HydrophobicContact CD2-CB 3.94Å; F1350-N1414 HydrophobicContact CE2-CB 4.47Å; F1350-S1415 VanDerWaalsContact CZ-CB 3.41Å; F1350-I1418 HydrophobicContact CB-CD1 3.55Å; F1350-I1418 HydrophobicContact CD1-CD1 3.3Å; F1350-I1418 HydrophobicContact CD2-CD1 4.23Å; F1350-I1418 HydrophobicContact CE1-CD1 4.01Å; F1350-I1418 HydrophobicContact CG-CD1 3.42Å; F1350-I1418 VanDerWaalsContact CG-CD1 3.42Å; F1350-L1431 HydrophobicContact CE1-CD1 3.64Å; F1350-L1431 HydrophobicContact CE1-CD2 3.92Å; F1350-L1431 HydrophobicContact CE1-CG 4.39Å; F1350-L1431 HydrophobicContact CZ-CD1 4.05Å; F1350-L1435 HydrophobicContact CZ-CD2 4.26Å
1351P78.9Confident82.9Confident58 Ų5860.1 Ų60.138%0.37730%0.295SS..Hα-helixtrans-61.3-35.4178.6-23.934.8000113.5L1347 E1355L1347-P1351 VanDerWaalsContact O-CD 3.29Å; L1347-P1351 WeakPolarHBondContact O-CD 3.48Å; P1351-E1355 WeakPolarHBondContact O-CG 3.31Å; P1351-E1355 PolarHBondContact O-N 3.25Å
1352L83.1Confident83.2Confident99 Ų9958.9 Ų58.952%0.51829%0.294SS..Hα-helixtrans-69.4-38.5-178.8-65.4168.7000111.9Q1349 F1350 K1356Q1349-L1352 WeakPolarHBondContact O-CB 3.12Å; Q1349-L1352 PolarHBondContact O-N 3.01Å; Q1349-L1352 VanDerWaalsContact O-N 3.16Å; F1350-L1352 VanDerWaalsContact C-N 3.29Å; F1350-L1352 PolarHBondContact O-N 3.4Å; L1352-K1356 WeakPolarHBondContact O-CG 3.31Å; L1352-K1356 PolarHBondContact O-N 3.13Å
1353D84.4Confident83.6Confident48 Ų4859.9 Ų59.926%0.25730%0.298SS..Hα-helixtrans-79.6-33.5-179.2-66.3-26.4000111.7Q1349 F1350 E1355 K1356 F1357 L1411Q1349-D1353 WeakPolarHBondContact CG-OD2 3.45Å; Q1349-D1353 VanDerWaalsContact NE2-CG 3.29Å; Q1349-D1353 PolarHBondContact NE2-OD1 3.15Å; Q1349-D1353 PolarHBondContact NE2-OD2 2.79Å; Q1349-D1353 PolarHBondContact O-N 2.7Å; F1350-D1353 PolarHBondContact O-N 3.47Å; D1353-E1355 VanDerWaalsContact C-N 3.31Å; D1353-E1355 PolarHBondContact O-N 3.36Å; D1353-K1356 PolarHBondContact O-N 2.97Å; D1353-K1356 IonicContact OD1-NZ 3.73Å; D1353-K1356 PolarHBondContact OD1-NZ 3.18Å; D1353-F1357 WeakPolarHBondContact O-CB 3.41Å; D1353-F1357 PolarHBondContact O-N 2.95Å; D1353-L1411 HydrophobicContact CB-CD2 4Å
1354L85Confident84.2Confident2 Ų257.9 Ų57.91%0.0129%0.286CS..Hα-helixtrans-59.1-41.7171-179.760.7000111.7F1350 F1357 L1358 L1411 L1431 R1434 L1435 M1438F1350-L1354 HydrophobicContact CE1-CD2 4.29Å; F1350-L1354 HydrophobicContact CZ-CD2 4.07Å; F1350-L1354 WeakPolarHBondContact O-CB 3.4Å; F1350-L1354 PolarHBondContact O-N 3.26Å; L1354-F1357 PolarHBondContact O-N 3.04Å; L1354-L1358 HydrophobicContact CD1-CD1 4.14Å; L1354-L1358 HydrophobicContact CD1-CG 4.29Å; L1354-L1358 HydrophobicContact CG-CD1 4.06Å; L1354-L1358 WeakPolarHBondContact O-CB 3.37Å; L1354-L1358 VanDerWaalsContact O-CG 3.31Å; L1354-L1358 WeakPolarHBondContact O-CG 3.39Å; L1354-L1358 PolarHBondContact O-N 3.39Å; L1354-L1411 HydrophobicContact CB-CD2 4.13Å; L1354-L1431 HydrophobicContact CD2-CD1 3.89Å; L1354-R1434 HydrophobicContact CD2-CB 4.36Å; L1354-L1435 HydrophobicContact CD1-CD2 4.31Å; L1354-M1438 HydrophobicContact CD1-SD 3.51Å; L1354-M1438 VanDerWaalsContact CD1-SD 3.51Å
1355E84.7Confident84.5Confident101 Ų10158.2 Ų58.247%0.47229%0.288SS..Hα-helixtrans-70.1-39.7179.1-72.8-169.1169.300113.3P1351 D1353 A1359 R1434P1351-E1355 WeakPolarHBondContact O-CG 3.31Å; P1351-E1355 PolarHBondContact O-N 3.25Å; D1353-E1355 VanDerWaalsContact C-N 3.31Å; D1353-E1355 PolarHBondContact O-N 3.36Å; E1355-A1359 PolarHBondContact O-N 3.23Å; E1355-A1359 VanDerWaalsContact O-N 3.11Å; E1355-R1434 IonicContact OE1-CZ 3.85Å; E1355-R1434 IonicContact OE1-NH1 2.71Å; E1355-R1434 PolarHBondContact OE1-NH1 2.94Å; E1355-R1434 IonicContact OE1-NH2 2.6Å; E1355-R1434 PolarHBondContact OE1-NH2 2.84Å
1356K85.1Confident84.8Confident131 Ų13154 Ų5457%0.5728%0.281SS*.Hα-helixtrans-60.5-45.5172.4-68.9170.6-162.2156.10111.6L1352 D1353 A1359 W1360L1352-K1356 WeakPolarHBondContact O-CG 3.31Å; L1352-K1356 PolarHBondContact O-N 3.13Å; D1353-K1356 PolarHBondContact O-N 2.97Å; D1353-K1356 IonicContact OD1-NZ 3.73Å; D1353-K1356 PolarHBondContact OD1-NZ 3.18Å; K1356-A1359 WeakPolarHBondContact O-CB 3.49Å; K1356-A1359 PolarHBondContact O-N 3.08Å; K1356-W1360 PolarHBondContact O-N 3.1Å; K1356-W1360 VanDerWaalsContact O-N 3.09Å
1357F90.5Very high85.1Confident4 Ų454.9 Ų54.92%0.01829%0.288CS..Hα-helixtrans-67.5-40.2-178.1-175.8-101000112.3D1353 L1354 A1359 W1360 L1361 H1404 V1407 Y1408 L1411 M1438 W1442D1353-F1357 WeakPolarHBondContact O-CB 3.41Å; D1353-F1357 PolarHBondContact O-N 2.95Å; L1354-F1357 PolarHBondContact O-N 3.04Å; F1357-A1359 VanDerWaalsContact C-N 3.29Å; F1357-A1359 PolarHBondContact O-N 3.4Å; F1357-W1360 HydrophobicContact CD2-CE3 4.14Å; F1357-W1360 AromaticContact CE2-CE3 3.89Å; F1357-W1360 HydrophobicContact CE2-CE3 3.89Å; F1357-W1360 AromaticContact CE2-CZ3 3.83Å; F1357-W1360 HydrophobicContact CE2-CZ3 3.83Å; F1357-W1360 HydrophobicContact CZ-CE3 4.44Å; F1357-W1360 HydrophobicContact CZ-CZ3 4.12Å; F1357-W1360 PolarHBondContact O-N 3.2Å; F1357-L1361 HydrophobicContact CD1-CD1 3.81Å; F1357-L1361 HydrophobicContact CD1-CG 4.26Å; F1357-L1361 HydrophobicContact CE1-CD1 3.39Å; F1357-L1361 HydrophobicContact CE1-CG 3.81Å; F1357-L1361 HydrophobicContact CZ-CD1 4.14Å; F1357-L1361 HydrophobicContact CZ-CG 4.1Å; F1357-L1361 WeakPolarHBondContact O-CB 3.28Å; F1357-L1361 PolarHBondContact O-N 3.06Å; F1357-H1404 HydrophobicContact CE2-CB 4.15Å; F1357-V1407 HydrophobicContact CB-CG1 4.38Å; F1357-V1407 HydrophobicContact CD2-CB 4.07Å; F1357-V1407 HydrophobicContact CD2-CG1 3.68Å; F1357-V1407 HydrophobicContact CE2-CB 4.31Å; F1357-V1407 HydrophobicContact CE2-CG1 4.38Å; F1357-V1407 HydrophobicContact CG-CG1 4.3Å; F1357-Y1408 AromaticContact CE1-CD2 4Å; F1357-Y1408 HydrophobicContact CE1-CD2 4Å; F1357-Y1408 AromaticContact CZ-CD2 3.99Å; F1357-Y1408 HydrophobicContact CZ-CD2 3.99Å; F1357-Y1408 HydrophobicContact CZ-CG 4.32Å; F1357-L1411 HydrophobicContact CB-CD1 3.4Å; F1357-L1411 HydrophobicContact CD1-CD1 3.85Å; F1357-L1411 HydrophobicContact CD2-CD1 4.35Å; F1357-L1411 HydrophobicContact CG-CD1 3.61Å; F1357-M1438 HydrophobicContact CD1-CG 3.72Å; F1357-M1438 HydrophobicContact CD1-SD 3.53Å; F1357-M1438 VanDerWaalsContact CD1-SD 3.53Å; F1357-M1438 HydrophobicContact CE1-CG 3.59Å; F1357-M1438 HydrophobicContact CE1-SD 3.72Å; F1357-W1442 HydrophobicContact CE2-CZ3 4.35Å; F1357-W1442 HydrophobicContact CZ-CD2 4.47Å; F1357-W1442 AromaticContact CZ-CE3 3.79Å; F1357-W1442 HydrophobicContact CZ-CE3 3.79Å; F1357-W1442 AromaticContact CZ-CZ3 3.98Å; F1357-W1442 HydrophobicContact CZ-CZ3 3.98Å
1358L86.5Confident85.6Confident24 Ų2453.9 Ų53.913%0.12628%0.283CS..Hα-helixtrans-63.5-32173.8-77.7171.6000113.2L1354 L1361 T1362 M1438L1354-L1358 HydrophobicContact CD1-CD1 4.14Å; L1354-L1358 HydrophobicContact CD1-CG 4.29Å; L1354-L1358 HydrophobicContact CG-CD1 4.06Å; L1354-L1358 WeakPolarHBondContact O-CB 3.37Å; L1354-L1358 VanDerWaalsContact O-CG 3.31Å; L1354-L1358 WeakPolarHBondContact O-CG 3.39Å; L1354-L1358 PolarHBondContact O-N 3.39Å; L1358-L1361 HydrophobicContact CD2-CD1 4.39Å; L1358-T1362 PolarHBondContact O-N 3.41Å; L1358-T1362 PolarHBondContact O-OG1 3.42Å; L1358-M1438 HydrophobicContact CD2-CB 3.85Å; L1358-M1438 HydrophobicContact CD2-CG 4.19Å
1359A86.1Confident85.8Confident62 Ų6251.5 Ų51.551%0.51227%0.273SS..Hα-helixtrans-67.6-53.6173.500000111.1E1355 K1356 F1357 L1361 T1362 E1363E1355-A1359 PolarHBondContact O-N 3.23Å; E1355-A1359 VanDerWaalsContact O-N 3.11Å; K1356-A1359 WeakPolarHBondContact O-CB 3.49Å; K1356-A1359 PolarHBondContact O-N 3.08Å; F1357-A1359 VanDerWaalsContact C-N 3.29Å; F1357-A1359 PolarHBondContact O-N 3.4Å; A1359-L1361 VanDerWaalsContact C-N 3.35Å; A1359-L1361 PolarHBondContact O-N 2.91Å; A1359-T1362 WeakPolarHBondContact O-CB 3.38Å; A1359-T1362 PolarHBondContact O-N 2.87Å; A1359-E1363 PolarHBondContact O-N 3.47Å
1360W93.4Very high86Confident27 Ų2752 Ų5210%0.10228%0.282CS..Hα-helixtrans-58.3-43.1176.716979000112.3K1356 F1357 T1362 E1363 A1364 E1400 I1401 H1404 W1442 L1445K1356-W1360 PolarHBondContact O-N 3.1Å; K1356-W1360 VanDerWaalsContact O-N 3.09Å; F1357-W1360 HydrophobicContact CD2-CE3 4.14Å; F1357-W1360 AromaticContact CE2-CE3 3.89Å; F1357-W1360 HydrophobicContact CE2-CE3 3.89Å; F1357-W1360 AromaticContact CE2-CZ3 3.83Å; F1357-W1360 HydrophobicContact CE2-CZ3 3.83Å; F1357-W1360 HydrophobicContact CZ-CE3 4.44Å; F1357-W1360 HydrophobicContact CZ-CZ3 4.12Å; F1357-W1360 PolarHBondContact O-N 3.2Å; W1360-T1362 PolarHBondContact O-N 3.2Å; W1360-T1362 VanDerWaalsContact O-N 3.13Å; W1360-E1363 WeakPolarHBondContact O-CB 3.28Å; W1360-E1363 PolarHBondContact O-N 3.48Å; W1360-A1364 HydrophobicContact CD2-CB 4.47Å; W1360-A1364 HydrophobicContact CH2-CB 4.16Å; W1360-A1364 HydrophobicContact CZ2-CB 3.69Å; W1360-A1364 PolarHBondContact O-N 2.85Å; W1360-E1400 HydrophobicContact CZ2-CB 4.23Å; W1360-E1400 PolarHBondContact NE1-OE2 2.89Å; W1360-I1401 HydrophobicContact CH2-CG1 4.46Å; W1360-H1404 AromaticContact CD1-CE1 3.75Å; W1360-H1404 AromaticContact CD1-NE2 3.9Å; W1360-H1404 HydrophobicContact CD2-CB 4.29Å; W1360-H1404 AromaticContact CD2-CD2 3.78Å; W1360-H1404 AromaticContact CD2-CG 3.74Å; W1360-H1404 AromaticContact CD2-ND1 3.9Å; W1360-H1404 AromaticContact CD2-NE2 3.98Å; W1360-H1404 AromaticContact CE2-CE1 3.67Å; W1360-H1404 AromaticContact CE2-CG 3.65Å; W1360-H1404 AromaticContact CE2-ND1 3.38Å; W1360-H1404 HydrophobicContact CE3-CB 4Å; W1360-H1404 AromaticContact CE3-CG 3.92Å; W1360-H1404 AromaticContact CG-NE2 3.88Å; W1360-H1404 HydrophobicContact CH2-CB 3.63Å; W1360-H1404 HydrophobicContact CZ2-CB 3.9Å; W1360-H1404 AromaticContact CZ2-CG 3.79Å; W1360-H1404 AromaticContact CZ2-ND1 3.57Å; W1360-H1404 HydrophobicContact CZ3-CB 3.68Å; W1360-H1404 AromaticContact NE1-CE1 3.46Å; W1360-H1404 PolarHBondContact NE1-CE1 2.91Å; W1360-H1404 AromaticContact NE1-ND1 3.61Å; W1360-W1442 HydrophobicContact CH2-CE3 4.37Å; W1360-W1442 AromaticContact CH2-CZ3 3.7Å; W1360-W1442 HydrophobicContact CH2-CZ3 3.7Å; W1360-W1442 HydrophobicContact CZ3-CE3 4.07Å; W1360-W1442 AromaticContact CZ3-CZ3 3.65Å; W1360-W1442 HydrophobicContact CZ3-CZ3 3.65Å; W1360-L1445 HydrophobicContact CH2-CD2 3.94Å; W1360-L1445 HydrophobicContact CZ3-CD2 4.41Å
1361L90.2Very high85.9Confident0 Ų051.8 Ų51.80%028%0.281CS..Hα-helixtrans-52.7-37.5175.5-101.4177000112.6F1357 L1358 A1359 E1365 M1438 K1441 W1442 L1445F1357-L1361 HydrophobicContact CD1-CD1 3.81Å; F1357-L1361 HydrophobicContact CD1-CG 4.26Å; F1357-L1361 HydrophobicContact CE1-CD1 3.39Å; F1357-L1361 HydrophobicContact CE1-CG 3.81Å; F1357-L1361 HydrophobicContact CZ-CD1 4.14Å; F1357-L1361 HydrophobicContact CZ-CG 4.1Å; F1357-L1361 WeakPolarHBondContact O-CB 3.28Å; F1357-L1361 PolarHBondContact O-N 3.06Å; L1358-L1361 HydrophobicContact CD2-CD1 4.39Å; A1359-L1361 VanDerWaalsContact C-N 3.35Å; A1359-L1361 PolarHBondContact O-N 2.91Å; L1361-E1365 VanDerWaalsContact O-CB 3.22Å; L1361-E1365 WeakPolarHBondContact O-CB 3.39Å; L1361-E1365 PolarHBondContact O-N 3.25Å; L1361-M1438 HydrophobicContact CD1-CG 3.83Å; L1361-K1441 HydrophobicContact CD1-CB 4.19Å; L1361-K1441 HydrophobicContact CD2-CB 4.31Å; L1361-W1442 HydrophobicContact CD2-CB 4.17Å; L1361-W1442 HydrophobicContact CD2-CE3 3.99Å; L1361-L1445 HydrophobicContact CD2-CD2 3.93Å
1362T87Confident85.9Confident60 Ų6050.4 Ų50.437%0.36827%0.27SS..Hα-helixtrans-76.1-34.2-178.9-55.60000111.5L1358 A1359 W1360 T1366 K1441L1358-T1362 PolarHBondContact O-N 3.41Å; L1358-T1362 PolarHBondContact O-OG1 3.42Å; A1359-T1362 WeakPolarHBondContact O-CB 3.38Å; A1359-T1362 PolarHBondContact O-N 2.87Å; W1360-T1362 PolarHBondContact O-N 3.2Å; W1360-T1362 VanDerWaalsContact O-N 3.13Å; T1362-T1366 PolarHBondContact O-N 3Å; T1362-T1366 PolarHBondContact O-OG1 3.01Å; T1362-K1441 PolarHBondContact OG1-NZ 2.82Å
1363E86.1Confident85.6Confident136 Ų13650.4 Ų50.464%0.63627%0.271SS*.Hα-helixtrans-67.7-51.5172.7-173.4165.5-156.700111.3A1359 W1360 E1365 T1366 T1367A1359-E1363 PolarHBondContact O-N 3.47Å; W1360-E1363 WeakPolarHBondContact O-CB 3.28Å; W1360-E1363 PolarHBondContact O-N 3.48Å; E1363-E1365 VanDerWaalsContact C-N 3.34Å; E1363-E1365 PolarHBondContact O-N 2.94Å; E1363-T1366 WeakPolarHBondContact O-CA 3.44Å; E1363-T1366 VanDerWaalsContact O-CB 3.29Å; E1363-T1366 WeakPolarHBondContact O-CB 3.48Å; E1363-T1366 PolarHBondContact O-N 3.41Å; E1363-T1367 PolarHBondContact O-N 2.87Å; E1363-T1367 PolarHBondContact O-OG1 3.05Å
1364A88.8Confident85.2Confident0 Ų049.4 Ų49.40%027%0.269CS..Hα-helixtrans-60.9-38.7177.800000112.8W1360 T1366 T1367 A1368 L1397 L1445W1360-A1364 HydrophobicContact CD2-CB 4.47Å; W1360-A1364 HydrophobicContact CH2-CB 4.16Å; W1360-A1364 HydrophobicContact CZ2-CB 3.69Å; W1360-A1364 PolarHBondContact O-N 2.85Å; A1364-T1366 VanDerWaalsContact C-N 3.3Å; A1364-T1366 PolarHBondContact O-N 3.48Å; A1364-T1367 PolarHBondContact O-N 3.25Å; A1364-A1368 WeakPolarHBondContact O-CB 3.35Å; A1364-A1368 PolarHBondContact O-N 3.38Å; A1364-L1397 HydrophobicContact CB-CD1 4.17Å; A1364-L1445 HydrophobicContact CB-CD1 4.24Å; A1364-L1445 HydrophobicContact CB-CD2 3.72Å
1365E85.6Confident84.3Confident37 Ų3750.8 Ų50.817%0.17328%0.277CS..Hα-helixtrans-62.2-36.6172179.1168.8-150.900112.2L1361 E1363 A1368 N1369 K1441 K1448L1361-E1365 VanDerWaalsContact O-CB 3.22Å; L1361-E1365 WeakPolarHBondContact O-CB 3.39Å; L1361-E1365 PolarHBondContact O-N 3.25Å; E1363-E1365 VanDerWaalsContact C-N 3.34Å; E1363-E1365 PolarHBondContact O-N 2.94Å; E1365-A1368 PolarHBondContact O-N 3.17Å; E1365-N1369 PolarHBondContact O-N 3.08Å; E1365-N1369 PolarHBondContact O-ND2 3.31Å; E1365-K1441 IonicContact OE2-NZ 3.89Å; E1365-K1448 IonicContact OE1-NZ 3.85Å; E1365-K1448 PolarHBondContact OE1-NZ 3.33Å
1366T84.5Confident83.3Confident81 Ų8152.9 Ų52.950%0.49728%0.281SS..Hα-helixtrans-65.7-45.3176.6-540000110.7T1362 E1363 A1364 A1368 N1369 V1370T1362-T1366 PolarHBondContact O-N 3Å; T1362-T1366 PolarHBondContact O-OG1 3.01Å; E1363-T1366 WeakPolarHBondContact O-CA 3.44Å; E1363-T1366 VanDerWaalsContact O-CB 3.29Å; E1363-T1366 WeakPolarHBondContact O-CB 3.48Å; E1363-T1366 PolarHBondContact O-N 3.41Å; A1364-T1366 VanDerWaalsContact C-N 3.3Å; A1364-T1366 PolarHBondContact O-N 3.48Å; T1366-A1368 PolarHBondContact O-N 3.06Å; T1366-N1369 PolarHBondContact O-N 3.14Å; T1366-V1370 WeakPolarHBondContact O-CG2 3.36Å; T1366-V1370 PolarHBondContact O-N 3.39Å; T1366-V1370 VanDerWaalsContact O-N 3.16Å
1367T85.9Confident81.9Confident57 Ų5753.7 Ų53.735%0.3529%0.285SS..Hα-helixtrans-59.9-44.1174.1-57.10000112E1363 A1364 N1369 V1370 L1371 L1397E1363-T1367 PolarHBondContact O-N 2.87Å; E1363-T1367 PolarHBondContact O-OG1 3.05Å; A1364-T1367 PolarHBondContact O-N 3.25Å; T1367-N1369 PolarHBondContact O-N 2.7Å; T1367-V1370 PolarHBondContact O-N 2.88Å; T1367-L1371 HydrophobicContact CG2-CD1 4.21Å; T1367-L1371 PolarHBondContact O-N 3.5Å; T1367-L1397 HydrophobicContact CG2-CD1 4.2Å; T1367-L1397 HydrophobicContact CG2-CD2 4.39Å
1368A86.1Confident80Confident0 Ų062.3 Ų62.30%033%0.325CS..Hα-helixtrans-60-43.117700000112.5A1364 E1365 T1366 L1371 Q1372 L1397 L1445 K1448 I1452A1364-A1368 WeakPolarHBondContact O-CB 3.35Å; A1364-A1368 PolarHBondContact O-N 3.38Å; E1365-A1368 PolarHBondContact O-N 3.17Å; T1366-A1368 PolarHBondContact O-N 3.06Å; A1368-L1371 PolarHBondContact O-N 3.5Å; A1368-Q1372 WeakPolarHBondContact O-CB 3.34Å; A1368-Q1372 PolarHBondContact O-N 3.07Å; A1368-L1397 HydrophobicContact CB-CD2 3.78Å; A1368-L1445 HydrophobicContact CB-CD1 3.74Å; A1368-K1448 HydrophobicContact CB-CB 4.12Å; A1368-K1448 HydrophobicContact CB-CD 4.4Å; A1368-I1452 WeakPolarHBondContact O-CD1 3.21Å
1369N84.9Confident78.3Confident58 Ų5872.2 Ų72.231%0.3136%0.361SS..Hα-helixtrans-62.7-44.8177.6-63.2-31.9000111.4E1365 T1366 T1367 L1371 Q1372 D1373 K1448E1365-N1369 PolarHBondContact O-N 3.08Å; E1365-N1369 PolarHBondContact O-ND2 3.31Å; T1366-N1369 PolarHBondContact O-N 3.14Å; T1367-N1369 PolarHBondContact O-N 2.7Å; N1369-L1371 VanDerWaalsContact C-N 3.34Å; N1369-L1371 PolarHBondContact O-N 3.26Å; N1369-Q1372 PolarHBondContact O-N 2.88Å; N1369-D1373 PolarHBondContact O-N 3.35Å; N1369-K1448 WeakPolarHBondContact OD1-CE 3.33Å; N1369-K1448 PolarHBondContact OD1-NZ 2.94Å
1370V84.9Confident76.6Confident98 Ų9871.6 Ų71.659%0.59435%0.348SS*.Hα-helixtrans-60.2-43.6178.3171.80000111.5T1366 T1367 A1374T1366-V1370 WeakPolarHBondContact O-CG2 3.36Å; T1366-V1370 PolarHBondContact O-N 3.39Å; T1366-V1370 VanDerWaalsContact O-N 3.16Å; T1367-V1370 PolarHBondContact O-N 2.88Å; V1370-A1374 WeakPolarHBondContact O-CB 3.47Å; V1370-A1374 PolarHBondContact O-N 3.39Å; V1370-A1374 VanDerWaalsContact O-N 3.09Å
1371L81.5Confident74.5Confident4 Ų477.2 Ų77.22%0.02138%0.379CS..Hα-helixtrans-64.8-46.7176.2-73.4166.7000111.7T1367 A1368 N1369 D1373 A1374 T1375 L1390 Q1393 L1397 I1452T1367-L1371 HydrophobicContact CG2-CD1 4.21Å; T1367-L1371 PolarHBondContact O-N 3.5Å; A1368-L1371 PolarHBondContact O-N 3.5Å; N1369-L1371 VanDerWaalsContact C-N 3.34Å; N1369-L1371 PolarHBondContact O-N 3.26Å; L1371-D1373 VanDerWaalsContact C-N 3.33Å; L1371-D1373 PolarHBondContact O-N 3.05Å; L1371-A1374 WeakPolarHBondContact O-CB 3.44Å; L1371-A1374 PolarHBondContact O-N 3.25Å; L1371-A1374 VanDerWaalsContact O-N 3.1Å; L1371-T1375 PolarHBondContact O-N 3.34Å; L1371-T1375 PolarHBondContact O-OG1 3.32Å; L1371-L1390 HydrophobicContact CD2-CD2 4.12Å; L1371-Q1393 HydrophobicContact CD1-CB 4.47Å; L1371-Q1393 HydrophobicContact CD2-CB 3.52Å; L1371-L1397 HydrophobicContact CD1-CB 4.25Å; L1371-L1397 HydrophobicContact CD1-CD2 3.84Å; L1371-I1452 HydrophobicContact CB-CD1 3.82Å
1372Q79.2Confident72.7Confident29 Ų2986.2 Ų86.214%0.13642%0.421CS..Hα-helixtrans-60.1-40.5-179.3-168.6174.334.800112.9A1368 N1369 R1376 I1452A1368-Q1372 WeakPolarHBondContact O-CB 3.34Å; A1368-Q1372 PolarHBondContact O-N 3.07Å; N1369-Q1372 PolarHBondContact O-N 2.88Å; Q1372-R1376 WeakPolarHBondContact O-CG 3.39Å; Q1372-R1376 PolarHBondContact O-N 2.69Å; Q1372-I1452 HydrophobicContact CB-CD1 4.16Å; Q1372-I1452 HydrophobicContact CB-CG1 3.88Å; Q1372-I1452 HydrophobicContact CG-CG1 4.3Å
1373D76.9Confident70.9Confident100 Ų10087.4 Ų87.454%0.53543%0.426SS..Hα-helixtrans-71.5-31.6175.7-79.6-15.9000112.7N1369 L1371 R1376N1369-D1373 PolarHBondContact O-N 3.35Å; L1371-D1373 VanDerWaalsContact C-N 3.33Å; L1371-D1373 PolarHBondContact O-N 3.05Å; D1373-R1376 PolarHBondContact O-N 2.96Å; D1373-R1376 IonicContact OD1-NH1 2.86Å
1374A75.4Confident69.5Low26 Ų2684.8 Ų84.822%0.21542%0.423CS..Hα-helixtrans-67.5-41.4173.300000112.1V1370 L1371 R1376 K1377 L1380 L1390V1370-A1374 WeakPolarHBondContact O-CB 3.47Å; V1370-A1374 PolarHBondContact O-N 3.39Å; V1370-A1374 VanDerWaalsContact O-N 3.09Å; L1371-A1374 WeakPolarHBondContact O-CB 3.44Å; L1371-A1374 PolarHBondContact O-N 3.25Å; L1371-A1374 VanDerWaalsContact O-N 3.1Å; A1374-R1376 PolarHBondContact O-N 3.16Å; A1374-K1377 PolarHBondContact O-N 3.23Å; A1374-L1380 WeakPolarHBondContact O-CD1 3.25Å; A1374-L1390 HydrophobicContact CB-CD1 4.4Å; A1374-L1390 HydrophobicContact CB-CD2 3.61Å
1375T66.2Low68.6Low31 Ų3193 Ų9319%0.1946%0.458CS..Hα-helixtrans-62.7-21.9177.9-41.20000113.2L1371 H1455 L1456L1371-T1375 PolarHBondContact O-N 3.34Å; L1371-T1375 PolarHBondContact O-OG1 3.32Å; T1375-H1455 HydrophobicContact CG2-CB 3.87Å; T1375-L1456 HydrophobicContact CG2-CD2 3.92Å; T1375-L1456 HydrophobicContact CG2-CG 4.02Å
1376R64.4Low67.8Low146 Ų14692 Ų9255%0.55146%0.458SS*.THydrogen-bonded Turntrans-85.9-6.1-176.8-75.8173.2170.6168.4-2.5115.6Q1372 D1373 A1374 E1378Q1372-R1376 WeakPolarHBondContact O-CG 3.39Å; Q1372-R1376 PolarHBondContact O-N 2.69Å; D1373-R1376 PolarHBondContact O-N 2.96Å; D1373-R1376 IonicContact OD1-NH1 2.86Å; A1374-R1376 PolarHBondContact O-N 3.16Å; R1376-E1378 PolarHBondContact O-N 3.31Å
1377K56.5Low66.9Low148 Ų14890.2 Ų90.264%0.64345%0.447SS*.  trans-77.1104.7-179.2-74.2177.4-179.5169.40111.2A1374 R1379 L1380A1374-K1377 PolarHBondContact O-N 3.23Å; K1377-R1379 PolarHBondContact O-N 3.26Å; K1377-L1380 HydrophobicContact CB-CD1 4.2Å; K1377-L1380 PolarHBondContact O-N 3.4Å
1378E49.7Very low66.1Low184 Ų18494.5 Ų94.586%0.8646%0.461SS*.G310 helixtrans-42.4-31.3-173.4-82.4-179.3141.300117R1376 L1380R1376-E1378 PolarHBondContact O-N 3.31Å; E1378-L1380 PolarHBondContact O-N 3.29Å
1379R50.3Low65.6Low233 Ų23399 Ų9988%0.87948%0.482SS*.G310 helixtrans-83.4-0.6-176.8-67.1-172.2-179.4176.70.1115.4K1377K1377-R1379 PolarHBondContact O-N 3.26Å
1380L51.1Low65.4Low49 Ų4997.2 Ų97.226%0.25747%0.472SS..G310 helixtrans-81.3-19.1-179.7-85.4164.4000114.6A1374 K1377 E1378 E1382 D1383 V1387 L1390A1374-L1380 WeakPolarHBondContact O-CD1 3.25Å; K1377-L1380 HydrophobicContact CB-CD1 4.2Å; K1377-L1380 PolarHBondContact O-N 3.4Å; E1378-L1380 PolarHBondContact O-N 3.29Å; L1380-E1382 PolarHBondContact O-N 2.91Å; L1380-D1383 PolarHBondContact O-N 3.43Å; L1380-D1383 VanDerWaalsContact O-N 3.08Å; L1380-V1387 WeakPolarHBondContact O-CG2 3.47Å; L1380-L1390 HydrophobicContact CD1-CD1 3.98Å
1381L50.2Low64.9Low144 Ų14495.8 Ų95.875%0.75446%0.46SS*.THydrogen-bonded Turntrans-63.9-20.9-178-79.7165.4000114.1
1382E52.1Low64.8Low189 Ų189100.6 Ų100.688%0.88348%0.481SS*.THydrogen-bonded Turntrans-90.1-19.8175.3-63.7-176.2165.400113.1L1380 S1384L1380-E1382 PolarHBondContact O-N 2.91Å; E1382-S1384 PolarHBondContact O-N 3.27Å
1383D49.6Very low65.1Low85 Ų85103.1 Ų103.146%0.45549%0.492SS..  trans-93.689.1178.4-171.3-6.2000111.4L1380 K1385 G1386 V1387L1380-D1383 PolarHBondContact O-N 3.43Å; L1380-D1383 VanDerWaalsContact O-N 3.08Å; D1383-K1385 PolarHBondContact O-N 2.97Å; D1383-K1385 VanDerWaalsContact OD1-CB 3.25Å; D1383-K1385 WeakPolarHBondContact OD1-CB 3.05Å; D1383-K1385 PolarHBondContact OD1-N 3.5Å; D1383-G1386 PolarHBondContact O-N 2.98Å; D1383-G1386 PolarHBondContact OD1-N 3.17Å; D1383-V1387 PolarHBondContact O-N 2.85Å; D1383-V1387 VanDerWaalsContact O-N 3.15Å
1384S56.3Low65.6Low82 Ų8299.7 Ų99.757%0.57347%0.472SS*.Hα-helixtrans-52.5-23175.6-174.50000114.1E1382 K1388E1382-S1384 PolarHBondContact O-N 3.27Å; S1384-K1388 WeakPolarHBondContact O-CG 3.31Å
1385K70Confident66Low172 Ų172103.7 Ų103.775%0.74849%0.486SS*.Hα-helixtrans-79.8-42.3176.6-130.7-178.3-177.3-174.10111.5D1383 K1388 E1389D1383-K1385 PolarHBondContact O-N 2.97Å; D1383-K1385 VanDerWaalsContact OD1-CB 3.25Å; D1383-K1385 WeakPolarHBondContact OD1-CB 3.05Å; D1383-K1385 PolarHBondContact OD1-N 3.5Å; K1385-K1388 PolarHBondContact O-N 3.37Å; K1385-E1389 PolarHBondContact O-N 2.92Å; K1385-E1389 VanDerWaalsContact O-N 3.17Å
1386G67.3Low66.9Low17 Ų17106.3 Ų106.318%0.17550%0.499CS..Hα-helixtrans-62.9-43.2176.400000113D1383 K1388 E1389 L1390D1383-G1386 PolarHBondContact O-N 2.98Å; D1383-G1386 PolarHBondContact OD1-N 3.17Å; G1386-K1388 VanDerWaalsContact C-N 3.34Å; G1386-K1388 PolarHBondContact O-N 3.44Å; G1386-E1389 PolarHBondContact O-N 3.44Å; G1386-L1390 PolarHBondContact O-N 3.24Å; G1386-L1390 VanDerWaalsContact O-N 3.09Å
1387V66.5Low68.1Low43 Ų4399.5 Ų99.526%0.26147%0.473SS..Hα-helixtrans-61.9-40.6176.5179.40000111.7L1380 D1383 L1390 M1391 L1456L1380-V1387 WeakPolarHBondContact O-CG2 3.47Å; D1383-V1387 PolarHBondContact O-N 2.85Å; D1383-V1387 VanDerWaalsContact O-N 3.15Å; V1387-L1390 PolarHBondContact O-N 2.94Å; V1387-M1391 WeakPolarHBondContact O-CB 3.4Å; V1387-M1391 PolarHBondContact O-N 2.91Å; V1387-L1456 HydrophobicContact CG1-CD2 4.19Å
1388K68.2Low69.6Low146 Ų14694.6 Ų94.664%0.63545%0.453SS*.Hα-helixtrans-65.3-39.7177.5-78-179.2179.4-176.70113.3S1384 K1385 G1386 M1391 K1392S1384-K1388 WeakPolarHBondContact O-CG 3.31Å; K1385-K1388 PolarHBondContact O-N 3.37Å; G1386-K1388 VanDerWaalsContact C-N 3.34Å; G1386-K1388 PolarHBondContact O-N 3.44Å; K1388-M1391 PolarHBondContact O-N 3.28Å; K1388-K1392 PolarHBondContact O-N 2.8Å
1389E76.2Confident71.1Confident95 Ų9587.5 Ų87.544%0.44443%0.429SS..Hα-helixtrans-67.6-42178.2-172.559.6-151.100111.4K1385 G1386 M1391 K1392 Q1393K1385-E1389 PolarHBondContact O-N 2.92Å; K1385-E1389 VanDerWaalsContact O-N 3.17Å; G1386-E1389 PolarHBondContact O-N 3.44Å; E1389-M1391 PolarHBondContact O-N 3.22Å; E1389-K1392 PolarHBondContact O-N 3.38Å; E1389-Q1393 WeakPolarHBondContact O-CG 3.47Å; E1389-Q1393 PolarHBondContact O-N 3.37Å; E1389-Q1393 PolarHBondContact OE1-NE2 2.92Å; E1389-Q1393 VanDerWaalsContact OE1-NE2 3.1Å
1390L80.2Confident72.9Confident21 Ų2180.3 Ų80.311%0.1141%0.406CS..Hα-helixtrans-63.8-39.7173.3-72.6173.9000112.6L1371 A1374 L1380 G1386 V1387 K1392 Q1393 W1394 L1456L1371-L1390 HydrophobicContact CD2-CD2 4.12Å; A1374-L1390 HydrophobicContact CB-CD1 4.4Å; A1374-L1390 HydrophobicContact CB-CD2 3.61Å; L1380-L1390 HydrophobicContact CD1-CD1 3.98Å; G1386-L1390 PolarHBondContact O-N 3.24Å; G1386-L1390 VanDerWaalsContact O-N 3.09Å; V1387-L1390 PolarHBondContact O-N 2.94Å; L1390-K1392 VanDerWaalsContact C-N 3.3Å; L1390-K1392 PolarHBondContact O-N 3.15Å; L1390-Q1393 PolarHBondContact O-N 3.27Å; L1390-W1394 WeakPolarHBondContact O-CB 3.36Å; L1390-W1394 PolarHBondContact O-N 3.08Å; L1390-L1456 HydrophobicContact CB-CD2 4.48Å
1391M75.7Confident74.6Confident67 Ų6778 Ų7833%0.3339%0.394SS..Hα-helixtrans-64.7-36176.6-161.5173.6-142.100111.8V1387 K1388 E1389 Q1395 L1456V1387-M1391 WeakPolarHBondContact O-CB 3.4Å; V1387-M1391 PolarHBondContact O-N 2.91Å; K1388-M1391 PolarHBondContact O-N 3.28Å; E1389-M1391 PolarHBondContact O-N 3.22Å; M1391-Q1395 VanDerWaalsContact O-CG 3.31Å; M1391-Q1395 WeakPolarHBondContact O-CG 3.48Å; M1391-Q1395 PolarHBondContact O-N 3.34Å; M1391-L1456 HydrophobicContact CB-CD1 4.36Å; M1391-L1456 HydrophobicContact CG-CD1 4.45Å
1392K79.8Confident76.2Confident106 Ų10676.6 Ų76.646%0.46138%0.383SS..Hα-helixtrans-67.2-49.1172.9-171.9-165.3166.5-1610111.9K1388 E1389 L1390 W1394 Q1395 D1396K1388-K1392 PolarHBondContact O-N 2.8Å; E1389-K1392 PolarHBondContact O-N 3.38Å; L1390-K1392 VanDerWaalsContact C-N 3.3Å; L1390-K1392 PolarHBondContact O-N 3.15Å; K1392-W1394 PolarHBondContact O-N 2.87Å; K1392-Q1395 WeakPolarHBondContact O-CA 3.24Å; K1392-Q1395 WeakPolarHBondContact O-CB 3.5Å; K1392-Q1395 PolarHBondContact O-N 3.3Å; K1392-D1396 PolarHBondContact O-N 3.17Å
1393Q84Confident77.7Confident82 Ų8270.9 Ų70.938%0.38337%0.369SS..Hα-helixtrans-63.9-31.3180-68173.914.500112.3L1371 E1389 L1390 L1397L1371-Q1393 HydrophobicContact CD1-CB 4.47Å; L1371-Q1393 HydrophobicContact CD2-CB 3.52Å; E1389-Q1393 WeakPolarHBondContact O-CG 3.47Å; E1389-Q1393 PolarHBondContact O-N 3.37Å; E1389-Q1393 PolarHBondContact OE1-NE2 2.92Å; E1389-Q1393 VanDerWaalsContact OE1-NE2 3.1Å; L1390-Q1393 PolarHBondContact O-N 3.27Å; Q1393-L1397 PolarHBondContact O-N 3.29Å; Q1393-L1397 VanDerWaalsContact O-N 3.16Å
1394W88.1Confident79.5Confident28 Ų2869.6 Ų69.611%0.10636%0.36CS..Hα-helixtrans-66.6-41.4168169.673.1000112.8L1390 K1392 L1397 Q1398 S1449 I1452 R1453 L1456L1390-W1394 WeakPolarHBondContact O-CB 3.36Å; L1390-W1394 PolarHBondContact O-N 3.08Å; K1392-W1394 PolarHBondContact O-N 2.87Å; W1394-L1397 PolarHBondContact O-N 3.2Å; W1394-Q1398 HydrophobicContact CZ2-CB 4.21Å; W1394-Q1398 HydrophobicContact CZ2-CG 4.1Å; W1394-Q1398 VanDerWaalsContact O-CB 3.3Å; W1394-Q1398 WeakPolarHBondContact O-CB 3.47Å; W1394-Q1398 PolarHBondContact O-N 2.61Å; W1394-S1449 PolarHBondContact NE1-O 3.48Å; W1394-S1449 VanDerWaalsContact NE1-O 3.17Å; W1394-S1449 PolarHBondContact NE1-OG 3.3Å; W1394-I1452 HydrophobicContact CB-CG2 3.97Å; W1394-I1452 HydrophobicContact CG-CG2 3.85Å; W1394-R1453 HydrophobicContact CH2-CB 4.29Å; W1394-R1453 HydrophobicContact CH2-CG 3.61Å; W1394-R1453 HydrophobicContact CZ2-CB 3.72Å; W1394-R1453 HydrophobicContact CZ2-CG 3.55Å; W1394-R1453 HydrophobicContact CZ3-CG 4.15Å; W1394-L1456 HydrophobicContact CB-CD1 4.4Å
1395Q83.6Confident81Confident110 Ų11066.6 Ų66.651%0.51434%0.338SS..Hα-helixtrans-62.2-41.5174.5-76.7170.9-16.800112.2M1391 K1392 Q1398 G1399M1391-Q1395 VanDerWaalsContact O-CG 3.31Å; M1391-Q1395 WeakPolarHBondContact O-CG 3.48Å; M1391-Q1395 PolarHBondContact O-N 3.34Å; K1392-Q1395 WeakPolarHBondContact O-CA 3.24Å; K1392-Q1395 WeakPolarHBondContact O-CB 3.5Å; K1392-Q1395 PolarHBondContact O-N 3.3Å; Q1395-Q1398 PolarHBondContact O-N 2.86Å; Q1395-G1399 PolarHBondContact O-N 3.22Å
1396D86Confident81.5Confident86 Ų8664.3 Ų64.346%0.4633%0.334SS..Hα-helixtrans-61.3-48.1177-65.4-28.6000110.4K1392 Q1398 G1399 E1400K1392-D1396 PolarHBondContact O-N 3.17Å; D1396-Q1398 PolarHBondContact O-N 2.9Å; D1396-G1399 PolarHBondContact O-N 3.33Å; D1396-E1400 PolarHBondContact O-N 3.47Å; D1396-E1400 VanDerWaalsContact O-N 3.1Å
1397L88.7Confident82.4Confident2 Ų266.4 Ų66.41%0.0134%0.343CS..Hα-helixtrans-62-39.7174175.165.1000113A1364 T1367 A1368 L1371 Q1393 W1394 G1399 E1400 I1401A1364-L1397 HydrophobicContact CB-CD1 4.17Å; T1367-L1397 HydrophobicContact CG2-CD1 4.2Å; T1367-L1397 HydrophobicContact CG2-CD2 4.39Å; A1368-L1397 HydrophobicContact CB-CD2 3.78Å; L1371-L1397 HydrophobicContact CD1-CB 4.25Å; L1371-L1397 HydrophobicContact CD1-CD2 3.84Å; Q1393-L1397 PolarHBondContact O-N 3.29Å; Q1393-L1397 VanDerWaalsContact O-N 3.16Å; W1394-L1397 PolarHBondContact O-N 3.2Å; L1397-G1399 VanDerWaalsContact C-N 3.31Å; L1397-E1400 PolarHBondContact O-N 3.05Å; L1397-I1401 HydrophobicContact CG-CD1 4.23Å; L1397-I1401 WeakPolarHBondContact O-CG1 3.42Å; L1397-I1401 PolarHBondContact O-N 3.26Å
1398Q88.2Confident83.4Confident45 Ų4565.9 Ų65.921%0.2134%0.337CS..Hα-helixtrans-65.3-37.9178.3-178.959.43000111.1W1394 Q1395 D1396 I1401 E1402 S1449W1394-Q1398 HydrophobicContact CZ2-CB 4.21Å; W1394-Q1398 HydrophobicContact CZ2-CG 4.1Å; W1394-Q1398 VanDerWaalsContact O-CB 3.3Å; W1394-Q1398 WeakPolarHBondContact O-CB 3.47Å; W1394-Q1398 PolarHBondContact O-N 2.61Å; Q1395-Q1398 PolarHBondContact O-N 2.86Å; D1396-Q1398 PolarHBondContact O-N 2.9Å; Q1398-I1401 PolarHBondContact O-N 3.07Å; Q1398-E1402 WeakPolarHBondContact CG-OE1 3.41Å; Q1398-E1402 PolarHBondContact NE2-OE1 3.32Å; Q1398-E1402 WeakPolarHBondContact O-CG 3.32Å; Q1398-E1402 PolarHBondContact O-N 3.27Å; Q1398-S1449 PolarHBondContact OE1-OG 2.9Å
1399G82Confident84.2Confident36 Ų3663.9 Ų63.937%0.37133%0.329SS..Hα-helixtrans-62.8-39.2171.500000113.2Q1395 D1396 L1397 E1402 A1403Q1395-G1399 PolarHBondContact O-N 3.22Å; D1396-G1399 PolarHBondContact O-N 3.33Å; L1397-G1399 VanDerWaalsContact C-N 3.31Å; G1399-E1402 PolarHBondContact O-N 2.82Å; G1399-A1403 WeakPolarHBondContact O-CB 3.21Å; G1399-A1403 PolarHBondContact O-N 2.92Å
1400E86.7Confident84.4Confident82 Ų8264.1 Ų64.138%0.38333%0.334SS..Hα-helixtrans-63.2-41.5172.8-73.2-174.2-14500112.7W1360 D1396 L1397 A1403 H1404W1360-E1400 HydrophobicContact CZ2-CB 4.23Å; W1360-E1400 PolarHBondContact NE1-OE2 2.89Å; D1396-E1400 PolarHBondContact O-N 3.47Å; D1396-E1400 VanDerWaalsContact O-N 3.1Å; L1397-E1400 PolarHBondContact O-N 3.05Å; E1400-A1403 PolarHBondContact O-N 3.01Å; E1400-H1404 PolarHBondContact O-N 2.9Å; E1400-H1404 VanDerWaalsContact O-N 3.13Å; E1400-H1404 PolarHBondContact O-ND1 3.48Å
1401I87.6Confident84.7Confident0 Ų063.4 Ų63.40%033%0.33CS..Hα-helixtrans-63.1-43.1176-67.6166000110.4W1360 L1397 Q1398 H1404 T1405 W1442 L1445 R1446W1360-I1401 HydrophobicContact CH2-CG1 4.46Å; L1397-I1401 HydrophobicContact CG-CD1 4.23Å; L1397-I1401 WeakPolarHBondContact O-CG1 3.42Å; L1397-I1401 PolarHBondContact O-N 3.26Å; Q1398-I1401 PolarHBondContact O-N 3.07Å; I1401-H1404 PolarHBondContact O-N 3.46Å; I1401-T1405 PolarHBondContact O-N 3.45Å; I1401-T1405 PolarHBondContact O-OG1 3.14Å; I1401-W1442 HydrophobicContact CG2-CH2 3.99Å; I1401-W1442 HydrophobicContact CG2-CZ2 4.49Å; I1401-W1442 HydrophobicContact CG2-CZ3 4.31Å; I1401-W1442 VanDerWaalsContact O-CH2 3.31Å; I1401-W1442 WeakPolarHBondContact O-CH2 3.5Å; I1401-L1445 HydrophobicContact CD1-CD1 4.07Å; I1401-L1445 HydrophobicContact CD1-CD2 4.3Å; I1401-L1445 HydrophobicContact CD1-CG 3.84Å; I1401-L1445 HydrophobicContact CG1-CD2 3.98Å; I1401-L1445 HydrophobicContact CG1-CG 4.09Å; I1401-R1446 HydrophobicContact CG2-CG 4.04Å
1402E83.8Confident85Confident114 Ų11461.7 Ų61.753%0.53332%0.322SS..Hα-helixtrans-64.3-47.7178.4-74.9167.5-163.100111Q1398 G1399 H1404 T1405Q1398-E1402 WeakPolarHBondContact CG-OE1 3.41Å; Q1398-E1402 PolarHBondContact NE2-OE1 3.32Å; Q1398-E1402 WeakPolarHBondContact O-CG 3.32Å; Q1398-E1402 PolarHBondContact O-N 3.27Å; G1399-E1402 PolarHBondContact O-N 2.82Å; E1402-H1404 VanDerWaalsContact C-N 3.26Å; E1402-H1404 PolarHBondContact O-N 3.03Å; E1402-T1405 VanDerWaalsContact O-CB 3.32Å; E1402-T1405 WeakPolarHBondContact O-CB 3.4Å; E1402-T1405 PolarHBondContact O-N 3.32Å; E1402-T1405 VanDerWaalsContact O-N 3.09Å; E1402-T1405 PolarHBondContact O-OG1 2.58Å
1403A82.4Confident85Confident70 Ų7061.9 Ų61.958%0.57933%0.325SS*.Hα-helixtrans-59.7-31.2177.500000114.3G1399 E1400G1399-A1403 WeakPolarHBondContact O-CB 3.21Å; G1399-A1403 PolarHBondContact O-N 2.92Å; E1400-A1403 PolarHBondContact O-N 3.01Å
1404H89.1Confident84.9Confident57 Ų5759.3 Ų59.326%0.26431%0.313SS..THydrogen-bonded Turntrans-92.4-0.6178.9-72.390.1000114.2F1357 W1360 E1400 I1401 E1402 D1406 V1407 Y1408 W1442F1357-H1404 HydrophobicContact CE2-CB 4.15Å; W1360-H1404 AromaticContact CD1-CE1 3.75Å; W1360-H1404 AromaticContact CD1-NE2 3.9Å; W1360-H1404 HydrophobicContact CD2-CB 4.29Å; W1360-H1404 AromaticContact CD2-CD2 3.78Å; W1360-H1404 AromaticContact CD2-CG 3.74Å; W1360-H1404 AromaticContact CD2-ND1 3.9Å; W1360-H1404 AromaticContact CD2-NE2 3.98Å; W1360-H1404 AromaticContact CE2-CE1 3.67Å; W1360-H1404 AromaticContact CE2-CG 3.65Å; W1360-H1404 AromaticContact CE2-ND1 3.38Å; W1360-H1404 HydrophobicContact CE3-CB 4Å; W1360-H1404 AromaticContact CE3-CG 3.92Å; W1360-H1404 AromaticContact CG-NE2 3.88Å; W1360-H1404 HydrophobicContact CH2-CB 3.63Å; W1360-H1404 HydrophobicContact CZ2-CB 3.9Å; W1360-H1404 AromaticContact CZ2-CG 3.79Å; W1360-H1404 AromaticContact CZ2-ND1 3.57Å; W1360-H1404 HydrophobicContact CZ3-CB 3.68Å; W1360-H1404 AromaticContact NE1-CE1 3.46Å; W1360-H1404 PolarHBondContact NE1-CE1 2.91Å; W1360-H1404 AromaticContact NE1-ND1 3.61Å; E1400-H1404 PolarHBondContact O-N 2.9Å; E1400-H1404 VanDerWaalsContact O-N 3.13Å; E1400-H1404 PolarHBondContact O-ND1 3.48Å; I1401-H1404 PolarHBondContact O-N 3.46Å; E1402-H1404 VanDerWaalsContact C-N 3.26Å; E1402-H1404 PolarHBondContact O-N 3.03Å; H1404-D1406 PolarHBondContact O-N 3.48Å; H1404-V1407 PolarHBondContact O-N 3.28Å; H1404-Y1408 PolarHBondContact O-N 2.78Å; H1404-Y1408 VanDerWaalsContact O-N 3.11Å; H1404-W1442 HydrophobicContact CB-CZ3 4.46Å
1405T86.8Confident84.5Confident20 Ų2058 Ų5812%0.12331%0.309CS..Hα-helixtrans-65.5-36.7-179.2-66.40000112.3I1401 E1402 V1407 Y1408 H1409 W1442 R1446I1401-T1405 PolarHBondContact O-N 3.45Å; I1401-T1405 PolarHBondContact O-OG1 3.14Å; E1402-T1405 VanDerWaalsContact O-CB 3.32Å; E1402-T1405 WeakPolarHBondContact O-CB 3.4Å; E1402-T1405 PolarHBondContact O-N 3.32Å; E1402-T1405 VanDerWaalsContact O-N 3.09Å; E1402-T1405 PolarHBondContact O-OG1 2.58Å; T1405-V1407 VanDerWaalsContact C-N 3.35Å; T1405-Y1408 WeakPolarHBondContact O-CB 3.3Å; T1405-Y1408 PolarHBondContact O-N 3.05Å; T1405-H1409 PolarHBondContact O-CD2 3.03Å; T1405-H1409 PolarHBondContact O-N 3.33Å; T1405-H1409 VanDerWaalsContact O-N 3.14Å; T1405-W1442 HydrophobicContact CG2-CZ2 4.22Å; T1405-W1442 WeakPolarHBondContact OG1-CH2 3.5Å; T1405-W1442 WeakPolarHBondContact OG1-CZ2 3.39Å; T1405-R1446 PolarHBondContact OG1-NH2 2.96Å
1406D79.9Confident84.3Confident124 Ų12456.5 Ų56.566%0.66330%0.302SS*.Hα-helixtrans-69.4-34.7177.3-64-19.4000111.9H1404 H1409 N1410H1404-D1406 PolarHBondContact O-N 3.48Å; D1406-H1409 PolarHBondContact O-N 3.44Å; D1406-N1410 VanDerWaalsContact O-CB 3.27Å; D1406-N1410 WeakPolarHBondContact O-CB 3.34Å; D1406-N1410 PolarHBondContact O-N 3.04Å
1407V86.1Confident84Confident60 Ų6056.9 Ų56.936%0.36430%0.299SS..Hα-helixtrans-65.3-42175.7-1750000110.4F1357 H1404 T1405 L1411F1357-V1407 HydrophobicContact CB-CG1 4.38Å; F1357-V1407 HydrophobicContact CD2-CB 4.07Å; F1357-V1407 HydrophobicContact CD2-CG1 3.68Å; F1357-V1407 HydrophobicContact CE2-CB 4.31Å; F1357-V1407 HydrophobicContact CE2-CG1 4.38Å; F1357-V1407 HydrophobicContact CG-CG1 4.3Å; H1404-V1407 PolarHBondContact O-N 3.28Å; T1405-V1407 VanDerWaalsContact C-N 3.35Å; V1407-L1411 HydrophobicContact CG1-CD1 4.12Å; V1407-L1411 WeakPolarHBondContact O-CB 3.19Å; V1407-L1411 WeakPolarHBondContact O-CG 3.34Å; V1407-L1411 PolarHBondContact O-N 3.33Å
1408Y87.6Confident83.4Confident33 Ų3357.1 Ų57.113%0.12930%0.3CS..Hα-helixtrans-56.4-52.5172.7172.1-92.7000111.9F1357 H1404 T1405 N1410 L1411 D1412 M1438 N1439 W1442F1357-Y1408 AromaticContact CE1-CD2 4Å; F1357-Y1408 HydrophobicContact CE1-CD2 4Å; F1357-Y1408 AromaticContact CZ-CD2 3.99Å; F1357-Y1408 HydrophobicContact CZ-CD2 3.99Å; F1357-Y1408 HydrophobicContact CZ-CG 4.32Å; H1404-Y1408 PolarHBondContact O-N 2.78Å; H1404-Y1408 VanDerWaalsContact O-N 3.11Å; T1405-Y1408 WeakPolarHBondContact O-CB 3.3Å; T1405-Y1408 PolarHBondContact O-N 3.05Å; Y1408-N1410 PolarHBondContact O-N 3.28Å; Y1408-L1411 PolarHBondContact O-N 2.96Å; Y1408-D1412 PolarHBondContact O-N 3.45Å; Y1408-M1438 HydrophobicContact CD2-CE 4.09Å; Y1408-M1438 HydrophobicContact CE2-CE 4.04Å; Y1408-N1439 WeakPolarHBondContact CE2-OD1 3.47Å; Y1408-N1439 PolarHBondContact OH-OD1 3.4Å; Y1408-W1442 AromaticContact CD1-NE1 3.83Å; Y1408-W1442 HydrophobicContact CD2-CB 4.06Å; Y1408-W1442 AromaticContact CD2-CD1 3.66Å; Y1408-W1442 AromaticContact CD2-CD2 3.87Å; Y1408-W1442 HydrophobicContact CD2-CD2 3.87Å; Y1408-W1442 AromaticContact CD2-CG 3.63Å; Y1408-W1442 HydrophobicContact CD2-CG 3.63Å; Y1408-W1442 AromaticContact CD2-NE1 3.89Å; Y1408-W1442 AromaticContact CE1-NE1 3.95Å; Y1408-W1442 HydrophobicContact CE2-CB 3.88Å; Y1408-W1442 AromaticContact CE2-CD1 3.4Å; Y1408-W1442 HydrophobicContact CE2-CD2 4.36Å; Y1408-W1442 AromaticContact CE2-CG 3.64Å; Y1408-W1442 HydrophobicContact CE2-CG 3.64Å; Y1408-W1442 AromaticContact CE2-NE1 3.97Å; Y1408-W1442 HydrophobicContact CG-CD2 4.15Å; Y1408-W1442 AromaticContact CG-CE2 3.87Å; Y1408-W1442 HydrophobicContact CG-CG 4.27Å; Y1408-W1442 HydrophobicContact CG-CZ2 4.28Å; Y1408-W1442 AromaticContact CG-NE1 3.82Å; Y1408-W1442 AromaticContact CZ-CD1 3.65Å
1409H85.4Confident82.9Confident104 Ų10456.2 Ų56.248%0.48130%0.297SS..Hα-helixtrans-67.4-38.4-176.4-74.5-61.9000112.8T1405 D1406 D1412 E1413T1405-H1409 PolarHBondContact O-CD2 3.03Å; T1405-H1409 PolarHBondContact O-N 3.33Å; T1405-H1409 VanDerWaalsContact O-N 3.14Å; D1406-H1409 PolarHBondContact O-N 3.44Å; H1409-D1412 PolarHBondContact O-N 3.24Å; H1409-E1413 PolarHBondContact O-N 2.84Å
1410N81.1Confident82.5Confident99 Ų9962.4 Ų62.453%0.52931%0.309SS..Hα-helixtrans-65.2-40.2176-165.1-14.4000111.3D1406 Y1408 N1414D1406-N1410 VanDerWaalsContact O-CB 3.27Å; D1406-N1410 WeakPolarHBondContact O-CB 3.34Å; D1406-N1410 PolarHBondContact O-N 3.04Å; Y1408-N1410 PolarHBondContact O-N 3.28Å; N1410-N1414 VanDerWaalsContact O-CB 3.27Å; N1410-N1414 WeakPolarHBondContact O-CB 3.4Å; N1410-N1414 PolarHBondContact O-N 3.44Å; N1410-N1414 PolarHBondContact O-ND2 3.44Å; N1410-N1414 VanDerWaalsContact O-ND2 3.13Å; N1410-N1414 PolarHBondContact OD1-ND2 3.28Å
1411L86Confident81.5Confident6 Ų659.7 Ų59.73%0.03130%0.299CS..Hα-helixtrans-64.1-47.5171.5-75171.9000112.1F1350 D1353 L1354 F1357 V1407 Y1408 E1413 N1414 S1415 M1438F1350-L1411 HydrophobicContact CD2-CD2 3.83Å; F1350-L1411 HydrophobicContact CE2-CD2 3.84Å; F1350-L1411 WeakPolarHBondContact CE2-O 3.45Å; D1353-L1411 HydrophobicContact CB-CD2 4Å; L1354-L1411 HydrophobicContact CB-CD2 4.13Å; F1357-L1411 HydrophobicContact CB-CD1 3.4Å; F1357-L1411 HydrophobicContact CD1-CD1 3.85Å; F1357-L1411 HydrophobicContact CD2-CD1 4.35Å; F1357-L1411 HydrophobicContact CG-CD1 3.61Å; V1407-L1411 HydrophobicContact CG1-CD1 4.12Å; V1407-L1411 WeakPolarHBondContact O-CB 3.19Å; V1407-L1411 WeakPolarHBondContact O-CG 3.34Å; V1407-L1411 PolarHBondContact O-N 3.33Å; Y1408-L1411 PolarHBondContact O-N 2.96Å; L1411-E1413 PolarHBondContact O-N 3.37Å; L1411-N1414 PolarHBondContact O-N 2.89Å; L1411-S1415 WeakPolarHBondContact O-CB 3.14Å; L1411-S1415 PolarHBondContact O-N 3.21Å; L1411-S1415 PolarHBondContact O-OG 3.27Å; L1411-M1438 HydrophobicContact CB-CE 4.32Å; L1411-M1438 HydrophobicContact CB-SD 4.33Å; L1411-M1438 HydrophobicContact CD1-SD 4.19Å
1412D81.5Confident80.5Confident31 Ų3161.1 Ų61.117%0.16631%0.307CS..Hα-helixtrans-60.8-48-179.8-166.880.9000111.5Y1408 H1409 N1414 S1415 Q1416 N1439Y1408-D1412 PolarHBondContact O-N 3.45Å; H1409-D1412 PolarHBondContact O-N 3.24Å; D1412-N1414 PolarHBondContact O-N 2.84Å; D1412-S1415 WeakPolarHBondContact O-CB 3.29Å; D1412-S1415 PolarHBondContact O-N 2.87Å; D1412-S1415 PolarHBondContact O-OG 3.47Å; D1412-Q1416 WeakPolarHBondContact O-CG 3.35Å; D1412-Q1416 PolarHBondContact O-N 3.1Å; D1412-Q1416 PolarHBondContact OD2-NE2 3.18Å; D1412-N1439 PolarHBondContact OD1-ND2 3.01Å; D1412-N1439 VanDerWaalsContact OD1-ND2 3.13Å
1413E80.6Confident79.6Confident111 Ų11163.8 Ų63.852%0.51932%0.319SS..Hα-helixtrans-59.5-48.2176-83.3-158.8-173.900113.4H1409 L1411 S1415 Q1416 K1417H1409-E1413 PolarHBondContact O-N 2.84Å; L1411-E1413 PolarHBondContact O-N 3.37Å; E1413-S1415 VanDerWaalsContact C-N 3.25Å; E1413-S1415 PolarHBondContact O-N 3.47Å; E1413-Q1416 PolarHBondContact O-N 3.32Å; E1413-K1417 WeakPolarHBondContact O-CG 3.4Å; E1413-K1417 PolarHBondContact O-N 2.82Å; E1413-K1417 IonicContact OE2-NZ 3.95Å; E1413-K1417 PolarHBondContact OE2-NZ 2.78Å
1414N82.5Confident78.9Confident27 Ų2764.6 Ų64.614%0.14433%0.334CS..Hα-helixtrans-67.3-33-179.2-68.8-19.7000111.2L1346 F1350 N1410 L1411 D1412 K1417 I1418L1346-N1414 HydrophobicContact CD1-CB 3.89Å; F1350-N1414 HydrophobicContact CD2-CB 3.94Å; F1350-N1414 HydrophobicContact CE2-CB 4.47Å; N1410-N1414 VanDerWaalsContact O-CB 3.27Å; N1410-N1414 WeakPolarHBondContact O-CB 3.4Å; N1410-N1414 PolarHBondContact O-N 3.44Å; N1410-N1414 PolarHBondContact O-ND2 3.44Å; N1410-N1414 VanDerWaalsContact O-ND2 3.13Å; N1410-N1414 PolarHBondContact OD1-ND2 3.28Å; L1411-N1414 PolarHBondContact O-N 2.89Å; D1412-N1414 PolarHBondContact O-N 2.84Å; N1414-K1417 PolarHBondContact O-N 2.76Å; N1414-K1417 PolarHBondContact OD1-NZ 2.81Å; N1414-I1418 WeakPolarHBondContact O-CB 3.44Å; N1414-I1418 VanDerWaalsContact O-CG1 3.29Å; N1414-I1418 WeakPolarHBondContact O-CG1 3.42Å; N1414-I1418 PolarHBondContact O-N 3.46Å
1415S79.3Confident77.8Confident2 Ų263.7 Ų63.71%0.01433%0.334CS..Hα-helixtrans-64.5-42.4173.286.40000112.3F1350 L1411 D1412 E1413 K1417 I1418 L1419 L1435F1350-S1415 VanDerWaalsContact CZ-CB 3.41Å; L1411-S1415 WeakPolarHBondContact O-CB 3.14Å; L1411-S1415 PolarHBondContact O-N 3.21Å; L1411-S1415 PolarHBondContact O-OG 3.27Å; D1412-S1415 WeakPolarHBondContact O-CB 3.29Å; D1412-S1415 PolarHBondContact O-N 2.87Å; D1412-S1415 PolarHBondContact O-OG 3.47Å; E1413-S1415 VanDerWaalsContact C-N 3.25Å; E1413-S1415 PolarHBondContact O-N 3.47Å; S1415-K1417 VanDerWaalsContact C-N 3.35Å; S1415-K1417 PolarHBondContact O-N 2.98Å; S1415-I1418 PolarHBondContact O-N 3.4Å; S1415-L1419 WeakPolarHBondContact O-CB 3.11Å; S1415-L1419 VanDerWaalsContact O-CG 3.31Å; S1415-L1419 WeakPolarHBondContact O-CG 3.49Å; S1415-L1419 PolarHBondContact O-N 3.05Å; S1415-L1435 VanDerWaalsContact CB-CD1 3.44Å; S1415-L1435 WeakPolarHBondContact OG-CD1 3.44Å; S1415-L1435 WeakPolarHBondContact OG-CD2 3.35Å
1416Q79Confident76.9Confident78 Ų7869.7 Ų69.736%0.36437%0.365SS..Hα-helixtrans-65.1-39176.1-69.3-177.334.800111.5D1412 E1413 I1418 R1420D1412-Q1416 WeakPolarHBondContact O-CG 3.35Å; D1412-Q1416 PolarHBondContact O-N 3.1Å; D1412-Q1416 PolarHBondContact OD2-NE2 3.18Å; E1413-Q1416 PolarHBondContact O-N 3.32Å; Q1416-I1418 VanDerWaalsContact C-N 3.34Å; Q1416-R1420 WeakPolarHBondContact O-CG 3.48Å; Q1416-R1420 PolarHBondContact O-N 2.93Å; Q1416-R1420 VanDerWaalsContact O-N 3.17Å; Q1416-R1420 PolarHBondContact O-NE 2.81Å
1417K78.8Confident76.3Confident94 Ų9468.9 Ų68.941%0.40936%0.361SS..Hα-helixtrans-60.7-43.9174-67163.8-160.8157.80110.7L1346 E1413 N1414 S1415 S1421L1346-K1417 HydrophobicContact CD2-CB 4.29Å; E1413-K1417 WeakPolarHBondContact O-CG 3.4Å; E1413-K1417 PolarHBondContact O-N 2.82Å; E1413-K1417 IonicContact OE2-NZ 3.95Å; E1413-K1417 PolarHBondContact OE2-NZ 2.78Å; N1414-K1417 PolarHBondContact O-N 2.76Å; N1414-K1417 PolarHBondContact OD1-NZ 2.81Å; S1415-K1417 VanDerWaalsContact C-N 3.35Å; S1415-K1417 PolarHBondContact O-N 2.98Å; K1417-S1421 PolarHBondContact O-N 2.87Å
1418I77.9Confident75.8Confident6 Ų666.6 Ų66.63%0.03135%0.348CS..Hα-helixtrans-71.8-43.5179.8-69.8167.2000112L1346 L1347 F1350 N1414 S1415 Q1416 R1420 S1421 L1422 L1431L1346-I1418 HydrophobicContact CD2-CG1 4.39Å; L1346-I1418 HydrophobicContact CG-CD1 4.27Å; L1346-I1418 HydrophobicContact CG-CG1 4.43Å; L1347-I1418 HydrophobicContact CD2-CB 4.41Å; L1347-I1418 HydrophobicContact CD2-CD1 4.16Å; L1347-I1418 HydrophobicContact CD2-CG1 3.83Å; L1347-I1418 HydrophobicContact CD2-CG2 3.83Å; F1350-I1418 HydrophobicContact CB-CD1 3.55Å; F1350-I1418 HydrophobicContact CD1-CD1 3.3Å; F1350-I1418 HydrophobicContact CD2-CD1 4.23Å; F1350-I1418 HydrophobicContact CE1-CD1 4.01Å; F1350-I1418 HydrophobicContact CG-CD1 3.42Å; F1350-I1418 VanDerWaalsContact CG-CD1 3.42Å; N1414-I1418 WeakPolarHBondContact O-CB 3.44Å; N1414-I1418 VanDerWaalsContact O-CG1 3.29Å; N1414-I1418 WeakPolarHBondContact O-CG1 3.42Å; N1414-I1418 PolarHBondContact O-N 3.46Å; S1415-I1418 PolarHBondContact O-N 3.4Å; Q1416-I1418 VanDerWaalsContact C-N 3.34Å; I1418-R1420 PolarHBondContact O-N 2.93Å; I1418-S1421 CarbonylContact O-C 3.36Å; I1418-S1421 WeakPolarHBondContact O-CA 3.46Å; I1418-S1421 WeakPolarHBondContact O-CB 3.45Å; I1418-S1421 PolarHBondContact O-N 3.31Å; I1418-S1421 PolarHBondContact O-OG 2.85Å; I1418-L1422 HydrophobicContact CG2-CD1 3.64Å; I1418-L1422 HydrophobicContact CG2-CG 4.25Å; I1418-L1422 WeakPolarHBondContact O-CG 3.42Å; I1418-L1422 PolarHBondContact O-N 3.48Å; I1418-L1431 HydrophobicContact CG2-CD2 3.75Å
1419L76.7Confident75.4Confident26 Ų2668.2 Ų68.214%0.13636%0.362CS..Hα-helixtrans-59.5-45.1178.5-79.6165.9000112.2S1415 S1421 L1422 E1423 A1428 L1431 Q1432 L1435S1415-L1419 WeakPolarHBondContact O-CB 3.11Å; S1415-L1419 VanDerWaalsContact O-CG 3.31Å; S1415-L1419 WeakPolarHBondContact O-CG 3.49Å; S1415-L1419 PolarHBondContact O-N 3.05Å; L1419-S1421 PolarHBondContact O-N 2.9Å; L1419-L1422 CarbonylContact O-C 3.5Å; L1419-L1422 PolarHBondContact O-N 3.48Å; L1419-L1422 VanDerWaalsContact O-N 3.1Å; L1419-E1423 PolarHBondContact O-N 2.95Å; L1419-E1423 VanDerWaalsContact O-N 3.07Å; L1419-A1428 HydrophobicContact CD2-CB 4.17Å; L1419-A1428 WeakPolarHBondContact CD2-O 3.23Å; L1419-L1431 HydrophobicContact CD2-CB 4.35Å; L1419-L1431 HydrophobicContact CD2-CD2 4.23Å; L1419-L1431 HydrophobicContact CD2-CG 4.33Å; L1419-L1431 HydrophobicContact CG-CD2 4.25Å; L1419-Q1432 HydrophobicContact CD2-CB 4.2Å; L1419-L1435 HydrophobicContact CD1-CD1 3.57Å; L1419-L1435 HydrophobicContact CG-CD1 4.24Å
1420R72.8Confident74.9Confident167 Ų16768.4 Ų68.463%0.6337%0.366SS*.Hα-helixtrans-59.5-29.8173.8-67.3172.3-149178.77112.3Q1416 I1418Q1416-R1420 WeakPolarHBondContact O-CG 3.48Å; Q1416-R1420 PolarHBondContact O-N 2.93Å; Q1416-R1420 VanDerWaalsContact O-N 3.17Å; Q1416-R1420 PolarHBondContact O-NE 2.81Å; I1418-R1420 PolarHBondContact O-N 2.93Å
1421S67.6Low74.8Confident25 Ų2564.8 Ų64.818%0.17535%0.346CS..Hα-helixtrans-82.1-21.7177.781.10000114K1417 I1418 L1419K1417-S1421 PolarHBondContact O-N 2.87Å; I1418-S1421 CarbonylContact O-C 3.36Å; I1418-S1421 WeakPolarHBondContact O-CA 3.46Å; I1418-S1421 WeakPolarHBondContact O-CB 3.45Å; I1418-S1421 PolarHBondContact O-N 3.31Å; I1418-S1421 PolarHBondContact O-OG 2.85Å; L1419-S1421 PolarHBondContact O-N 2.9Å
1422L66.3Low74.6Confident30 Ų3068.2 Ų68.216%0.15736%0.362CS..SBendtrans-1056.1-178.1-67.8178.5000113.3I1418 L1419 G1424 S1425 A1428I1418-L1422 HydrophobicContact CG2-CD1 3.64Å; I1418-L1422 HydrophobicContact CG2-CG 4.25Å; I1418-L1422 WeakPolarHBondContact O-CG 3.42Å; I1418-L1422 PolarHBondContact O-N 3.48Å; L1419-L1422 CarbonylContact O-C 3.5Å; L1419-L1422 PolarHBondContact O-N 3.48Å; L1419-L1422 VanDerWaalsContact O-N 3.1Å; L1422-G1424 PolarHBondContact O-N 3.29Å; L1422-S1425 WeakPolarHBondContact O-CB 3.41Å; L1422-S1425 PolarHBondContact O-N 3.49Å; L1422-S1425 PolarHBondContact O-OG 3.13Å; L1422-A1428 HydrophobicContact CB-CB 3.89Å; L1422-A1428 WeakPolarHBondContact O-CB 3.23Å
1423E64.9Low74.7Confident170 Ų17074.7 Ų74.779%0.79438%0.384SS*.THydrogen-bonded Turntrans-53.6122.7-171.1-164.5165.9-143.800112L1419L1419-E1423 PolarHBondContact O-N 2.95Å; L1419-E1423 VanDerWaalsContact O-N 3.07Å
1424G66.7Low74.8Confident86 Ų8674 Ų7489%0.88738%0.377SS*.THydrogen-bonded Turntrans92.9-4.3-175.400000116.4L1422L1422-G1424 PolarHBondContact O-N 3.29Å
1425S66.6Low74.9Confident39 Ų3972.8 Ų72.827%0.27337%0.37SS..SBendtrans-88.7152172.167.70000113.1L1422 D1427 A1428 V1429L1422-S1425 WeakPolarHBondContact O-CB 3.41Å; L1422-S1425 PolarHBondContact O-N 3.49Å; L1422-S1425 PolarHBondContact O-OG 3.13Å; S1425-D1427 PolarHBondContact O-N 2.89Å; S1425-A1428 WeakPolarHBondContact O-CB 3.2Å; S1425-A1428 PolarHBondContact O-N 3Å; S1425-A1428 VanDerWaalsContact O-N 3.14Å; S1425-A1428 PolarHBondContact OG-N 3.39Å; S1425-V1429 PolarHBondContact O-N 2.93Å
1426D68.4Low75Confident145 Ų14576.6 Ų76.678%0.77539%0.391SS*.Hα-helixtrans-61.1-29.9171.6-78.5-36.3000112.1A1428 V1429 L1430D1426-A1428 VanDerWaalsContact C-N 3.34Å; D1426-A1428 PolarHBondContact O-N 2.9Å; D1426-V1429 PolarHBondContact O-N 3.12Å; D1426-L1430 PolarHBondContact O-N 3.04Å
1427D66.9Low75.3Confident108 Ų10876.5 Ų76.558%0.57839%0.392SS*.Hα-helixtrans-63.7-37.2174.9-71.1-30.7000112S1425 V1429 L1430 L1431S1425-D1427 PolarHBondContact O-N 2.89Å; D1427-V1429 VanDerWaalsContact C-N 3.35Å; D1427-L1430 PolarHBondContact O-N 2.75Å; D1427-L1431 VanDerWaalsContact O-CB 3.26Å; D1427-L1431 WeakPolarHBondContact O-CB 3.42Å; D1427-L1431 PolarHBondContact O-N 3.38Å
1428A75.7Confident75.8Confident11 Ų1172 Ų729%0.09137%0.373CS..Hα-helixtrans-63.9-39.8172.900000111.8L1419 L1422 S1425 D1426 L1431 Q1432L1419-A1428 HydrophobicContact CD2-CB 4.17Å; L1419-A1428 WeakPolarHBondContact CD2-O 3.23Å; L1422-A1428 HydrophobicContact CB-CB 3.89Å; L1422-A1428 WeakPolarHBondContact O-CB 3.23Å; S1425-A1428 WeakPolarHBondContact O-CB 3.2Å; S1425-A1428 PolarHBondContact O-N 3Å; S1425-A1428 VanDerWaalsContact O-N 3.14Å; S1425-A1428 PolarHBondContact OG-N 3.39Å; D1426-A1428 VanDerWaalsContact C-N 3.34Å; D1426-A1428 PolarHBondContact O-N 2.9Å; A1428-L1431 PolarHBondContact O-N 3.13Å; A1428-Q1432 VanDerWaalsContact O-CB 3.28Å; A1428-Q1432 WeakPolarHBondContact O-CB 3.46Å; A1428-Q1432 PolarHBondContact O-N 3.36Å
1429V78.2Confident76.1Confident68 Ų6873.7 Ų73.741%0.41238%0.382SS..Hα-helixtrans-66.5-40176.5-177.90000111.1S1425 D1426 D1427 R1433S1425-V1429 PolarHBondContact O-N 2.93Å; D1426-V1429 PolarHBondContact O-N 3.12Å; D1427-V1429 VanDerWaalsContact C-N 3.35Å; V1429-R1433 WeakPolarHBondContact O-CG 3.22Å; V1429-R1433 PolarHBondContact O-N 3.02Å
1430L75.1Confident76.5Confident108 Ų10878.4 Ų78.457%0.56540%0.402SS*.Hα-helixtrans-66.3-42.2176.1-158.380.7000111.4D1426 D1427 R1433 R1434D1426-L1430 PolarHBondContact O-N 3.04Å; D1427-L1430 PolarHBondContact O-N 2.75Å; L1430-R1433 PolarHBondContact O-N 3.35Å; L1430-R1434 PolarHBondContact O-N 3.37Å
1431L79.6Confident77.2Confident22 Ų2272.3 Ų72.312%0.11538%0.38CS..Hα-helixtrans-68.4-45.5179.3179.960.2000111.9F1350 L1354 I1418 L1419 D1427 A1428 R1433 R1434 L1435F1350-L1431 HydrophobicContact CE1-CD1 3.64Å; F1350-L1431 HydrophobicContact CE1-CD2 3.92Å; F1350-L1431 HydrophobicContact CE1-CG 4.39Å; F1350-L1431 HydrophobicContact CZ-CD1 4.05Å; L1354-L1431 HydrophobicContact CD2-CD1 3.89Å; I1418-L1431 HydrophobicContact CG2-CD2 3.75Å; L1419-L1431 HydrophobicContact CD2-CB 4.35Å; L1419-L1431 HydrophobicContact CD2-CD2 4.23Å; L1419-L1431 HydrophobicContact CD2-CG 4.33Å; L1419-L1431 HydrophobicContact CG-CD2 4.25Å; D1427-L1431 VanDerWaalsContact O-CB 3.26Å; D1427-L1431 WeakPolarHBondContact O-CB 3.42Å; D1427-L1431 PolarHBondContact O-N 3.38Å; A1428-L1431 PolarHBondContact O-N 3.13Å; L1431-R1433 VanDerWaalsContact C-N 3.27Å; L1431-R1433 PolarHBondContact O-N 3.33Å; L1431-R1434 PolarHBondContact O-N 3.29Å; L1431-L1435 HydrophobicContact CD1-CD1 4.18Å; L1431-L1435 HydrophobicContact CD1-CG 4.34Å; L1431-L1435 HydrophobicContact CG-CD1 3.85Å; L1431-L1435 HydrophobicContact CG-CG 4.49Å; L1431-L1435 WeakPolarHBondContact O-CD1 3.49Å; L1431-L1435 WeakPolarHBondContact O-CG 3.27Å; L1431-L1435 PolarHBondContact O-N 2.98Å
1432Q82Confident78.4Confident79 Ų7971.8 Ų71.837%0.36937%0.374SS..Hα-helixtrans-53.2-46.5174.3-17466.251.900110.6L1419 A1428 R1434 L1435 D1436L1419-Q1432 HydrophobicContact CD2-CB 4.2Å; A1428-Q1432 VanDerWaalsContact O-CB 3.28Å; A1428-Q1432 WeakPolarHBondContact O-CB 3.46Å; A1428-Q1432 PolarHBondContact O-N 3.36Å; Q1432-R1434 VanDerWaalsContact C-N 3.34Å; Q1432-R1434 PolarHBondContact O-N 2.73Å; Q1432-L1435 WeakPolarHBondContact O-CB 3.32Å; Q1432-L1435 PolarHBondContact O-N 3.13Å; Q1432-L1435 VanDerWaalsContact O-N 3.12Å; Q1432-D1436 PolarHBondContact NE2-OD1 2.93Å; Q1432-D1436 PolarHBondContact O-N 3.38Å
1433R82.2Confident79.2Confident167 Ų16772.4 Ų72.463%0.6338%0.381SS*.Hα-helixtrans-61.6-35.6175.9-72.5172.9-179.5165.53.8113.8V1429 L1430 L1431 L1435 N1437V1429-R1433 WeakPolarHBondContact O-CG 3.22Å; V1429-R1433 PolarHBondContact O-N 3.02Å; L1430-R1433 PolarHBondContact O-N 3.35Å; L1431-R1433 VanDerWaalsContact C-N 3.27Å; L1431-R1433 PolarHBondContact O-N 3.33Å; R1433-L1435 VanDerWaalsContact C-N 3.35Å; R1433-N1437 WeakPolarHBondContact O-CB 3.33Å; R1433-N1437 PolarHBondContact O-N 3.49Å
1434R83.2Confident80.1Confident95 Ų9566.7 Ų66.736%0.35835%0.354SS..Hα-helixtrans-68.3-36.5175.1-67.5-174.992.2175.58111.2L1354 E1355 L1430 L1431 Q1432 M1438L1354-R1434 HydrophobicContact CD2-CB 4.36Å; E1355-R1434 IonicContact OE1-CZ 3.85Å; E1355-R1434 IonicContact OE1-NH1 2.71Å; E1355-R1434 PolarHBondContact OE1-NH1 2.94Å; E1355-R1434 IonicContact OE1-NH2 2.6Å; E1355-R1434 PolarHBondContact OE1-NH2 2.84Å; L1430-R1434 PolarHBondContact O-N 3.37Å; L1431-R1434 PolarHBondContact O-N 3.29Å; Q1432-R1434 VanDerWaalsContact C-N 3.34Å; Q1432-R1434 PolarHBondContact O-N 2.73Å; R1434-M1438 PolarHBondContact O-N 3.04Å
1435L84.6Confident81.2Confident2 Ų262.6 Ų62.61%0.0131%0.312CS..Hα-helixtrans-73.7-44.3178-65.6159000112.4F1350 L1354 S1415 L1419 L1431 Q1432 R1433 N1437 M1438 N1439F1350-L1435 HydrophobicContact CZ-CD2 4.26Å; L1354-L1435 HydrophobicContact CD1-CD2 4.31Å; S1415-L1435 VanDerWaalsContact CB-CD1 3.44Å; S1415-L1435 WeakPolarHBondContact OG-CD1 3.44Å; S1415-L1435 WeakPolarHBondContact OG-CD2 3.35Å; L1419-L1435 HydrophobicContact CD1-CD1 3.57Å; L1419-L1435 HydrophobicContact CG-CD1 4.24Å; L1431-L1435 HydrophobicContact CD1-CD1 4.18Å; L1431-L1435 HydrophobicContact CD1-CG 4.34Å; L1431-L1435 HydrophobicContact CG-CD1 3.85Å; L1431-L1435 HydrophobicContact CG-CG 4.49Å; L1431-L1435 WeakPolarHBondContact O-CD1 3.49Å; L1431-L1435 WeakPolarHBondContact O-CG 3.27Å; L1431-L1435 PolarHBondContact O-N 2.98Å; Q1432-L1435 WeakPolarHBondContact O-CB 3.32Å; Q1432-L1435 PolarHBondContact O-N 3.13Å; Q1432-L1435 VanDerWaalsContact O-N 3.12Å; R1433-L1435 VanDerWaalsContact C-N 3.35Å; L1435-N1437 PolarHBondContact O-N 2.91Å; L1435-M1438 HydrophobicContact CD2-CE 4.07Å; L1435-M1438 WeakPolarHBondContact O-CA 3.46Å; L1435-M1438 WeakPolarHBondContact O-CB 3.41Å; L1435-M1438 PolarHBondContact O-N 3.15Å; L1435-N1439 WeakPolarHBondContact O-CB 3.35Å; L1435-N1439 VanDerWaalsContact O-CG 3.28Å; L1435-N1439 PolarHBondContact O-N 3.44Å
1436D82Confident82.2Confident83 Ų8365.9 Ų65.944%0.44432%0.318SS..Hα-helixtrans-56.9-40.7174.2-63-22.8000110.5Q1432 F1440Q1432-D1436 PolarHBondContact NE2-OD1 2.93Å; Q1432-D1436 PolarHBondContact O-N 3.38Å; D1436-F1440 WeakPolarHBondContact O-CB 3.47Å; D1436-F1440 PolarHBondContact O-N 3.24Å
1437N85.1Confident82.7Confident75 Ų7564.1 Ų64.140%0.40130%0.304SS..Hα-helixtrans-67-41.1173.7176.452.7000112.9R1433 L1435 K1441R1433-N1437 WeakPolarHBondContact O-CB 3.33Å; R1433-N1437 PolarHBondContact O-N 3.49Å; L1435-N1437 PolarHBondContact O-N 2.91Å; N1437-K1441 WeakPolarHBondContact O-CB 3.44Å; N1437-K1441 WeakPolarHBondContact O-CG 3.4Å; N1437-K1441 PolarHBondContact O-N 3.35Å
1438M88.5Confident83.5Confident0 Ų060.4 Ų60.40%028%0.282CS..Hα-helixtrans-59.2-51.5173.2-175.1-17577.400111.2L1354 F1357 L1358 L1361 Y1408 L1411 R1434 L1435 K1441 W1442L1354-M1438 HydrophobicContact CD1-SD 3.51Å; L1354-M1438 VanDerWaalsContact CD1-SD 3.51Å; F1357-M1438 HydrophobicContact CD1-CG 3.72Å; F1357-M1438 HydrophobicContact CD1-SD 3.53Å; F1357-M1438 VanDerWaalsContact CD1-SD 3.53Å; F1357-M1438 HydrophobicContact CE1-CG 3.59Å; F1357-M1438 HydrophobicContact CE1-SD 3.72Å; L1358-M1438 HydrophobicContact CD2-CB 3.85Å; L1358-M1438 HydrophobicContact CD2-CG 4.19Å; L1361-M1438 HydrophobicContact CD1-CG 3.83Å; Y1408-M1438 HydrophobicContact CD2-CE 4.09Å; Y1408-M1438 HydrophobicContact CE2-CE 4.04Å; L1411-M1438 HydrophobicContact CB-CE 4.32Å; L1411-M1438 HydrophobicContact CB-SD 4.33Å; L1411-M1438 HydrophobicContact CD1-SD 4.19Å; R1434-M1438 PolarHBondContact O-N 3.04Å; L1435-M1438 HydrophobicContact CD2-CE 4.07Å; L1435-M1438 WeakPolarHBondContact O-CA 3.46Å; L1435-M1438 WeakPolarHBondContact O-CB 3.41Å; L1435-M1438 PolarHBondContact O-N 3.15Å; M1438-K1441 PolarHBondContact O-N 3.5Å; M1438-W1442 WeakPolarHBondContact O-CB 3.35Å; M1438-W1442 PolarHBondContact O-N 3.16Å
1439N86.1Confident83.9Confident41 Ų4160 Ų6022%0.21928%0.279CS..Hα-helixtrans-66.8-39.9-176.3-68.2-3.1000111Y1408 D1412 L1435 S1443Y1408-N1439 WeakPolarHBondContact CE2-OD1 3.47Å; Y1408-N1439 PolarHBondContact OH-OD1 3.4Å; D1412-N1439 PolarHBondContact OD1-ND2 3.01Å; D1412-N1439 VanDerWaalsContact OD1-ND2 3.13Å; L1435-N1439 WeakPolarHBondContact O-CB 3.35Å; L1435-N1439 VanDerWaalsContact O-CG 3.28Å; L1435-N1439 PolarHBondContact O-N 3.44Å; N1439-S1443 WeakPolarHBondContact O-CB 3.48Å; N1439-S1443 PolarHBondContact O-N 2.71Å
1440F84.3Confident83.9Confident125 Ų12561.3 Ų61.355%0.54828%0.283SS..Hα-helixtrans-59.6-54.8171.7179.5-100.8000111.6D1436 W1442 S1443 E1444D1436-F1440 WeakPolarHBondContact O-CB 3.47Å; D1436-F1440 PolarHBondContact O-N 3.24Å; F1440-W1442 PolarHBondContact O-N 2.87Å; F1440-S1443 PolarHBondContact O-N 2.72Å; F1440-S1443 VanDerWaalsContact O-N 3.14Å; F1440-S1443 PolarHBondContact O-OG 3.28Å; F1440-E1444 HydrophobicContact CD1-CG 4.47Å; F1440-E1444 HydrophobicContact CE1-CG 3.99Å; F1440-E1444 HydrophobicContact CE2-CG 4.06Å; F1440-E1444 HydrophobicContact CZ-CG 3.76Å; F1440-E1444 PolarHBondContact O-N 3.47Å
1441K87.8Confident83.9Confident40 Ų4059.6 Ų59.617%0.17428%0.275CS..Hα-helixtrans-58.3-43.9179.5-79.7-169.9168.6-144.40112.9L1361 T1362 E1365 N1437 M1438 S1443 E1444 L1445L1361-K1441 HydrophobicContact CD1-CB 4.19Å; L1361-K1441 HydrophobicContact CD2-CB 4.31Å; T1362-K1441 PolarHBondContact OG1-NZ 2.82Å; E1365-K1441 IonicContact OE2-NZ 3.89Å; N1437-K1441 WeakPolarHBondContact O-CB 3.44Å; N1437-K1441 WeakPolarHBondContact O-CG 3.4Å; N1437-K1441 PolarHBondContact O-N 3.35Å; M1438-K1441 PolarHBondContact O-N 3.5Å; K1441-S1443 VanDerWaalsContact C-N 3.35Å; K1441-S1443 PolarHBondContact O-N 3.28Å; K1441-E1444 PolarHBondContact O-N 2.93Å; K1441-L1445 WeakPolarHBondContact O-CB 3.42Å; K1441-L1445 PolarHBondContact O-N 3.44Å
1442W91.6Very high83.7Confident13 Ų1358.7 Ų58.75%0.04927%0.27CS..Hα-helixtrans-60.6-43.3175.7177.7-108.3000112.2F1357 W1360 L1361 I1401 H1404 T1405 Y1408 M1438 F1440 L1445 R1446F1357-W1442 HydrophobicContact CE2-CZ3 4.35Å; F1357-W1442 HydrophobicContact CZ-CD2 4.47Å; F1357-W1442 AromaticContact CZ-CE3 3.79Å; F1357-W1442 HydrophobicContact CZ-CE3 3.79Å; F1357-W1442 AromaticContact CZ-CZ3 3.98Å; F1357-W1442 HydrophobicContact CZ-CZ3 3.98Å; W1360-W1442 HydrophobicContact CH2-CE3 4.37Å; W1360-W1442 AromaticContact CH2-CZ3 3.7Å; W1360-W1442 HydrophobicContact CH2-CZ3 3.7Å; W1360-W1442 HydrophobicContact CZ3-CE3 4.07Å; W1360-W1442 AromaticContact CZ3-CZ3 3.65Å; W1360-W1442 HydrophobicContact CZ3-CZ3 3.65Å; L1361-W1442 HydrophobicContact CD2-CB 4.17Å; L1361-W1442 HydrophobicContact CD2-CE3 3.99Å; I1401-W1442 HydrophobicContact CG2-CH2 3.99Å; I1401-W1442 HydrophobicContact CG2-CZ2 4.49Å; I1401-W1442 HydrophobicContact CG2-CZ3 4.31Å; I1401-W1442 VanDerWaalsContact O-CH2 3.31Å; I1401-W1442 WeakPolarHBondContact O-CH2 3.5Å; H1404-W1442 HydrophobicContact CB-CZ3 4.46Å; T1405-W1442 HydrophobicContact CG2-CZ2 4.22Å; T1405-W1442 WeakPolarHBondContact OG1-CH2 3.5Å; T1405-W1442 WeakPolarHBondContact OG1-CZ2 3.39Å; Y1408-W1442 AromaticContact CD1-NE1 3.83Å; Y1408-W1442 HydrophobicContact CD2-CB 4.06Å; Y1408-W1442 AromaticContact CD2-CD1 3.66Å; Y1408-W1442 AromaticContact CD2-CD2 3.87Å; Y1408-W1442 HydrophobicContact CD2-CD2 3.87Å; Y1408-W1442 AromaticContact CD2-CG 3.63Å; Y1408-W1442 HydrophobicContact CD2-CG 3.63Å; Y1408-W1442 AromaticContact CD2-NE1 3.89Å; Y1408-W1442 AromaticContact CE1-NE1 3.95Å; Y1408-W1442 HydrophobicContact CE2-CB 3.88Å; Y1408-W1442 AromaticContact CE2-CD1 3.4Å; Y1408-W1442 HydrophobicContact CE2-CD2 4.36Å; Y1408-W1442 AromaticContact CE2-CG 3.64Å; Y1408-W1442 HydrophobicContact CE2-CG 3.64Å; Y1408-W1442 AromaticContact CE2-NE1 3.97Å; Y1408-W1442 HydrophobicContact CG-CD2 4.15Å; Y1408-W1442 AromaticContact CG-CE2 3.87Å; Y1408-W1442 HydrophobicContact CG-CG 4.27Å; Y1408-W1442 HydrophobicContact CG-CZ2 4.28Å; Y1408-W1442 AromaticContact CG-NE1 3.82Å; Y1408-W1442 AromaticContact CZ-CD1 3.65Å; M1438-W1442 WeakPolarHBondContact O-CB 3.35Å; M1438-W1442 PolarHBondContact O-N 3.16Å; F1440-W1442 PolarHBondContact O-N 2.87Å; W1442-L1445 PolarHBondContact O-N 3.48Å; W1442-R1446 PolarHBondContact O-N 3.14Å
1443S84.4Confident83.3Confident43 Ų4359.3 Ų59.330%0.30127%0.269SS..Hα-helixtrans-65.1-39.8177.381.10000112.4N1439 F1440 K1441 K1447N1439-S1443 WeakPolarHBondContact O-CB 3.48Å; N1439-S1443 PolarHBondContact O-N 2.71Å; F1440-S1443 PolarHBondContact O-N 2.72Å; F1440-S1443 VanDerWaalsContact O-N 3.14Å; F1440-S1443 PolarHBondContact O-OG 3.28Å; K1441-S1443 VanDerWaalsContact C-N 3.35Å; K1441-S1443 PolarHBondContact O-N 3.28Å; S1443-K1447 WeakPolarHBondContact O-CG 3.35Å; S1443-K1447 PolarHBondContact O-N 3.44Å
1444E82.9Confident82.5Confident50 Ų5053.9 Ų53.923%0.23426%0.256CS..Hα-helixtrans-70.8-39.5177.1-74-59.1120.100112F1440 K1441 R1446 K1447 K1448F1440-E1444 HydrophobicContact CD1-CG 4.47Å; F1440-E1444 HydrophobicContact CE1-CG 3.99Å; F1440-E1444 HydrophobicContact CE2-CG 4.06Å; F1440-E1444 HydrophobicContact CZ-CG 3.76Å; F1440-E1444 PolarHBondContact O-N 3.47Å; K1441-E1444 PolarHBondContact O-N 2.93Å; E1444-R1446 PolarHBondContact O-N 2.97Å; E1444-K1447 PolarHBondContact O-N 2.98Å; E1444-K1447 WeakPolarHBondContact OE1-CD 3.3Å; E1444-K1447 IonicContact OE1-NZ 3.86Å; E1444-K1447 PolarHBondContact OE1-NZ 3.41Å; E1444-K1448 WeakPolarHBondContact O-CB 3.46Å; E1444-K1448 VanDerWaalsContact O-CG 3.25Å; E1444-K1448 WeakPolarHBondContact O-CG 3.44Å; E1444-K1448 PolarHBondContact O-N 3.27Å
1445L89.4Confident81.5Confident0 Ų054.6 Ų54.60%026%0.264CS..Hα-helixtrans-58.3-47.9173.1176.759000111.3W1360 L1361 A1364 A1368 I1401 K1441 W1442 K1448 S1449W1360-L1445 HydrophobicContact CH2-CD2 3.94Å; W1360-L1445 HydrophobicContact CZ3-CD2 4.41Å; L1361-L1445 HydrophobicContact CD2-CD2 3.93Å; A1364-L1445 HydrophobicContact CB-CD1 4.24Å; A1364-L1445 HydrophobicContact CB-CD2 3.72Å; A1368-L1445 HydrophobicContact CB-CD1 3.74Å; I1401-L1445 HydrophobicContact CD1-CD1 4.07Å; I1401-L1445 HydrophobicContact CD1-CD2 4.3Å; I1401-L1445 HydrophobicContact CD1-CG 3.84Å; I1401-L1445 HydrophobicContact CG1-CD2 3.98Å; I1401-L1445 HydrophobicContact CG1-CG 4.09Å; K1441-L1445 WeakPolarHBondContact O-CB 3.42Å; K1441-L1445 PolarHBondContact O-N 3.44Å; W1442-L1445 PolarHBondContact O-N 3.48Å; L1445-K1448 PolarHBondContact O-N 3.1Å; L1445-S1449 PolarHBondContact O-N 3.46Å
1446R87.8Confident80.6Confident108 Ų10855.4 Ų55.441%0.40827%0.268SS..Hα-helixtrans-62.6-41.7175.7-79-172.9165.3-147.1-2.3112.4I1401 T1405 W1442 E1444 S1449 L1450I1401-R1446 HydrophobicContact CG2-CG 4.04Å; T1405-R1446 PolarHBondContact OG1-NH2 2.96Å; W1442-R1446 PolarHBondContact O-N 3.14Å; E1444-R1446 PolarHBondContact O-N 2.97Å; R1446-S1449 PolarHBondContact O-N 3.21Å; R1446-L1450 WeakPolarHBondContact O-CB 3.48Å; R1446-L1450 PolarHBondContact O-N 2.92Å
1447K79.8Confident79.5Confident109 Ų10955.7 Ų55.747%0.47427%0.267SS..Hα-helixtrans-63-41.4173.6-73.4175.7-157.9162.10112.6S1443 E1444 L1450 N1451S1443-K1447 WeakPolarHBondContact O-CG 3.35Å; S1443-K1447 PolarHBondContact O-N 3.44Å; E1444-K1447 PolarHBondContact O-N 2.98Å; E1444-K1447 WeakPolarHBondContact OE1-CD 3.3Å; E1444-K1447 IonicContact OE1-NZ 3.86Å; E1444-K1447 PolarHBondContact OE1-NZ 3.41Å; K1447-L1450 PolarHBondContact O-N 3.1Å; K1447-N1451 WeakPolarHBondContact O-CB 3.26Å; K1447-N1451 VanDerWaalsContact O-CG 3.3Å; K1447-N1451 PolarHBondContact O-N 3.14Å; K1447-N1451 PolarHBondContact O-ND2 3.27Å
1448K83.5Confident77.9Confident29 Ų2956 Ų5613%0.12628%0.279CS..Hα-helixtrans-62.8-47.2177.6-74170-176-175.70110.8E1365 A1368 N1369 E1444 L1445 L1450 N1451 I1452E1365-K1448 IonicContact OE1-NZ 3.85Å; E1365-K1448 PolarHBondContact OE1-NZ 3.33Å; A1368-K1448 HydrophobicContact CB-CB 4.12Å; A1368-K1448 HydrophobicContact CB-CD 4.4Å; N1369-K1448 WeakPolarHBondContact OD1-CE 3.33Å; N1369-K1448 PolarHBondContact OD1-NZ 2.94Å; E1444-K1448 WeakPolarHBondContact O-CB 3.46Å; E1444-K1448 VanDerWaalsContact O-CG 3.25Å; E1444-K1448 WeakPolarHBondContact O-CG 3.44Å; E1444-K1448 PolarHBondContact O-N 3.27Å; L1445-K1448 PolarHBondContact O-N 3.1Å; K1448-L1450 PolarHBondContact O-N 3.41Å; K1448-N1451 PolarHBondContact O-N 3.24Å; K1448-I1452 WeakPolarHBondContact O-CD1 3.35Å; K1448-I1452 VanDerWaalsContact O-CG1 3.29Å; K1448-I1452 WeakPolarHBondContact O-CG1 3.32Å; K1448-I1452 PolarHBondContact O-N 3.06Å
1449S84.1Confident76Confident2 Ų260.8 Ų60.81%0.01431%0.313CS..Hα-helixtrans-55-50172.1178.70000111.8W1394 Q1398 L1445 R1446 N1451 I1452 R1453W1394-S1449 PolarHBondContact NE1-O 3.48Å; W1394-S1449 VanDerWaalsContact NE1-O 3.17Å; W1394-S1449 PolarHBondContact NE1-OG 3.3Å; Q1398-S1449 PolarHBondContact OE1-OG 2.9Å; L1445-S1449 PolarHBondContact O-N 3.46Å; R1446-S1449 PolarHBondContact O-N 3.21Å; S1449-N1451 VanDerWaalsContact C-N 3.3Å; S1449-N1451 PolarHBondContact O-N 3.45Å; S1449-I1452 PolarHBondContact O-N 2.91Å; S1449-R1453 PolarHBondContact O-N 2.91Å
1450L77.5Confident73.8Confident96 Ų9661.8 Ų61.850%0.50332%0.323SS..Hα-helixtrans-61.8-35.9179.8-157.391.3000112.9R1446 K1447 K1448 S1454R1446-L1450 WeakPolarHBondContact O-CB 3.48Å; R1446-L1450 PolarHBondContact O-N 2.92Å; K1447-L1450 PolarHBondContact O-N 3.1Å; K1448-L1450 PolarHBondContact O-N 3.41Å; L1450-S1454 WeakPolarHBondContact O-CB 3.45Å; L1450-S1454 PolarHBondContact O-N 2.89Å; L1450-S1454 PolarHBondContact O-OG 3.28Å
1451N75.1Confident72.2Confident73 Ų7360.6 Ų60.639%0.3932%0.322SS..Hα-helixtrans-73.1-35.5176.7-77-33.6000112.9K1447 K1448 S1449 R1453 S1454 H1455K1447-N1451 WeakPolarHBondContact O-CB 3.26Å; K1447-N1451 VanDerWaalsContact O-CG 3.3Å; K1447-N1451 PolarHBondContact O-N 3.14Å; K1447-N1451 PolarHBondContact O-ND2 3.27Å; K1448-N1451 PolarHBondContact O-N 3.24Å; S1449-N1451 VanDerWaalsContact C-N 3.3Å; S1449-N1451 PolarHBondContact O-N 3.45Å; N1451-R1453 VanDerWaalsContact C-N 3.34Å; N1451-S1454 PolarHBondContact O-OG 2.7Å; N1451-H1455 PolarHBondContact O-CD2 2.89Å; N1451-H1455 PolarHBondContact O-N 2.8Å; N1451-H1455 VanDerWaalsContact O-N 3.15Å
1452I76.3Confident70.6Confident2 Ų266.3 Ų66.31%0.0135%0.35CS..Hα-helixtrans-62.4-47.7171.2-67.2156.8000109A1368 L1371 Q1372 W1394 K1448 S1449 H1455 L1456A1368-I1452 WeakPolarHBondContact O-CD1 3.21Å; L1371-I1452 HydrophobicContact CB-CD1 3.82Å; Q1372-I1452 HydrophobicContact CB-CD1 4.16Å; Q1372-I1452 HydrophobicContact CB-CG1 3.88Å; Q1372-I1452 HydrophobicContact CG-CG1 4.3Å; W1394-I1452 HydrophobicContact CB-CG2 3.97Å; W1394-I1452 HydrophobicContact CG-CG2 3.85Å; K1448-I1452 WeakPolarHBondContact O-CD1 3.35Å; K1448-I1452 VanDerWaalsContact O-CG1 3.29Å; K1448-I1452 WeakPolarHBondContact O-CG1 3.32Å; K1448-I1452 PolarHBondContact O-N 3.06Å; S1449-I1452 PolarHBondContact O-N 2.91Å; I1452-H1455 PolarHBondContact O-N 3.47Å; I1452-L1456 HydrophobicContact CG2-CD1 3.9Å; I1452-L1456 WeakPolarHBondContact O-CG 3.44Å; I1452-L1456 PolarHBondContact O-N 3.3Å
1453R72.8Confident69.3Low92 Ų9269.4 Ų69.435%0.34736%0.361SS..Hα-helixtrans-57.3-52176.9-161.5-170.175-164.6-2111.9W1394 S1449 N1451 H1455 L1456 E1457W1394-R1453 HydrophobicContact CH2-CB 4.29Å; W1394-R1453 HydrophobicContact CH2-CG 3.61Å; W1394-R1453 HydrophobicContact CZ2-CB 3.72Å; W1394-R1453 HydrophobicContact CZ2-CG 3.55Å; W1394-R1453 HydrophobicContact CZ3-CG 4.15Å; S1449-R1453 PolarHBondContact O-N 2.91Å; N1451-R1453 VanDerWaalsContact C-N 3.34Å; R1453-H1455 VanDerWaalsContact C-N 3.3Å; R1453-H1455 PolarHBondContact O-N 2.76Å; R1453-L1456 CarbonylContact O-C 3.58Å; R1453-L1456 PolarHBondContact O-N 3.45Å; R1453-L1456 VanDerWaalsContact O-N 3.07Å; R1453-E1457 WeakPolarHBondContact CD-OE1 3.46Å; R1453-E1457 VanDerWaalsContact CG-CD 3.47Å; R1453-E1457 HydrophobicContact CG-CG 4.18Å; R1453-E1457 WeakPolarHBondContact CG-OE1 3.38Å; R1453-E1457 IonicContact CZ-OE2 3.78Å; R1453-E1457 IonicContact NE-OE1 2.68Å; R1453-E1457 PolarHBondContact NE-OE1 3.34Å; R1453-E1457 IonicContact NE-OE2 3.4Å; R1453-E1457 PolarHBondContact NE-OE2 2.99Å; R1453-E1457 WeakPolarHBondContact O-CB 3.49Å; R1453-E1457 WeakPolarHBondContact O-CG 3.49Å; R1453-E1457 PolarHBondContact O-N 2.87Å
1454S66Low68.5Low53 Ų5371 Ų7137%0.37136%0.363SS..Hα-helixtrans-64.2-32.7-177.168.50000113.4L1450 N1451 A1458L1450-S1454 WeakPolarHBondContact O-CB 3.45Å; L1450-S1454 PolarHBondContact O-N 2.89Å; L1450-S1454 PolarHBondContact O-OG 3.28Å; N1451-S1454 PolarHBondContact O-OG 2.7Å; S1454-A1458 WeakPolarHBondContact O-CB 3.38Å; S1454-A1458 PolarHBondContact O-N 3.48Å
1455H62.5Low67.8Low111 Ų11178.1 Ų78.151%0.51439%0.387SS..Hα-helixtrans-69.7-36.9171.5-89.3-72.2000113.3T1375 N1451 I1452 R1453T1375-H1455 HydrophobicContact CG2-CB 3.87Å; N1451-H1455 PolarHBondContact O-CD2 2.89Å; N1451-H1455 PolarHBondContact O-N 2.8Å; N1451-H1455 VanDerWaalsContact O-N 3.15Å; I1452-H1455 PolarHBondContact O-N 3.47Å; R1453-H1455 VanDerWaalsContact C-N 3.3Å; R1453-H1455 PolarHBondContact O-N 2.76Å
1456L64.5Low67.2Low18 Ų1879.1 Ų79.19%0.09439%0.393CS..Hα-helixtrans-72.5-29.4174.3-68.3169.9000112.6T1375 V1387 L1390 M1391 W1394 I1452 R1453T1375-L1456 HydrophobicContact CG2-CD2 3.92Å; T1375-L1456 HydrophobicContact CG2-CG 4.02Å; V1387-L1456 HydrophobicContact CG1-CD2 4.19Å; L1390-L1456 HydrophobicContact CB-CD2 4.48Å; M1391-L1456 HydrophobicContact CB-CD1 4.36Å; M1391-L1456 HydrophobicContact CG-CD1 4.45Å; W1394-L1456 HydrophobicContact CB-CD1 4.4Å; I1452-L1456 HydrophobicContact CG2-CD1 3.9Å; I1452-L1456 WeakPolarHBondContact O-CG 3.44Å; I1452-L1456 PolarHBondContact O-N 3.3Å; R1453-L1456 CarbonylContact O-C 3.58Å; R1453-L1456 PolarHBondContact O-N 3.45Å; R1453-L1456 VanDerWaalsContact O-N 3.07Å
1457E60.1Low66.8Low90 Ų9075.9 Ų75.942%0.42138%0.382SS..Hα-helixtrans-87.1-19.5-178.6-72.8174.5159.200114.1R1453 S1459 S1460R1453-E1457 WeakPolarHBondContact CD-OE1 3.46Å; R1453-E1457 VanDerWaalsContact CG-CD 3.47Å; R1453-E1457 HydrophobicContact CG-CG 4.18Å; R1453-E1457 WeakPolarHBondContact CG-OE1 3.38Å; R1453-E1457 IonicContact CZ-OE2 3.78Å; R1453-E1457 IonicContact NE-OE1 2.68Å; R1453-E1457 PolarHBondContact NE-OE1 3.34Å; R1453-E1457 IonicContact NE-OE2 3.4Å; R1453-E1457 PolarHBondContact NE-OE2 2.99Å; R1453-E1457 WeakPolarHBondContact O-CB 3.49Å; R1453-E1457 WeakPolarHBondContact O-CG 3.49Å; R1453-E1457 PolarHBondContact O-N 2.87Å; E1457-S1459 PolarHBondContact O-N 3.37Å; E1457-S1460 PolarHBondContact O-N 3.16Å
1458A50.9Low66.7Low80 Ų8075.2 Ų75.266%0.66138%0.383SS*.THydrogen-bonded Turntrans-62.8-8.3-176.500000114.9S1454 S1460S1454-A1458 WeakPolarHBondContact O-CB 3.38Å; S1454-A1458 PolarHBondContact O-N 3.48Å; A1458-S1460 PolarHBondContact O-N 3.39Å
1459S47.6Very low66.5Low101 Ų10175.7 Ų75.771%0.70639%0.39SS*.THydrogen-bonded Turntrans-81.726.217469.90000114.1E1457E1457-S1459 PolarHBondContact O-N 3.37Å
1460S40.4Very low66.8Low63 Ų6375.6 Ų75.644%0.44139%0.39SS..SBendtrans-135.2146.4-176171.40000113.2E1457 A1458 K1464E1457-S1460 PolarHBondContact O-N 3.16Å; A1458-S1460 PolarHBondContact O-N 3.39Å; S1460-K1464 WeakPolarHBondContact OG-CD 3.49Å; S1460-K1464 PolarHBondContact OG-NZ 3.26Å
1461D50.3Low67.1Low99 Ų9974.9 Ų74.953%0.52938%0.384SS..  trans-53.9136.4-167.4-41.8-70.7000115.9W1463 K1464D1461-W1463 VanDerWaalsContact C-N 3.29Å; D1461-W1463 PolarHBondContact O-N 3.39Å; D1461-W1463 VanDerWaalsContact O-N 3.1Å; D1461-K1464 PolarHBondContact O-N 3.28Å; D1461-K1464 VanDerWaalsContact O-N 3.14Å; D1461-K1464 WeakPolarHBondContact OD2-CE 3.38Å; D1461-K1464 IonicContact OD2-NZ 2.82Å; D1461-K1464 PolarHBondContact OD2-NZ 2.99Å
1462Q55Low67.5Low161 Ų16177.6 Ų77.675%0.75239%0.394SS*.Hα-helixtrans-53.2-33.8-173.2-72.6175.4-24.100115.4K1464 R1465 L1466Q1462-K1464 VanDerWaalsContact C-N 3.26Å; Q1462-K1464 PolarHBondContact O-N 3.06Å; Q1462-R1465 WeakPolarHBondContact O-CB 3.48Å; Q1462-R1465 PolarHBondContact O-N 3.16Å; Q1462-R1465 VanDerWaalsContact O-N 3.14Å; Q1462-L1466 PolarHBondContact O-N 3.22Å
1463W64.2Low68.2Low78 Ų7878 Ų7830%0.29540%0.397SS..Hα-helixtrans-63.5-30.6-177.776-94.8000113D1461 R1465 L1466 H1467 F1528 V1556 L1560D1461-W1463 VanDerWaalsContact C-N 3.29Å; D1461-W1463 PolarHBondContact O-N 3.39Å; D1461-W1463 VanDerWaalsContact O-N 3.1Å; W1463-R1465 VanDerWaalsContact C-N 3.27Å; W1463-R1465 PolarHBondContact O-N 2.93Å; W1463-L1466 PolarHBondContact O-N 2.73Å; W1463-H1467 HydrophobicContact CE3-CB 4.47Å; W1463-H1467 HydrophobicContact CZ3-CB 4.48Å; W1463-H1467 PolarHBondContact O-N 3.12Å; W1463-F1528 HydrophobicContact CB-CE1 4.44Å; W1463-F1528 HydrophobicContact CB-CE2 4.41Å; W1463-F1528 HydrophobicContact CB-CZ 3.84Å; W1463-V1556 HydrophobicContact CB-CG1 3.83Å; W1463-V1556 HydrophobicContact CD2-CG1 3.68Å; W1463-V1556 HydrophobicContact CD2-CG2 4.05Å; W1463-V1556 HydrophobicContact CE3-CG1 3.67Å; W1463-V1556 HydrophobicContact CE3-CG2 4.12Å; W1463-V1556 HydrophobicContact CG-CG1 3.78Å; W1463-V1556 HydrophobicContact CH2-CG2 4.26Å; W1463-V1556 HydrophobicContact CZ2-CG2 4.19Å; W1463-V1556 HydrophobicContact CZ3-CG1 4.45Å; W1463-V1556 HydrophobicContact CZ3-CG2 4.23Å; W1463-L1560 HydrophobicContact CB-CD1 4.35Å
1464K68.2Low69Low75 Ų7574.9 Ų74.933%0.32639%0.386SS..Hα-helixtrans-67.3-31.7178.4-59.9-179.8-157150.40111.4S1460 D1461 Q1462 H1467 L1468S1460-K1464 WeakPolarHBondContact OG-CD 3.49Å; S1460-K1464 PolarHBondContact OG-NZ 3.26Å; D1461-K1464 PolarHBondContact O-N 3.28Å; D1461-K1464 VanDerWaalsContact O-N 3.14Å; D1461-K1464 WeakPolarHBondContact OD2-CE 3.38Å; D1461-K1464 IonicContact OD2-NZ 2.82Å; D1461-K1464 PolarHBondContact OD2-NZ 2.99Å; Q1462-K1464 VanDerWaalsContact C-N 3.26Å; Q1462-K1464 PolarHBondContact O-N 3.06Å; K1464-H1467 PolarHBondContact O-N 2.8Å; K1464-L1468 WeakPolarHBondContact O-CG 3.23Å; K1464-L1468 PolarHBondContact O-N 3.04Å
1465R67.5Low70Confident200 Ų20076.2 Ų76.276%0.75539%0.392SS*.Hα-helixtrans-66.8-44.2175.7-171.9177.2179.2169.20.2111.3Q1462 W1463 L1468 S1469Q1462-R1465 WeakPolarHBondContact O-CB 3.48Å; Q1462-R1465 PolarHBondContact O-N 3.16Å; Q1462-R1465 VanDerWaalsContact O-N 3.14Å; W1463-R1465 VanDerWaalsContact C-N 3.27Å; W1463-R1465 PolarHBondContact O-N 2.93Å; R1465-L1468 PolarHBondContact O-N 3.31Å; R1465-S1469 PolarHBondContact O-N 3.11Å; R1465-S1469 PolarHBondContact O-OG 3.41Å
1466L77.4Confident71.5Confident22 Ų2273.1 Ų73.112%0.11538%0.376CS..Hα-helixtrans-61.1-43.4174-82.3159.6000111.9Q1462 W1463 S1469 L1470 T1524 V1525 F1528 L1560Q1462-L1466 PolarHBondContact O-N 3.22Å; W1463-L1466 PolarHBondContact O-N 2.73Å; L1466-S1469 PolarHBondContact O-N 3.5Å; L1466-L1470 WeakPolarHBondContact O-CG 3.49Å; L1466-L1470 PolarHBondContact O-N 3.18Å; L1466-T1524 HydrophobicContact CD2-CG2 3.79Å; L1466-V1525 HydrophobicContact CD2-CG2 3.86Å; L1466-F1528 HydrophobicContact CD1-CB 4.05Å; L1466-F1528 HydrophobicContact CD1-CD2 4.06Å; L1466-F1528 HydrophobicContact CD1-CG 3.97Å; L1466-L1560 HydrophobicContact CB-CD1 4.43Å; L1466-L1560 HydrophobicContact CB-CD2 3.97Å
1467H79.3Confident72.8Confident39 Ų3972.3 Ų72.318%0.18137%0.372CS..Hα-helixtrans-59.1-47176.7-179.763000112.7W1463 K1464 L1470 Q1471 L1560 Q1563W1463-H1467 HydrophobicContact CE3-CB 4.47Å; W1463-H1467 HydrophobicContact CZ3-CB 4.48Å; W1463-H1467 PolarHBondContact O-N 3.12Å; K1464-H1467 PolarHBondContact O-N 2.8Å; H1467-L1470 PolarHBondContact O-N 2.9Å; H1467-Q1471 PolarHBondContact NE2-NE2 3.37Å; H1467-Q1471 PolarHBondContact O-N 2.97Å; H1467-Q1471 VanDerWaalsContact O-N 3.09Å; H1467-L1560 HydrophobicContact CB-CD2 3.96Å; H1467-Q1563 PolarHBondContact CE1-NE2 3.43Å; H1467-Q1563 VanDerWaalsContact CE1-NE2 3.3Å; H1467-Q1563 PolarHBondContact CE1-OE1 3.3Å; H1467-Q1563 PolarHBondContact ND1-NE2 2.8Å; H1467-Q1563 PolarHBondContact ND1-OE1 3.43Å
1468L77.1Confident74.1Confident95 Ų9573.2 Ų73.250%0.49738%0.376SS..Hα-helixtrans-62.6-47.2177.4-78.5163.1000112K1464 R1465 L1470 Q1471 E1472K1464-L1468 WeakPolarHBondContact O-CG 3.23Å; K1464-L1468 PolarHBondContact O-N 3.04Å; R1465-L1468 PolarHBondContact O-N 3.31Å; L1468-L1470 VanDerWaalsContact C-N 3.3Å; L1468-L1470 PolarHBondContact O-N 2.93Å; L1468-Q1471 PolarHBondContact O-N 3.34Å; L1468-Q1471 VanDerWaalsContact O-N 3.1Å; L1468-E1472 WeakPolarHBondContact O-CG 3.4Å; L1468-E1472 PolarHBondContact O-N 3.42Å
1469S80.6Confident75.9Confident39 Ų3974.4 Ų74.427%0.27337%0.371SS..Hα-helixtrans-64.2-32.5179-63.10000113.1R1465 L1466 L1473R1465-S1469 PolarHBondContact O-N 3.11Å; R1465-S1469 PolarHBondContact O-OG 3.41Å; L1466-S1469 PolarHBondContact O-N 3.5Å; S1469-L1473 WeakPolarHBondContact O-CG 3.46Å; S1469-L1473 PolarHBondContact O-N 2.99Å; S1469-L1473 VanDerWaalsContact O-N 3.14Å
1470L88.5Confident78Confident0 Ų071.3 Ų71.30%034%0.344CS..Hα-helixtrans-67.3-40.8171.4-69.6169.6000112L1466 H1467 L1468 L1473 L1474 T1521 V1525 L1560 Q1563 A1564 V1567L1466-L1470 WeakPolarHBondContact O-CG 3.49Å; L1466-L1470 PolarHBondContact O-N 3.18Å; H1467-L1470 PolarHBondContact O-N 2.9Å; L1468-L1470 VanDerWaalsContact C-N 3.3Å; L1468-L1470 PolarHBondContact O-N 2.93Å; L1470-L1473 PolarHBondContact O-N 3.48Å; L1470-L1474 WeakPolarHBondContact O-CG 3.32Å; L1470-L1474 PolarHBondContact O-N 2.93Å; L1470-T1521 HydrophobicContact CD2-CG2 3.95Å; L1470-T1521 HydrophobicContact CG-CG2 4.37Å; L1470-V1525 HydrophobicContact CD1-CG2 3.86Å; L1470-V1525 HydrophobicContact CD2-CG2 4.21Å; L1470-V1525 HydrophobicContact CG-CG2 4.31Å; L1470-L1560 HydrophobicContact CD1-CD2 4.01Å; L1470-Q1563 HydrophobicContact CB-CB 4.08Å; L1470-Q1563 HydrophobicContact CD1-CB 3.76Å; L1470-Q1563 HydrophobicContact CG-CB 4.47Å; L1470-A1564 HydrophobicContact CD2-CB 4.29Å; L1470-V1567 HydrophobicContact CB-CG2 4.45Å; L1470-V1567 HydrophobicContact CD2-CB 4.5Å; L1470-V1567 HydrophobicContact CD2-CG2 4Å
1471Q84.9Confident80.4Confident82 Ų8269.4 Ų69.438%0.38333%0.329SS..Hα-helixtrans-64.6-43175.7-74.2-176.2-29.700112.5H1467 L1468 L1473 L1474 V1475 Q1563H1467-Q1471 PolarHBondContact NE2-NE2 3.37Å; H1467-Q1471 PolarHBondContact O-N 2.97Å; H1467-Q1471 VanDerWaalsContact O-N 3.09Å; L1468-Q1471 PolarHBondContact O-N 3.34Å; L1468-Q1471 VanDerWaalsContact O-N 3.1Å; Q1471-L1473 VanDerWaalsContact C-N 3.28Å; Q1471-L1473 PolarHBondContact O-N 3.47Å; Q1471-L1474 PolarHBondContact O-N 3.01Å; Q1471-V1475 WeakPolarHBondContact O-CG2 3.41Å; Q1471-V1475 PolarHBondContact O-N 3.46Å; Q1471-Q1563 VanDerWaalsContact CG-NE2 3.35Å
1472E83.3Confident82.1Confident129 Ų12969.2 Ų69.260%0.60333%0.328SS*.Hα-helixtrans-59.6-39.2175.2-72.1174.8165.200111.7L1468 W1476L1468-E1472 WeakPolarHBondContact O-CG 3.4Å; L1468-E1472 PolarHBondContact O-N 3.42Å; E1472-W1476 VanDerWaalsContact O-CB 3.3Å; E1472-W1476 WeakPolarHBondContact O-CB 3.43Å; E1472-W1476 PolarHBondContact O-N 3.32Å
1473L91Very high83.7Confident12 Ų1265.8 Ų65.86%0.06331%0.312CS..Hα-helixtrans-67.7-42.8173.9-71.4177.2000112.5S1469 L1470 Q1471 W1476 L1477 V1517 I1518 T1521 V1567S1469-L1473 WeakPolarHBondContact O-CG 3.46Å; S1469-L1473 PolarHBondContact O-N 2.99Å; S1469-L1473 VanDerWaalsContact O-N 3.14Å; L1470-L1473 PolarHBondContact O-N 3.48Å; Q1471-L1473 VanDerWaalsContact C-N 3.28Å; Q1471-L1473 PolarHBondContact O-N 3.47Å; L1473-W1476 PolarHBondContact O-N 2.99Å; L1473-L1477 WeakPolarHBondContact O-CB 3.34Å; L1473-L1477 VanDerWaalsContact O-CG 3.22Å; L1473-L1477 WeakPolarHBondContact O-CG 3.31Å; L1473-L1477 PolarHBondContact O-N 3.29Å; L1473-V1517 HydrophobicContact CD2-CG1 4.47Å; L1473-I1518 HydrophobicContact CD1-CG1 4.19Å; L1473-I1518 HydrophobicContact CD2-CG1 3.83Å; L1473-T1521 HydrophobicContact CD1-CG2 3.97Å; L1473-V1567 HydrophobicContact CB-CG1 4.24Å; L1473-V1567 HydrophobicContact CB-CG2 4.13Å; L1473-V1567 HydrophobicContact CD1-CG1 4.26Å
1474L88.8Confident84.9Confident25 Ų2562.3 Ų62.313%0.13130%0.299CS..Hα-helixtrans-59.5-47.4176.2-73171.2000112.3L1470 Q1471 W1476 L1477 Q1478 E1566 V1567L1470-L1474 WeakPolarHBondContact O-CG 3.32Å; L1470-L1474 PolarHBondContact O-N 2.93Å; Q1471-L1474 PolarHBondContact O-N 3.01Å; L1474-W1476 VanDerWaalsContact C-N 3.32Å; L1474-W1476 PolarHBondContact O-N 2.89Å; L1474-L1477 PolarHBondContact O-N 3.4Å; L1474-Q1478 WeakPolarHBondContact O-CG 3.46Å; L1474-Q1478 PolarHBondContact O-N 2.93Å; L1474-E1566 HydrophobicContact CD1-CB 4.41Å; L1474-E1566 HydrophobicContact CD2-CB 3.85Å; L1474-V1567 HydrophobicContact CD1-CG2 4.42Å; L1474-V1567 HydrophobicContact CD2-CB 4.35Å; L1474-V1567 HydrophobicContact CD2-CG2 3.65Å; L1474-V1567 HydrophobicContact CG-CG2 3.59Å
1475V88.1Confident85.7Confident81 Ų8161.6 Ų61.649%0.49130%0.304SS..Hα-helixtrans-63.9-40178174.60000110.8Q1471 Q1478 L1479Q1471-V1475 WeakPolarHBondContact O-CG2 3.41Å; Q1471-V1475 PolarHBondContact O-N 3.46Å; V1475-Q1478 PolarHBondContact O-N 2.87Å; V1475-L1479 HydrophobicContact CG1-CD1 4.05Å; V1475-L1479 WeakPolarHBondContact O-CB 3.31Å; V1475-L1479 WeakPolarHBondContact O-CG 3.29Å; V1475-L1479 PolarHBondContact O-N 3.35Å
1476W93Very high86.5Confident46 Ų4661.8 Ų61.817%0.17431%0.305CS..Hα-helixtrans-65.7-39.2176.2-177.482.1000112.8E1472 L1473 L1474 K1480 L1511 K1514 I1518 W1571E1472-W1476 VanDerWaalsContact O-CB 3.3Å; E1472-W1476 WeakPolarHBondContact O-CB 3.43Å; E1472-W1476 PolarHBondContact O-N 3.32Å; L1473-W1476 PolarHBondContact O-N 2.99Å; L1474-W1476 VanDerWaalsContact C-N 3.32Å; L1474-W1476 PolarHBondContact O-N 2.89Å; W1476-K1480 HydrophobicContact CD2-CG 4.23Å; W1476-K1480 HydrophobicContact CH2-CG 4.02Å; W1476-K1480 HydrophobicContact CZ2-CD 4.32Å; W1476-K1480 HydrophobicContact CZ2-CG 3.61Å; W1476-K1480 HydrophobicContact CZ3-CG 4.48Å; W1476-K1480 WeakPolarHBondContact O-CG 3.17Å; W1476-K1480 PolarHBondContact O-N 3.47Å; W1476-K1480 VanDerWaalsContact O-N 3.13Å; W1476-L1511 HydrophobicContact CH2-CD2 3.93Å; W1476-K1514 HydrophobicContact CD2-CD 4.28Å; W1476-K1514 HydrophobicContact CH2-CB 3.49Å; W1476-K1514 VanDerWaalsContact CH2-CB 3.49Å; W1476-K1514 HydrophobicContact CH2-CD 4.15Å; W1476-K1514 HydrophobicContact CH2-CG 3.56Å; W1476-K1514 HydrophobicContact CZ2-CB 3.98Å; W1476-K1514 HydrophobicContact CZ2-CD 3.88Å; W1476-K1514 HydrophobicContact CZ2-CG 3.47Å; W1476-K1514 VanDerWaalsContact CZ2-CG 3.47Å; W1476-K1514 HydrophobicContact CZ3-CB 3.89Å; W1476-K1514 HydrophobicContact CZ3-CD 4.45Å; W1476-K1514 HydrophobicContact CZ3-CG 4.22Å; W1476-I1518 HydrophobicContact CZ3-CD1 4.25Å; W1476-W1571 HydrophobicContact CZ3-CZ3 4.38Å
1477L92.9Very high86.9Confident2 Ų261.9 Ų61.91%0.0130%0.304CS..Hα-helixtrans-63.8-45.7175.9-72.5168.3000111.5L1473 L1474 K1480 D1481 I1518 V1567 E1570 W1571 L1574L1473-L1477 WeakPolarHBondContact O-CB 3.34Å; L1473-L1477 VanDerWaalsContact O-CG 3.22Å; L1473-L1477 WeakPolarHBondContact O-CG 3.31Å; L1473-L1477 PolarHBondContact O-N 3.29Å; L1474-L1477 PolarHBondContact O-N 3.4Å; L1477-K1480 PolarHBondContact O-N 3.04Å; L1477-K1480 VanDerWaalsContact O-N 3.15Å; L1477-D1481 PolarHBondContact O-N 3.48Å; L1477-I1518 HydrophobicContact CD2-CD1 4.13Å; L1477-V1567 HydrophobicContact CD1-CG1 4.16Å; L1477-V1567 WeakPolarHBondContact CD1-O 3.45Å; L1477-E1570 HydrophobicContact CB-CB 4.28Å; L1477-E1570 HydrophobicContact CD1-CB 4.02Å; L1477-W1571 HydrophobicContact CD1-CB 4.27Å; L1477-W1571 HydrophobicContact CD2-CB 4.12Å; L1477-W1571 HydrophobicContact CD2-CE3 3.69Å; L1477-L1574 HydrophobicContact CD2-CD2 3.95Å
1478Q87.2Confident86.8Confident108 Ų10863 Ų6351%0.50532%0.32SS..Hα-helixtrans-59.9-48.7176.3-72.7174.8-11.900111.7L1474 V1475 K1480 D1481 D1482L1474-Q1478 WeakPolarHBondContact O-CG 3.46Å; L1474-Q1478 PolarHBondContact O-N 2.93Å; V1475-Q1478 PolarHBondContact O-N 2.87Å; Q1478-K1480 PolarHBondContact O-N 3.07Å; Q1478-K1480 VanDerWaalsContact O-N 3.17Å; Q1478-D1481 PolarHBondContact O-N 3.1Å; Q1478-D1481 VanDerWaalsContact O-N 3.14Å; Q1478-D1482 PolarHBondContact O-N 3.1Å
1479L88.6Confident87.1Confident106 Ų10663.7 Ų63.756%0.55533%0.331SS*.Hα-helixtrans-59.6-27.6176.4-73.4170.2000113.3V1475 E1483V1475-L1479 HydrophobicContact CG1-CD1 4.05Å; V1475-L1479 WeakPolarHBondContact O-CB 3.31Å; V1475-L1479 WeakPolarHBondContact O-CG 3.29Å; V1475-L1479 PolarHBondContact O-N 3.35Å; L1479-E1483 WeakPolarHBondContact O-CB 3.35Å; L1479-E1483 PolarHBondContact O-N 3.02Å; L1479-E1483 VanDerWaalsContact O-N 3.14Å
1480K92.4Very high87.3Confident35 Ų3563.5 Ų63.515%0.15233%0.326CS..Hα-helixtrans-85.2-30.2175.9-71.5-54.4-166177.50113.8W1476 L1477 Q1478 E1483 L1484 F1507 E1510 L1574W1476-K1480 HydrophobicContact CD2-CG 4.23Å; W1476-K1480 HydrophobicContact CH2-CG 4.02Å; W1476-K1480 HydrophobicContact CZ2-CD 4.32Å; W1476-K1480 HydrophobicContact CZ2-CG 3.61Å; W1476-K1480 HydrophobicContact CZ3-CG 4.48Å; W1476-K1480 WeakPolarHBondContact O-CG 3.17Å; W1476-K1480 PolarHBondContact O-N 3.47Å; W1476-K1480 VanDerWaalsContact O-N 3.13Å; L1477-K1480 PolarHBondContact O-N 3.04Å; L1477-K1480 VanDerWaalsContact O-N 3.15Å; Q1478-K1480 PolarHBondContact O-N 3.07Å; Q1478-K1480 VanDerWaalsContact O-N 3.17Å; K1480-E1483 PolarHBondContact O-N 2.92Å; K1480-L1484 WeakPolarHBondContact O-CB 3.48Å; K1480-L1484 PolarHBondContact O-N 3.21Å; K1480-F1507 HydrophobicContact CB-CE2 4.16Å; K1480-F1507 HydrophobicContact CB-CZ 4.16Å; K1480-F1507 HydrophobicContact CD-CE2 3.9Å; K1480-F1507 WeakPolarHBondContact O-CE2 3.43Å; K1480-F1507 VanDerWaalsContact O-CZ 3.26Å; K1480-F1507 WeakPolarHBondContact O-CZ 3.37Å; K1480-E1510 WeakPolarHBondContact CE-OE2 3.41Å; K1480-E1510 IonicContact NZ-OE2 2.71Å; K1480-E1510 PolarHBondContact NZ-OE2 2.89Å; K1480-L1574 HydrophobicContact CB-CD2 3.75Å
1481D89.9Confident87Confident23 Ų2364.2 Ų64.212%0.12333%0.334CS..Hα-helixtrans-68-38.3169.7-157.327.5000110.8L1477 Q1478 L1484 S1485 K1573 L1574 H1577L1477-D1481 PolarHBondContact O-N 3.48Å; Q1478-D1481 PolarHBondContact O-N 3.1Å; Q1478-D1481 VanDerWaalsContact O-N 3.14Å; D1481-L1484 PolarHBondContact O-N 3.03Å; D1481-S1485 WeakPolarHBondContact O-CB 3.48Å; D1481-S1485 PolarHBondContact O-N 3.42Å; D1481-S1485 PolarHBondContact O-OG 3.39Å; D1481-K1573 IonicContact OD2-NZ 3.92Å; D1481-K1573 PolarHBondContact OD2-NZ 2.92Å; D1481-L1574 HydrophobicContact CB-CD1 3.95Å; D1481-H1577 IonicContact OD1-CE1 2.79Å; D1481-H1577 IonicContact OD1-CG 2.77Å; D1481-H1577 IonicContact OD1-ND1 3.01Å; D1481-H1577 PolarHBondContact OD1-ND1 3.14Å
1482D86.3Confident86.9Confident95 Ų9561 Ų6151%0.50832%0.323SS..Hα-helixtrans-61.7-46.9170.8-76.3-21.5000112Q1478 L1484 S1485 R1486Q1478-D1482 PolarHBondContact O-N 3.1Å; D1482-L1484 VanDerWaalsContact C-N 3.35Å; D1482-L1484 PolarHBondContact O-N 2.8Å; D1482-S1485 PolarHBondContact O-N 2.95Å; D1482-R1486 VanDerWaalsContact O-CG 3.28Å; D1482-R1486 WeakPolarHBondContact O-CG 3.32Å; D1482-R1486 PolarHBondContact O-N 2.89Å
1483E88.4Confident86.8Confident90 Ų9057.3 Ų57.342%0.42131%0.307SS..Hα-helixtrans-63-38.8178.5-178.960-160.600112.4L1479 K1480 R1486 F1507L1479-E1483 WeakPolarHBondContact O-CB 3.35Å; L1479-E1483 PolarHBondContact O-N 3.02Å; L1479-E1483 VanDerWaalsContact O-N 3.14Å; K1480-E1483 PolarHBondContact O-N 2.92Å; E1483-R1486 PolarHBondContact O-N 2.71Å; E1483-F1507 HydrophobicContact CB-CE2 4.29Å; E1483-F1507 HydrophobicContact CG-CD2 4.35Å; E1483-F1507 HydrophobicContact CG-CE2 4.25Å
1484L89.2Confident86.5Confident4 Ų459.7 Ų59.72%0.02132%0.317CS..Hα-helixtrans-66.1-44.1173.8-177.559.2000111.3K1480 D1481 D1482 R1486 Q1487 F1507 L1574 H1577 W1581K1480-L1484 WeakPolarHBondContact O-CB 3.48Å; K1480-L1484 PolarHBondContact O-N 3.21Å; D1481-L1484 PolarHBondContact O-N 3.03Å; D1482-L1484 VanDerWaalsContact C-N 3.35Å; D1482-L1484 PolarHBondContact O-N 2.8Å; L1484-R1486 PolarHBondContact O-N 3.35Å; L1484-Q1487 WeakPolarHBondContact O-CB 3.47Å; L1484-Q1487 PolarHBondContact O-N 3.32Å; L1484-Q1487 VanDerWaalsContact O-N 3.1Å; L1484-F1507 HydrophobicContact CB-CE1 4.14Å; L1484-F1507 HydrophobicContact CB-CE2 4.26Å; L1484-F1507 HydrophobicContact CB-CZ 3.76Å; L1484-F1507 HydrophobicContact CD1-CD1 4.34Å; L1484-F1507 HydrophobicContact CD1-CE1 4.12Å; L1484-F1507 HydrophobicContact CD2-CE1 4.13Å; L1484-F1507 HydrophobicContact CD2-CZ 4.44Å; L1484-F1507 HydrophobicContact CG-CE1 4.37Å; L1484-F1507 HydrophobicContact CG-CZ 4.48Å; L1484-L1574 HydrophobicContact CD2-CD1 4.23Å; L1484-H1577 HydrophobicContact CD2-CB 3.81Å; L1484-W1581 HydrophobicContact CD1-CB 4.21Å; L1484-W1581 HydrophobicContact CD1-CG 4.05Å
1485S84.8Confident86.4Confident61 Ų6162.9 Ų62.943%0.42734%0.339SS..Hα-helixtrans-61.4-29.4178.8-59.90000112.9D1481 D1482 Q1487D1481-S1485 WeakPolarHBondContact O-CB 3.48Å; D1481-S1485 PolarHBondContact O-N 3.42Å; D1481-S1485 PolarHBondContact O-OG 3.39Å; D1482-S1485 PolarHBondContact O-N 2.95Å; S1485-Q1487 VanDerWaalsContact C-N 3.27Å; S1485-Q1487 PolarHBondContact O-N 2.65Å
1486R86.1Confident86.2Confident204 Ų20460.7 Ų60.777%0.7733%0.329SS*.THydrogen-bonded Turntrans-73.1-9.8176.6-72.2171.1106.2117.33114.7D1482 E1483 L1484 A1488D1482-R1486 VanDerWaalsContact O-CG 3.28Å; D1482-R1486 WeakPolarHBondContact O-CG 3.32Å; D1482-R1486 PolarHBondContact O-N 2.89Å; E1483-R1486 PolarHBondContact O-N 2.71Å; L1484-R1486 PolarHBondContact O-N 3.35Å; R1486-A1488 VanDerWaalsContact C-N 3.33Å
1487Q84Confident86.1Confident23 Ų2358.5 Ų58.511%0.10732%0.321CS..THydrogen-bonded Turntrans-80.5-12179.8-62.2-173.718.600113.9L1484 S1485 Q1500 W1581L1484-Q1487 WeakPolarHBondContact O-CB 3.47Å; L1484-Q1487 PolarHBondContact O-N 3.32Å; L1484-Q1487 VanDerWaalsContact O-N 3.1Å; S1485-Q1487 VanDerWaalsContact C-N 3.27Å; S1485-Q1487 PolarHBondContact O-N 2.65Å; Q1487-Q1500 PolarHBondContact O-NE2 3.45Å; Q1487-W1581 HydrophobicContact CB-CZ2 3.85Å; Q1487-W1581 WeakPolarHBondContact O-CZ2 3.38Å
1488A77.5Confident85.9Confident62 Ų6261 Ų6151%0.51233%0.333SS..PPolyproline II helixtrans-79.3150175.300000112.1R1486 W1581R1486-A1488 VanDerWaalsContact C-N 3.33Å; A1488-W1581 HydrophobicContact CB-CH2 4.34Å
1489P83.9Confident85.9Confident110 Ų11063.1 Ų63.171%0.71434%0.34SS*.SBendcis-84.3172.31.735.1-36.6000114.2Q1500P1489-Q1500 PolarHBondContact O-NE2 3.44Å
1490I83.9Confident85.9Confident35 Ų3559.9 Ų59.918%0.17932%0.322CS..PPolyproline II helixtrans-70.8141.8174.7-62.4178.3000110.3V1497 W1581 K1584 T1588I1490-V1497 HydrophobicContact CG2-CG1 4.08Å; I1490-V1497 HydrophobicContact CG2-CG2 3.71Å; I1490-W1581 HydrophobicContact CD1-CH2 4.21Å; I1490-W1581 HydrophobicContact CD1-CZ3 3.86Å; I1490-W1581 HydrophobicContact CG1-CH2 3.35Å; I1490-W1581 HydrophobicContact CG1-CZ2 4.39Å; I1490-W1581 HydrophobicContact CG1-CZ3 3.49Å; I1490-W1581 VanDerWaalsContact CG1-CZ3 3.49Å; I1490-K1584 HydrophobicContact CD1-CB 3.81Å; I1490-T1588 HydrophobicContact CG2-CG2 3.76Å
1491G82.9Confident86Confident16 Ų1658.3 Ų58.317%0.16532%0.315CS..PPolyproline II helixtrans-67.9156.9177.600000114.6V1497G1491-V1497 WeakPolarHBondContact O-CG2 3.47Å
1492G82.9Confident85.9Confident14 Ų1460.6 Ų60.614%0.14433%0.328CS..SBendtrans-92.20.5-175.700000116.6Q1664 S1666 N1669G1492-Q1664 WeakPolarHBondContact CA-O 3.19Å; G1492-S1666 PolarHBondContact O-N 2.9Å; G1492-N1669 PolarHBondContact O-ND2 3.38Å
1493D82Confident86.1Confident51 Ų5159.5 Ų59.527%0.27332%0.324SS..SBendtrans-140.7158.7179.359.551.9000112P1495 A1496 V1497D1493-P1495 WeakPolarHBondContact OD1-CD 3.27Å; D1493-A1496 PolarHBondContact O-N 3.08Å; D1493-A1496 WeakPolarHBondContact OD1-CB 3.41Å; D1493-A1496 PolarHBondContact OD1-N 2.95Å; D1493-V1497 WeakPolarHBondContact O-CG2 3.35Å; D1493-V1497 PolarHBondContact O-N 2.92Å; D1493-V1497 VanDerWaalsContact O-N 3.13Å
1494F84.9Confident86.3Confident63 Ų6355.2 Ų55.228%0.27630%0.304SS..Hα-helixtrans-57.5-44.5-175.9-176.4-84.7000112.9A1496 Q1498 L1589 R1593F1494-A1496 PolarHBondContact O-N 3.43Å; F1494-Q1498 HydrophobicContact CE1-CB 4.42Å; F1494-Q1498 WeakPolarHBondContact O-CB 3.4Å; F1494-Q1498 PolarHBondContact O-N 3.29Å; F1494-L1589 HydrophobicContact CD2-CD2 3.7Å; F1494-L1589 HydrophobicContact CE2-CD2 3.6Å; F1494-L1589 HydrophobicContact CG-CD2 4.28Å; F1494-L1589 HydrophobicContact CZ-CD2 4.1Å; F1494-R1593 HydrophobicContact CE2-CB 4.36Å
1495P85.3Confident86.4Confident92 Ų9259.7 Ų59.760%0.59732%0.321SS*.Hα-helixtrans-61.2-40.9176.3-2535.8000114.5D1493 K1499D1493-P1495 WeakPolarHBondContact OD1-CD 3.27Å; P1495-K1499 WeakPolarHBondContact O-CB 3.38Å; P1495-K1499 PolarHBondContact O-N 2.71Å
1496A85Confident86.5Confident34 Ų3458.4 Ų58.428%0.28131%0.314SS..Hα-helixtrans-66.6-45.7179.300000111.8D1493 F1494 Q1498 K1499 Q1500D1493-A1496 PolarHBondContact O-N 3.08Å; D1493-A1496 WeakPolarHBondContact OD1-CB 3.41Å; D1493-A1496 PolarHBondContact OD1-N 2.95Å; F1494-A1496 PolarHBondContact O-N 3.43Å; A1496-Q1498 VanDerWaalsContact C-N 3.34Å; A1496-K1499 WeakPolarHBondContact O-CB 3.35Å; A1496-K1499 PolarHBondContact O-N 2.74Å; A1496-Q1500 PolarHBondContact O-N 3.4Å
1497V89.4Confident86.8Confident0 Ų049.1 Ų49.10%028%0.28CS..Hα-helixtrans-70.2-33.4178.4-170.30000111.1I1490 G1491 D1493 K1499 Q1500 N1501 I1585 T1588 L1589 L1592I1490-V1497 HydrophobicContact CG2-CG1 4.08Å; I1490-V1497 HydrophobicContact CG2-CG2 3.71Å; G1491-V1497 WeakPolarHBondContact O-CG2 3.47Å; D1493-V1497 WeakPolarHBondContact O-CG2 3.35Å; D1493-V1497 PolarHBondContact O-N 2.92Å; D1493-V1497 VanDerWaalsContact O-N 3.13Å; V1497-K1499 PolarHBondContact O-N 3.36Å; V1497-Q1500 PolarHBondContact O-N 2.74Å; V1497-N1501 PolarHBondContact O-N 2.89Å; V1497-I1585 HydrophobicContact CG1-CG2 4.17Å; V1497-T1588 HydrophobicContact CG1-CG2 4.23Å; V1497-T1588 HydrophobicContact CG2-CG2 4.09Å; V1497-L1589 HydrophobicContact CB-CD2 4Å; V1497-L1589 HydrophobicContact CB-CG 4.17Å; V1497-L1589 HydrophobicContact CG1-CD1 4.3Å; V1497-L1589 HydrophobicContact CG1-CD2 4.13Å; V1497-L1589 HydrophobicContact CG1-CG 3.72Å; V1497-L1592 HydrophobicContact CB-CD1 4.47Å; V1497-L1592 HydrophobicContact CG2-CD1 3.84Å
1498Q89.1Confident87.1Confident54 Ų5451 Ų5125%0.25229%0.287SS..Hα-helixtrans-63.1-42.7173.3179.853.752.100110.9F1494 A1496 Q1500 N1501 D1502 L1589F1494-Q1498 HydrophobicContact CE1-CB 4.42Å; F1494-Q1498 WeakPolarHBondContact O-CB 3.4Å; F1494-Q1498 PolarHBondContact O-N 3.29Å; A1496-Q1498 VanDerWaalsContact C-N 3.34Å; Q1498-Q1500 PolarHBondContact O-N 3.02Å; Q1498-N1501 WeakPolarHBondContact O-CB 3.42Å; Q1498-N1501 PolarHBondContact O-N 3.15Å; Q1498-D1502 PolarHBondContact NE2-OD1 2.91Å; Q1498-D1502 PolarHBondContact NE2-OD2 2.88Å; Q1498-D1502 PolarHBondContact O-N 3.09Å; Q1498-L1589 HydrophobicContact CB-CD2 4.14Å
1499K87.2Confident87.5Confident154 Ų15455.1 Ų55.167%0.6729%0.289SS*.Hα-helixtrans-62.4-40.3173.3-174-179.9178.3-1770112.1P1495 A1496 V1497 N1501 D1502 V1503P1495-K1499 WeakPolarHBondContact O-CB 3.38Å; P1495-K1499 PolarHBondContact O-N 2.71Å; A1496-K1499 WeakPolarHBondContact O-CB 3.35Å; A1496-K1499 PolarHBondContact O-N 2.74Å; V1497-K1499 PolarHBondContact O-N 3.36Å; K1499-N1501 VanDerWaalsContact C-N 3.35Å; K1499-D1502 PolarHBondContact O-N 3.49Å; K1499-V1503 WeakPolarHBondContact O-CG2 3.4Å; K1499-V1503 PolarHBondContact O-N 2.62Å
1500Q89.7Confident87.6Confident37 Ų3754 Ų5417%0.17328%0.275CS..Hα-helixtrans-62.4-40.2172.9-73.1177.5-49.600111.7Q1487 P1489 A1496 V1497 Q1498 D1502 V1503 H1504 I1585Q1487-Q1500 PolarHBondContact O-NE2 3.45Å; P1489-Q1500 PolarHBondContact O-NE2 3.44Å; A1496-Q1500 PolarHBondContact O-N 3.4Å; V1497-Q1500 PolarHBondContact O-N 2.74Å; Q1498-Q1500 PolarHBondContact O-N 3.02Å; Q1500-D1502 PolarHBondContact O-N 3.24Å; Q1500-V1503 PolarHBondContact O-N 3.38Å; Q1500-H1504 WeakPolarHBondContact O-CB 3.18Å; Q1500-H1504 PolarHBondContact O-N 2.98Å; Q1500-I1585 HydrophobicContact CB-CD1 4.2Å
1501N92.9Very high88Confident2 Ų252.5 Ų52.51%0.01127%0.267CS..Hα-helixtrans-60.2-44.9174.2-156.8-25.4000111.4V1497 Q1498 K1499 V1503 H1504 R1505 Q1582 I1585 D1586 L1589V1497-N1501 PolarHBondContact O-N 2.89Å; Q1498-N1501 WeakPolarHBondContact O-CB 3.42Å; Q1498-N1501 PolarHBondContact O-N 3.15Å; K1499-N1501 VanDerWaalsContact C-N 3.35Å; N1501-V1503 PolarHBondContact O-N 2.76Å; N1501-H1504 PolarHBondContact O-N 3.46Å; N1501-R1505 PolarHBondContact ND2-NH2 2.88Å; N1501-R1505 WeakPolarHBondContact O-CB 3.26Å; N1501-R1505 WeakPolarHBondContact O-CD 3.44Å; N1501-R1505 WeakPolarHBondContact O-CG 3.18Å; N1501-R1505 PolarHBondContact O-N 2.85Å; N1501-R1505 PolarHBondContact OD1-NE 2.8Å; N1501-Q1582 PolarHBondContact OD1-NE2 2.82Å; N1501-I1585 HydrophobicContact CB-CG2 3.48Å; N1501-I1585 VanDerWaalsContact CB-CG2 3.48Å; N1501-D1586 PolarHBondContact ND2-OD1 3.48Å; N1501-L1589 HydrophobicContact CB-CD1 3.99Å; N1501-L1589 WeakPolarHBondContact ND2-CD1 3.33Å
1502D88.7Confident88.1Confident71 Ų7159 Ų5938%0.3829%0.291SS..Hα-helixtrans-69.7-33-179.3-67.4-39.3000113.7Q1498 K1499 Q1500 R1505 A1506Q1498-D1502 PolarHBondContact NE2-OD1 2.91Å; Q1498-D1502 PolarHBondContact NE2-OD2 2.88Å; Q1498-D1502 PolarHBondContact O-N 3.09Å; K1499-D1502 PolarHBondContact O-N 3.49Å; Q1500-D1502 PolarHBondContact O-N 3.24Å; D1502-R1505 WeakPolarHBondContact OD1-CD 3.33Å; D1502-R1505 IonicContact OD1-CZ 2.72Å; D1502-R1505 IonicContact OD1-NE 3.55Å; D1502-R1505 IonicContact OD1-NH1 3.98Å; D1502-R1505 PolarHBondContact OD1-NH1 3.24Å; D1502-A1506 PolarHBondContact O-N 3.49Å; D1502-A1506 VanDerWaalsContact O-N 3.16Å
1503V90.2Very high88.2Confident72 Ų7263.1 Ų63.144%0.43631%0.313SS..Hα-helixtrans-65.3-47.5168.6171.60000111K1499 Q1500 N1501 R1505 A1506 F1507K1499-V1503 WeakPolarHBondContact O-CG2 3.4Å; K1499-V1503 PolarHBondContact O-N 2.62Å; Q1500-V1503 PolarHBondContact O-N 3.38Å; N1501-V1503 PolarHBondContact O-N 2.76Å; V1503-R1505 VanDerWaalsContact C-N 3.33Å; V1503-R1505 PolarHBondContact O-N 3.19Å; V1503-A1506 WeakPolarHBondContact O-CA 3.46Å; V1503-A1506 WeakPolarHBondContact O-CB 3.26Å; V1503-A1506 PolarHBondContact O-N 2.89Å; V1503-F1507 PolarHBondContact O-N 3.33Å
1504H93.8Very high88.5Confident0 Ų064.2 Ų64.20%032%0.316CS..Hα-helixtrans-66.8-33.8179.2-16939.7000113Q1500 N1501 A1506 F1507 K1508 S1578 W1581 Q1582 I1585Q1500-H1504 WeakPolarHBondContact O-CB 3.18Å; Q1500-H1504 PolarHBondContact O-N 2.98Å; N1501-H1504 PolarHBondContact O-N 3.46Å; H1504-A1506 VanDerWaalsContact C-N 3.27Å; H1504-A1506 PolarHBondContact O-N 3.23Å; H1504-F1507 AromaticContact CE1-CD1 3.92Å; H1504-F1507 AromaticContact ND1-CD1 3.78Å; H1504-F1507 WeakPolarHBondContact O-CB 3.23Å; H1504-F1507 PolarHBondContact O-N 3.17Å; H1504-K1508 PolarHBondContact O-N 2.64Å; H1504-S1578 PolarHBondContact CE1-OG 3.37Å; H1504-S1578 PolarHBondContact NE2-O 2.87Å; H1504-W1581 AromaticContact CD2-CD1 3.62Å; H1504-W1581 AromaticContact CE1-CD1 3.72Å; H1504-W1581 AromaticContact CG-CD1 3.63Å; H1504-W1581 AromaticContact ND1-CD1 3.72Å; H1504-W1581 AromaticContact NE2-CD1 3.67Å; H1504-Q1582 PolarHBondContact CD2-OE1 3Å; H1504-I1585 HydrophobicContact CB-CD1 4.16Å
1505R89.6Confident88.8Confident98 Ų9865.3 Ų65.337%0.3732%0.322SS..Hα-helixtrans-61.2-35.5169.3-72.8163.9-175.2178.9-3.8111.7N1501 D1502 V1503 R1509N1501-R1505 PolarHBondContact ND2-NH2 2.88Å; N1501-R1505 WeakPolarHBondContact O-CB 3.26Å; N1501-R1505 WeakPolarHBondContact O-CD 3.44Å; N1501-R1505 WeakPolarHBondContact O-CG 3.18Å; N1501-R1505 PolarHBondContact O-N 2.85Å; N1501-R1505 PolarHBondContact OD1-NE 2.8Å; D1502-R1505 WeakPolarHBondContact OD1-CD 3.33Å; D1502-R1505 IonicContact OD1-CZ 2.72Å; D1502-R1505 IonicContact OD1-NE 3.55Å; D1502-R1505 IonicContact OD1-NH1 3.98Å; D1502-R1505 PolarHBondContact OD1-NH1 3.24Å; V1503-R1505 VanDerWaalsContact C-N 3.33Å; V1503-R1505 PolarHBondContact O-N 3.19Å; R1505-R1509 WeakPolarHBondContact O-CG 3.28Å; R1505-R1509 PolarHBondContact O-N 3.46Å
1506A87.4Confident88.7Confident35 Ų3564.8 Ų64.829%0.28932%0.318SS..Hα-helixtrans-68.3-46.5172.600000111.6D1502 V1503 H1504 K1508 R1509 E1510D1502-A1506 PolarHBondContact O-N 3.49Å; D1502-A1506 VanDerWaalsContact O-N 3.16Å; V1503-A1506 WeakPolarHBondContact O-CA 3.46Å; V1503-A1506 WeakPolarHBondContact O-CB 3.26Å; V1503-A1506 PolarHBondContact O-N 2.89Å; H1504-A1506 VanDerWaalsContact C-N 3.27Å; H1504-A1506 PolarHBondContact O-N 3.23Å; A1506-K1508 VanDerWaalsContact C-N 3.33Å; A1506-K1508 PolarHBondContact O-N 3.45Å; A1506-R1509 VanDerWaalsContact CA-NH1 3.3Å; A1506-R1509 WeakPolarHBondContact O-CB 3.09Å; A1506-R1509 PolarHBondContact O-N 3.07Å; A1506-E1510 PolarHBondContact O-N 3.36Å; A1506-E1510 VanDerWaalsContact O-N 3.08Å
1507F92.9Very high88.7Confident9 Ų966.7 Ų66.74%0.03933%0.326CS..Hα-helixtrans-54.2-45.8174.3-177.9-94.2000112.2K1480 E1483 L1484 V1503 H1504 R1509 E1510 L1511 L1574K1480-F1507 HydrophobicContact CB-CE2 4.16Å; K1480-F1507 HydrophobicContact CB-CZ 4.16Å; K1480-F1507 HydrophobicContact CD-CE2 3.9Å; K1480-F1507 WeakPolarHBondContact O-CE2 3.43Å; K1480-F1507 VanDerWaalsContact O-CZ 3.26Å; K1480-F1507 WeakPolarHBondContact O-CZ 3.37Å; E1483-F1507 HydrophobicContact CB-CE2 4.29Å; E1483-F1507 HydrophobicContact CG-CD2 4.35Å; E1483-F1507 HydrophobicContact CG-CE2 4.25Å; L1484-F1507 HydrophobicContact CB-CE1 4.14Å; L1484-F1507 HydrophobicContact CB-CE2 4.26Å; L1484-F1507 HydrophobicContact CB-CZ 3.76Å; L1484-F1507 HydrophobicContact CD1-CD1 4.34Å; L1484-F1507 HydrophobicContact CD1-CE1 4.12Å; L1484-F1507 HydrophobicContact CD2-CE1 4.13Å; L1484-F1507 HydrophobicContact CD2-CZ 4.44Å; L1484-F1507 HydrophobicContact CG-CE1 4.37Å; L1484-F1507 HydrophobicContact CG-CZ 4.48Å; V1503-F1507 PolarHBondContact O-N 3.33Å; H1504-F1507 AromaticContact CE1-CD1 3.92Å; H1504-F1507 AromaticContact ND1-CD1 3.78Å; H1504-F1507 WeakPolarHBondContact O-CB 3.23Å; H1504-F1507 PolarHBondContact O-N 3.17Å; F1507-R1509 VanDerWaalsContact C-N 3.34Å; F1507-R1509 PolarHBondContact O-N 3.22Å; F1507-E1510 WeakPolarHBondContact O-CB 3.34Å; F1507-E1510 PolarHBondContact O-N 3.04Å; F1507-E1510 VanDerWaalsContact O-N 3.15Å; F1507-L1511 HydrophobicContact CD1-CD1 4.17Å; F1507-L1511 HydrophobicContact CD1-CG 4.26Å; F1507-L1511 HydrophobicContact CE1-CD1 3.71Å; F1507-L1511 HydrophobicContact CE1-CD2 4.13Å; F1507-L1511 HydrophobicContact CE1-CG 3.98Å; F1507-L1511 HydrophobicContact CZ-CD1 4.49Å; F1507-L1511 HydrophobicContact CZ-CD2 4.15Å; F1507-L1511 HydrophobicContact CZ-CG 4.49Å; F1507-L1511 PolarHBondContact O-N 3.43Å; F1507-L1574 HydrophobicContact CZ-CD1 4.14Å
1508K89Confident88.8Confident61 Ų6166.7 Ų66.727%0.26533%0.326SS..Hα-helixtrans-63.5-31.4174.3-82.5-177173.9173.10114.6H1504 A1506 K1512 S1578 Q1582H1504-K1508 PolarHBondContact O-N 2.64Å; A1506-K1508 VanDerWaalsContact C-N 3.33Å; A1506-K1508 PolarHBondContact O-N 3.45Å; K1508-K1512 WeakPolarHBondContact O-CG 3.36Å; K1508-K1512 PolarHBondContact O-N 3.39Å; K1508-S1578 VanDerWaalsContact CE-O 3.27Å; K1508-S1578 WeakPolarHBondContact CE-O 3.44Å; K1508-S1578 WeakPolarHBondContact CE-OG 3.48Å; K1508-S1578 WeakPolarHBondContact CG-OG 3.28Å; K1508-S1578 PolarHBondContact NZ-O 3.07Å; K1508-Q1582 VanDerWaalsContact NZ-CG 3.26Å; K1508-Q1582 VanDerWaalsContact NZ-OE1 3.14Å
1509R86.3Confident88.8Confident149 Ų14969 Ų6956%0.56234%0.338SS*.Hα-helixtrans-66.2-43172.1-68.7172.8-146.4118.13.6110.2R1505 A1506 F1507 K1512 T1513R1505-R1509 WeakPolarHBondContact O-CG 3.28Å; R1505-R1509 PolarHBondContact O-N 3.46Å; A1506-R1509 VanDerWaalsContact CA-NH1 3.3Å; A1506-R1509 WeakPolarHBondContact O-CB 3.09Å; A1506-R1509 PolarHBondContact O-N 3.07Å; F1507-R1509 VanDerWaalsContact C-N 3.34Å; F1507-R1509 PolarHBondContact O-N 3.22Å; R1509-K1512 PolarHBondContact O-N 3.23Å; R1509-T1513 WeakPolarHBondContact O-CG2 3.37Å; R1509-T1513 PolarHBondContact O-N 3.29Å
1510E87Confident88.6Confident86 Ų8665 Ų6540%0.40233%0.33SS..Hα-helixtrans-61.2-45.7176.4-69.3-175.4-151.200112.4K1480 A1506 F1507 K1512 T1513 K1514K1480-E1510 WeakPolarHBondContact CE-OE2 3.41Å; K1480-E1510 IonicContact NZ-OE2 2.71Å; K1480-E1510 PolarHBondContact NZ-OE2 2.89Å; A1506-E1510 PolarHBondContact O-N 3.36Å; A1506-E1510 VanDerWaalsContact O-N 3.08Å; F1507-E1510 WeakPolarHBondContact O-CB 3.34Å; F1507-E1510 PolarHBondContact O-N 3.04Å; F1507-E1510 VanDerWaalsContact O-N 3.15Å; E1510-K1512 VanDerWaalsContact C-N 3.34Å; E1510-K1512 PolarHBondContact O-N 3.5Å; E1510-T1513 PolarHBondContact O-N 3.43Å; E1510-T1513 VanDerWaalsContact O-N 3.1Å; E1510-T1513 PolarHBondContact O-OG1 3.41Å; E1510-K1514 PolarHBondContact O-N 2.97Å
1511L91.2Very high88.3Confident4 Ų464.2 Ų64.22%0.02133%0.328CS..Hα-helixtrans-54.2-50.2174.4-62.9-171.1000111.1W1476 F1507 T1513 K1514 E1515 W1571 L1574W1476-L1511 HydrophobicContact CH2-CD2 3.93Å; F1507-L1511 HydrophobicContact CD1-CD1 4.17Å; F1507-L1511 HydrophobicContact CD1-CG 4.26Å; F1507-L1511 HydrophobicContact CE1-CD1 3.71Å; F1507-L1511 HydrophobicContact CE1-CD2 4.13Å; F1507-L1511 HydrophobicContact CE1-CG 3.98Å; F1507-L1511 HydrophobicContact CZ-CD1 4.49Å; F1507-L1511 HydrophobicContact CZ-CD2 4.15Å; F1507-L1511 HydrophobicContact CZ-CG 4.49Å; F1507-L1511 PolarHBondContact O-N 3.43Å; L1511-T1513 VanDerWaalsContact C-N 3.27Å; L1511-T1513 PolarHBondContact O-N 3.23Å; L1511-K1514 PolarHBondContact O-N 3.19Å; L1511-E1515 PolarHBondContact O-N 3.11Å; L1511-W1571 HydrophobicContact CB-CH2 4.04Å; L1511-W1571 HydrophobicContact CB-CZ3 4.2Å; L1511-W1571 HydrophobicContact CD2-CZ3 4.18Å; L1511-W1571 WeakPolarHBondContact O-CH2 3.41Å; L1511-L1574 HydrophobicContact CD1-CG 4.48Å; L1511-L1574 HydrophobicContact CD2-CD2 3.79Å; L1511-L1574 HydrophobicContact CD2-CG 4.33Å
1512K85.5Confident88.1Confident153 Ų15365.1 Ų65.167%0.66533%0.332SS*.Hα-helixtrans-60.1-31.1177.6-74.7-175.2174.6-170.90114.1K1508 R1509 E1510 K1514K1508-K1512 WeakPolarHBondContact O-CG 3.36Å; K1508-K1512 PolarHBondContact O-N 3.39Å; R1509-K1512 PolarHBondContact O-N 3.23Å; E1510-K1512 VanDerWaalsContact C-N 3.34Å; E1510-K1512 PolarHBondContact O-N 3.5Å; K1512-K1514 VanDerWaalsContact C-N 3.26Å; K1512-K1514 PolarHBondContact O-N 3.43Å
1513T84.1Confident87.8Confident101 Ų10166.2 Ų66.262%0.6234%0.335SS*.Hα-helixtrans-72.6-19.6174.361.30000113.6R1509 E1510 L1511R1509-T1513 WeakPolarHBondContact O-CG2 3.37Å; R1509-T1513 PolarHBondContact O-N 3.29Å; E1510-T1513 PolarHBondContact O-N 3.43Å; E1510-T1513 VanDerWaalsContact O-N 3.1Å; E1510-T1513 PolarHBondContact O-OG1 3.41Å; L1511-T1513 VanDerWaalsContact C-N 3.27Å; L1511-T1513 PolarHBondContact O-N 3.23Å
1514K89.9Confident87.2Confident73 Ų7365.9 Ų65.932%0.31733%0.333SS..Hα-helixtrans-99.6-24.8-176.6-76.9-90-175.3173.90113.6W1476 E1510 L1511 K1512 P1516 V1517 I1518W1476-K1514 HydrophobicContact CD2-CD 4.28Å; W1476-K1514 HydrophobicContact CH2-CB 3.49Å; W1476-K1514 VanDerWaalsContact CH2-CB 3.49Å; W1476-K1514 HydrophobicContact CH2-CD 4.15Å; W1476-K1514 HydrophobicContact CH2-CG 3.56Å; W1476-K1514 HydrophobicContact CZ2-CB 3.98Å; W1476-K1514 HydrophobicContact CZ2-CD 3.88Å; W1476-K1514 HydrophobicContact CZ2-CG 3.47Å; W1476-K1514 VanDerWaalsContact CZ2-CG 3.47Å; W1476-K1514 HydrophobicContact CZ3-CB 3.89Å; W1476-K1514 HydrophobicContact CZ3-CD 4.45Å; W1476-K1514 HydrophobicContact CZ3-CG 4.22Å; E1510-K1514 PolarHBondContact O-N 2.97Å; L1511-K1514 PolarHBondContact O-N 3.19Å; K1512-K1514 VanDerWaalsContact C-N 3.26Å; K1512-K1514 PolarHBondContact O-N 3.43Å; K1514-P1516 VanDerWaalsContact C-CD 3.44Å; K1514-P1516 VanDerWaalsContact C-N 3.35Å; K1514-V1517 WeakPolarHBondContact O-CB 3.42Å; K1514-V1517 PolarHBondContact O-N 2.96Å; K1514-I1518 PolarHBondContact O-N 3.13Å; K1514-I1518 VanDerWaalsContact O-N 3.14Å
1515E90.3Very high86.7Confident87 Ų8766 Ų6641%0.40733%0.334SS..Hα-helixtrans-44-47.8172.9-177.2175.4-168.600113.8L1511 V1517 I1518 M1519 W1571L1511-E1515 PolarHBondContact O-N 3.11Å; E1515-V1517 VanDerWaalsContact C-N 3.29Å; E1515-V1517 PolarHBondContact O-N 3.42Å; E1515-I1518 PolarHBondContact O-N 3.01Å; E1515-M1519 HydrophobicContact CG-CG 4.38Å; E1515-M1519 WeakPolarHBondContact O-CB 3.27Å; E1515-M1519 VanDerWaalsContact O-CG 3.29Å; E1515-M1519 WeakPolarHBondContact O-CG 3.26Å; E1515-M1519 PolarHBondContact O-N 3.16Å; E1515-W1571 HydrophobicContact CB-CH2 3.95Å; E1515-W1571 HydrophobicContact CB-CZ2 3.58Å; E1515-W1571 HydrophobicContact CG-CZ2 3.76Å
1516P82.6Confident86.2Confident81 Ų8169.4 Ų69.453%0.52635%0.347SS..Hα-helixtrans-65-31-179.9-20.634.1000113.5K1514 S1520K1514-P1516 VanDerWaalsContact C-CD 3.44Å; K1514-P1516 VanDerWaalsContact C-N 3.35Å; P1516-S1520 WeakPolarHBondContact O-CB 3.4Å; P1516-S1520 PolarHBondContact O-N 3.13Å
1517V86.8Confident85.5Confident73 Ų7371.5 Ų71.544%0.44235%0.352SS..Hα-helixtrans-73.2-42.3179.5-175.40000110.4L1473 K1514 E1515 T1521L1473-V1517 HydrophobicContact CD2-CG1 4.47Å; K1514-V1517 WeakPolarHBondContact O-CB 3.42Å; K1514-V1517 PolarHBondContact O-N 2.96Å; E1515-V1517 VanDerWaalsContact C-N 3.29Å; E1515-V1517 PolarHBondContact O-N 3.42Å; V1517-T1521 WeakPolarHBondContact O-CB 3.44Å; V1517-T1521 PolarHBondContact O-N 2.98Å; V1517-T1521 PolarHBondContact O-OG1 3.14Å
1518I90.7Very high84.4Confident0 Ų073.3 Ų73.30%036%0.36CS..Hα-helixtrans-61.7-54175-66.9168.2000109.4L1473 W1476 L1477 K1514 E1515 S1520 T1521 L1522 V1567 W1571L1473-I1518 HydrophobicContact CD1-CG1 4.19Å; L1473-I1518 HydrophobicContact CD2-CG1 3.83Å; W1476-I1518 HydrophobicContact CZ3-CD1 4.25Å; L1477-I1518 HydrophobicContact CD2-CD1 4.13Å; K1514-I1518 PolarHBondContact O-N 3.13Å; K1514-I1518 VanDerWaalsContact O-N 3.14Å; E1515-I1518 PolarHBondContact O-N 3.01Å; I1518-S1520 PolarHBondContact O-N 3.45Å; I1518-T1521 PolarHBondContact O-N 3.16Å; I1518-T1521 VanDerWaalsContact O-N 3.1Å; I1518-L1522 HydrophobicContact CG2-CD1 3.87Å; I1518-L1522 HydrophobicContact CG2-CG 4.39Å; I1518-L1522 WeakPolarHBondContact O-CG 3.34Å; I1518-L1522 PolarHBondContact O-N 2.89Å; I1518-V1567 HydrophobicContact CG2-CG1 3.97Å; I1518-W1571 HydrophobicContact CD1-CD2 3.59Å; I1518-W1571 HydrophobicContact CD1-CE3 3.36Å; I1518-W1571 HydrophobicContact CD1-CG 4.15Å; I1518-W1571 HydrophobicContact CD1-CH2 4.33Å; I1518-W1571 HydrophobicContact CD1-CZ3 3.74Å; I1518-W1571 HydrophobicContact CG2-CG 4.24Å
1519M88.8Confident83.6Confident102 Ų10272.2 Ų72.250%0.50236%0.357SS..Hα-helixtrans-59.5-43.9-179.7-65.8-58-69.600112.4E1515 T1521 L1522 E1523E1515-M1519 HydrophobicContact CG-CG 4.38Å; E1515-M1519 WeakPolarHBondContact O-CB 3.27Å; E1515-M1519 VanDerWaalsContact O-CG 3.29Å; E1515-M1519 WeakPolarHBondContact O-CG 3.26Å; E1515-M1519 PolarHBondContact O-N 3.16Å; M1519-T1521 VanDerWaalsContact C-N 3.32Å; M1519-T1521 PolarHBondContact O-N 3.41Å; M1519-L1522 PolarHBondContact O-N 2.77Å; M1519-E1523 WeakPolarHBondContact O-CB 3.49Å; M1519-E1523 PolarHBondContact O-N 2.93Å
1520S82.7Confident82.5Confident72 Ų7270.5 Ų70.550%0.50336%0.363SS..Hα-helixtrans-65.2-33.8176.7-174.20000112.9P1516 I1518 T1524P1516-S1520 WeakPolarHBondContact O-CB 3.4Å; P1516-S1520 PolarHBondContact O-N 3.13Å; I1518-S1520 PolarHBondContact O-N 3.45Å; S1520-T1524 WeakPolarHBondContact O-CB 3.43Å; S1520-T1524 PolarHBondContact O-N 2.67Å; S1520-T1524 PolarHBondContact O-OG1 2.89Å
1521T84.6Confident81.3Confident20 Ų2073.7 Ų73.712%0.12338%0.378CS..Hα-helixtrans-72.4-45.2178.4-54.40000110.4L1470 L1473 V1517 I1518 M1519 E1523 T1524 V1525L1470-T1521 HydrophobicContact CD2-CG2 3.95Å; L1470-T1521 HydrophobicContact CG-CG2 4.37Å; L1473-T1521 HydrophobicContact CD1-CG2 3.97Å; V1517-T1521 WeakPolarHBondContact O-CB 3.44Å; V1517-T1521 PolarHBondContact O-N 2.98Å; V1517-T1521 PolarHBondContact O-OG1 3.14Å; I1518-T1521 PolarHBondContact O-N 3.16Å; I1518-T1521 VanDerWaalsContact O-N 3.1Å; M1519-T1521 VanDerWaalsContact C-N 3.32Å; M1519-T1521 PolarHBondContact O-N 3.41Å; T1521-E1523 VanDerWaalsContact C-N 3.32Å; T1521-E1523 PolarHBondContact O-N 2.76Å; T1521-T1524 PolarHBondContact O-N 3.33Å; T1521-V1525 WeakPolarHBondContact O-CG2 3.44Å; T1521-V1525 PolarHBondContact O-N 2.94Å
1522L88.3Confident79.4Confident20 Ų2077 Ų7711%0.10539%0.393CS..Hα-helixtrans-60-40.9174.8-66.2174.9000112I1518 M1519 V1525 R1526 A1564 V1567 N1568I1518-L1522 HydrophobicContact CG2-CD1 3.87Å; I1518-L1522 HydrophobicContact CG2-CG 4.39Å; I1518-L1522 WeakPolarHBondContact O-CG 3.34Å; I1518-L1522 PolarHBondContact O-N 2.89Å; M1519-L1522 PolarHBondContact O-N 2.77Å; L1522-V1525 PolarHBondContact O-N 3.49Å; L1522-R1526 PolarHBondContact O-N 2.9Å; L1522-A1564 HydrophobicContact CD2-CB 3.71Å; L1522-A1564 WeakPolarHBondContact CD2-O 3.46Å; L1522-V1567 HydrophobicContact CD2-CB 4.29Å; L1522-V1567 HydrophobicContact CD2-CG1 4.15Å; L1522-N1568 HydrophobicContact CD1-CB 4.14Å
1523E81.3Confident77.2Confident95 Ų9576 Ų7644%0.44440%0.403SS..Hα-helixtrans-68.4-37.9176.1-169.759.7-162.200112.1M1519 T1521 V1525 R1526 I1527M1519-E1523 WeakPolarHBondContact O-CB 3.49Å; M1519-E1523 PolarHBondContact O-N 2.93Å; T1521-E1523 VanDerWaalsContact C-N 3.32Å; T1521-E1523 PolarHBondContact O-N 2.76Å; E1523-V1525 VanDerWaalsContact C-N 3.3Å; E1523-V1525 PolarHBondContact O-N 2.97Å; E1523-R1526 WeakPolarHBondContact O-CB 3.23Å; E1523-R1526 PolarHBondContact O-N 3.33Å; E1523-R1526 VanDerWaalsContact O-N 3.13Å; E1523-R1526 WeakPolarHBondContact OE2-CD 3.36Å; E1523-I1527 HydrophobicContact CG-CD1 4.31Å; E1523-I1527 WeakPolarHBondContact O-CG1 3.23Å; E1523-I1527 PolarHBondContact O-N 3.14Å
1524T79.3Confident74.9Confident64 Ų6479.3 Ų79.339%0.39342%0.416SS..Hα-helixtrans-64.4-36.6174.6-49.60000111.4L1466 S1520 T1521 F1528L1466-T1524 HydrophobicContact CD2-CG2 3.79Å; S1520-T1524 WeakPolarHBondContact O-CB 3.43Å; S1520-T1524 PolarHBondContact O-N 2.67Å; S1520-T1524 PolarHBondContact O-OG1 2.89Å; T1521-T1524 PolarHBondContact O-N 3.33Å; T1524-F1528 WeakPolarHBondContact O-CB 3.35Å; T1524-F1528 PolarHBondContact O-N 3.29Å
1525V81.8Confident72Confident2 Ų285.6 Ų85.61%0.01245%0.446CS..Hα-helixtrans-64.3-44.4171.1177.30000110.8L1466 L1470 T1521 L1522 E1523 I1527 F1528 L1529 L1560 A1564L1466-V1525 HydrophobicContact CD2-CG2 3.86Å; L1470-V1525 HydrophobicContact CD1-CG2 3.86Å; L1470-V1525 HydrophobicContact CD2-CG2 4.21Å; L1470-V1525 HydrophobicContact CG-CG2 4.31Å; T1521-V1525 WeakPolarHBondContact O-CG2 3.44Å; T1521-V1525 PolarHBondContact O-N 2.94Å; L1522-V1525 PolarHBondContact O-N 3.49Å; E1523-V1525 VanDerWaalsContact C-N 3.3Å; E1523-V1525 PolarHBondContact O-N 2.97Å; V1525-I1527 PolarHBondContact O-N 3.37Å; V1525-F1528 PolarHBondContact O-N 2.92Å; V1525-L1529 HydrophobicContact CG1-CD1 3.87Å; V1525-L1529 HydrophobicContact CG1-CG 4.21Å; V1525-L1529 VanDerWaalsContact O-CG 3.22Å; V1525-L1529 WeakPolarHBondContact O-CG 3.43Å; V1525-L1529 PolarHBondContact O-N 3.45Å; V1525-L1560 HydrophobicContact CG1-CB 4.25Å; V1525-A1564 HydrophobicContact CB-CB 4.3Å; V1525-A1564 HydrophobicContact CG1-CB 3.91Å; V1525-A1564 HydrophobicContact CG2-CB 4.4Å
1526R79.3Confident69.2Low170 Ų17085.2 Ų85.264%0.64247%0.465SS*.Hα-helixtrans-56.7-49175.8-79.3-179.9166.6-165.1-1.4112.1L1522 E1523 F1528 L1529 T1530L1522-R1526 PolarHBondContact O-N 2.9Å; E1523-R1526 WeakPolarHBondContact O-CB 3.23Å; E1523-R1526 PolarHBondContact O-N 3.33Å; E1523-R1526 VanDerWaalsContact O-N 3.13Å; E1523-R1526 WeakPolarHBondContact OE2-CD 3.36Å; R1526-F1528 PolarHBondContact O-N 2.74Å; R1526-L1529 PolarHBondContact O-N 3.49Å; R1526-L1529 VanDerWaalsContact O-N 3.11Å; R1526-T1530 PolarHBondContact O-N 3.5Å; R1526-T1530 PolarHBondContact O-OG1 3.1Å; R1526-T1530 VanDerWaalsContact O-OG1 3.06Å
1527I72.3Confident66.7Low79 Ų7989.1 Ų89.141%0.40548%0.481SS..Hα-helixtrans-57-50.1177.6-66.8165.3000110.3E1523 V1525 L1529 T1530 E1531E1523-I1527 HydrophobicContact CG-CD1 4.31Å; E1523-I1527 WeakPolarHBondContact O-CG1 3.23Å; E1523-I1527 PolarHBondContact O-N 3.14Å; V1525-I1527 PolarHBondContact O-N 3.37Å; I1527-L1529 PolarHBondContact O-N 2.81Å; I1527-T1530 WeakPolarHBondContact CA-OG1 3.34Å; I1527-T1530 PolarHBondContact O-N 2.93Å; I1527-T1530 PolarHBondContact O-OG1 3.5Å; I1527-E1531 PolarHBondContact O-N 2.95Å; I1527-E1531 VanDerWaalsContact O-N 3.16Å
1528F71.3Confident63.8Low48 Ų4893.9 Ų93.921%0.21150%0.499CS..Hα-helixtrans-59.1-32.7177.6-176.4-92.7000113.3W1463 L1466 T1524 V1525 R1526 L1560W1463-F1528 HydrophobicContact CB-CE1 4.44Å; W1463-F1528 HydrophobicContact CB-CE2 4.41Å; W1463-F1528 HydrophobicContact CB-CZ 3.84Å; L1466-F1528 HydrophobicContact CD1-CB 4.05Å; L1466-F1528 HydrophobicContact CD1-CD2 4.06Å; L1466-F1528 HydrophobicContact CD1-CG 3.97Å; T1524-F1528 WeakPolarHBondContact O-CB 3.35Å; T1524-F1528 PolarHBondContact O-N 3.29Å; V1525-F1528 PolarHBondContact O-N 2.92Å; R1526-F1528 PolarHBondContact O-N 2.74Å; F1528-L1560 HydrophobicContact CD1-CD1 3.78Å; F1528-L1560 HydrophobicContact CE1-CD1 3.63Å; F1528-L1560 HydrophobicContact CZ-CD1 4.47Å
1529L72.1Confident60.9Low38 Ų38103.2 Ų103.220%0.19954%0.539CS..Hα-helixtrans-76.3-30175.4-66.3172.9000113V1525 R1526 I1527 T1557 R1561V1525-L1529 HydrophobicContact CG1-CD1 3.87Å; V1525-L1529 HydrophobicContact CG1-CG 4.21Å; V1525-L1529 VanDerWaalsContact O-CG 3.22Å; V1525-L1529 WeakPolarHBondContact O-CG 3.43Å; V1525-L1529 PolarHBondContact O-N 3.45Å; R1526-L1529 PolarHBondContact O-N 3.49Å; R1526-L1529 VanDerWaalsContact O-N 3.11Å; I1527-L1529 PolarHBondContact O-N 2.81Å; L1529-T1557 HydrophobicContact CD2-CG2 3.41Å; L1529-T1557 VanDerWaalsContact CD2-CG2 3.41Å; L1529-T1557 WeakPolarHBondContact CD2-O 3.39Å; L1529-R1561 HydrophobicContact CD1-CB 4.19Å; L1529-R1561 HydrophobicContact CD1-CG 4.42Å
1530T63.1Low58Low113 Ų113104.9 Ų104.969%0.69355%0.549SS*.Hα-helixtrans-79.4-23.4177.234.20000114.9R1526 I1527 Q1532R1526-T1530 PolarHBondContact O-N 3.5Å; R1526-T1530 PolarHBondContact O-OG1 3.1Å; R1526-T1530 VanDerWaalsContact O-OG1 3.06Å; I1527-T1530 WeakPolarHBondContact CA-OG1 3.34Å; I1527-T1530 PolarHBondContact O-N 2.93Å; I1527-T1530 PolarHBondContact O-OG1 3.5Å; T1530-Q1532 VanDerWaalsContact C-N 3.28Å; T1530-Q1532 PolarHBondContact O-N 3.22Å
1531E61.8Low55.3Low153 Ų153111.4 Ų111.472%0.71556%0.564SS**SBendtrans-80.4-1.5-178.4-70.3-172.3155.800114.2I1527I1527-E1531 PolarHBondContact O-N 2.95Å; I1527-E1531 VanDerWaalsContact O-N 3.16Å
1532Q50.8Low52.7Low72 Ų72119 Ų11934%0.33660%0.599SS.*SBendtrans-84.4128.1174-70.2-173.85.300111.7T1530 T1557T1530-Q1532 VanDerWaalsContact C-N 3.28Å; T1530-Q1532 PolarHBondContact O-N 3.22Å; Q1532-T1557 VanDerWaalsContact CD-OG1 3.28Å; Q1532-T1557 PolarHBondContact NE2-OG1 3.03Å; Q1532-T1557 PolarHBondContact OE1-OG1 2.94Å
1533P39.5Very low49.9Very low133 Ų133126.9 Ų126.986%0.86464%0.635SS**  trans-67.1143.1-170.9-20.732.5000114.6
1534L35.6Very low48Very low171 Ų171128 Ų12890%0.89565%0.651SS**  trans-125.868.8-176.6-168.895.1000112.4
1535E29.9Very low45.7Very low205 Ų205136.3 Ų136.396%0.95868%0.675SS**  trans-162.6148.9166.7-127.5171.7172.100113.6
1536G31.5Very low43.5Very low78 Ų78144.7 Ų144.780%0.80471%0.714SS**  trans117.252.3166.100000118.1
1537L28.7Very low41.6Very low164 Ų164142.3 Ų142.386%0.85971%0.713SS**  trans-72.6154.1171.5-132.5126.3000112
1538E26.6Very low40.2Very low173 Ų173142 Ų14281%0.80872%0.716SS**  trans72.297170.9-52.5-166.2144.200119.8
1539K29.2Very low39.4Very low195 Ų195144.6 Ų144.685%0.84874%0.738SS**  -166.6108.2129.1-106.1154.8-169.9170.10115.7
1540L28.1Very low38.3Very low138 Ų138149.1 Ų149.172%0.72376%0.758SS**  trans55.5103.4132.1-56.1176000121.5
1541Y26.8Very low37.6Very low208 Ų208148.2 Ų148.282%0.81675%0.746SS**  trans69.1127.2131.7-71.8-72.6000123.8
1542Q28.8Very low37.1Very low180 Ų180149.6 Ų149.684%0.84175%0.745SS**  trans107.5126.7143.5-77.7-178.713.800121.4
1543E30.5Very low37.3Very low185 Ų185148.2 Ų148.286%0.86475%0.746SS**  trans70.4145.7165.9-62.3-155.8142.400122.2
1544P40.5Very low38.5Very low120 Ų120148.2 Ų148.278%0.77973%0.734SS**  trans-126.1106.8-162.434.1-12.1000114
1545R30.7Very low39.9Very low237 Ų237143.9 Ų143.989%0.89471%0.712SS**  trans-158.5137.1158-138171.4-179.7166.5-1.4112.6
1546E37.1Very low41.7Very low178 Ų178135.3 Ų135.383%0.83267%0.673SS**SBendtrans68.2133.7179.5-55.2-166174.200116.3P1548E1546-P1548 WeakPolarHBondContact O-CD 3.16Å
1547L38.7Very low43.7Very low120 Ų120132.2 Ų132.263%0.62864%0.639SS**  trans-69120-171.2-65.3153.2000110E1551L1547-E1551 VanDerWaalsContact CD2-OE2 3.25Å; L1547-E1551 WeakPolarHBondContact CD2-OE2 3.47Å
1548P43.3Very low45.8Very low72 Ų72132.1 Ų132.147%0.46863%0.627SS.*  trans-60.2149.7-174.7-26.735.5000113.7E1546 E1550 E1551E1546-P1548 WeakPolarHBondContact O-CD 3.16Å; P1548-E1550 PolarHBondContact O-N 3.15Å; P1548-E1550 VanDerWaalsContact O-N 3.13Å; P1548-E1551 PolarHBondContact O-N 2.99Å
1549P53.2Low48.3Very low103 Ų103127.2 Ų127.267%0.66961%0.606SS**Hα-helixtrans-52.3-31.5175.3-28.436.5000114.7E1551 R1552 A1553P1549-E1551 VanDerWaalsContact C-N 3.3Å; P1549-E1551 PolarHBondContact O-N 3.16Å; P1549-R1552 PolarHBondContact O-N 3.39Å; P1549-A1553 PolarHBondContact O-N 3.32Å
1550E49.3Very low50.8Low134 Ų134117.9 Ų117.963%0.62657%0.566SS**Hα-helixtrans-46.1-47.6170.7-99.773.4-160.700113.5P1548 R1552 A1553 Q1554P1548-E1550 PolarHBondContact O-N 3.15Å; P1548-E1550 VanDerWaalsContact O-N 3.13Å; E1550-R1552 VanDerWaalsContact C-N 3.31Å; E1550-R1552 PolarHBondContact O-N 2.98Å; E1550-A1553 PolarHBondContact O-N 3.43Å; E1550-Q1554 WeakPolarHBondContact O-CB 3.17Å; E1550-Q1554 WeakPolarHBondContact O-CG 3.36Å; E1550-Q1554 PolarHBondContact O-N 2.89Å
1551E50.1Low53.3Low94 Ų94116.8 Ų116.844%0.43955%0.552SS.*Hα-helixtrans-69.5-30.6-178.2-77.2-166.5155.300112.1L1547 P1548 P1549 N1555L1547-E1551 VanDerWaalsContact CD2-OE2 3.25Å; L1547-E1551 WeakPolarHBondContact CD2-OE2 3.47Å; P1548-E1551 PolarHBondContact O-N 2.99Å; P1549-E1551 VanDerWaalsContact C-N 3.3Å; P1549-E1551 PolarHBondContact O-N 3.16Å; E1551-N1555 VanDerWaalsContact O-CB 3.31Å; E1551-N1555 WeakPolarHBondContact O-CB 3.49Å; E1551-N1555 PolarHBondContact O-N 3.16Å; E1551-N1555 PolarHBondContact O-ND2 3.16Å
1552R50.6Low56Low182 Ų182112.4 Ų112.469%0.68754%0.537SS*.Hα-helixtrans-70.5-43175.3-65.1-174.8-174.5167.64.9110.7P1549 E1550 N1555 V1556P1549-R1552 PolarHBondContact O-N 3.39Å; E1550-R1552 VanDerWaalsContact C-N 3.31Å; E1550-R1552 PolarHBondContact O-N 2.98Å; R1552-N1555 PolarHBondContact O-N 2.74Å; R1552-V1556 WeakPolarHBondContact O-CG2 3.35Å; R1552-V1556 PolarHBondContact O-N 2.67Å
1553A55.2Low58.7Low43 Ų43104.4 Ų104.436%0.35550%0.5SS..Hα-helixtrans-59.5-52.3173.500000110.9P1549 E1550 N1555 V1556 T1557P1549-A1553 PolarHBondContact O-N 3.32Å; E1550-A1553 PolarHBondContact O-N 3.43Å; A1553-N1555 VanDerWaalsContact C-N 3.31Å; A1553-N1555 PolarHBondContact O-N 2.99Å; A1553-V1556 PolarHBondContact O-N 3.5Å; A1553-T1557 WeakPolarHBondContact O-CB 3.37Å; A1553-T1557 PolarHBondContact O-N 2.93Å; A1553-T1557 PolarHBondContact O-OG1 3.25Å
1554Q63.5Low61.4Low132 Ų13296.3 Ų96.362%0.61746%0.464SS*.Hα-helixtrans-59.4-37178.1-73.8-174.50.500113.3E1550 R1558E1550-Q1554 WeakPolarHBondContact O-CB 3.17Å; E1550-Q1554 WeakPolarHBondContact O-CG 3.36Å; E1550-Q1554 PolarHBondContact O-N 2.89Å; Q1554-R1558 VanDerWaalsContact O-CB 3.31Å; Q1554-R1558 WeakPolarHBondContact O-CB 3.27Å; Q1554-R1558 PolarHBondContact O-N 3.3Å
1555N65.4Low63.7Low80 Ų8095.9 Ų95.943%0.42845%0.452SS..Hα-helixtrans-68.5-40.3176.3-84.1-60.3000112.9E1551 R1552 A1553 R1558 L1559E1551-N1555 VanDerWaalsContact O-CB 3.31Å; E1551-N1555 WeakPolarHBondContact O-CB 3.49Å; E1551-N1555 PolarHBondContact O-N 3.16Å; E1551-N1555 PolarHBondContact O-ND2 3.16Å; R1552-N1555 PolarHBondContact O-N 2.74Å; A1553-N1555 VanDerWaalsContact C-N 3.31Å; A1553-N1555 PolarHBondContact O-N 2.99Å; N1555-R1558 PolarHBondContact O-N 2.86Å; N1555-R1558 PolarHBondContact OD1-NH2 3.39Å; N1555-L1559 WeakPolarHBondContact O-CB 3.29Å; N1555-L1559 PolarHBondContact O-N 3.05Å
1556V68Low66.5Low26 Ų2687.5 Ų87.516%0.15842%0.423CS..Hα-helixtrans-64.1-46.7173.6169.80000110.6W1463 R1552 A1553 R1558 L1559 L1560W1463-V1556 HydrophobicContact CB-CG1 3.83Å; W1463-V1556 HydrophobicContact CD2-CG1 3.68Å; W1463-V1556 HydrophobicContact CD2-CG2 4.05Å; W1463-V1556 HydrophobicContact CE3-CG1 3.67Å; W1463-V1556 HydrophobicContact CE3-CG2 4.12Å; W1463-V1556 HydrophobicContact CG-CG1 3.78Å; W1463-V1556 HydrophobicContact CH2-CG2 4.26Å; W1463-V1556 HydrophobicContact CZ2-CG2 4.19Å; W1463-V1556 HydrophobicContact CZ3-CG1 4.45Å; W1463-V1556 HydrophobicContact CZ3-CG2 4.23Å; R1552-V1556 WeakPolarHBondContact O-CG2 3.35Å; R1552-V1556 PolarHBondContact O-N 2.67Å; A1553-V1556 PolarHBondContact O-N 3.5Å; V1556-R1558 VanDerWaalsContact C-N 3.3Å; V1556-R1558 PolarHBondContact O-N 3.02Å; V1556-L1559 PolarHBondContact O-N 3.26Å; V1556-L1559 VanDerWaalsContact O-N 3.17Å; V1556-L1560 HydrophobicContact CG1-CD1 4.04Å; V1556-L1560 HydrophobicContact CG1-CG 4.45Å; V1556-L1560 PolarHBondContact O-N 3.3Å
1557T73.3Confident69.1Low13 Ų1379 Ų798%0.0838%0.383CS..Hα-helixtrans-56.6-41174.9-620000111.6L1529 Q1532 A1553 R1561L1529-T1557 HydrophobicContact CD2-CG2 3.41Å; L1529-T1557 VanDerWaalsContact CD2-CG2 3.41Å; L1529-T1557 WeakPolarHBondContact CD2-O 3.39Å; Q1532-T1557 VanDerWaalsContact CD-OG1 3.28Å; Q1532-T1557 PolarHBondContact NE2-OG1 3.03Å; Q1532-T1557 PolarHBondContact OE1-OG1 2.94Å; A1553-T1557 WeakPolarHBondContact O-CB 3.37Å; A1553-T1557 PolarHBondContact O-N 2.93Å; A1553-T1557 PolarHBondContact O-OG1 3.25Å; T1557-R1561 VanDerWaalsContact O-CB 3.31Å; T1557-R1561 WeakPolarHBondContact O-CB 3.32Å; T1557-R1561 PolarHBondContact O-N 2.84Å
1558R73.8Confident71.6Confident161 Ų16175.7 Ų75.761%0.60837%0.366SS*.Hα-helixtrans-70.2-39.9175.2-174.4176.864.9158.3-3.7113Q1554 N1555 V1556 K1562Q1554-R1558 VanDerWaalsContact O-CB 3.31Å; Q1554-R1558 WeakPolarHBondContact O-CB 3.27Å; Q1554-R1558 PolarHBondContact O-N 3.3Å; N1555-R1558 PolarHBondContact O-N 2.86Å; N1555-R1558 PolarHBondContact OD1-NH2 3.39Å; V1556-R1558 VanDerWaalsContact C-N 3.3Å; V1556-R1558 PolarHBondContact O-N 3.02Å; R1558-K1562 WeakPolarHBondContact O-CB 3.21Å; R1558-K1562 PolarHBondContact O-N 3.35Å
1559L77.9Confident73.8Confident70 Ų7076 Ų7637%0.36637%0.366SS..Hα-helixtrans-66.1-49.5-179.6178.762.5000111.7N1555 V1556 R1561 K1562 Q1563N1555-L1559 WeakPolarHBondContact O-CB 3.29Å; N1555-L1559 PolarHBondContact O-N 3.05Å; V1556-L1559 PolarHBondContact O-N 3.26Å; V1556-L1559 VanDerWaalsContact O-N 3.17Å; L1559-R1561 VanDerWaalsContact C-N 3.31Å; L1559-R1561 PolarHBondContact O-N 2.87Å; L1559-K1562 PolarHBondContact O-N 3.38Å; L1559-Q1563 PolarHBondContact O-N 3.28Å
1560L82.4Confident75.7Confident0 Ų073.6 Ų73.60%035%0.346CS..Hα-helixtrans-62.6-38.9178-69.7176.3000111.7W1463 L1466 H1467 L1470 V1525 F1528 V1556 A1564W1463-L1560 HydrophobicContact CB-CD1 4.35Å; L1466-L1560 HydrophobicContact CB-CD1 4.43Å; L1466-L1560 HydrophobicContact CB-CD2 3.97Å; H1467-L1560 HydrophobicContact CB-CD2 3.96Å; L1470-L1560 HydrophobicContact CD1-CD2 4.01Å; V1525-L1560 HydrophobicContact CG1-CB 4.25Å; F1528-L1560 HydrophobicContact CD1-CD1 3.78Å; F1528-L1560 HydrophobicContact CE1-CD1 3.63Å; F1528-L1560 HydrophobicContact CZ-CD1 4.47Å; V1556-L1560 HydrophobicContact CG1-CD1 4.04Å; V1556-L1560 HydrophobicContact CG1-CG 4.45Å; V1556-L1560 PolarHBondContact O-N 3.3Å; L1560-A1564 WeakPolarHBondContact O-CB 3.26Å; L1560-A1564 PolarHBondContact O-N 2.89Å
1561R81.4Confident77.8Confident114 Ų11468 Ų6843%0.4332%0.32SS..Hα-helixtrans-61.3-50.9174.2-173.7-177.3-58.1142.44.1111.8L1529 T1557 L1559 Q1563 A1564 E1565L1529-R1561 HydrophobicContact CD1-CB 4.19Å; L1529-R1561 HydrophobicContact CD1-CG 4.42Å; T1557-R1561 VanDerWaalsContact O-CB 3.31Å; T1557-R1561 WeakPolarHBondContact O-CB 3.32Å; T1557-R1561 PolarHBondContact O-N 2.84Å; L1559-R1561 VanDerWaalsContact C-N 3.31Å; L1559-R1561 PolarHBondContact O-N 2.87Å; R1561-Q1563 VanDerWaalsContact C-N 3.31Å; R1561-Q1563 PolarHBondContact O-N 2.83Å; R1561-A1564 PolarHBondContact O-N 3.29Å; R1561-E1565 VanDerWaalsContact CG-OE1 3.28Å; R1561-E1565 WeakPolarHBondContact CG-OE1 3.48Å; R1561-E1565 WeakPolarHBondContact O-CG 3.3Å; R1561-E1565 PolarHBondContact O-N 2.88Å
1562K82.3Confident79.8Confident116 Ų11668.6 Ų68.650%0.50432%0.322SS..Hα-helixtrans-57.8-42.8179.5-176.2174.8-174.4-73.40112R1558 L1559 E1565 E1566R1558-K1562 WeakPolarHBondContact O-CB 3.21Å; R1558-K1562 PolarHBondContact O-N 3.35Å; L1559-K1562 PolarHBondContact O-N 3.38Å; K1562-E1565 PolarHBondContact O-N 2.91Å; K1562-E1566 IonicContact NZ-OE1 3.69Å; K1562-E1566 PolarHBondContact NZ-OE1 2.97Å; K1562-E1566 VanDerWaalsContact O-CG 3.26Å; K1562-E1566 WeakPolarHBondContact O-CG 3.39Å; K1562-E1566 PolarHBondContact O-N 3.29Å
1563Q85.2Confident81.7Confident13 Ų1364.3 Ų64.36%0.06131%0.309CS..Hα-helixtrans-72.7-33.8178.6-73.2-176.5-50.200113.5H1467 L1470 Q1471 L1559 R1561 E1565 E1566 V1567H1467-Q1563 PolarHBondContact CE1-NE2 3.43Å; H1467-Q1563 VanDerWaalsContact CE1-NE2 3.3Å; H1467-Q1563 PolarHBondContact CE1-OE1 3.3Å; H1467-Q1563 PolarHBondContact ND1-NE2 2.8Å; H1467-Q1563 PolarHBondContact ND1-OE1 3.43Å; L1470-Q1563 HydrophobicContact CB-CB 4.08Å; L1470-Q1563 HydrophobicContact CD1-CB 3.76Å; L1470-Q1563 HydrophobicContact CG-CB 4.47Å; Q1471-Q1563 VanDerWaalsContact CG-NE2 3.35Å; L1559-Q1563 PolarHBondContact O-N 3.28Å; R1561-Q1563 VanDerWaalsContact C-N 3.31Å; R1561-Q1563 PolarHBondContact O-N 2.83Å; Q1563-E1565 VanDerWaalsContact C-N 3.34Å; Q1563-E1566 PolarHBondContact O-N 3.34Å; Q1563-V1567 WeakPolarHBondContact O-CB 3.49Å; Q1563-V1567 VanDerWaalsContact O-CG2 3.31Å; Q1563-V1567 WeakPolarHBondContact O-CG2 3.38Å; Q1563-V1567 PolarHBondContact O-N 2.91Å
1564A88.5Confident83.5Confident14 Ų1462.3 Ų62.312%0.11629%0.292CS..Hα-helixtrans-66.3-39172.400000111.5L1470 L1522 V1525 L1560 R1561 N1568L1470-A1564 HydrophobicContact CD2-CB 4.29Å; L1522-A1564 HydrophobicContact CD2-CB 3.71Å; L1522-A1564 WeakPolarHBondContact CD2-O 3.46Å; V1525-A1564 HydrophobicContact CB-CB 4.3Å; V1525-A1564 HydrophobicContact CG1-CB 3.91Å; V1525-A1564 HydrophobicContact CG2-CB 4.4Å; L1560-A1564 WeakPolarHBondContact O-CB 3.26Å; L1560-A1564 PolarHBondContact O-N 2.89Å; R1561-A1564 PolarHBondContact O-N 3.29Å; A1564-N1568 WeakPolarHBondContact O-CB 3.45Å; A1564-N1568 PolarHBondContact O-N 3.48Å
1565E87Confident84.8Confident111 Ų11158.8 Ų58.852%0.51928%0.277SS..Hα-helixtrans-60.9-48.4170.8-71.6163.6-178.100110.9R1561 K1562 Q1563 V1567 N1568 T1569R1561-E1565 VanDerWaalsContact CG-OE1 3.28Å; R1561-E1565 WeakPolarHBondContact CG-OE1 3.48Å; R1561-E1565 WeakPolarHBondContact O-CG 3.3Å; R1561-E1565 PolarHBondContact O-N 2.88Å; K1562-E1565 PolarHBondContact O-N 2.91Å; Q1563-E1565 VanDerWaalsContact C-N 3.34Å; E1565-V1567 PolarHBondContact O-N 3Å; E1565-N1568 PolarHBondContact O-N 2.91Å; E1565-T1569 PolarHBondContact O-N 3Å; E1565-T1569 PolarHBondContact O-OG1 2.99Å
1566E90.1Very high86.1Confident61 Ų6160.3 Ų60.329%0.28529%0.285SS..Hα-helixtrans-58.4-47.3176.7-73.8166171.600112.8L1474 K1562 Q1563 N1568 T1569 E1570L1474-E1566 HydrophobicContact CD1-CB 4.41Å; L1474-E1566 HydrophobicContact CD2-CB 3.85Å; K1562-E1566 IonicContact NZ-OE1 3.69Å; K1562-E1566 PolarHBondContact NZ-OE1 2.97Å; K1562-E1566 VanDerWaalsContact O-CG 3.26Å; K1562-E1566 WeakPolarHBondContact O-CG 3.39Å; K1562-E1566 PolarHBondContact O-N 3.29Å; Q1563-E1566 PolarHBondContact O-N 3.34Å; E1566-N1568 VanDerWaalsContact C-N 3.31Å; E1566-N1568 PolarHBondContact O-N 2.91Å; E1566-T1569 WeakPolarHBondContact CA-OG1 3.36Å; E1566-T1569 PolarHBondContact O-N 2.87Å; E1566-T1569 PolarHBondContact O-OG1 2.74Å; E1566-E1570 PolarHBondContact O-N 2.6Å
1567V92.7Very high87.2Confident0 Ų062.3 Ų62.30%029%0.292CS..Hα-helixtrans-59.2-43.2176.4166.50000110.7L1470 L1473 L1474 L1477 I1518 L1522 Q1563 E1565 W1571L1470-V1567 HydrophobicContact CB-CG2 4.45Å; L1470-V1567 HydrophobicContact CD2-CB 4.5Å; L1470-V1567 HydrophobicContact CD2-CG2 4Å; L1473-V1567 HydrophobicContact CB-CG1 4.24Å; L1473-V1567 HydrophobicContact CB-CG2 4.13Å; L1473-V1567 HydrophobicContact CD1-CG1 4.26Å; L1474-V1567 HydrophobicContact CD1-CG2 4.42Å; L1474-V1567 HydrophobicContact CD2-CB 4.35Å; L1474-V1567 HydrophobicContact CD2-CG2 3.65Å; L1474-V1567 HydrophobicContact CG-CG2 3.59Å; L1477-V1567 HydrophobicContact CD1-CG1 4.16Å; L1477-V1567 WeakPolarHBondContact CD1-O 3.45Å; I1518-V1567 HydrophobicContact CG2-CG1 3.97Å; L1522-V1567 HydrophobicContact CD2-CB 4.29Å; L1522-V1567 HydrophobicContact CD2-CG1 4.15Å; Q1563-V1567 WeakPolarHBondContact O-CB 3.49Å; Q1563-V1567 VanDerWaalsContact O-CG2 3.31Å; Q1563-V1567 WeakPolarHBondContact O-CG2 3.38Å; Q1563-V1567 PolarHBondContact O-N 2.91Å; E1565-V1567 PolarHBondContact O-N 3Å; V1567-W1571 WeakPolarHBondContact O-CB 3.45Å; V1567-W1571 PolarHBondContact O-N 2.63Å
1568N90.7Very high88.2Confident51 Ų5161.8 Ų61.827%0.27329%0.289SS..Hα-helixtrans-66.1-43.6178.5-167.785.8000111.6L1522 A1564 E1565 E1566 W1571 E1572L1522-N1568 HydrophobicContact CD1-CB 4.14Å; A1564-N1568 WeakPolarHBondContact O-CB 3.45Å; A1564-N1568 PolarHBondContact O-N 3.48Å; E1565-N1568 PolarHBondContact O-N 2.91Å; E1566-N1568 VanDerWaalsContact C-N 3.31Å; E1566-N1568 PolarHBondContact O-N 2.91Å; N1568-W1571 PolarHBondContact O-N 3.19Å; N1568-E1572 PolarHBondContact ND2-OE1 2.76Å; N1568-E1572 WeakPolarHBondContact O-CG 3.14Å; N1568-E1572 PolarHBondContact O-N 3.49Å
1569T90.3Very high89Confident77 Ų7756.1 Ų56.147%0.47228%0.277SS..Hα-helixtrans-65.7-42.4179.548.60000113.2E1565 E1566 W1571 E1572 K1573E1565-T1569 PolarHBondContact O-N 3Å; E1565-T1569 PolarHBondContact O-OG1 2.99Å; E1566-T1569 WeakPolarHBondContact CA-OG1 3.36Å; E1566-T1569 PolarHBondContact O-N 2.87Å; E1566-T1569 PolarHBondContact O-OG1 2.74Å; T1569-W1571 VanDerWaalsContact C-N 3.35Å; T1569-E1572 PolarHBondContact O-N 2.8Å; T1569-K1573 VanDerWaalsContact O-CB 3.25Å; T1569-K1573 WeakPolarHBondContact O-CB 3.5Å; T1569-K1573 PolarHBondContact O-N 3.22Å
1570E91.4Very high89.5Confident54 Ų5455.7 Ų55.725%0.25228%0.275SS..Hα-helixtrans-71.5-31.5177.6-70.7-58.9146.200111.7L1477 E1566 K1573 L1574L1477-E1570 HydrophobicContact CB-CB 4.28Å; L1477-E1570 HydrophobicContact CD1-CB 4.02Å; E1566-E1570 PolarHBondContact O-N 2.6Å; E1570-K1573 IonicContact OE1-NZ 3.12Å; E1570-K1573 IonicContact OE2-NZ 2.96Å; E1570-K1573 PolarHBondContact OE2-NZ 3.14Å; E1570-L1574 VanDerWaalsContact O-CB 3.24Å; E1570-L1574 WeakPolarHBondContact O-CB 3.04Å; E1570-L1574 PolarHBondContact O-N 2.69Å
1571W94.7Very high90Very high16 Ų1656.9 Ų56.96%0.06128%0.28CS..Hα-helixtrans-66-45.2171.9174.7-114.6000112.8W1476 L1477 L1511 E1515 I1518 V1567 N1568 T1569 N1575W1476-W1571 HydrophobicContact CZ3-CZ3 4.38Å; L1477-W1571 HydrophobicContact CD1-CB 4.27Å; L1477-W1571 HydrophobicContact CD2-CB 4.12Å; L1477-W1571 HydrophobicContact CD2-CE3 3.69Å; L1511-W1571 HydrophobicContact CB-CH2 4.04Å; L1511-W1571 HydrophobicContact CB-CZ3 4.2Å; L1511-W1571 HydrophobicContact CD2-CZ3 4.18Å; L1511-W1571 WeakPolarHBondContact O-CH2 3.41Å; E1515-W1571 HydrophobicContact CB-CH2 3.95Å; E1515-W1571 HydrophobicContact CB-CZ2 3.58Å; E1515-W1571 HydrophobicContact CG-CZ2 3.76Å; I1518-W1571 HydrophobicContact CD1-CD2 3.59Å; I1518-W1571 HydrophobicContact CD1-CE3 3.36Å; I1518-W1571 HydrophobicContact CD1-CG 4.15Å; I1518-W1571 HydrophobicContact CD1-CH2 4.33Å; I1518-W1571 HydrophobicContact CD1-CZ3 3.74Å; I1518-W1571 HydrophobicContact CG2-CG 4.24Å; V1567-W1571 WeakPolarHBondContact O-CB 3.45Å; V1567-W1571 PolarHBondContact O-N 2.63Å; N1568-W1571 PolarHBondContact O-N 3.19Å; T1569-W1571 VanDerWaalsContact C-N 3.35Å; W1571-N1575 VanDerWaalsContact CZ2-ND2 3.31Å; W1571-N1575 WeakPolarHBondContact CZ2-ND2 3.46Å; W1571-N1575 PolarHBondContact O-N 3.05Å; W1571-N1575 VanDerWaalsContact O-N 3.11Å; W1571-N1575 PolarHBondContact O-ND2 3.1Å
1572E91.4Very high90.6Very high107 Ų10752.6 Ų52.650%0.527%0.265SS..Hα-helixtrans-63.4-44.9175.1-75.2176.7-168.200111.5N1568 T1569 N1575 L1576N1568-E1572 PolarHBondContact ND2-OE1 2.76Å; N1568-E1572 WeakPolarHBondContact O-CG 3.14Å; N1568-E1572 PolarHBondContact O-N 3.49Å; T1569-E1572 PolarHBondContact O-N 2.8Å; E1572-N1575 PolarHBondContact O-N 3.3Å; E1572-L1576 PolarHBondContact O-N 2.95Å
1573K90.6Very high90.9Very high92 Ų9253.8 Ų53.840%0.427%0.266SS..Hα-helixtrans-58.2-47.1175.6170.5171.2157.4-93.10112.5D1481 T1569 E1570 N1575 L1576 H1577D1481-K1573 IonicContact OD2-NZ 3.92Å; D1481-K1573 PolarHBondContact OD2-NZ 2.92Å; T1569-K1573 VanDerWaalsContact O-CB 3.25Å; T1569-K1573 WeakPolarHBondContact O-CB 3.5Å; T1569-K1573 PolarHBondContact O-N 3.22Å; E1570-K1573 IonicContact OE1-NZ 3.12Å; E1570-K1573 IonicContact OE2-NZ 2.96Å; E1570-K1573 PolarHBondContact OE2-NZ 3.14Å; K1573-N1575 VanDerWaalsContact C-N 3.33Å; K1573-N1575 PolarHBondContact O-N 3.43Å; K1573-L1576 PolarHBondContact O-N 3.45Å; K1573-H1577 WeakPolarHBondContact O-CB 3.35Å; K1573-H1577 PolarHBondContact O-N 3.4Å
1574L93.2Very high91Very high1 Ų158.8 Ų58.81%0.00529%0.287CS..Hα-helixtrans-63.8-37.5178.4-176.958.9000112.4L1477 K1480 D1481 L1484 F1507 L1511 E1570 S1578L1477-L1574 HydrophobicContact CD2-CD2 3.95Å; K1480-L1574 HydrophobicContact CB-CD2 3.75Å; D1481-L1574 HydrophobicContact CB-CD1 3.95Å; L1484-L1574 HydrophobicContact CD2-CD1 4.23Å; F1507-L1574 HydrophobicContact CZ-CD1 4.14Å; L1511-L1574 HydrophobicContact CD1-CG 4.48Å; L1511-L1574 HydrophobicContact CD2-CD2 3.79Å; L1511-L1574 HydrophobicContact CD2-CG 4.33Å; E1570-L1574 VanDerWaalsContact O-CB 3.24Å; E1570-L1574 WeakPolarHBondContact O-CB 3.04Å; E1570-L1574 PolarHBondContact O-N 2.69Å; L1574-S1578 WeakPolarHBondContact O-CB 3.39Å; L1574-S1578 PolarHBondContact O-N 3.41Å
1575N91.1Very high91.1Very high57 Ų5758.1 Ų58.131%0.30528%0.282SS..Hα-helixtrans-68.7-39.6175.6-80.3-65000112.5W1571 E1572 K1573 S1578 A1579W1571-N1575 VanDerWaalsContact CZ2-ND2 3.31Å; W1571-N1575 WeakPolarHBondContact CZ2-ND2 3.46Å; W1571-N1575 PolarHBondContact O-N 3.05Å; W1571-N1575 VanDerWaalsContact O-N 3.11Å; W1571-N1575 PolarHBondContact O-ND2 3.1Å; E1572-N1575 PolarHBondContact O-N 3.3Å; K1573-N1575 VanDerWaalsContact C-N 3.33Å; K1573-N1575 PolarHBondContact O-N 3.43Å; N1575-S1578 PolarHBondContact O-N 3.34Å; N1575-A1579 WeakPolarHBondContact O-CB 3.09Å; N1575-A1579 PolarHBondContact O-N 3.22Å
1576L91.3Very high91.2Very high112 Ų11256.1 Ų56.159%0.58628%0.275SS*.Hα-helixtrans-60.5-50.8171.8-82.9157.9000111.3E1572 K1573 S1578 A1579 D1580E1572-L1576 PolarHBondContact O-N 2.95Å; K1573-L1576 PolarHBondContact O-N 3.45Å; L1576-S1578 VanDerWaalsContact C-N 3.29Å; L1576-S1578 PolarHBondContact O-N 3.21Å; L1576-A1579 WeakPolarHBondContact O-CB 3.44Å; L1576-A1579 PolarHBondContact O-N 2.82Å; L1576-D1580 PolarHBondContact O-N 3.43Å
1577H92.2Very high91.1Very high68 Ų6858.4 Ų58.432%0.31529%0.285SS..Hα-helixtrans-57.7-42.3178-167.4-172.7000111.5D1481 L1484 K1573 D1580 W1581D1481-H1577 IonicContact OD1-CE1 2.79Å; D1481-H1577 IonicContact OD1-CG 2.77Å; D1481-H1577 IonicContact OD1-ND1 3.01Å; D1481-H1577 PolarHBondContact OD1-ND1 3.14Å; L1484-H1577 HydrophobicContact CD2-CB 3.81Å; K1573-H1577 WeakPolarHBondContact O-CB 3.35Å; K1573-H1577 PolarHBondContact O-N 3.4Å; H1577-D1580 PolarHBondContact O-N 2.85Å; H1577-W1581 WeakPolarHBondContact O-CB 3.37Å; H1577-W1581 PolarHBondContact O-N 3.25Å
1578S93.8Very high90.9Very high2 Ų258.7 Ų58.71%0.01429%0.287CS..Hα-helixtrans-67.3-32.7175.5-177.90000113.5H1504 K1508 L1574 N1575 L1576 Q1582H1504-S1578 PolarHBondContact CE1-OG 3.37Å; H1504-S1578 PolarHBondContact NE2-O 2.87Å; K1508-S1578 VanDerWaalsContact CE-O 3.27Å; K1508-S1578 WeakPolarHBondContact CE-O 3.44Å; K1508-S1578 WeakPolarHBondContact CE-OG 3.48Å; K1508-S1578 WeakPolarHBondContact CG-OG 3.28Å; K1508-S1578 PolarHBondContact NZ-O 3.07Å; L1574-S1578 WeakPolarHBondContact O-CB 3.39Å; L1574-S1578 PolarHBondContact O-N 3.41Å; N1575-S1578 PolarHBondContact O-N 3.34Å; L1576-S1578 VanDerWaalsContact C-N 3.29Å; L1576-S1578 PolarHBondContact O-N 3.21Å; S1578-Q1582 PolarHBondContact O-N 3.37Å
1579A90.4Very high90.8Very high43 Ų4356.8 Ų56.836%0.35528%0.277SS..Hα-helixtrans-71.3-43.4173.600000111.8N1575 L1576 Q1582 R1583N1575-A1579 WeakPolarHBondContact O-CB 3.09Å; N1575-A1579 PolarHBondContact O-N 3.22Å; L1576-A1579 WeakPolarHBondContact O-CB 3.44Å; L1576-A1579 PolarHBondContact O-N 2.82Å; A1579-Q1582 PolarHBondContact O-N 3.16Å; A1579-R1583 PolarHBondContact O-N 2.87Å; A1579-R1583 VanDerWaalsContact O-N 3.09Å
1580D89.8Confident90.6Very high61 Ų6158.2 Ų58.233%0.32628%0.278SS..Hα-helixtrans-65-43177.6-72.8-24.4000112.3L1576 H1577 Q1582 R1583 K1584L1576-D1580 PolarHBondContact O-N 3.43Å; H1577-D1580 PolarHBondContact O-N 2.85Å; D1580-Q1582 VanDerWaalsContact C-N 3.35Å; D1580-Q1582 PolarHBondContact O-N 3.41Å; D1580-R1583 WeakPolarHBondContact O-CB 3.47Å; D1580-R1583 PolarHBondContact O-N 2.89Å; D1580-R1583 IonicContact OD1-CZ 2.61Å; D1580-R1583 IonicContact OD1-NH1 3.09Å; D1580-R1583 PolarHBondContact OD1-NH1 2.74Å; D1580-R1583 IonicContact OD1-NH2 2.84Å; D1580-R1583 PolarHBondContact OD1-NH2 3.39Å; D1580-K1584 PolarHBondContact O-N 3.43Å; D1580-K1584 VanDerWaalsContact O-N 3.11Å
1581W92.8Very high90.4Very high25 Ų2557.9 Ų57.910%0.09528%0.275CS..Hα-helixtrans-62.8-40.8177.4-176.2-128.9000112.4L1484 Q1487 A1488 I1490 H1504 H1577 R1583 K1584 I1585L1484-W1581 HydrophobicContact CD1-CB 4.21Å; L1484-W1581 HydrophobicContact CD1-CG 4.05Å; Q1487-W1581 HydrophobicContact CB-CZ2 3.85Å; Q1487-W1581 WeakPolarHBondContact O-CZ2 3.38Å; A1488-W1581 HydrophobicContact CB-CH2 4.34Å; I1490-W1581 HydrophobicContact CD1-CH2 4.21Å; I1490-W1581 HydrophobicContact CD1-CZ3 3.86Å; I1490-W1581 HydrophobicContact CG1-CH2 3.35Å; I1490-W1581 HydrophobicContact CG1-CZ2 4.39Å; I1490-W1581 HydrophobicContact CG1-CZ3 3.49Å; I1490-W1581 VanDerWaalsContact CG1-CZ3 3.49Å; H1504-W1581 AromaticContact CD2-CD1 3.62Å; H1504-W1581 AromaticContact CE1-CD1 3.72Å; H1504-W1581 AromaticContact CG-CD1 3.63Å; H1504-W1581 AromaticContact ND1-CD1 3.72Å; H1504-W1581 AromaticContact NE2-CD1 3.67Å; H1577-W1581 WeakPolarHBondContact O-CB 3.37Å; H1577-W1581 PolarHBondContact O-N 3.25Å; W1581-R1583 PolarHBondContact O-N 3.42Å; W1581-K1584 HydrophobicContact CE3-CD 4.46Å; W1581-K1584 PolarHBondContact O-N 3.21Å; W1581-I1585 HydrophobicContact CD2-CD1 4.16Å; W1581-I1585 HydrophobicContact CD2-CG1 4.41Å; W1581-I1585 HydrophobicContact CG-CD1 4.29Å; W1581-I1585 HydrophobicContact CZ2-CD1 4.1Å; W1581-I1585 HydrophobicContact CZ2-CG1 4.38Å; W1581-I1585 WeakPolarHBondContact O-CG1 3.39Å; W1581-I1585 PolarHBondContact O-N 3.14Å
1582Q93.1Very high90.3Very high24 Ų2457.4 Ų57.411%0.11227%0.273CS..Hα-helixtrans-61.3-44.5173.6-176.87960.900111.8N1501 H1504 K1508 S1578 A1579 D1580 K1584 I1585 D1586N1501-Q1582 PolarHBondContact OD1-NE2 2.82Å; H1504-Q1582 PolarHBondContact CD2-OE1 3Å; K1508-Q1582 VanDerWaalsContact NZ-CG 3.26Å; K1508-Q1582 VanDerWaalsContact NZ-OE1 3.14Å; S1578-Q1582 PolarHBondContact O-N 3.37Å; A1579-Q1582 PolarHBondContact O-N 3.16Å; D1580-Q1582 VanDerWaalsContact C-N 3.35Å; D1580-Q1582 PolarHBondContact O-N 3.41Å; Q1582-K1584 VanDerWaalsContact C-N 3.31Å; Q1582-K1584 PolarHBondContact O-N 2.91Å; Q1582-I1585 PolarHBondContact O-N 3.41Å; Q1582-D1586 VanDerWaalsContact CG-OD2 3.31Å; Q1582-D1586 WeakPolarHBondContact CG-OD2 3.22Å; Q1582-D1586 PolarHBondContact NE2-OD1 2.97Å; Q1582-D1586 PolarHBondContact NE2-OD2 3Å; Q1582-D1586 VanDerWaalsContact NE2-OD2 3.11Å; Q1582-D1586 WeakPolarHBondContact O-CB 3.41Å; Q1582-D1586 VanDerWaalsContact O-CG 3.31Å; Q1582-D1586 PolarHBondContact O-N 3.45Å
1583R88Confident90.1Very high141 Ų14157 Ų5753%0.53227%0.267SS..Hα-helixtrans-57.8-46.2179.8-164.5-170.8-50.9112.112.3110.9A1579 D1580 W1581 D1586 E1587A1579-R1583 PolarHBondContact O-N 2.87Å; A1579-R1583 VanDerWaalsContact O-N 3.09Å; D1580-R1583 WeakPolarHBondContact O-CB 3.47Å; D1580-R1583 PolarHBondContact O-N 2.89Å; D1580-R1583 IonicContact OD1-CZ 2.61Å; D1580-R1583 IonicContact OD1-NH1 3.09Å; D1580-R1583 PolarHBondContact OD1-NH1 2.74Å; D1580-R1583 IonicContact OD1-NH2 2.84Å; D1580-R1583 PolarHBondContact OD1-NH2 3.39Å; W1581-R1583 PolarHBondContact O-N 3.42Å; R1583-D1586 PolarHBondContact O-N 3.35Å; R1583-E1587 VanDerWaalsContact O-CB 3.23Å; R1583-E1587 WeakPolarHBondContact O-CB 3.19Å; R1583-E1587 PolarHBondContact O-N 3.11Å
1584K88.3Confident90.1Very high117 Ų11756.2 Ų56.251%0.50927%0.265SS..Hα-helixtrans-63.5-41.3177.2-66.8179.9178.2-178.50113I1490 D1580 W1581 Q1582 T1588I1490-K1584 HydrophobicContact CD1-CB 3.81Å; D1580-K1584 PolarHBondContact O-N 3.43Å; D1580-K1584 VanDerWaalsContact O-N 3.11Å; W1581-K1584 HydrophobicContact CE3-CD 4.46Å; W1581-K1584 PolarHBondContact O-N 3.21Å; Q1582-K1584 VanDerWaalsContact C-N 3.31Å; Q1582-K1584 PolarHBondContact O-N 2.91Å; K1584-T1588 VanDerWaalsContact O-CB 3.31Å; K1584-T1588 WeakPolarHBondContact O-CB 3.3Å; K1584-T1588 PolarHBondContact O-N 3.02Å; K1584-T1588 PolarHBondContact O-OG1 3.34Å
1585I90.7Very high90.1Very high0 Ų056.4 Ų56.40%027%0.266CS..Hα-helixtrans-62.3-48.1175.9-77.2174.4000111V1497 Q1500 N1501 H1504 W1581 Q1582 T1588 L1589V1497-I1585 HydrophobicContact CG1-CG2 4.17Å; Q1500-I1585 HydrophobicContact CB-CD1 4.2Å; N1501-I1585 HydrophobicContact CB-CG2 3.48Å; N1501-I1585 VanDerWaalsContact CB-CG2 3.48Å; H1504-I1585 HydrophobicContact CB-CD1 4.16Å; W1581-I1585 HydrophobicContact CD2-CD1 4.16Å; W1581-I1585 HydrophobicContact CD2-CG1 4.41Å; W1581-I1585 HydrophobicContact CG-CD1 4.29Å; W1581-I1585 HydrophobicContact CZ2-CD1 4.1Å; W1581-I1585 HydrophobicContact CZ2-CG1 4.38Å; W1581-I1585 WeakPolarHBondContact O-CG1 3.39Å; W1581-I1585 PolarHBondContact O-N 3.14Å; Q1582-I1585 PolarHBondContact O-N 3.41Å; I1585-T1588 PolarHBondContact O-N 2.79Å; I1585-L1589 HydrophobicContact CG2-CD1 3.94Å; I1585-L1589 WeakPolarHBondContact O-CB 3.42Å; I1585-L1589 WeakPolarHBondContact O-CG 3.5Å; I1585-L1589 PolarHBondContact O-N 3.39Å
1586D89.2Confident90Very high69 Ų6957 Ų5737%0.36927%0.267SS..Hα-helixtrans-69.9-40.3-176.3-64.8-22.4000111.3N1501 Q1582 R1583 L1589 E1590N1501-D1586 PolarHBondContact ND2-OD1 3.48Å; Q1582-D1586 VanDerWaalsContact CG-OD2 3.31Å; Q1582-D1586 WeakPolarHBondContact CG-OD2 3.22Å; Q1582-D1586 PolarHBondContact NE2-OD1 2.97Å; Q1582-D1586 PolarHBondContact NE2-OD2 3Å; Q1582-D1586 VanDerWaalsContact NE2-OD2 3.11Å; Q1582-D1586 WeakPolarHBondContact O-CB 3.41Å; Q1582-D1586 VanDerWaalsContact O-CG 3.31Å; Q1582-D1586 PolarHBondContact O-N 3.45Å; R1583-D1586 PolarHBondContact O-N 3.35Å; D1586-L1589 PolarHBondContact O-N 3.43Å; D1586-E1590 PolarHBondContact O-N 3.46Å; D1586-E1590 VanDerWaalsContact O-N 3.1Å
1587E87.7Confident89.9Confident109 Ų10957.1 Ų57.151%0.50926%0.264SS..Hα-helixtrans-61.4-41.6172.9-177.8174-162.700112.2R1583 R1591R1583-E1587 VanDerWaalsContact O-CB 3.23Å; R1583-E1587 WeakPolarHBondContact O-CB 3.19Å; R1583-E1587 PolarHBondContact O-N 3.11Å; E1587-R1591 PolarHBondContact O-N 3.21Å; E1587-R1591 VanDerWaalsContact O-N 3.12Å
1588T88.6Confident89.8Confident6 Ų654.4 Ų54.44%0.03725%0.253CS..Hα-helixtrans-67.9-39.9176.3-57.10000112.1I1490 V1497 K1584 I1585 E1590 R1591 L1592 I1663I1490-T1588 HydrophobicContact CG2-CG2 3.76Å; V1497-T1588 HydrophobicContact CG1-CG2 4.23Å; V1497-T1588 HydrophobicContact CG2-CG2 4.09Å; K1584-T1588 VanDerWaalsContact O-CB 3.31Å; K1584-T1588 WeakPolarHBondContact O-CB 3.3Å; K1584-T1588 PolarHBondContact O-N 3.02Å; K1584-T1588 PolarHBondContact O-OG1 3.34Å; I1585-T1588 PolarHBondContact O-N 2.79Å; T1588-E1590 VanDerWaalsContact C-N 3.34Å; T1588-E1590 PolarHBondContact O-N 3.3Å; T1588-R1591 PolarHBondContact O-N 3.45Å; T1588-L1592 HydrophobicContact CG2-CD1 3.67Å; T1588-L1592 HydrophobicContact CG2-CG 4.17Å; T1588-L1592 WeakPolarHBondContact O-CB 3.47Å; T1588-L1592 WeakPolarHBondContact O-CG 3.31Å; T1588-L1592 PolarHBondContact O-N 3.03Å; T1588-I1663 HydrophobicContact CG2-CD1 3.66Å; T1588-I1663 HydrophobicContact CG2-CG1 4.31Å; T1588-I1663 HydrophobicContact CG2-CG2 4.26Å; T1588-I1663 WeakPolarHBondContact OG1-CD1 3.3Å
1589L88.6Confident89.8Confident12 Ų1254.7 Ų54.76%0.06326%0.255CS..Hα-helixtrans-63.1-40.1178-84.3165.3000112.5F1494 V1497 Q1498 N1501 I1585 D1586 R1593F1494-L1589 HydrophobicContact CD2-CD2 3.7Å; F1494-L1589 HydrophobicContact CE2-CD2 3.6Å; F1494-L1589 HydrophobicContact CG-CD2 4.28Å; F1494-L1589 HydrophobicContact CZ-CD2 4.1Å; V1497-L1589 HydrophobicContact CB-CD2 4Å; V1497-L1589 HydrophobicContact CB-CG 4.17Å; V1497-L1589 HydrophobicContact CG1-CD1 4.3Å; V1497-L1589 HydrophobicContact CG1-CD2 4.13Å; V1497-L1589 HydrophobicContact CG1-CG 3.72Å; Q1498-L1589 HydrophobicContact CB-CD2 4.14Å; N1501-L1589 HydrophobicContact CB-CD1 3.99Å; N1501-L1589 WeakPolarHBondContact ND2-CD1 3.33Å; I1585-L1589 HydrophobicContact CG2-CD1 3.94Å; I1585-L1589 WeakPolarHBondContact O-CB 3.42Å; I1585-L1589 WeakPolarHBondContact O-CG 3.5Å; I1585-L1589 PolarHBondContact O-N 3.39Å; D1586-L1589 PolarHBondContact O-N 3.43Å; L1589-R1593 WeakPolarHBondContact O-CB 3.41Å; L1589-R1593 PolarHBondContact O-N 3.43Å
1590E86.5Confident89.7Confident107 Ų10756.7 Ų56.750%0.526%0.26SS..Hα-helixtrans-67-47.4176.8-161.266.8179.600110.7D1586 T1588 L1592 R1593 E1594D1586-E1590 PolarHBondContact O-N 3.46Å; D1586-E1590 VanDerWaalsContact O-N 3.1Å; T1588-E1590 VanDerWaalsContact C-N 3.34Å; T1588-E1590 PolarHBondContact O-N 3.3Å; E1590-L1592 VanDerWaalsContact C-N 3.33Å; E1590-L1592 PolarHBondContact O-N 2.85Å; E1590-R1593 WeakPolarHBondContact O-CB 3.47Å; E1590-R1593 PolarHBondContact O-N 3.32Å; E1590-R1593 VanDerWaalsContact O-N 3.08Å; E1590-R1593 IonicContact OE2-NE 3.27Å; E1590-E1594 WeakPolarHBondContact O-CG 3.5Å; E1590-E1594 PolarHBondContact O-N 3.44Å
1591R87.3Confident89.7Confident47 Ų4758.5 Ų58.518%0.17727%0.266CS..Hα-helixtrans-65.1-34.2-180-152.580.6-171.8118-5.2113.3E1587 T1588 E1594 L1595 L1654 Q1657 L1658E1587-R1591 PolarHBondContact O-N 3.21Å; E1587-R1591 VanDerWaalsContact O-N 3.12Å; T1588-R1591 PolarHBondContact O-N 3.45Å; R1591-E1594 WeakPolarHBondContact CD-OE2 3.47Å; R1591-E1594 IonicContact CZ-OE2 3.66Å; R1591-E1594 IonicContact NE-OE2 2.84Å; R1591-E1594 VanDerWaalsContact NH1-CD 3.3Å; R1591-E1594 IonicContact NH1-OE1 3.68Å; R1591-E1594 IonicContact NH1-OE2 2.61Å; R1591-E1594 PolarHBondContact NH1-OE2 2.99Å; R1591-L1595 PolarHBondContact O-N 2.89Å; R1591-L1595 VanDerWaalsContact O-N 3.1Å; R1591-L1654 VanDerWaalsContact CZ-CD2 3.42Å; R1591-Q1657 VanDerWaalsContact NH2-CD 3.33Å; R1591-L1658 HydrophobicContact CB-CD2 3.84Å; R1591-L1658 HydrophobicContact CB-CG 4.32Å; R1591-L1658 HydrophobicContact CG-CD1 4.45Å; R1591-L1658 HydrophobicContact CG-CD2 3.93Å; R1591-L1658 HydrophobicContact CG-CG 3.89Å
1592L90.8Very high89.7Confident5 Ų557.4 Ų57.43%0.02626%0.263CS..Hα-helixtrans-71.3-33.8172.6-76.3170.4000112.5V1497 T1588 E1590 Q1596 L1658 L1665V1497-L1592 HydrophobicContact CB-CD1 4.47Å; V1497-L1592 HydrophobicContact CG2-CD1 3.84Å; T1588-L1592 HydrophobicContact CG2-CD1 3.67Å; T1588-L1592 HydrophobicContact CG2-CG 4.17Å; T1588-L1592 WeakPolarHBondContact O-CB 3.47Å; T1588-L1592 WeakPolarHBondContact O-CG 3.31Å; T1588-L1592 PolarHBondContact O-N 3.03Å; E1590-L1592 VanDerWaalsContact C-N 3.33Å; E1590-L1592 PolarHBondContact O-N 2.85Å; L1592-Q1596 PolarHBondContact O-N 2.83Å; L1592-L1658 HydrophobicContact CD2-CD1 3.84Å; L1592-L1658 HydrophobicContact CD2-CD2 4.3Å; L1592-L1658 HydrophobicContact CG-CD1 4.39Å; L1592-L1658 HydrophobicContact CG-CD2 4.19Å; L1592-L1665 HydrophobicContact CD2-CD2 4.08Å
1593R89Confident89.8Confident99 Ų9957.7 Ų57.737%0.37427%0.265SS..Hα-helixtrans-64.7-49.9172.5173.5-170.4-56.4-68.8-5110.9F1494 L1589 E1590 L1595 Q1596 E1597F1494-R1593 HydrophobicContact CE2-CB 4.36Å; L1589-R1593 WeakPolarHBondContact O-CB 3.41Å; L1589-R1593 PolarHBondContact O-N 3.43Å; E1590-R1593 WeakPolarHBondContact O-CB 3.47Å; E1590-R1593 PolarHBondContact O-N 3.32Å; E1590-R1593 VanDerWaalsContact O-N 3.08Å; E1590-R1593 IonicContact OE2-NE 3.27Å; R1593-L1595 VanDerWaalsContact C-N 3.28Å; R1593-L1595 PolarHBondContact O-N 3.23Å; R1593-Q1596 WeakPolarHBondContact O-CB 3.46Å; R1593-Q1596 PolarHBondContact O-N 3.33Å; R1593-Q1596 VanDerWaalsContact O-N 3.09Å; R1593-E1597 WeakPolarHBondContact CD-OE1 3.48Å; R1593-E1597 HydrophobicContact CG-CG 4.35Å; R1593-E1597 WeakPolarHBondContact CG-OE1 3.46Å; R1593-E1597 WeakPolarHBondContact O-CG 3.48Å; R1593-E1597 PolarHBondContact O-N 2.96Å
1594E89.8Confident89.9Confident76 Ų7655.8 Ų55.836%0.35526%0.264SS..Hα-helixtrans-58.7-40.5177.8-68.1171.4122.500111.4E1590 R1591 A1598 L1654E1590-E1594 WeakPolarHBondContact O-CG 3.5Å; E1590-E1594 PolarHBondContact O-N 3.44Å; R1591-E1594 WeakPolarHBondContact CD-OE2 3.47Å; R1591-E1594 IonicContact CZ-OE2 3.66Å; R1591-E1594 IonicContact NE-OE2 2.84Å; R1591-E1594 VanDerWaalsContact NH1-CD 3.3Å; R1591-E1594 IonicContact NH1-OE1 3.68Å; R1591-E1594 IonicContact NH1-OE2 2.61Å; R1591-E1594 PolarHBondContact NH1-OE2 2.99Å; E1594-A1598 VanDerWaalsContact O-CB 3.32Å; E1594-A1598 WeakPolarHBondContact O-CB 3.47Å; E1594-A1598 PolarHBondContact O-N 3.31Å; E1594-L1654 WeakPolarHBondContact O-CD1 3.27Å
1595L92.3Very high89.9Confident5 Ų553.1 Ų53.13%0.02625%0.253CS..Hα-helixtrans-60.9-46.1173.3178.364.4000111.8R1591 R1593 T1599 V1651 L1654 A1655 L1658 L1665 L1673R1591-L1595 PolarHBondContact O-N 2.89Å; R1591-L1595 VanDerWaalsContact O-N 3.1Å; R1593-L1595 VanDerWaalsContact C-N 3.28Å; R1593-L1595 PolarHBondContact O-N 3.23Å; L1595-T1599 WeakPolarHBondContact O-CB 3.47Å; L1595-T1599 PolarHBondContact O-N 3.32Å; L1595-T1599 PolarHBondContact O-OG1 3.3Å; L1595-V1651 HydrophobicContact CD1-CG1 4.06Å; L1595-L1654 HydrophobicContact CB-CB 4.37Å; L1595-L1654 HydrophobicContact CD1-CB 3.85Å; L1595-L1654 HydrophobicContact CD1-CD1 4.47Å; L1595-A1655 HydrophobicContact CD1-CB 4.27Å; L1595-L1658 HydrophobicContact CB-CD1 4.25Å; L1595-L1658 HydrophobicContact CD2-CD1 3.77Å; L1595-L1665 HydrophobicContact CD2-CD1 4.47Å; L1595-L1665 HydrophobicContact CD2-CD2 3.8Å; L1595-L1673 HydrophobicContact CD1-CD1 4.39Å; L1595-L1673 HydrophobicContact CD2-CD1 4.46Å
1596Q89.4Confident89.9Confident69 Ų6953.1 Ų53.132%0.32225%0.253SS..Hα-helixtrans-61.9-49.2178.7-176.662.950.100111.3L1592 R1593 A1598 T1599 D1600L1592-Q1596 PolarHBondContact O-N 2.83Å; R1593-Q1596 WeakPolarHBondContact O-CB 3.46Å; R1593-Q1596 PolarHBondContact O-N 3.33Å; R1593-Q1596 VanDerWaalsContact O-N 3.09Å; Q1596-A1598 PolarHBondContact O-N 3.17Å; Q1596-T1599 WeakPolarHBondContact O-CB 3.36Å; Q1596-T1599 PolarHBondContact O-N 2.76Å; Q1596-D1600 PolarHBondContact NE2-OD1 2.84Å; Q1596-D1600 PolarHBondContact NE2-OD2 3.33Å; Q1596-D1600 PolarHBondContact O-N 2.95Å
1597E90Very high89.9Confident115 Ų11556.8 Ų56.854%0.53726%0.262SS..Hα-helixtrans-62.2-43.1-178.7-70.5175.2-167.200111.9R1593 D1600 E1601R1593-E1597 WeakPolarHBondContact CD-OE1 3.48Å; R1593-E1597 HydrophobicContact CG-CG 4.35Å; R1593-E1597 WeakPolarHBondContact CG-OE1 3.46Å; R1593-E1597 WeakPolarHBondContact O-CG 3.48Å; R1593-E1597 PolarHBondContact O-N 2.96Å; E1597-D1600 PolarHBondContact O-N 3.49Å; E1597-E1601 WeakPolarHBondContact O-CB 3.35Å; E1597-E1601 PolarHBondContact O-N 2.64Å
1598A90.8Very high89.9Confident10 Ų1057 Ų578%0.08326%0.262CS..Hα-helixtrans-69.1-32.3175.600000113.2E1594 Q1596 L1602 V1651 L1654E1594-A1598 VanDerWaalsContact O-CB 3.32Å; E1594-A1598 WeakPolarHBondContact O-CB 3.47Å; E1594-A1598 PolarHBondContact O-N 3.31Å; Q1596-A1598 PolarHBondContact O-N 3.17Å; A1598-L1602 WeakPolarHBondContact O-CB 3.45Å; A1598-L1602 PolarHBondContact O-N 3.18Å; A1598-V1651 HydrophobicContact CB-CG2 3.7Å; A1598-V1651 VanDerWaalsContact O-CG2 3.32Å; A1598-V1651 WeakPolarHBondContact O-CG2 3.35Å; A1598-L1654 HydrophobicContact CB-CD1 3.6Å
1599T92.1Very high89.8Confident9 Ų956.9 Ų56.96%0.05526%0.263CS..Hα-helixtrans-66.5-46.4175.1-63.50000110.6L1595 Q1596 L1602 D1603 T1672 L1676L1595-T1599 WeakPolarHBondContact O-CB 3.47Å; L1595-T1599 PolarHBondContact O-N 3.32Å; L1595-T1599 PolarHBondContact O-OG1 3.3Å; Q1596-T1599 WeakPolarHBondContact O-CB 3.36Å; Q1596-T1599 PolarHBondContact O-N 2.76Å; T1599-L1602 PolarHBondContact O-N 3.29Å; T1599-D1603 PolarHBondContact O-N 3.01Å; T1599-T1672 HydrophobicContact CG2-CG2 3.58Å; T1599-L1676 HydrophobicContact CG2-CD1 3.54Å
1600D89Confident89.9Confident84 Ų8459 Ų5945%0.44927%0.272SS..Hα-helixtrans-67.2-37.8178.6-67.1-29.9000111.8Q1596 E1597 D1603 L1604Q1596-D1600 PolarHBondContact NE2-OD1 2.84Å; Q1596-D1600 PolarHBondContact NE2-OD2 3.33Å; Q1596-D1600 PolarHBondContact O-N 2.95Å; E1597-D1600 PolarHBondContact O-N 3.49Å; D1600-D1603 PolarHBondContact O-N 3.43Å; D1600-L1604 WeakPolarHBondContact O-CB 3.42Å; D1600-L1604 PolarHBondContact O-N 2.94Å
1601E90.8Very high89.9Confident99 Ų9959 Ų5946%0.46328%0.28SS..Hα-helixtrans-64-41.8173.6-169.4-174.9177.800112E1597 K1605E1597-E1601 WeakPolarHBondContact O-CB 3.35Å; E1597-E1601 PolarHBondContact O-N 2.64Å; E1601-K1605 HydrophobicContact CG-CD 4.14Å; E1601-K1605 WeakPolarHBondContact O-CG 3.33Å; E1601-K1605 PolarHBondContact O-N 3.38Å; E1601-K1605 VanDerWaalsContact O-N 3.07Å; E1601-K1605 WeakPolarHBondContact OE1-CE 3.2Å; E1601-K1605 IonicContact OE1-NZ 2.63Å; E1601-K1605 PolarHBondContact OE1-NZ 3.32Å
1602L92.8Very high89.8Confident3 Ų360 Ų602%0.01629%0.287CS..Hα-helixtrans-67.1-42.5177.117759.1000112A1598 T1599 K1605 L1606 L1644 N1647 V1648 V1651 L1676A1598-L1602 WeakPolarHBondContact O-CB 3.45Å; A1598-L1602 PolarHBondContact O-N 3.18Å; T1599-L1602 PolarHBondContact O-N 3.29Å; L1602-K1605 PolarHBondContact O-N 3.44Å; L1602-L1606 HydrophobicContact CD1-CD1 3.93Å; L1602-L1606 HydrophobicContact CD1-CG 3.98Å; L1602-L1606 HydrophobicContact CG-CD1 3.97Å; L1602-L1606 HydrophobicContact CG-CG 4.45Å; L1602-L1606 WeakPolarHBondContact O-CB 3.38Å; L1602-L1606 WeakPolarHBondContact O-CG 3.32Å; L1602-L1606 PolarHBondContact O-N 3.12Å; L1602-L1644 HydrophobicContact CD1-CD2 4.08Å; L1602-N1647 HydrophobicContact CD1-CB 4.09Å; L1602-V1648 HydrophobicContact CD1-CG2 3.73Å; L1602-V1648 HydrophobicContact CD2-CB 4.49Å; L1602-V1648 HydrophobicContact CD2-CG2 3.85Å; L1602-V1648 HydrophobicContact CG-CG2 4.45Å; L1602-V1651 HydrophobicContact CB-CG2 4.32Å; L1602-V1651 HydrophobicContact CD2-CB 4.32Å; L1602-V1651 HydrophobicContact CD2-CG2 4.03Å; L1602-L1676 HydrophobicContact CB-CD1 4.41Å; L1602-L1676 HydrophobicContact CD2-CB 4.01Å; L1602-L1676 HydrophobicContact CD2-CD1 4.11Å; L1602-L1676 HydrophobicContact CG-CB 4.43Å; L1602-L1676 HydrophobicContact CG-CD1 4.28Å
1603D93.4Very high89.5Confident29 Ų2963.7 Ų63.716%0.15530%0.303CS..Hα-helixtrans-59.6-47.5174.7-174.236000111.2T1599 D1600 K1605 L1606 R1607 L1676 R1679T1599-D1603 PolarHBondContact O-N 3.01Å; D1600-D1603 PolarHBondContact O-N 3.43Å; D1603-K1605 PolarHBondContact O-N 3.09Å; D1603-L1606 PolarHBondContact O-N 2.98Å; D1603-R1607 VanDerWaalsContact CG-NE 3.34Å; D1603-R1607 WeakPolarHBondContact O-CG 3.41Å; D1603-R1607 PolarHBondContact O-N 2.85Å; D1603-R1607 IonicContact OD1-CZ 2.79Å; D1603-R1607 IonicContact OD1-NE 3.3Å; D1603-R1607 PolarHBondContact OD1-NE 3.13Å; D1603-R1607 IonicContact OD1-NH2 2.72Å; D1603-R1607 IonicContact OD2-CZ 2.72Å; D1603-R1607 IonicContact OD2-NE 3.24Å; D1603-R1607 PolarHBondContact OD2-NE 2.84Å; D1603-R1607 IonicContact OD2-NH2 3.8Å; D1603-R1607 PolarHBondContact OD2-NH2 3.39Å; D1603-L1676 HydrophobicContact CB-CD2 3.71Å; D1603-R1679 IonicContact OD1-CZ 3.84Å; D1603-R1679 VanDerWaalsContact OD1-CZ 3.23Å; D1603-R1679 IonicContact OD1-NH1 3.99Å; D1603-R1679 PolarHBondContact OD1-NH1 3.44Å; D1603-R1679 IonicContact OD1-NH2 2.64Å; D1603-R1679 PolarHBondContact OD1-NH2 3.49Å
1604L90.4Very high89.2Confident101 Ų10162.3 Ų62.353%0.52932%0.32SS..Hα-helixtrans-58.7-46.3179.3-179.961.8000111.9D1600 R1607 Q1608D1600-L1604 WeakPolarHBondContact O-CB 3.42Å; D1600-L1604 PolarHBondContact O-N 2.94Å; L1604-R1607 PolarHBondContact O-N 2.83Å; L1604-Q1608 WeakPolarHBondContact O-CG 3.27Å; L1604-Q1608 PolarHBondContact O-N 3.26Å; L1604-Q1608 VanDerWaalsContact O-N 3.15Å
1605K88.2Confident89Confident62 Ų6262.7 Ų62.727%0.2733%0.331SS..Hα-helixtrans-68.2-37.2178.6-69.2167.7168.4171.80112.3E1601 L1602 D1603 Q1608 A1609 L1644 N1647E1601-K1605 HydrophobicContact CG-CD 4.14Å; E1601-K1605 WeakPolarHBondContact O-CG 3.33Å; E1601-K1605 PolarHBondContact O-N 3.38Å; E1601-K1605 VanDerWaalsContact O-N 3.07Å; E1601-K1605 WeakPolarHBondContact OE1-CE 3.2Å; E1601-K1605 IonicContact OE1-NZ 2.63Å; E1601-K1605 PolarHBondContact OE1-NZ 3.32Å; L1602-K1605 PolarHBondContact O-N 3.44Å; D1603-K1605 PolarHBondContact O-N 3.09Å; K1605-Q1608 PolarHBondContact O-N 3.21Å; K1605-A1609 PolarHBondContact O-N 2.96Å; K1605-L1644 HydrophobicContact CB-CD2 3.37Å; K1605-L1644 HydrophobicContact CD-CD2 3.93Å; K1605-L1644 HydrophobicContact CG-CD2 4.24Å; K1605-N1647 PolarHBondContact NZ-ND2 2.88Å; K1605-N1647 PolarHBondContact NZ-OD1 2.84Å
1606L91.8Very high88.7Confident0 Ų065.2 Ų65.20%034%0.34CS..Hα-helixtrans-64.3-47.2174.1-77.8172.1000111.4L1602 D1603 Q1608 A1609 E1610 L1644 L1676 R1679 W1680 L1683L1602-L1606 HydrophobicContact CD1-CD1 3.93Å; L1602-L1606 HydrophobicContact CD1-CG 3.98Å; L1602-L1606 HydrophobicContact CG-CD1 3.97Å; L1602-L1606 HydrophobicContact CG-CG 4.45Å; L1602-L1606 WeakPolarHBondContact O-CB 3.38Å; L1602-L1606 WeakPolarHBondContact O-CG 3.32Å; L1602-L1606 PolarHBondContact O-N 3.12Å; D1603-L1606 PolarHBondContact O-N 2.98Å; L1606-Q1608 VanDerWaalsContact C-N 3.28Å; L1606-Q1608 PolarHBondContact O-N 2.81Å; L1606-A1609 PolarHBondContact O-N 3.44Å; L1606-A1609 VanDerWaalsContact O-N 3.09Å; L1606-E1610 WeakPolarHBondContact O-CB 3.37Å; L1606-E1610 VanDerWaalsContact O-CG 3.29Å; L1606-E1610 WeakPolarHBondContact O-CG 3.26Å; L1606-E1610 PolarHBondContact O-N 3.34Å; L1606-L1644 HydrophobicContact CD2-CD1 4.34Å; L1606-L1676 HydrophobicContact CD1-CB 4.22Å; L1606-L1676 HydrophobicContact CD1-CD2 3.89Å; L1606-R1679 HydrophobicContact CD1-CB 4.41Å; L1606-W1680 HydrophobicContact CD2-CB 4.03Å; L1606-W1680 HydrophobicContact CD2-CE3 4Å; L1606-L1683 HydrophobicContact CD2-CD2 4.11Å
1607R88.9Confident88.3Confident145 Ų14567.2 Ų67.255%0.54735%0.35SS..Hα-helixtrans-57.2-40176.9-72-175.4-164.2-138.58.4112.6D1603 L1604 A1609 E1610 V1611D1603-R1607 VanDerWaalsContact CG-NE 3.34Å; D1603-R1607 WeakPolarHBondContact O-CG 3.41Å; D1603-R1607 PolarHBondContact O-N 2.85Å; D1603-R1607 IonicContact OD1-CZ 2.79Å; D1603-R1607 IonicContact OD1-NE 3.3Å; D1603-R1607 PolarHBondContact OD1-NE 3.13Å; D1603-R1607 IonicContact OD1-NH2 2.72Å; D1603-R1607 IonicContact OD2-CZ 2.72Å; D1603-R1607 IonicContact OD2-NE 3.24Å; D1603-R1607 PolarHBondContact OD2-NE 2.84Å; D1603-R1607 IonicContact OD2-NH2 3.8Å; D1603-R1607 PolarHBondContact OD2-NH2 3.39Å; L1604-R1607 PolarHBondContact O-N 2.83Å; R1607-A1609 PolarHBondContact O-N 3.45Å; R1607-E1610 WeakPolarHBondContact CA-OE2 3.32Å; R1607-E1610 PolarHBondContact N-OE2 3.39Å; R1607-E1610 PolarHBondContact O-N 3.38Å; R1607-V1611 VanDerWaalsContact O-CG2 3.32Å; R1607-V1611 WeakPolarHBondContact O-CG2 3.39Å; R1607-V1611 PolarHBondContact O-N 3.06Å
1608Q87.7Confident87.9Confident113 Ų11364.7 Ų64.753%0.52834%0.343SS..Hα-helixtrans-60.5-44.1176.4-72.8171.110.500111.9L1604 K1605 L1606 V1611 I1612L1604-Q1608 WeakPolarHBondContact O-CG 3.27Å; L1604-Q1608 PolarHBondContact O-N 3.26Å; L1604-Q1608 VanDerWaalsContact O-N 3.15Å; K1605-Q1608 PolarHBondContact O-N 3.21Å; L1606-Q1608 VanDerWaalsContact C-N 3.28Å; L1606-Q1608 PolarHBondContact O-N 2.81Å; Q1608-V1611 PolarHBondContact O-N 2.92Å; Q1608-I1612 WeakPolarHBondContact O-CG1 3.19Å; Q1608-I1612 PolarHBondContact O-N 2.94Å
1609A86Confident87.3Confident5 Ų565.5 Ų65.54%0.04135%0.347CS..Hα-helixtrans-72.5-34.4176.900000113.2K1605 L1606 R1607 V1611 I1612 K1613 I1641 L1683K1605-A1609 PolarHBondContact O-N 2.96Å; L1606-A1609 PolarHBondContact O-N 3.44Å; L1606-A1609 VanDerWaalsContact O-N 3.09Å; R1607-A1609 PolarHBondContact O-N 3.45Å; A1609-V1611 VanDerWaalsContact C-N 3.35Å; A1609-I1612 PolarHBondContact O-N 3.41Å; A1609-K1613 PolarHBondContact O-N 3.05Å; A1609-I1641 HydrophobicContact CB-CG2 3.81Å; A1609-L1683 HydrophobicContact CB-CD1 4.25Å; A1609-L1683 HydrophobicContact CB-CD2 3.54Å
1610E90.7Very high86.3Confident56 Ų5668.7 Ų68.726%0.26238%0.381SS..Hα-helixtrans-63.5-37.5173.6-71.5167.7148.200111.9L1606 R1607 K1613 G1614 R1679L1606-E1610 WeakPolarHBondContact O-CB 3.37Å; L1606-E1610 VanDerWaalsContact O-CG 3.29Å; L1606-E1610 WeakPolarHBondContact O-CG 3.26Å; L1606-E1610 PolarHBondContact O-N 3.34Å; R1607-E1610 WeakPolarHBondContact CA-OE2 3.32Å; R1607-E1610 PolarHBondContact N-OE2 3.39Å; R1607-E1610 PolarHBondContact O-N 3.38Å; E1610-K1613 WeakPolarHBondContact O-CB 3.48Å; E1610-K1613 PolarHBondContact O-N 2.93Å; E1610-G1614 PolarHBondContact O-N 2.68Å; E1610-R1679 WeakPolarHBondContact OE1-CB 3.27Å; E1610-R1679 IonicContact OE1-CZ 2.7Å; E1610-R1679 IonicContact OE1-NE 2.65Å; E1610-R1679 PolarHBondContact OE1-NE 3.3Å; E1610-R1679 IonicContact OE1-NH2 3.98Å; E1610-R1679 IonicContact OE2-CZ 2.71Å; E1610-R1679 IonicContact OE2-NE 2.67Å; E1610-R1679 PolarHBondContact OE2-NE 2.77Å; E1610-R1679 IonicContact OE2-NH2 2.6Å; E1610-R1679 PolarHBondContact OE2-NH2 3.08Å
1611V86.9Confident85.7Confident108 Ų10870.3 Ų70.366%0.65539%0.39SS*.Hα-helixtrans-63.3-40.5172.5167.50000111.6R1607 Q1608 A1609 G1614 S1615R1607-V1611 VanDerWaalsContact O-CG2 3.32Å; R1607-V1611 WeakPolarHBondContact O-CG2 3.39Å; R1607-V1611 PolarHBondContact O-N 3.06Å; Q1608-V1611 PolarHBondContact O-N 2.92Å; A1609-V1611 VanDerWaalsContact C-N 3.35Å; V1611-G1614 PolarHBondContact O-N 3.16Å; V1611-S1615 PolarHBondContact O-N 3.19Å
1612I84.8Confident85.1Confident67 Ų6766.3 Ų66.334%0.34437%0.372SS..Hα-helixtrans-64.7-43.3176.1-61168000110.4Q1608 A1609 G1614 S1615 W1616 L1637Q1608-I1612 WeakPolarHBondContact O-CG1 3.19Å; Q1608-I1612 PolarHBondContact O-N 2.94Å; A1609-I1612 PolarHBondContact O-N 3.41Å; I1612-G1614 VanDerWaalsContact C-N 3.31Å; I1612-G1614 PolarHBondContact O-N 3Å; I1612-S1615 WeakPolarHBondContact O-CB 3.36Å; I1612-S1615 PolarHBondContact O-N 3.41Å; I1612-S1615 VanDerWaalsContact O-N 3.13Å; I1612-S1615 PolarHBondContact O-OG 3.46Å; I1612-W1616 PolarHBondContact O-NE1 3.32Å; I1612-L1637 HydrophobicContact CB-CD1 4.26Å; I1612-L1637 HydrophobicContact CB-CD2 4.31Å; I1612-L1637 HydrophobicContact CD1-CD1 3.67Å; I1612-L1637 HydrophobicContact CG2-CD1 3.97Å; I1612-L1637 HydrophobicContact CG2-CD2 3.74Å; I1612-L1637 HydrophobicContact CG2-CG 4.43Å
1613K84.1Confident84.2Confident82 Ų8272.6 Ų72.636%0.35741%0.405SS..Hα-helixtrans-56.6-43.1171.6172.9-173.8168.9-175.60111.8A1609 E1610 S1615 W1616 L1683 A1686A1609-K1613 PolarHBondContact O-N 3.05Å; E1610-K1613 WeakPolarHBondContact O-CB 3.48Å; E1610-K1613 PolarHBondContact O-N 2.93Å; K1613-S1615 PolarHBondContact O-N 2.85Å; K1613-W1616 HydrophobicContact CB-CH2 4.45Å; K1613-W1616 HydrophobicContact CB-CZ3 4.41Å; K1613-W1616 HydrophobicContact CG-CE3 4.07Å; K1613-W1616 HydrophobicContact CG-CH2 4.42Å; K1613-W1616 HydrophobicContact CG-CZ3 3.95Å; K1613-W1616 WeakPolarHBondContact O-CB 3.49Å; K1613-W1616 PolarHBondContact O-N 2.85Å; K1613-L1683 HydrophobicContact CB-CD1 4.41Å; K1613-L1683 HydrophobicContact CD-CD1 4.38Å; K1613-A1686 HydrophobicContact CD-CB 3.82Å; K1613-A1686 VanDerWaalsContact CE-CB 3.49Å
1614G84.5Confident83.2Confident70 Ų7075 Ų7572%0.72242%0.417SS*.Hα-helixtrans-64-19.3177.700000114.8E1610 V1611 I1612 W1616E1610-G1614 PolarHBondContact O-N 2.68Å; V1611-G1614 PolarHBondContact O-N 3.16Å; I1612-G1614 VanDerWaalsContact C-N 3.31Å; I1612-G1614 PolarHBondContact O-N 3Å; G1614-W1616 VanDerWaalsContact C-N 3.33Å
1615S84Confident82.4Confident84 Ų8477.2 Ų77.259%0.58743%0.429SS*.THydrogen-bonded Turntrans-82-5.3176.6770000114.6V1611 I1612 K1613 Q1617V1611-S1615 PolarHBondContact O-N 3.19Å; I1612-S1615 WeakPolarHBondContact O-CB 3.36Å; I1612-S1615 PolarHBondContact O-N 3.41Å; I1612-S1615 VanDerWaalsContact O-N 3.13Å; I1612-S1615 PolarHBondContact O-OG 3.46Å; K1613-S1615 PolarHBondContact O-N 2.85Å; S1615-Q1617 PolarHBondContact O-N 2.91Å
1616W87.1Confident81.9Confident59 Ų5975.5 Ų75.522%0.22343%0.425CS..PPolyproline II helixtrans-75.4118.8-175.5-64.9-11.8000112.8I1612 K1613 G1614 V1634 L1637 V1687 R1690I1612-W1616 PolarHBondContact O-NE1 3.32Å; K1613-W1616 HydrophobicContact CB-CH2 4.45Å; K1613-W1616 HydrophobicContact CB-CZ3 4.41Å; K1613-W1616 HydrophobicContact CG-CE3 4.07Å; K1613-W1616 HydrophobicContact CG-CH2 4.42Å; K1613-W1616 HydrophobicContact CG-CZ3 3.95Å; K1613-W1616 WeakPolarHBondContact O-CB 3.49Å; K1613-W1616 PolarHBondContact O-N 2.85Å; G1614-W1616 VanDerWaalsContact C-N 3.33Å; W1616-V1634 HydrophobicContact CH2-CG1 4.39Å; W1616-V1634 HydrophobicContact CZ2-CG1 4.17Å; W1616-V1634 HydrophobicContact CZ2-CG2 4.18Å; W1616-L1637 HydrophobicContact CZ2-CD2 3.69Å; W1616-V1687 HydrophobicContact CH2-CB 4.48Å; W1616-V1687 HydrophobicContact CH2-CG2 3.86Å; W1616-V1687 HydrophobicContact CZ2-CG2 4.44Å; W1616-R1690 HydrophobicContact CD2-CG 4.09Å; W1616-R1690 HydrophobicContact CE3-CB 3.96Å; W1616-R1690 HydrophobicContact CE3-CG 3.68Å; W1616-R1690 HydrophobicContact CH2-CB 3.92Å; W1616-R1690 HydrophobicContact CH2-CG 4.1Å; W1616-R1690 HydrophobicContact CZ2-CG 4.47Å; W1616-R1690 HydrophobicContact CZ3-CB 3.48Å; W1616-R1690 VanDerWaalsContact CZ3-CB 3.48Å; W1616-R1690 HydrophobicContact CZ3-CG 3.69Å
1617Q80.7Confident81.3Confident111 Ų11175.8 Ų75.852%0.51943%0.426SS..PPolyproline II helixtrans-66.9149.5171-67.6170.9-2500111.5S1615 L1622 R1690S1615-Q1617 PolarHBondContact O-N 2.91Å; Q1617-L1622 HydrophobicContact CB-CD2 4.06Å; Q1617-R1690 PolarHBondContact O-NH1 3.18Å; Q1617-R1690 PolarHBondContact O-NH2 2.89Å
1618P81.4Confident81Confident62 Ų6272.1 Ų72.140%0.40342%0.416SS..PPolyproline II helixtrans-53.7142.3171.7-25.435.4000111.8G1620 D1621P1618-G1620 PolarHBondContact O-N 3.5Å; P1618-D1621 WeakPolarHBondContact CB-OD2 3.33Å; P1618-D1621 WeakPolarHBondContact CD-OD2 3.35Å; P1618-D1621 VanDerWaalsContact CG-OD2 3.27Å; P1618-D1621 WeakPolarHBondContact CG-OD2 3.34Å; P1618-D1621 PolarHBondContact O-N 3.33Å; P1618-D1621 VanDerWaalsContact O-N 3.08Å
1619V78.8Confident80.7Confident26 Ų2671 Ų7116%0.15841%0.413CS..G310 helixtrans-63.6-31.1-174.3178.20000112.3D1621 L1622 L1627 Q1693 L1694 A1697V1619-D1621 VanDerWaalsContact C-N 3.28Å; V1619-D1621 PolarHBondContact O-N 3.21Å; V1619-L1622 PolarHBondContact O-N 3.41Å; V1619-L1627 HydrophobicContact CG1-CD2 4.28Å; V1619-Q1693 HydrophobicContact CG2-CB 4Å; V1619-L1694 HydrophobicContact CG1-CD2 4.16Å; V1619-L1694 HydrophobicContact CG2-CD2 4.07Å; V1619-L1694 HydrophobicContact CG2-CG 4.39Å; V1619-A1697 HydrophobicContact CG1-CB 3.42Å; V1619-A1697 VanDerWaalsContact CG1-CB 3.42Å
1620G69.9Low80.7Confident76 Ų7673 Ų7378%0.78442%0.421SS*.G310 helixtrans-70.2-18.1175.900000115.2P1618P1618-G1620 PolarHBondContact O-N 3.5Å
1621D76.4Confident80.5Confident119 Ų11970.5 Ų70.564%0.63641%0.41SS*.G310 helixtrans-90-7.7178-61.8-27.9000112.4P1618 V1619P1618-D1621 WeakPolarHBondContact CB-OD2 3.33Å; P1618-D1621 WeakPolarHBondContact CD-OD2 3.35Å; P1618-D1621 VanDerWaalsContact CG-OD2 3.27Å; P1618-D1621 WeakPolarHBondContact CG-OD2 3.34Å; P1618-D1621 PolarHBondContact O-N 3.33Å; P1618-D1621 VanDerWaalsContact O-N 3.08Å; V1619-D1621 VanDerWaalsContact C-N 3.28Å; V1619-D1621 PolarHBondContact O-N 3.21Å
1622L78.5Confident80.4Confident14 Ų1470.4 Ų70.47%0.07340%0.402CS..SBendtrans-77.6132.9178.4-61.1-179000110.5Q1617 V1619 I1624 L1627 H1630 L1694Q1617-L1622 HydrophobicContact CB-CD2 4.06Å; V1619-L1622 PolarHBondContact O-N 3.41Å; L1622-I1624 PolarHBondContact O-N 3.35Å; L1622-L1627 HydrophobicContact CB-CD2 3.88Å; L1622-L1627 HydrophobicContact CD1-CD2 3.87Å; L1622-H1630 HydrophobicContact CD1-CB 4.11Å; L1622-L1694 HydrophobicContact CD1-CD2 3.58Å
1623L74.4Confident80.5Confident136 Ų13673.2 Ų73.271%0.71241%0.412SS*.  trans-60131.9168.5-66.5172.8000109.1D1625 S1626L1623-D1625 PolarHBondContact O-N 3.48Å; L1623-D1625 VanDerWaalsContact O-N 3.13Å; L1623-S1626 WeakPolarHBondContact O-CA 3.3Å; L1623-S1626 WeakPolarHBondContact O-CB 3.36Å; L1623-S1626 PolarHBondContact O-N 3.48Å; L1623-S1626 PolarHBondContact O-OG 2.86Å
1624I72.5Confident80.8Confident80 Ų8069.5 Ų69.541%0.4140%0.397SS..G310 helixtrans-51.4-41.8-175.1-66.6169.5000111.7L1622 S1626 L1627 F1701L1622-I1624 PolarHBondContact O-N 3.35Å; I1624-S1626 PolarHBondContact O-N 3.4Å; I1624-L1627 HydrophobicContact CG2-CD1 4.46Å; I1624-L1627 WeakPolarHBondContact O-CB 3.5Å; I1624-L1627 WeakPolarHBondContact O-CG 3.46Å; I1624-L1627 PolarHBondContact O-N 2.94Å; I1624-F1701 HydrophobicContact CD1-CB 4.06Å; I1624-F1701 HydrophobicContact CG1-CB 4.19Å; I1624-F1701 VanDerWaalsContact CG2-O 3.22Å; I1624-F1701 WeakPolarHBondContact CG2-O 3.46Å
1625D73Confident80.8Confident146 Ų14670.9 Ų70.978%0.78138%0.383SS*.G310 helixtrans-63.8-24.8179.1-58.3-26.2000113.4L1623L1623-D1625 PolarHBondContact O-N 3.48Å; L1623-D1625 VanDerWaalsContact O-N 3.13Å
1626S78.7Confident80.9Confident27 Ų2769.4 Ų69.419%0.18938%0.375CS..G310 helixtrans-89.4-8.9-179.574.10000114.3L1623 I1624 Q1628 D1629 H1630L1623-S1626 WeakPolarHBondContact O-CA 3.3Å; L1623-S1626 WeakPolarHBondContact O-CB 3.36Å; L1623-S1626 PolarHBondContact O-N 3.48Å; L1623-S1626 PolarHBondContact O-OG 2.86Å; I1624-S1626 PolarHBondContact O-N 3.4Å; S1626-Q1628 PolarHBondContact O-N 2.92Å; S1626-D1629 PolarHBondContact O-N 2.88Å; S1626-D1629 VanDerWaalsContact O-N 3.1Å; S1626-H1630 PolarHBondContact O-CD2 2.91Å; S1626-H1630 VanDerWaalsContact O-CD2 3.31Å; S1626-H1630 PolarHBondContact O-N 2.95Å; S1626-H1630 VanDerWaalsContact O-N 3.07Å
1627L79.3Confident80.8Confident5 Ų566.9 Ų66.93%0.02637%0.367CS..Hα-helixtrans-57.7-34.8-175.6-71.8171.1000112.6V1619 L1622 I1624 L1631 L1694 A1697 H1698V1619-L1627 HydrophobicContact CG1-CD2 4.28Å; L1622-L1627 HydrophobicContact CB-CD2 3.88Å; L1622-L1627 HydrophobicContact CD1-CD2 3.87Å; I1624-L1627 HydrophobicContact CG2-CD1 4.46Å; I1624-L1627 WeakPolarHBondContact O-CB 3.5Å; I1624-L1627 WeakPolarHBondContact O-CG 3.46Å; I1624-L1627 PolarHBondContact O-N 2.94Å; L1627-L1631 WeakPolarHBondContact O-CB 3.39Å; L1627-L1631 PolarHBondContact O-N 2.84Å; L1627-L1694 HydrophobicContact CD2-CD2 4.02Å; L1627-A1697 HydrophobicContact CD1-CB 4.21Å; L1627-A1697 HydrophobicContact CD2-CB 4.27Å; L1627-H1698 HydrophobicContact CB-CB 4.25Å; L1627-H1698 HydrophobicContact CD1-CB 4.44Å
1628Q81Confident81.1Confident68 Ų6867.8 Ų67.832%0.31837%0.365SS..Hα-helixtrans-66.4-47176-179.162.820.900112S1626 H1630 L1631 E1632S1626-Q1628 PolarHBondContact O-N 2.92Å; Q1628-H1630 VanDerWaalsContact C-N 3.28Å; Q1628-H1630 PolarHBondContact O-N 3.26Å; Q1628-L1631 WeakPolarHBondContact O-CB 3.28Å; Q1628-L1631 PolarHBondContact O-N 3.12Å; Q1628-L1631 VanDerWaalsContact O-N 3.08Å; Q1628-E1632 PolarHBondContact NE2-OE1 3.39Å; Q1628-E1632 PolarHBondContact O-N 3.28Å
1629D82.7Confident81.1Confident89 Ų8967 Ų6748%0.47637%0.368SS..Hα-helixtrans-59.4-40.5176.5-68.31.7000111.6S1626 E1632 K1633S1626-D1629 PolarHBondContact O-N 2.88Å; S1626-D1629 VanDerWaalsContact O-N 3.1Å; D1629-E1632 PolarHBondContact O-N 2.91Å; D1629-K1633 WeakPolarHBondContact O-CD 3.45Å; D1629-K1633 VanDerWaalsContact O-CG 3.24Å; D1629-K1633 WeakPolarHBondContact O-CG 3.29Å; D1629-K1633 PolarHBondContact O-N 3.08Å
1630H86.2Confident81.1Confident47 Ų4772.2 Ų72.222%0.21839%0.391CS..Hα-helixtrans-67.2-37.1175.7-80.5-82.4000112L1622 S1626 Q1628 K1633 V1634 L1694L1622-H1630 HydrophobicContact CD1-CB 4.11Å; S1626-H1630 PolarHBondContact O-CD2 2.91Å; S1626-H1630 VanDerWaalsContact O-CD2 3.31Å; S1626-H1630 PolarHBondContact O-N 2.95Å; S1626-H1630 VanDerWaalsContact O-N 3.07Å; Q1628-H1630 VanDerWaalsContact C-N 3.28Å; Q1628-H1630 PolarHBondContact O-N 3.26Å; H1630-K1633 PolarHBondContact O-N 3.36Å; H1630-V1634 WeakPolarHBondContact O-CG2 3.26Å; H1630-V1634 PolarHBondContact O-N 3.18Å; H1630-V1634 VanDerWaalsContact O-N 3.11Å; H1630-L1694 HydrophobicContact CB-CD1 4.18Å; H1630-L1694 HydrophobicContact CB-CD2 4.14Å
1631L85.5Confident82Confident4 Ų469.1 Ų69.12%0.02136%0.356CS..Hα-helixtrans-64-41.2175.2-168.775.4000112L1627 Q1628 K1635 L1694L1627-L1631 WeakPolarHBondContact O-CB 3.39Å; L1627-L1631 PolarHBondContact O-N 2.84Å; Q1628-L1631 WeakPolarHBondContact O-CB 3.28Å; Q1628-L1631 PolarHBondContact O-N 3.12Å; Q1628-L1631 VanDerWaalsContact O-N 3.08Å; L1631-K1635 HydrophobicContact CG-CD 4.48Å; L1631-K1635 WeakPolarHBondContact O-CG 3.26Å; L1631-K1635 PolarHBondContact O-N 3.14Å; L1631-K1635 VanDerWaalsContact O-N 3.07Å; L1631-L1694 HydrophobicContact CD1-CB 3.61Å
1632E85.5Confident82.3Confident106 Ų10666.1 Ų66.150%0.49535%0.348SS..Hα-helixtrans-68.2-42.7177.2-71.4-179.4-164.300112Q1628 D1629 V1634 K1635 A1636Q1628-E1632 PolarHBondContact NE2-OE1 3.39Å; Q1628-E1632 PolarHBondContact O-N 3.28Å; D1629-E1632 PolarHBondContact O-N 2.91Å; E1632-V1634 PolarHBondContact O-N 2.95Å; E1632-K1635 PolarHBondContact O-N 3.36Å; E1632-A1636 PolarHBondContact O-N 2.92Å
1633K86.2Confident82.6Confident126 Ų12668.8 Ų68.855%0.54837%0.367SS..Hα-helixtrans-58.2-42.9174.2-72.7164.5-171.5166.10112.8D1629 H1630 A1636 L1637D1629-K1633 WeakPolarHBondContact O-CD 3.45Å; D1629-K1633 VanDerWaalsContact O-CG 3.24Å; D1629-K1633 WeakPolarHBondContact O-CG 3.29Å; D1629-K1633 PolarHBondContact O-N 3.08Å; H1630-K1633 PolarHBondContact O-N 3.36Å; K1633-A1636 PolarHBondContact O-N 3.05Å; K1633-L1637 PolarHBondContact O-N 3.3Å
1634V89.7Confident83.2Confident5 Ų562.9 Ų62.93%0.0334%0.335CS..Hα-helixtrans-72.2-33.2178.4-179.20000111.5W1616 H1630 E1632 L1637 R1638 V1687 R1690 V1691 L1694W1616-V1634 HydrophobicContact CH2-CG1 4.39Å; W1616-V1634 HydrophobicContact CZ2-CG1 4.17Å; W1616-V1634 HydrophobicContact CZ2-CG2 4.18Å; H1630-V1634 WeakPolarHBondContact O-CG2 3.26Å; H1630-V1634 PolarHBondContact O-N 3.18Å; H1630-V1634 VanDerWaalsContact O-N 3.11Å; E1632-V1634 PolarHBondContact O-N 2.95Å; V1634-L1637 PolarHBondContact O-N 3.45Å; V1634-R1638 PolarHBondContact O-N 3.42Å; V1634-V1687 HydrophobicContact CG1-CG1 4.21Å; V1634-R1690 HydrophobicContact CG1-CB 4.34Å; V1634-R1690 HydrophobicContact CG1-CG 4.17Å; V1634-R1690 HydrophobicContact CG2-CG 3.95Å; V1634-V1691 HydrophobicContact CB-CG2 4.35Å; V1634-V1691 HydrophobicContact CG1-CG2 3.58Å; V1634-L1694 HydrophobicContact CG2-CD1 3.97Å
1635K85.7Confident83.9Confident98 Ų9866 Ų6643%0.42635%0.346SS..Hα-helixtrans-65.3-38.8171.3-75.9171-179.3170.80112.3L1631 E1632 R1638 G1639L1631-K1635 HydrophobicContact CG-CD 4.48Å; L1631-K1635 WeakPolarHBondContact O-CG 3.26Å; L1631-K1635 PolarHBondContact O-N 3.14Å; L1631-K1635 VanDerWaalsContact O-N 3.07Å; E1632-K1635 PolarHBondContact O-N 3.36Å; K1635-R1638 PolarHBondContact O-N 2.84Å; K1635-G1639 PolarHBondContact O-N 3.19Å
1636A85Confident84.6Confident53 Ų5365.8 Ų65.844%0.43834%0.34SS..Hα-helixtrans-62.1-48.9173.500000111.2E1632 K1633 R1638 G1639 E1640E1632-A1636 PolarHBondContact O-N 2.92Å; K1633-A1636 PolarHBondContact O-N 3.05Å; A1636-R1638 VanDerWaalsContact C-N 3.29Å; A1636-R1638 PolarHBondContact O-N 3.08Å; A1636-G1639 WeakPolarHBondContact O-CA 3.47Å; A1636-G1639 PolarHBondContact O-N 3.44Å; A1636-E1640 PolarHBondContact O-N 3.18Å
1637L84.8Confident85.1Confident7 Ų766.3 Ų66.34%0.03734%0.341CS..Hα-helixtrans-57.6-40.3175.2-174.168.8000112.2I1612 W1616 K1633 V1634 G1639 E1640 I1641 V1687I1612-L1637 HydrophobicContact CB-CD1 4.26Å; I1612-L1637 HydrophobicContact CB-CD2 4.31Å; I1612-L1637 HydrophobicContact CD1-CD1 3.67Å; I1612-L1637 HydrophobicContact CG2-CD1 3.97Å; I1612-L1637 HydrophobicContact CG2-CD2 3.74Å; I1612-L1637 HydrophobicContact CG2-CG 4.43Å; W1616-L1637 HydrophobicContact CZ2-CD2 3.69Å; K1633-L1637 PolarHBondContact O-N 3.3Å; V1634-L1637 PolarHBondContact O-N 3.45Å; L1637-G1639 PolarHBondContact O-N 2.93Å; L1637-E1640 PolarHBondContact O-N 3.29Å; L1637-E1640 VanDerWaalsContact O-N 3.13Å; L1637-I1641 HydrophobicContact CD1-CG2 4.06Å; L1637-I1641 HydrophobicContact CG-CG2 4.18Å; L1637-I1641 WeakPolarHBondContact O-CG1 3.47Å; L1637-I1641 WeakPolarHBondContact O-CG2 3.4Å; L1637-I1641 PolarHBondContact O-N 3.13Å; L1637-V1687 HydrophobicContact CD2-CG2 4.39Å
1638R87.1Confident85.6Confident129 Ų12966.5 Ų66.549%0.48734%0.343SS..Hα-helixtrans-58.8-30.1175.3-166.2175-174.6-103.66.5112.5V1634 K1635 A1636 V1687 E1688V1634-R1638 PolarHBondContact O-N 3.42Å; K1635-R1638 PolarHBondContact O-N 2.84Å; A1636-R1638 VanDerWaalsContact C-N 3.29Å; A1636-R1638 PolarHBondContact O-N 3.08Å; R1638-V1687 HydrophobicContact CB-CG1 3.74Å; R1638-V1687 HydrophobicContact CG-CG1 3.88Å; R1638-E1688 IonicContact CZ-OE1 3.76Å; R1638-E1688 IonicContact NE-OE1 3.66Å; R1638-E1688 IonicContact NH2-OE1 2.67Å; R1638-E1688 PolarHBondContact NH2-OE1 3.16Å
1639G81.7Confident85.9Confident46 Ų4665.9 Ų65.947%0.47435%0.345SS..Hα-helixtrans-74.9-47.8171.200000112.6K1635 A1636 L1637 I1641 A1642K1635-G1639 PolarHBondContact O-N 3.19Å; A1636-G1639 WeakPolarHBondContact O-CA 3.47Å; A1636-G1639 PolarHBondContact O-N 3.44Å; L1637-G1639 PolarHBondContact O-N 2.93Å; G1639-I1641 VanDerWaalsContact C-N 3.3Å; G1639-I1641 PolarHBondContact O-N 2.98Å; G1639-A1642 WeakPolarHBondContact O-CB 3.48Å; G1639-A1642 PolarHBondContact O-N 2.58Å; G1639-A1642 VanDerWaalsContact O-N 3.13Å
1640E79.8Confident86.4Confident135 Ų13566.4 Ų66.463%0.63135%0.345SS*.Hα-helixtrans-59.7-36.1179.9-69.5173.6-176.200113.2A1636 L1637 P1643A1636-E1640 PolarHBondContact O-N 3.18Å; L1637-E1640 PolarHBondContact O-N 3.29Å; L1637-E1640 VanDerWaalsContact O-N 3.13Å; E1640-P1643 WeakPolarHBondContact O-CD 3.28Å
1641I87.3Confident86.7Confident11 Ų1164.2 Ų64.26%0.05634%0.335CS..THydrogen-bonded Turntrans-81.8-14.1178.170.9173.2000113.7A1609 L1637 G1639 P1643 L1644 W1680 L1683 V1687A1609-I1641 HydrophobicContact CB-CG2 3.81Å; L1637-I1641 HydrophobicContact CD1-CG2 4.06Å; L1637-I1641 HydrophobicContact CG-CG2 4.18Å; L1637-I1641 WeakPolarHBondContact O-CG1 3.47Å; L1637-I1641 WeakPolarHBondContact O-CG2 3.4Å; L1637-I1641 PolarHBondContact O-N 3.13Å; G1639-I1641 VanDerWaalsContact C-N 3.3Å; G1639-I1641 PolarHBondContact O-N 2.98Å; I1641-P1643 VanDerWaalsContact C-CD 3.48Å; I1641-L1644 HydrophobicContact CB-CD1 4.08Å; I1641-L1644 HydrophobicContact CG2-CD1 4.31Å; I1641-L1644 VanDerWaalsContact O-CB 3.25Å; I1641-L1644 WeakPolarHBondContact O-CB 3.44Å; I1641-L1644 PolarHBondContact O-N 3.04Å; I1641-W1680 HydrophobicContact CB-CZ3 4.18Å; I1641-W1680 HydrophobicContact CD1-CZ3 4.36Å; I1641-W1680 HydrophobicContact CG1-CH2 4.47Å; I1641-W1680 HydrophobicContact CG1-CZ3 4.4Å; I1641-W1680 VanDerWaalsContact O-CH2 3.26Å; I1641-W1680 WeakPolarHBondContact O-CH2 3.41Å; I1641-W1680 WeakPolarHBondContact O-CZ3 3.28Å; I1641-L1683 HydrophobicContact CD1-CD2 4.45Å; I1641-L1683 HydrophobicContact CD1-CG 4.36Å; I1641-L1683 HydrophobicContact CG2-CD2 4.4Å; I1641-V1687 HydrophobicContact CD1-CG2 3.92Å
1642A84.3Confident87Confident57 Ų5766.1 Ų66.147%0.47135%0.345SS..THydrogen-bonded Turntrans-57.6-39.4-174.200000114.2G1639 L1644 K1645G1639-A1642 WeakPolarHBondContact O-CB 3.48Å; G1639-A1642 PolarHBondContact O-N 2.58Å; G1639-A1642 VanDerWaalsContact O-N 3.13Å; A1642-L1644 PolarHBondContact O-N 3.05Å; A1642-K1645 WeakPolarHBondContact O-CB 3.2Å; A1642-K1645 PolarHBondContact O-N 3.32Å
1643P84.2Confident87.1Confident70 Ų7063.7 Ų63.746%0.45534%0.336SS..THydrogen-bonded Turntrans-64.7-15.9174.7-22.535.3000114.8E1640 I1641 K1645 E1646 N1647E1640-P1643 WeakPolarHBondContact O-CD 3.28Å; I1641-P1643 VanDerWaalsContact C-CD 3.48Å; P1643-K1645 PolarHBondContact O-N 2.94Å; P1643-E1646 PolarHBondContact O-N 3.45Å; P1643-N1647 PolarHBondContact O-ND2 3.42Å
1644L87.1Confident87.3Confident11 Ų1157.8 Ų57.86%0.05831%0.31CS..Hα-helixtrans-61.3-27.7175.1-76.1167.1000112.5L1602 K1605 L1606 I1641 A1642 E1646 N1647 V1648 W1680L1602-L1644 HydrophobicContact CD1-CD2 4.08Å; K1605-L1644 HydrophobicContact CB-CD2 3.37Å; K1605-L1644 HydrophobicContact CD-CD2 3.93Å; K1605-L1644 HydrophobicContact CG-CD2 4.24Å; L1606-L1644 HydrophobicContact CD2-CD1 4.34Å; I1641-L1644 HydrophobicContact CB-CD1 4.08Å; I1641-L1644 HydrophobicContact CG2-CD1 4.31Å; I1641-L1644 VanDerWaalsContact O-CB 3.25Å; I1641-L1644 WeakPolarHBondContact O-CB 3.44Å; I1641-L1644 PolarHBondContact O-N 3.04Å; A1642-L1644 PolarHBondContact O-N 3.05Å; L1644-E1646 PolarHBondContact O-N 3.37Å; L1644-N1647 PolarHBondContact O-N 2.87Å; L1644-V1648 VanDerWaalsContact O-CG2 3.3Å; L1644-V1648 WeakPolarHBondContact O-CG2 3.42Å; L1644-V1648 PolarHBondContact O-N 2.84Å; L1644-W1680 HydrophobicContact CB-CE3 3.79Å; L1644-W1680 HydrophobicContact CB-CH2 3.9Å; L1644-W1680 HydrophobicContact CB-CZ3 3.42Å; L1644-W1680 VanDerWaalsContact CB-CZ3 3.42Å; L1644-W1680 HydrophobicContact CD1-CE3 4.31Å; L1644-W1680 HydrophobicContact CD1-CZ3 3.96Å; L1644-W1680 HydrophobicContact CG-CZ3 4.31Å
1645K87.9Confident87.3Confident146 Ų14658 Ų5864%0.63531%0.312SS*.Hα-helixtrans-56.6-37.4173.9-170-176.3174.5-169.40112.2A1642 P1643 V1648 S1649 W1680A1642-K1645 WeakPolarHBondContact O-CB 3.2Å; A1642-K1645 PolarHBondContact O-N 3.32Å; P1643-K1645 PolarHBondContact O-N 2.94Å; K1645-V1648 PolarHBondContact O-N 3.02Å; K1645-S1649 PolarHBondContact O-N 3.28Å; K1645-S1649 PolarHBondContact O-OG 2.89Å; K1645-S1649 VanDerWaalsContact O-OG 3.13Å; K1645-W1680 HydrophobicContact CB-CZ2 3.89Å
1646E86.9Confident87.2Confident141 Ų14159.8 Ų59.866%0.65932%0.316SS*.Hα-helixtrans-70.9-41.8179.8-63.3-178.1173.400111.2P1643 L1644 V1648 S1649 H1650P1643-E1646 PolarHBondContact O-N 3.45Å; L1644-E1646 PolarHBondContact O-N 3.37Å; E1646-V1648 VanDerWaalsContact C-N 3.34Å; E1646-V1648 PolarHBondContact O-N 3.35Å; E1646-S1649 VanDerWaalsContact CA-OG 3.31Å; E1646-S1649 WeakPolarHBondContact CA-OG 3.49Å; E1646-S1649 PolarHBondContact O-N 2.68Å; E1646-S1649 PolarHBondContact O-OG 2.97Å; E1646-H1650 WeakPolarHBondContact O-CB 3.47Å; E1646-H1650 PolarHBondContact O-N 3.23Å
1647N88.7Confident87.2Confident38 Ų3861.5 Ų61.520%0.20332%0.315CS..Hα-helixtrans-61.6-42.1173.3-55.6-51.8000111L1602 K1605 P1643 L1644 H1650 V1651L1602-N1647 HydrophobicContact CD1-CB 4.09Å; K1605-N1647 PolarHBondContact NZ-ND2 2.88Å; K1605-N1647 PolarHBondContact NZ-OD1 2.84Å; P1643-N1647 PolarHBondContact O-ND2 3.42Å; L1644-N1647 PolarHBondContact O-N 2.87Å; N1647-H1650 PolarHBondContact O-N 2.89Å; N1647-V1651 WeakPolarHBondContact O-CG2 3.46Å; N1647-V1651 PolarHBondContact O-N 2.87Å
1648V91.1Very high87.3Confident10 Ų1061.2 Ų61.26%0.06131%0.314CS..Hα-helixtrans-62.5-45175173.10000111.2L1602 L1644 K1645 E1646 H1650 N1652 N1677 W1680L1602-V1648 HydrophobicContact CD1-CG2 3.73Å; L1602-V1648 HydrophobicContact CD2-CB 4.49Å; L1602-V1648 HydrophobicContact CD2-CG2 3.85Å; L1602-V1648 HydrophobicContact CG-CG2 4.45Å; L1644-V1648 VanDerWaalsContact O-CG2 3.3Å; L1644-V1648 WeakPolarHBondContact O-CG2 3.42Å; L1644-V1648 PolarHBondContact O-N 2.84Å; K1645-V1648 PolarHBondContact O-N 3.02Å; E1646-V1648 VanDerWaalsContact C-N 3.34Å; E1646-V1648 PolarHBondContact O-N 3.35Å; V1648-H1650 VanDerWaalsContact C-N 3.33Å; V1648-H1650 PolarHBondContact O-N 2.9Å; V1648-N1652 WeakPolarHBondContact CG1-ND2 3.22Å; V1648-N1652 WeakPolarHBondContact O-CB 3.33Å; V1648-N1652 PolarHBondContact O-N 2.59Å; V1648-N1652 VanDerWaalsContact O-N 3.16Å; V1648-N1652 PolarHBondContact O-ND2 3.21Å; V1648-N1677 WeakPolarHBondContact CG1-OD1 3.33Å; V1648-W1680 HydrophobicContact CG2-CB 4.04Å; V1648-W1680 HydrophobicContact CG2-CD2 4.24Å; V1648-W1680 HydrophobicContact CG2-CG 3.77Å
1649S87.5Confident87Confident54 Ų5459.2 Ų59.238%0.37832%0.316SS..Hα-helixtrans-62.7-41.1173.642.50000111.9K1645 E1646 N1652 D1653K1645-S1649 PolarHBondContact O-N 3.28Å; K1645-S1649 PolarHBondContact O-OG 2.89Å; K1645-S1649 VanDerWaalsContact O-OG 3.13Å; E1646-S1649 VanDerWaalsContact CA-OG 3.31Å; E1646-S1649 WeakPolarHBondContact CA-OG 3.49Å; E1646-S1649 PolarHBondContact O-N 2.68Å; E1646-S1649 PolarHBondContact O-OG 2.97Å; S1649-N1652 PolarHBondContact O-N 2.91Å; S1649-D1653 WeakPolarHBondContact O-CB 3.38Å; S1649-D1653 PolarHBondContact O-N 2.89Å
1650H91.7Very high86.7Confident100 Ų10062.6 Ų62.646%0.46333%0.328SS..Hα-helixtrans-59.1-54.8179.7-171.160.1000111.3E1646 N1647 V1648 N1652 D1653 L1654E1646-H1650 WeakPolarHBondContact O-CB 3.47Å; E1646-H1650 PolarHBondContact O-N 3.23Å; N1647-H1650 PolarHBondContact O-N 2.89Å; V1648-H1650 VanDerWaalsContact C-N 3.33Å; V1648-H1650 PolarHBondContact O-N 2.9Å; H1650-N1652 VanDerWaalsContact C-N 3.3Å; H1650-N1652 PolarHBondContact O-N 2.79Å; H1650-D1653 PolarHBondContact O-N 2.93Å; H1650-L1654 VanDerWaalsContact O-CG 3.32Å; H1650-L1654 WeakPolarHBondContact O-CG 3.4Å; H1650-L1654 PolarHBondContact O-N 3.07Å
1651V93.1Very high86.5Confident2 Ų260.7 Ų60.71%0.01232%0.321CS..Hα-helixtrans-56.6-42.3177.9174.20000112L1595 A1598 L1602 N1647 L1654 A1655 L1673L1595-V1651 HydrophobicContact CD1-CG1 4.06Å; A1598-V1651 HydrophobicContact CB-CG2 3.7Å; A1598-V1651 VanDerWaalsContact O-CG2 3.32Å; A1598-V1651 WeakPolarHBondContact O-CG2 3.35Å; L1602-V1651 HydrophobicContact CB-CG2 4.32Å; L1602-V1651 HydrophobicContact CD2-CB 4.32Å; L1602-V1651 HydrophobicContact CD2-CG2 4.03Å; N1647-V1651 WeakPolarHBondContact O-CG2 3.46Å; N1647-V1651 PolarHBondContact O-N 2.87Å; V1651-L1654 PolarHBondContact O-N 2.93Å; V1651-A1655 WeakPolarHBondContact O-CB 3.45Å; V1651-A1655 PolarHBondContact O-N 3.01Å; V1651-A1655 VanDerWaalsContact O-N 3.1Å; V1651-L1673 HydrophobicContact CG1-CD2 3.75Å; V1651-L1673 HydrophobicContact CG1-CG 4.2Å
1652N91.9Very high86Confident44 Ų4463.2 Ų63.224%0.23535%0.35CS..Hα-helixtrans-67.6-32.9175.7-74.9-57.5000113.3V1648 S1649 H1650 R1656 N1677V1648-N1652 WeakPolarHBondContact CG1-ND2 3.22Å; V1648-N1652 WeakPolarHBondContact O-CB 3.33Å; V1648-N1652 PolarHBondContact O-N 2.59Å; V1648-N1652 VanDerWaalsContact O-N 3.16Å; V1648-N1652 PolarHBondContact O-ND2 3.21Å; S1649-N1652 PolarHBondContact O-N 2.91Å; H1650-N1652 VanDerWaalsContact C-N 3.3Å; H1650-N1652 PolarHBondContact O-N 2.79Å; N1652-R1656 WeakPolarHBondContact O-CB 3.43Å; N1652-R1656 PolarHBondContact O-N 2.89Å; N1652-N1677 PolarHBondContact ND2-ND2 3.43Å; N1652-N1677 PolarHBondContact ND2-OD1 3.12Å; N1652-N1677 PolarHBondContact OD1-ND2 3.14Å
1653D87.9Confident85.9Confident55 Ų5561 Ų6129%0.29433%0.33SS..Hα-helixtrans-75-36.6177.6-69.5-13.9000111.7S1649 H1650 R1656 Q1657S1649-D1653 WeakPolarHBondContact O-CB 3.38Å; S1649-D1653 PolarHBondContact O-N 2.89Å; H1650-D1653 PolarHBondContact O-N 2.93Å; D1653-R1656 PolarHBondContact O-N 3.1Å; D1653-R1656 IonicContact OD1-CZ 2.72Å; D1653-R1656 IonicContact OD1-NH1 3.18Å; D1653-R1656 PolarHBondContact OD1-NH1 3.32Å; D1653-R1656 IonicContact OD1-NH2 2.62Å; D1653-R1656 PolarHBondContact OD1-NH2 3.29Å; D1653-Q1657 WeakPolarHBondContact O-CB 3.32Å; D1653-Q1657 VanDerWaalsContact O-CG 3.27Å; D1653-Q1657 WeakPolarHBondContact O-CG 3.17Å; D1653-Q1657 PolarHBondContact O-N 3.39Å; D1653-Q1657 PolarHBondContact O-NE2 3.34Å
1654L89.5Confident85.8Confident1 Ų165.8 Ų65.81%0.00535%0.346CS..Hα-helixtrans-58.4-50.1169.9-63.6-178.7000110.6R1591 E1594 L1595 A1598 H1650 V1651 R1656 Q1657 L1658R1591-L1654 VanDerWaalsContact CZ-CD2 3.42Å; E1594-L1654 WeakPolarHBondContact O-CD1 3.27Å; L1595-L1654 HydrophobicContact CB-CB 4.37Å; L1595-L1654 HydrophobicContact CD1-CB 3.85Å; L1595-L1654 HydrophobicContact CD1-CD1 4.47Å; A1598-L1654 HydrophobicContact CB-CD1 3.6Å; H1650-L1654 VanDerWaalsContact O-CG 3.32Å; H1650-L1654 WeakPolarHBondContact O-CG 3.4Å; H1650-L1654 PolarHBondContact O-N 3.07Å; V1651-L1654 PolarHBondContact O-N 2.93Å; L1654-R1656 PolarHBondContact O-N 2.94Å; L1654-Q1657 PolarHBondContact O-N 3.09Å; L1654-L1658 PolarHBondContact O-N 2.83Å; L1654-L1658 VanDerWaalsContact O-N 3.13Å
1655A89.4Confident85.6Confident9 Ų966.2 Ų66.27%0.07435%0.348CS..Hα-helixtrans-61.6-41177.600000112.8L1595 V1651 L1658 T1659 L1665 L1673L1595-A1655 HydrophobicContact CD1-CB 4.27Å; V1651-A1655 WeakPolarHBondContact O-CB 3.45Å; V1651-A1655 PolarHBondContact O-N 3.01Å; V1651-A1655 VanDerWaalsContact O-N 3.1Å; A1655-L1658 PolarHBondContact O-N 3.36Å; A1655-T1659 PolarHBondContact O-N 3.3Å; A1655-T1659 VanDerWaalsContact O-N 3.14Å; A1655-T1659 PolarHBondContact O-OG1 3.48Å; A1655-L1665 HydrophobicContact CB-CD1 3.92Å; A1655-L1673 HydrophobicContact CB-CD1 3.61Å; A1655-L1673 HydrophobicContact CB-CD2 3.91Å; A1655-L1673 HydrophobicContact CB-CG 4.44Å
1656R85Confident85.4Confident136 Ų13659.8 Ų59.851%0.51332%0.322SS..Hα-helixtrans-63.9-42.8176.2-160.5-177.2-47.4107.119.5111.4N1652 D1653 L1654 L1658 T1659 T1660N1652-R1656 WeakPolarHBondContact O-CB 3.43Å; N1652-R1656 PolarHBondContact O-N 2.89Å; D1653-R1656 PolarHBondContact O-N 3.1Å; D1653-R1656 IonicContact OD1-CZ 2.72Å; D1653-R1656 IonicContact OD1-NH1 3.18Å; D1653-R1656 PolarHBondContact OD1-NH1 3.32Å; D1653-R1656 IonicContact OD1-NH2 2.62Å; D1653-R1656 PolarHBondContact OD1-NH2 3.29Å; L1654-R1656 PolarHBondContact O-N 2.94Å; R1656-L1658 PolarHBondContact O-N 2.77Å; R1656-T1659 CarbonylContact O-C 3.55Å; R1656-T1659 WeakPolarHBondContact O-CA 3.26Å; R1656-T1659 VanDerWaalsContact O-CB 3.3Å; R1656-T1659 WeakPolarHBondContact O-CB 3.41Å; R1656-T1659 PolarHBondContact O-N 3.32Å; R1656-T1659 VanDerWaalsContact O-N 3.09Å; R1656-T1660 PolarHBondContact O-N 2.79Å; R1656-T1660 PolarHBondContact O-OG1 3.35Å
1657Q84.4Confident85Confident90 Ų9058.4 Ų58.442%0.42133%0.325SS..Hα-helixtrans-64.6-39.4179.5-73.9174.248.500113R1591 D1653 L1654 T1659 T1660 L1661R1591-Q1657 VanDerWaalsContact NH2-CD 3.33Å; D1653-Q1657 WeakPolarHBondContact O-CB 3.32Å; D1653-Q1657 VanDerWaalsContact O-CG 3.27Å; D1653-Q1657 WeakPolarHBondContact O-CG 3.17Å; D1653-Q1657 PolarHBondContact O-N 3.39Å; D1653-Q1657 PolarHBondContact O-NE2 3.34Å; L1654-Q1657 PolarHBondContact O-N 3.09Å; Q1657-T1659 VanDerWaalsContact C-N 3.28Å; Q1657-T1659 PolarHBondContact O-N 3.1Å; Q1657-T1660 PolarHBondContact O-N 2.82Å; Q1657-L1661 WeakPolarHBondContact O-CG 3.34Å; Q1657-L1661 PolarHBondContact O-N 2.81Å
1658L86.3Confident84.7Confident0 Ų064.2 Ų64.20%035%0.346CS..Hα-helixtrans-58.8-41.3170.3-78.7161.8000111.6R1591 L1592 L1595 L1654 A1655 R1656 L1661 G1662 I1663 L1665R1591-L1658 HydrophobicContact CB-CD2 3.84Å; R1591-L1658 HydrophobicContact CB-CG 4.32Å; R1591-L1658 HydrophobicContact CG-CD1 4.45Å; R1591-L1658 HydrophobicContact CG-CD2 3.93Å; R1591-L1658 HydrophobicContact CG-CG 3.89Å; L1592-L1658 HydrophobicContact CD2-CD1 3.84Å; L1592-L1658 HydrophobicContact CD2-CD2 4.3Å; L1592-L1658 HydrophobicContact CG-CD1 4.39Å; L1592-L1658 HydrophobicContact CG-CD2 4.19Å; L1595-L1658 HydrophobicContact CB-CD1 4.25Å; L1595-L1658 HydrophobicContact CD2-CD1 3.77Å; L1654-L1658 PolarHBondContact O-N 2.83Å; L1654-L1658 VanDerWaalsContact O-N 3.13Å; A1655-L1658 PolarHBondContact O-N 3.36Å; R1656-L1658 PolarHBondContact O-N 2.77Å; L1658-L1661 PolarHBondContact O-N 3.33Å; L1658-G1662 PolarHBondContact O-N 3.09Å; L1658-I1663 HydrophobicContact CD2-CB 4.48Å; L1658-I1663 HydrophobicContact CD2-CD1 3.72Å; L1658-I1663 HydrophobicContact CD2-CG2 4.46Å; L1658-I1663 WeakPolarHBondContact O-CB 3.37Å; L1658-I1663 PolarHBondContact O-N 3.1Å; L1658-L1665 HydrophobicContact CB-CD2 4.42Å; L1658-L1665 HydrophobicContact CD1-CD2 3.9Å
1659T81.7Confident84.4Confident88 Ų8864.7 Ų64.754%0.5435%0.348SS..Hα-helixtrans-64.6-41.7175.5-49.50000111.7A1655 R1656 Q1657 L1661 G1662A1655-T1659 PolarHBondContact O-N 3.3Å; A1655-T1659 VanDerWaalsContact O-N 3.14Å; A1655-T1659 PolarHBondContact O-OG1 3.48Å; R1656-T1659 CarbonylContact O-C 3.55Å; R1656-T1659 WeakPolarHBondContact O-CA 3.26Å; R1656-T1659 VanDerWaalsContact O-CB 3.3Å; R1656-T1659 WeakPolarHBondContact O-CB 3.41Å; R1656-T1659 PolarHBondContact O-N 3.32Å; R1656-T1659 VanDerWaalsContact O-N 3.09Å; Q1657-T1659 VanDerWaalsContact C-N 3.28Å; Q1657-T1659 PolarHBondContact O-N 3.1Å; T1659-L1661 VanDerWaalsContact C-N 3.27Å; T1659-L1661 PolarHBondContact O-N 3.35Å; T1659-G1662 WeakPolarHBondContact O-CA 3.45Å; T1659-G1662 PolarHBondContact O-N 2.67Å
1660T75.5Confident84.3Confident117 Ų11766 Ų6672%0.71835%0.35SS*.Hα-helixtrans-64.2-30.1176.1-42.30000112.7R1656 Q1657 G1662R1656-T1660 PolarHBondContact O-N 2.79Å; R1656-T1660 PolarHBondContact O-OG1 3.35Å; Q1657-T1660 PolarHBondContact O-N 2.82Å; T1660-G1662 PolarHBondContact O-N 3.18Å
1661L75.8Confident83.8Confident94 Ų9464.9 Ų64.949%0.49235%0.353SS..THydrogen-bonded Turntrans-75.40.6172-69.5170000113.3Q1657 L1658 T1659 I1663Q1657-L1661 WeakPolarHBondContact O-CG 3.34Å; Q1657-L1661 PolarHBondContact O-N 2.81Å; L1658-L1661 PolarHBondContact O-N 3.33Å; T1659-L1661 VanDerWaalsContact C-N 3.27Å; T1659-L1661 PolarHBondContact O-N 3.35Å; L1661-I1663 VanDerWaalsContact C-N 3.34Å; L1661-I1663 HydrophobicContact CB-CD1 3.79Å; L1661-I1663 HydrophobicContact CB-CG1 4.3Å; L1661-I1663 HydrophobicContact CD1-CD1 4.26Å
1662G76.2Confident83.5Confident64 Ų6466.5 Ų66.566%0.6636%0.364SS*.THydrogen-bonded Turntrans79.113.1-17900000114.4L1658 T1659 T1660L1658-G1662 PolarHBondContact O-N 3.09Å; T1659-G1662 WeakPolarHBondContact O-CA 3.45Å; T1659-G1662 PolarHBondContact O-N 2.67Å; T1660-G1662 PolarHBondContact O-N 3.18Å
1663I82.7Confident83.4Confident10 Ų1065 Ų655%0.05136%0.356CS..  trans-91.6110.6-179.2-57.3153000108.2T1588 L1658 L1661 L1665T1588-I1663 HydrophobicContact CG2-CD1 3.66Å; T1588-I1663 HydrophobicContact CG2-CG1 4.31Å; T1588-I1663 HydrophobicContact CG2-CG2 4.26Å; T1588-I1663 WeakPolarHBondContact OG1-CD1 3.3Å; L1658-I1663 HydrophobicContact CD2-CB 4.48Å; L1658-I1663 HydrophobicContact CD2-CD1 3.72Å; L1658-I1663 HydrophobicContact CD2-CG2 4.46Å; L1658-I1663 WeakPolarHBondContact O-CB 3.37Å; L1658-I1663 PolarHBondContact O-N 3.1Å; L1661-I1663 VanDerWaalsContact C-N 3.34Å; L1661-I1663 HydrophobicContact CB-CD1 3.79Å; L1661-I1663 HydrophobicContact CB-CG1 4.3Å; L1661-I1663 HydrophobicContact CD1-CD1 4.26Å; I1663-L1665 PolarHBondContact O-N 3.48Å
1664Q81.3Confident83.3Confident171 Ų17168.5 Ų68.580%0.79937%0.37SS*.  trans-75.6115.5174.4-68.1-172.4-4.900109.8G1492G1492-Q1664 WeakPolarHBondContact CA-O 3.19Å
1665L84.1Confident83.4Confident20 Ų2071.9 Ų71.911%0.10539%0.388CS..  trans-59.6145.8175.2-69.6171.7000111.6L1592 L1595 A1655 L1658 I1663 N1669 L1670 L1673L1592-L1665 HydrophobicContact CD2-CD2 4.08Å; L1595-L1665 HydrophobicContact CD2-CD1 4.47Å; L1595-L1665 HydrophobicContact CD2-CD2 3.8Å; A1655-L1665 HydrophobicContact CB-CD1 3.92Å; L1658-L1665 HydrophobicContact CB-CD2 4.42Å; L1658-L1665 HydrophobicContact CD1-CD2 3.9Å; I1663-L1665 PolarHBondContact O-N 3.48Å; L1665-N1669 HydrophobicContact CB-CB 4.4Å; L1665-N1669 HydrophobicContact CD2-CB 4.44Å; L1665-L1670 HydrophobicContact CB-CD1 4.29Å; L1665-L1670 HydrophobicContact CB-CG 4.19Å; L1665-L1673 HydrophobicContact CD1-CD1 4.15Å
1666S83.3Confident83.5Confident12 Ų1271.6 Ų71.68%0.08439%0.385CS..  trans-63.4153.5174.176.10000111.7G1492 Y1668 N1669 L1670G1492-S1666 PolarHBondContact O-N 2.9Å; S1666-Y1668 PolarHBondContact O-N 3.46Å; S1666-Y1668 VanDerWaalsContact O-N 3.14Å; S1666-N1669 PolarHBondContact O-N 2.9Å; S1666-N1669 VanDerWaalsContact O-N 3.08Å; S1666-N1669 PolarHBondContact OG-N 3.5Å; S1666-L1670 PolarHBondContact O-N 3.47Å
1667P78.4Confident83.8Confident112 Ų11266.6 Ų66.673%0.72737%0.369SS*.Hα-helixtrans-56.3-30.2175.9-26.635.2000113.6S1671P1667-S1671 VanDerWaalsContact O-CB 3.31Å; P1667-S1671 WeakPolarHBondContact O-CB 3.46Å; P1667-S1671 PolarHBondContact O-N 2.81Å
1668Y81.4Confident84Confident160 Ų16065.8 Ų65.863%0.62737%0.37SS*.Hα-helixtrans-66-47.8175.4177.2-94.8000111.9S1666 S1671 T1672S1666-Y1668 PolarHBondContact O-N 3.46Å; S1666-Y1668 VanDerWaalsContact O-N 3.14Å; Y1668-S1671 PolarHBondContact O-N 3.45Å; Y1668-T1672 WeakPolarHBondContact O-CB 3.48Å; Y1668-T1672 PolarHBondContact O-N 3.32Å; Y1668-T1672 PolarHBondContact O-OG1 2.87Å
1669N85Confident84.4Confident19 Ų1967.5 Ų67.510%0.10238%0.376CS..Hα-helixtrans-64.8-42.7178.5-71.2-9.9000111G1492 L1665 S1666 T1672 L1673G1492-N1669 PolarHBondContact O-ND2 3.38Å; L1665-N1669 HydrophobicContact CB-CB 4.4Å; L1665-N1669 HydrophobicContact CD2-CB 4.44Å; S1666-N1669 PolarHBondContact O-N 2.9Å; S1666-N1669 VanDerWaalsContact O-N 3.08Å; S1666-N1669 PolarHBondContact OG-N 3.5Å; N1669-T1672 PolarHBondContact O-N 3.41Å; N1669-L1673 PolarHBondContact O-N 3.3Å
1670L85.6Confident84.9Confident83 Ų8364.5 Ų64.544%0.43536%0.355SS..Hα-helixtrans-58.6-50.7174.2-90.9155.5000112.2L1665 S1666 T1672 L1673 E1674L1665-L1670 HydrophobicContact CB-CD1 4.29Å; L1665-L1670 HydrophobicContact CB-CG 4.19Å; S1666-L1670 PolarHBondContact O-N 3.47Å; L1670-T1672 VanDerWaalsContact C-N 3.27Å; L1670-T1672 PolarHBondContact O-N 3.26Å; L1670-L1673 WeakPolarHBondContact O-CB 3.34Å; L1670-L1673 PolarHBondContact O-N 3.39Å; L1670-E1674 WeakPolarHBondContact O-CG 3.43Å; L1670-E1674 PolarHBondContact O-N 3.35Å
1671S82.3Confident85.5Confident75 Ų7565.1 Ų65.152%0.52435%0.348SS..Hα-helixtrans-61.7-35178.3-172.80000112.7P1667 Y1668 E1674 D1675P1667-S1671 VanDerWaalsContact O-CB 3.31Å; P1667-S1671 WeakPolarHBondContact O-CB 3.46Å; P1667-S1671 PolarHBondContact O-N 2.81Å; Y1668-S1671 PolarHBondContact O-N 3.45Å; S1671-E1674 PolarHBondContact O-N 3.42Å; S1671-D1675 PolarHBondContact O-N 3.1Å
1672T86Confident86.1Confident37 Ų3765.5 Ų65.523%0.22735%0.35CS..Hα-helixtrans-70.4-41.7178-52.30000111.2T1599 Y1668 N1669 L1670 E1674 D1675 L1676T1599-T1672 HydrophobicContact CG2-CG2 3.58Å; Y1668-T1672 WeakPolarHBondContact O-CB 3.48Å; Y1668-T1672 PolarHBondContact O-N 3.32Å; Y1668-T1672 PolarHBondContact O-OG1 2.87Å; N1669-T1672 PolarHBondContact O-N 3.41Å; L1670-T1672 VanDerWaalsContact C-N 3.27Å; L1670-T1672 PolarHBondContact O-N 3.26Å; T1672-E1674 VanDerWaalsContact C-N 3.35Å; T1672-E1674 PolarHBondContact O-N 3.06Å; T1672-D1675 PolarHBondContact O-N 3.14Å; T1672-L1676 HydrophobicContact CG2-CD1 4.43Å; T1672-L1676 WeakPolarHBondContact O-CG 3.5Å; T1672-L1676 PolarHBondContact O-N 2.87Å; T1672-L1676 VanDerWaalsContact O-N 3.11Å
1673L88.9Confident86.8Confident13 Ų1362.5 Ų62.57%0.06832%0.319CS..Hα-helixtrans-59.2-43.6171.5-98.9140000112L1595 V1651 A1655 L1665 N1669 L1670 N1677L1595-L1673 HydrophobicContact CD1-CD1 4.39Å; L1595-L1673 HydrophobicContact CD2-CD1 4.46Å; V1651-L1673 HydrophobicContact CG1-CD2 3.75Å; V1651-L1673 HydrophobicContact CG1-CG 4.2Å; A1655-L1673 HydrophobicContact CB-CD1 3.61Å; A1655-L1673 HydrophobicContact CB-CD2 3.91Å; A1655-L1673 HydrophobicContact CB-CG 4.44Å; L1665-L1673 HydrophobicContact CD1-CD1 4.15Å; N1669-L1673 PolarHBondContact O-N 3.3Å; L1670-L1673 WeakPolarHBondContact O-CB 3.34Å; L1670-L1673 PolarHBondContact O-N 3.39Å; L1673-N1677 WeakPolarHBondContact O-CB 3.45Å; L1673-N1677 PolarHBondContact O-N 2.91Å; L1673-N1677 VanDerWaalsContact O-N 3.13Å; L1673-N1677 PolarHBondContact O-ND2 2.89Å
1674E86.5Confident87Confident127 Ų12766.1 Ų66.159%0.59334%0.335SS*.Hα-helixtrans-66.8-39.9178.6-72.5-177.4171.700112.6L1670 S1671 T1672 T1678L1670-E1674 WeakPolarHBondContact O-CG 3.43Å; L1670-E1674 PolarHBondContact O-N 3.35Å; S1671-E1674 PolarHBondContact O-N 3.42Å; T1672-E1674 VanDerWaalsContact C-N 3.35Å; T1672-E1674 PolarHBondContact O-N 3.06Å; E1674-T1678 VanDerWaalsContact O-CB 3.31Å; E1674-T1678 WeakPolarHBondContact O-CB 3.42Å; E1674-T1678 PolarHBondContact O-N 3.43Å; E1674-T1678 PolarHBondContact O-OG1 3.36Å
1675D91Very high87.3Confident72 Ų7261.8 Ų61.839%0.38532%0.32SS..Hα-helixtrans-59.2-55.2173.817863.1000111.9S1671 T1672 N1677 T1678 R1679S1671-D1675 PolarHBondContact O-N 3.1Å; T1672-D1675 PolarHBondContact O-N 3.14Å; D1675-N1677 VanDerWaalsContact C-N 3.34Å; D1675-N1677 PolarHBondContact O-N 3.46Å; D1675-T1678 WeakPolarHBondContact O-CA 3.13Å; D1675-T1678 WeakPolarHBondContact O-CB 3.34Å; D1675-T1678 PolarHBondContact O-N 3.31Å; D1675-R1679 VanDerWaalsContact CG-CD 3.48Å; D1675-R1679 PolarHBondContact O-N 3.37Å; D1675-R1679 VanDerWaalsContact OD1-CD 3.25Å; D1675-R1679 WeakPolarHBondContact OD1-CD 3.25Å; D1675-R1679 WeakPolarHBondContact OD2-CD 3.41Å; D1675-R1679 IonicContact OD2-CZ 2.67Å; D1675-R1679 IonicContact OD2-NE 3.32Å; D1675-R1679 IonicContact OD2-NH1 3.1Å; D1675-R1679 PolarHBondContact OD2-NH1 3.14Å
1676L92.1Very high87.5Confident3 Ų361.7 Ų61.72%0.01632%0.323CS..Hα-helixtrans-61.5-40.9-177.4-64.5175.1000112.4T1599 L1602 D1603 L1606 T1672 T1678 W1680T1599-L1676 HydrophobicContact CG2-CD1 3.54Å; L1602-L1676 HydrophobicContact CB-CD1 4.41Å; L1602-L1676 HydrophobicContact CD2-CB 4.01Å; L1602-L1676 HydrophobicContact CD2-CD1 4.11Å; L1602-L1676 HydrophobicContact CG-CB 4.43Å; L1602-L1676 HydrophobicContact CG-CD1 4.28Å; D1603-L1676 HydrophobicContact CB-CD2 3.71Å; L1606-L1676 HydrophobicContact CD1-CB 4.22Å; L1606-L1676 HydrophobicContact CD1-CD2 3.89Å; T1672-L1676 HydrophobicContact CG2-CD1 4.43Å; T1672-L1676 WeakPolarHBondContact O-CG 3.5Å; T1672-L1676 PolarHBondContact O-N 2.87Å; T1672-L1676 VanDerWaalsContact O-N 3.11Å; L1676-T1678 VanDerWaalsContact C-N 3.29Å; L1676-T1678 PolarHBondContact O-N 3.34Å; L1676-W1680 WeakPolarHBondContact O-CB 3.38Å; L1676-W1680 PolarHBondContact O-N 2.73Å
1677N91.3Very high87.8Confident31 Ų3161.2 Ų61.217%0.16632%0.319CS..Hα-helixtrans-63.2-34.8173.8-86-73.6000112.6V1648 N1652 L1673 D1675 K1681V1648-N1677 WeakPolarHBondContact CG1-OD1 3.33Å; N1652-N1677 PolarHBondContact ND2-ND2 3.43Å; N1652-N1677 PolarHBondContact ND2-OD1 3.12Å; N1652-N1677 PolarHBondContact OD1-ND2 3.14Å; L1673-N1677 WeakPolarHBondContact O-CB 3.45Å; L1673-N1677 PolarHBondContact O-N 2.91Å; L1673-N1677 VanDerWaalsContact O-N 3.13Å; L1673-N1677 PolarHBondContact O-ND2 2.89Å; D1675-N1677 VanDerWaalsContact C-N 3.34Å; D1675-N1677 PolarHBondContact O-N 3.46Å; N1677-K1681 WeakPolarHBondContact O-CG 3.29Å; N1677-K1681 PolarHBondContact O-N 3.12Å
1678T89.2Confident88.2Confident73 Ų7359.1 Ų59.145%0.44830%0.3SS..Hα-helixtrans-75.1-46.3179.6-59.70000110.9E1674 D1675 L1676 W1680 K1681 L1682E1674-T1678 VanDerWaalsContact O-CB 3.31Å; E1674-T1678 WeakPolarHBondContact O-CB 3.42Å; E1674-T1678 PolarHBondContact O-N 3.43Å; E1674-T1678 PolarHBondContact O-OG1 3.36Å; D1675-T1678 WeakPolarHBondContact O-CA 3.13Å; D1675-T1678 WeakPolarHBondContact O-CB 3.34Å; D1675-T1678 PolarHBondContact O-N 3.31Å; L1676-T1678 VanDerWaalsContact C-N 3.29Å; L1676-T1678 PolarHBondContact O-N 3.34Å; T1678-W1680 PolarHBondContact O-N 2.86Å; T1678-K1681 PolarHBondContact O-N 3.34Å; T1678-K1681 VanDerWaalsContact O-N 3.16Å; T1678-L1682 HydrophobicContact CG2-CD1 4.02Å; T1678-L1682 HydrophobicContact CG2-CG 4.42Å; T1678-L1682 WeakPolarHBondContact O-CG 3.42Å; T1678-L1682 PolarHBondContact O-N 3.45Å
1679R94Very high88.4Confident37 Ų3754.2 Ų54.214%0.1429%0.285CS..Hα-helixtrans-61-42.1176.5-76.5166.759.8-152.6-5.2112.6D1603 L1606 E1610 D1675 K1681 L1682 L1683D1603-R1679 IonicContact OD1-CZ 3.84Å; D1603-R1679 VanDerWaalsContact OD1-CZ 3.23Å; D1603-R1679 IonicContact OD1-NH1 3.99Å; D1603-R1679 PolarHBondContact OD1-NH1 3.44Å; D1603-R1679 IonicContact OD1-NH2 2.64Å; D1603-R1679 PolarHBondContact OD1-NH2 3.49Å; L1606-R1679 HydrophobicContact CD1-CB 4.41Å; E1610-R1679 WeakPolarHBondContact OE1-CB 3.27Å; E1610-R1679 IonicContact OE1-CZ 2.7Å; E1610-R1679 IonicContact OE1-NE 2.65Å; E1610-R1679 PolarHBondContact OE1-NE 3.3Å; E1610-R1679 IonicContact OE1-NH2 3.98Å; E1610-R1679 IonicContact OE2-CZ 2.71Å; E1610-R1679 IonicContact OE2-NE 2.67Å; E1610-R1679 PolarHBondContact OE2-NE 2.77Å; E1610-R1679 IonicContact OE2-NH2 2.6Å; E1610-R1679 PolarHBondContact OE2-NH2 3.08Å; D1675-R1679 VanDerWaalsContact CG-CD 3.48Å; D1675-R1679 PolarHBondContact O-N 3.37Å; D1675-R1679 VanDerWaalsContact OD1-CD 3.25Å; D1675-R1679 WeakPolarHBondContact OD1-CD 3.25Å; D1675-R1679 WeakPolarHBondContact OD2-CD 3.41Å; D1675-R1679 IonicContact OD2-CZ 2.67Å; D1675-R1679 IonicContact OD2-NE 3.32Å; D1675-R1679 IonicContact OD2-NH1 3.1Å; D1675-R1679 PolarHBondContact OD2-NH1 3.14Å; R1679-K1681 PolarHBondContact O-N 3.18Å; R1679-L1682 PolarHBondContact O-N 3.12Å; R1679-L1683 WeakPolarHBondContact O-CB 3.47Å; R1679-L1683 PolarHBondContact O-N 3.11Å
1680W92.5Very high88.6Confident24 Ų2454.2 Ų54.29%0.09128%0.283CS..Hα-helixtrans-55.3-48.2171169.8-118.2000112.7L1606 I1641 L1644 K1645 V1648 L1676 T1678 L1683 Q1684L1606-W1680 HydrophobicContact CD2-CB 4.03Å; L1606-W1680 HydrophobicContact CD2-CE3 4Å; I1641-W1680 HydrophobicContact CB-CZ3 4.18Å; I1641-W1680 HydrophobicContact CD1-CZ3 4.36Å; I1641-W1680 HydrophobicContact CG1-CH2 4.47Å; I1641-W1680 HydrophobicContact CG1-CZ3 4.4Å; I1641-W1680 VanDerWaalsContact O-CH2 3.26Å; I1641-W1680 WeakPolarHBondContact O-CH2 3.41Å; I1641-W1680 WeakPolarHBondContact O-CZ3 3.28Å; L1644-W1680 HydrophobicContact CB-CE3 3.79Å; L1644-W1680 HydrophobicContact CB-CH2 3.9Å; L1644-W1680 HydrophobicContact CB-CZ3 3.42Å; L1644-W1680 VanDerWaalsContact CB-CZ3 3.42Å; L1644-W1680 HydrophobicContact CD1-CE3 4.31Å; L1644-W1680 HydrophobicContact CD1-CZ3 3.96Å; L1644-W1680 HydrophobicContact CG-CZ3 4.31Å; K1645-W1680 HydrophobicContact CB-CZ2 3.89Å; V1648-W1680 HydrophobicContact CG2-CB 4.04Å; V1648-W1680 HydrophobicContact CG2-CD2 4.24Å; V1648-W1680 HydrophobicContact CG2-CG 3.77Å; L1676-W1680 WeakPolarHBondContact O-CB 3.38Å; L1676-W1680 PolarHBondContact O-N 2.73Å; T1678-W1680 PolarHBondContact O-N 2.86Å; W1680-L1683 HydrophobicContact CE3-CD2 4.39Å; W1680-L1683 HydrophobicContact CZ3-CD2 4.47Å; W1680-L1683 PolarHBondContact O-N 3.02Å; W1680-Q1684 PolarHBondContact O-N 3.48Å
1681K88.6Confident88.6Confident130 Ų13051.4 Ų51.457%0.56527%0.269SS*.Hα-helixtrans-63.9-43.2178.1-72.1169.8-176.6170.30112.2N1677 T1678 R1679 L1683 Q1684 V1685N1677-K1681 WeakPolarHBondContact O-CG 3.29Å; N1677-K1681 PolarHBondContact O-N 3.12Å; T1678-K1681 PolarHBondContact O-N 3.34Å; T1678-K1681 VanDerWaalsContact O-N 3.16Å; R1679-K1681 PolarHBondContact O-N 3.18Å; K1681-L1683 VanDerWaalsContact C-N 3.33Å; K1681-L1683 PolarHBondContact O-N 3.18Å; K1681-Q1684 PolarHBondContact O-N 3.15Å; K1681-V1685 WeakPolarHBondContact O-CG2 3.5Å; K1681-V1685 PolarHBondContact O-N 3.39Å
1682L87.8Confident88.5Confident102 Ų10253.9 Ų53.953%0.53427%0.267SS..Hα-helixtrans-65.6-34.8178.2-70.7173.4000112.5T1678 R1679 A1686T1678-L1682 HydrophobicContact CG2-CD1 4.02Å; T1678-L1682 HydrophobicContact CG2-CG 4.42Å; T1678-L1682 WeakPolarHBondContact O-CG 3.42Å; T1678-L1682 PolarHBondContact O-N 3.45Å; R1679-L1682 PolarHBondContact O-N 3.12Å; L1682-A1686 VanDerWaalsContact O-CB 3.27Å; L1682-A1686 WeakPolarHBondContact O-CB 3.41Å; L1682-A1686 PolarHBondContact O-N 3.03Å
1683L90.5Very high88.4Confident2 Ų256.5 Ų56.51%0.0128%0.277CS..Hα-helixtrans-65.8-46172.6-179.667.2000111.1L1606 A1609 K1613 I1641 R1679 W1680 K1681 A1686 V1687L1606-L1683 HydrophobicContact CD2-CD2 4.11Å; A1609-L1683 HydrophobicContact CB-CD1 4.25Å; A1609-L1683 HydrophobicContact CB-CD2 3.54Å; K1613-L1683 HydrophobicContact CB-CD1 4.41Å; K1613-L1683 HydrophobicContact CD-CD1 4.38Å; I1641-L1683 HydrophobicContact CD1-CD2 4.45Å; I1641-L1683 HydrophobicContact CD1-CG 4.36Å; I1641-L1683 HydrophobicContact CG2-CD2 4.4Å; R1679-L1683 WeakPolarHBondContact O-CB 3.47Å; R1679-L1683 PolarHBondContact O-N 3.11Å; W1680-L1683 HydrophobicContact CE3-CD2 4.39Å; W1680-L1683 HydrophobicContact CZ3-CD2 4.47Å; W1680-L1683 PolarHBondContact O-N 3.02Å; K1681-L1683 VanDerWaalsContact C-N 3.33Å; K1681-L1683 PolarHBondContact O-N 3.18Å; L1683-A1686 PolarHBondContact O-N 3.3Å; L1683-V1687 WeakPolarHBondContact O-CG2 3.32Å; L1683-V1687 PolarHBondContact O-N 3.14Å
1684Q87.2Confident88.2Confident85 Ų8555.9 Ų55.940%0.39727%0.274SS..Hα-helixtrans-59.6-48.1177.8-172.1-177.5-9.500111.9W1680 K1681 V1687 E1688W1680-Q1684 PolarHBondContact O-N 3.48Å; K1681-Q1684 PolarHBondContact O-N 3.15Å; Q1684-V1687 PolarHBondContact O-N 2.99Å; Q1684-E1688 PolarHBondContact O-N 3.19Å; Q1684-E1688 VanDerWaalsContact O-N 3.15Å
1685V88.1Confident87.6Confident80 Ų8054 Ų5449%0.48527%0.265SS..Hα-helixtrans-61.4-45.2177.4173.50000111.1K1681 V1687 E1688 D1689K1681-V1685 WeakPolarHBondContact O-CG2 3.5Å; K1681-V1685 PolarHBondContact O-N 3.39Å; V1685-V1687 VanDerWaalsContact C-N 3.31Å; V1685-V1687 PolarHBondContact O-N 3.45Å; V1685-E1688 PolarHBondContact O-N 3.07Å; V1685-E1688 VanDerWaalsContact O-N 3.15Å; V1685-D1689 PolarHBondContact O-N 3.39Å
1686A88.3Confident86.8Confident19 Ų1954.4 Ų54.416%0.15726%0.264CS..Hα-helixtrans-62.3-35.8179.900000113.3K1613 L1682 L1683 R1690K1613-A1686 HydrophobicContact CD-CB 3.82Å; K1613-A1686 VanDerWaalsContact CE-CB 3.49Å; L1682-A1686 VanDerWaalsContact O-CB 3.27Å; L1682-A1686 WeakPolarHBondContact O-CB 3.41Å; L1682-A1686 PolarHBondContact O-N 3.03Å; L1683-A1686 PolarHBondContact O-N 3.3Å; A1686-R1690 VanDerWaalsContact O-CB 3.24Å; A1686-R1690 WeakPolarHBondContact O-CB 3.48Å; A1686-R1690 PolarHBondContact O-N 3.09Å
1687V89.8Confident85.8Confident1 Ų155 Ų551%0.00627%0.27CS..Hα-helixtrans-66.6-43.6173.71710000111.1W1616 V1634 L1637 R1638 I1641 L1683 Q1684 V1685 R1690 V1691W1616-V1687 HydrophobicContact CH2-CB 4.48Å; W1616-V1687 HydrophobicContact CH2-CG2 3.86Å; W1616-V1687 HydrophobicContact CZ2-CG2 4.44Å; V1634-V1687 HydrophobicContact CG1-CG1 4.21Å; L1637-V1687 HydrophobicContact CD2-CG2 4.39Å; R1638-V1687 HydrophobicContact CB-CG1 3.74Å; R1638-V1687 HydrophobicContact CG-CG1 3.88Å; I1641-V1687 HydrophobicContact CD1-CG2 3.92Å; L1683-V1687 WeakPolarHBondContact O-CG2 3.32Å; L1683-V1687 PolarHBondContact O-N 3.14Å; Q1684-V1687 PolarHBondContact O-N 2.99Å; V1685-V1687 VanDerWaalsContact C-N 3.31Å; V1685-V1687 PolarHBondContact O-N 3.45Å; V1687-R1690 PolarHBondContact O-N 3.48Å; V1687-V1691 WeakPolarHBondContact O-CG2 3.42Å; V1687-V1691 PolarHBondContact O-N 3.44Å
1688E86.8Confident84.7Confident69 Ų6956.5 Ų56.532%0.32228%0.276SS..Hα-helixtrans-70-39.3-179.9-67.4-169.7172.500113R1638 Q1684 V1685 V1691 R1692R1638-E1688 IonicContact CZ-OE1 3.76Å; R1638-E1688 IonicContact NE-OE1 3.66Å; R1638-E1688 IonicContact NH2-OE1 2.67Å; R1638-E1688 PolarHBondContact NH2-OE1 3.16Å; Q1684-E1688 PolarHBondContact O-N 3.19Å; Q1684-E1688 VanDerWaalsContact O-N 3.15Å; V1685-E1688 PolarHBondContact O-N 3.07Å; V1685-E1688 VanDerWaalsContact O-N 3.15Å; E1688-V1691 PolarHBondContact O-N 3.17Å; E1688-R1692 PolarHBondContact O-N 3.18Å
1689D84.3Confident83.5Confident57 Ų5760.4 Ų60.431%0.30528%0.282SS..Hα-helixtrans-65-40.5173-76.1-14000111.6V1685 V1691 R1692 Q1693V1685-D1689 PolarHBondContact O-N 3.39Å; D1689-V1691 PolarHBondContact O-N 3.39Å; D1689-R1692 WeakPolarHBondContact O-CB 3.18Å; D1689-R1692 PolarHBondContact O-N 2.74Å; D1689-R1692 VanDerWaalsContact O-N 3.11Å; D1689-R1692 IonicContact OD1-CZ 3.76Å; D1689-R1692 IonicContact OD1-NH1 3.59Å; D1689-R1692 PolarHBondContact OD1-NH1 3.26Å; D1689-R1692 IonicContact OD1-NH2 3.48Å; D1689-R1692 PolarHBondContact OD1-NH2 3.08Å; D1689-Q1693 WeakPolarHBondContact O-CG 3.39Å; D1689-Q1693 PolarHBondContact O-N 3.36Å
1690R90.9Very high82.1Confident18 Ų1861.6 Ų61.67%0.06829%0.291CS..Hα-helixtrans-65-38.8176.2-176.161.9-178.2-151.4-1.3112.4W1616 Q1617 V1634 A1686 V1687 R1692 L1694W1616-R1690 HydrophobicContact CD2-CG 4.09Å; W1616-R1690 HydrophobicContact CE3-CB 3.96Å; W1616-R1690 HydrophobicContact CE3-CG 3.68Å; W1616-R1690 HydrophobicContact CH2-CB 3.92Å; W1616-R1690 HydrophobicContact CH2-CG 4.1Å; W1616-R1690 HydrophobicContact CZ2-CG 4.47Å; W1616-R1690 HydrophobicContact CZ3-CB 3.48Å; W1616-R1690 VanDerWaalsContact CZ3-CB 3.48Å; W1616-R1690 HydrophobicContact CZ3-CG 3.69Å; Q1617-R1690 PolarHBondContact O-NH1 3.18Å; Q1617-R1690 PolarHBondContact O-NH2 2.89Å; V1634-R1690 HydrophobicContact CG1-CB 4.34Å; V1634-R1690 HydrophobicContact CG1-CG 4.17Å; V1634-R1690 HydrophobicContact CG2-CG 3.95Å; A1686-R1690 VanDerWaalsContact O-CB 3.24Å; A1686-R1690 WeakPolarHBondContact O-CB 3.48Å; A1686-R1690 PolarHBondContact O-N 3.09Å; V1687-R1690 PolarHBondContact O-N 3.48Å; R1690-R1692 VanDerWaalsContact C-N 3.3Å; R1690-R1692 PolarHBondContact O-N 3.27Å; R1690-L1694 HydrophobicContact CG-CD1 4.12Å; R1690-L1694 WeakPolarHBondContact O-CB 3.34Å; R1690-L1694 WeakPolarHBondContact O-CG 3.14Å; R1690-L1694 PolarHBondContact O-N 2.93Å; R1690-L1694 VanDerWaalsContact O-N 3.12Å
1691V85Confident80.7Confident25 Ų2565.1 Ų65.115%0.15231%0.307CS..Hα-helixtrans-62.4-38.3171.9171.10000110.9V1634 V1687 E1688 D1689 H1695V1634-V1691 HydrophobicContact CB-CG2 4.35Å; V1634-V1691 HydrophobicContact CG1-CG2 3.58Å; V1687-V1691 WeakPolarHBondContact O-CG2 3.42Å; V1687-V1691 PolarHBondContact O-N 3.44Å; E1688-V1691 PolarHBondContact O-N 3.17Å; D1689-V1691 PolarHBondContact O-N 3.39Å; V1691-H1695 WeakPolarHBondContact CG1-ND1 3.49Å; V1691-H1695 PolarHBondContact O-N 3.21Å; V1691-H1695 VanDerWaalsContact O-N 3.15Å; V1691-H1695 PolarHBondContact O-ND1 3.02Å
1692R79.7Confident79.4Confident126 Ų12659 Ų5948%0.47528%0.282SS..Hα-helixtrans-65-53.3177.8-162.5-174.2-52.4118.618.1111.6E1688 D1689 R1690 L1694 H1695 E1696E1688-R1692 PolarHBondContact O-N 3.18Å; D1689-R1692 WeakPolarHBondContact O-CB 3.18Å; D1689-R1692 PolarHBondContact O-N 2.74Å; D1689-R1692 VanDerWaalsContact O-N 3.11Å; D1689-R1692 IonicContact OD1-CZ 3.76Å; D1689-R1692 IonicContact OD1-NH1 3.59Å; D1689-R1692 PolarHBondContact OD1-NH1 3.26Å; D1689-R1692 IonicContact OD1-NH2 3.48Å; D1689-R1692 PolarHBondContact OD1-NH2 3.08Å; R1690-R1692 VanDerWaalsContact C-N 3.3Å; R1690-R1692 PolarHBondContact O-N 3.27Å; R1692-L1694 VanDerWaalsContact C-N 3.32Å; R1692-L1694 PolarHBondContact O-N 3.32Å; R1692-H1695 PolarHBondContact O-N 2.95Å; R1692-H1695 VanDerWaalsContact O-N 3.12Å; R1692-E1696 WeakPolarHBondContact CG-OE1 3.44Å; R1692-E1696 WeakPolarHBondContact O-CG 3.17Å; R1692-E1696 PolarHBondContact O-N 2.96Å
1693Q83.6Confident77.8Confident92 Ų9260.1 Ų60.143%0.4330%0.295SS..Hα-helixtrans-58-41.1180-67.4171.3-0.300112.6V1619 D1689 E1696 A1697V1619-Q1693 HydrophobicContact CG2-CB 4Å; D1689-Q1693 WeakPolarHBondContact O-CG 3.39Å; D1689-Q1693 PolarHBondContact O-N 3.36Å; Q1693-E1696 PolarHBondContact O-N 2.91Å; Q1693-A1697 WeakPolarHBondContact O-CB 3.48Å; Q1693-A1697 PolarHBondContact O-N 3.32Å
1694L84.7Confident76Confident0 Ų063.3 Ų63.30%032%0.321CS..Hα-helixtrans-69.1-36.5177.5-72.8171.2000112.5V1619 L1622 L1627 H1630 L1631 V1634 R1690 R1692 H1698V1619-L1694 HydrophobicContact CG1-CD2 4.16Å; V1619-L1694 HydrophobicContact CG2-CD2 4.07Å; V1619-L1694 HydrophobicContact CG2-CG 4.39Å; L1622-L1694 HydrophobicContact CD1-CD2 3.58Å; L1627-L1694 HydrophobicContact CD2-CD2 4.02Å; H1630-L1694 HydrophobicContact CB-CD1 4.18Å; H1630-L1694 HydrophobicContact CB-CD2 4.14Å; L1631-L1694 HydrophobicContact CD1-CB 3.61Å; V1634-L1694 HydrophobicContact CG2-CD1 3.97Å; R1690-L1694 HydrophobicContact CG-CD1 4.12Å; R1690-L1694 WeakPolarHBondContact O-CB 3.34Å; R1690-L1694 WeakPolarHBondContact O-CG 3.14Å; R1690-L1694 PolarHBondContact O-N 2.93Å; R1690-L1694 VanDerWaalsContact O-N 3.12Å; R1692-L1694 VanDerWaalsContact C-N 3.32Å; R1692-L1694 PolarHBondContact O-N 3.32Å; L1694-H1698 WeakPolarHBondContact O-CB 3.41Å; L1694-H1698 PolarHBondContact O-N 3.43Å
1695H75.2Confident75Confident87 Ų8760.8 Ų60.840%0.40331%0.313SS..Hα-helixtrans-66.5-39.3171.6-78.7100.4000111.9V1691 R1692 R1699V1691-H1695 WeakPolarHBondContact CG1-ND1 3.49Å; V1691-H1695 PolarHBondContact O-N 3.21Å; V1691-H1695 VanDerWaalsContact O-N 3.15Å; V1691-H1695 PolarHBondContact O-ND1 3.02Å; R1692-H1695 PolarHBondContact O-N 2.95Å; R1692-H1695 VanDerWaalsContact O-N 3.12Å; H1695-R1699 VanDerWaalsContact O-CB 3.23Å; H1695-R1699 WeakPolarHBondContact O-CB 3.32Å; H1695-R1699 PolarHBondContact O-N 2.89Å
1696E73Confident74.2Confident82 Ų8257.9 Ų57.938%0.38329%0.294SS..Hα-helixtrans-65-51.1178.4-73.7165.8175.100111.2R1692 Q1693 H1698 R1699 D1700R1692-E1696 WeakPolarHBondContact CG-OE1 3.44Å; R1692-E1696 WeakPolarHBondContact O-CG 3.17Å; R1692-E1696 PolarHBondContact O-N 2.96Å; Q1693-E1696 PolarHBondContact O-N 2.91Å; E1696-H1698 VanDerWaalsContact C-N 3.34Å; E1696-H1698 PolarHBondContact O-N 2.89Å; E1696-R1699 WeakPolarHBondContact O-CB 3.45Å; E1696-R1699 PolarHBondContact O-N 3.2Å; E1696-R1699 VanDerWaalsContact O-N 3.13Å; E1696-D1700 WeakPolarHBondContact O-CB 3.33Å; E1696-D1700 PolarHBondContact O-N 3.26Å
1697A71.2Confident73.5Confident15 Ų1561.8 Ų61.812%0.12431%0.309CS..Hα-helixtrans-60.9-40.4175.700000112.7V1619 L1627 Q1693 R1699 D1700 F1701V1619-A1697 HydrophobicContact CG1-CB 3.42Å; V1619-A1697 VanDerWaalsContact CG1-CB 3.42Å; L1627-A1697 HydrophobicContact CD1-CB 4.21Å; L1627-A1697 HydrophobicContact CD2-CB 4.27Å; Q1693-A1697 WeakPolarHBondContact O-CB 3.48Å; Q1693-A1697 PolarHBondContact O-N 3.32Å; A1697-R1699 VanDerWaalsContact C-N 3.33Å; A1697-R1699 PolarHBondContact O-N 3.46Å; A1697-D1700 PolarHBondContact O-N 3.28Å; A1697-F1701 PolarHBondContact O-N 3.36Å
1698H69Low73.1Confident63 Ų6365.4 Ų65.429%0.29233%0.325SS..Hα-helixtrans-68.4-32.3176.4-171.349.5000112.5L1627 L1694 E1696 G1702L1627-H1698 HydrophobicContact CB-CB 4.25Å; L1627-H1698 HydrophobicContact CD1-CB 4.44Å; L1694-H1698 WeakPolarHBondContact O-CB 3.41Å; L1694-H1698 PolarHBondContact O-N 3.43Å; E1696-H1698 VanDerWaalsContact C-N 3.34Å; E1696-H1698 PolarHBondContact O-N 2.89Å; H1698-G1702 VanDerWaalsContact O-CA 3.23Å; H1698-G1702 WeakPolarHBondContact O-CA 3.27Å; H1698-G1702 PolarHBondContact O-N 3.08Å
1699R63.4Low73.1Confident155 Ų15562.1 Ų62.159%0.58531%0.309SS*.Hα-helixtrans-68.8-41.7173.2-173.7-163.875.7-164-4.1112.1H1695 E1696 A1697H1695-R1699 VanDerWaalsContact O-CB 3.23Å; H1695-R1699 WeakPolarHBondContact O-CB 3.32Å; H1695-R1699 PolarHBondContact O-N 2.89Å; E1696-R1699 WeakPolarHBondContact O-CB 3.45Å; E1696-R1699 PolarHBondContact O-N 3.2Å; E1696-R1699 VanDerWaalsContact O-N 3.13Å; A1697-R1699 VanDerWaalsContact C-N 3.33Å; A1697-R1699 PolarHBondContact O-N 3.46Å
1700D63.9Low73Confident62 Ų6261.7 Ų61.733%0.33231%0.311SS..Hα-helixtrans-90-25.9-168.3-66.7-15.9000113.5E1696 A1697 S1705E1696-D1700 WeakPolarHBondContact O-CB 3.33Å; E1696-D1700 PolarHBondContact O-N 3.26Å; A1697-D1700 PolarHBondContact O-N 3.28Å; D1700-S1705 WeakPolarHBondContact O-CB 3.31Å
1701F63Low72.7Confident97 Ų9765.1 Ų65.143%0.42533%0.334SS..Hα-helixtrans-122.4-9.4179.3-58-72.4000114.8I1624 A1697 H1707I1624-F1701 HydrophobicContact CD1-CB 4.06Å; I1624-F1701 HydrophobicContact CG1-CB 4.19Å; I1624-F1701 VanDerWaalsContact CG2-O 3.22Å; I1624-F1701 WeakPolarHBondContact CG2-O 3.46Å; A1697-F1701 PolarHBondContact O-N 3.36Å; F1701-H1707 AromaticContact CE1-CD2 3.72Å; F1701-H1707 AromaticContact CE1-NE2 3.78Å
1702G61.5Low72.8Confident3 Ų364.1 Ų64.13%0.03133%0.328CS..SBendtrans-63.5174.4179.700000113.8H1698 A1704 S1705H1698-G1702 VanDerWaalsContact O-CA 3.23Å; H1698-G1702 WeakPolarHBondContact O-CA 3.27Å; H1698-G1702 PolarHBondContact O-N 3.08Å; G1702-A1704 PolarHBondContact O-N 3.45Å; G1702-S1705 VanDerWaalsContact O-CB 3.23Å; G1702-S1705 WeakPolarHBondContact O-CB 3.35Å; G1702-S1705 PolarHBondContact O-N 3.47Å; G1702-S1705 PolarHBondContact O-OG 2.91Å
1703P55.3Low73.3Confident125 Ų12558.8 Ų58.881%0.81231%0.31SS*.THydrogen-bonded Turntrans-59.4-12.4-173.6-26.735.5000116.4
1704A53.5Low73.3Confident68 Ų6861.7 Ų61.756%0.56232%0.323SS*.THydrogen-bonded Turntrans-99.96.4176.100000113.8G1702 L1804G1702-A1704 PolarHBondContact O-N 3.45Å; A1704-L1804 HydrophobicContact CB-CD2 3.92Å; A1704-L1804 WeakPolarHBondContact O-CD1 3.46Å
1705S64.2Low72.9Confident32 Ų3265.3 Ų65.322%0.22436%0.36CS..  trans-76.3139.3-176.363.20000112.6D1700 G1702 H1707D1700-S1705 WeakPolarHBondContact O-CB 3.31Å; G1702-S1705 VanDerWaalsContact O-CB 3.23Å; G1702-S1705 WeakPolarHBondContact O-CB 3.35Å; G1702-S1705 PolarHBondContact O-N 3.47Å; G1702-S1705 PolarHBondContact O-OG 2.91Å; S1705-H1707 PolarHBondContact O-N 3.02Å
1706Q72.7Confident73.5Confident19 Ų1963.6 Ų63.69%0.08936%0.357CS..  trans-86.914.2173.7-59.7-176.717.300112.4F1708 L1709 R1719 I1721 L1804 I1807Q1706-F1708 VanDerWaalsContact C-N 3.25Å; Q1706-F1708 PolarHBondContact O-N 3.37Å; Q1706-F1708 VanDerWaalsContact O-N 3.14Å; Q1706-L1709 WeakPolarHBondContact O-CB 3.05Å; Q1706-L1709 PolarHBondContact O-N 2.71Å; Q1706-R1719 VanDerWaalsContact OE1-NH2 3.08Å; Q1706-I1721 HydrophobicContact CB-CD1 3.96Å; Q1706-I1721 HydrophobicContact CG-CD1 4.2Å; Q1706-L1804 HydrophobicContact CG-CD1 4.27Å; Q1706-I1807 HydrophobicContact CG-CD1 3.75Å
1707H73Confident74.3Confident101 Ų10162.7 Ų62.747%0.46835%0.35SS..G310 helixtrans-60.1-31.7-165.7-173-82.6000113.3F1701 S1705 L1709 S1710F1701-H1707 AromaticContact CE1-CD2 3.72Å; F1701-H1707 AromaticContact CE1-NE2 3.78Å; S1705-H1707 PolarHBondContact O-N 3.02Å; H1707-L1709 PolarHBondContact O-N 2.97Å; H1707-S1710 VanDerWaalsContact O-CB 3.26Å; H1707-S1710 WeakPolarHBondContact O-CB 3.41Å; H1707-S1710 PolarHBondContact O-N 3.33Å; H1707-S1710 PolarHBondContact O-OG 3.15Å
1708F80.8Confident75.1Confident77 Ų7766.5 Ų66.534%0.33837%0.365SS..G310 helixtrans-60.2-28.2177.880.7-83000113.3Q1706 S1710 T1711 I1807 T1811 P1828Q1706-F1708 VanDerWaalsContact C-N 3.25Å; Q1706-F1708 PolarHBondContact O-N 3.37Å; Q1706-F1708 VanDerWaalsContact O-N 3.14Å; F1708-S1710 VanDerWaalsContact C-N 3.26Å; F1708-S1710 PolarHBondContact O-N 3.22Å; F1708-T1711 PolarHBondContact O-OG1 2.94Å; F1708-I1807 HydrophobicContact CE1-CG2 4.13Å; F1708-I1807 HydrophobicContact CZ-CG2 4.06Å; F1708-T1811 HydrophobicContact CE2-CG2 4.35Å; F1708-T1811 HydrophobicContact CZ-CG2 4.18Å; F1708-T1811 WeakPolarHBondContact CZ-OG1 3.3Å; F1708-P1828 HydrophobicContact CD2-CG 4.34Å
1709L86.5Confident76.1Confident0 Ų064.7 Ų64.70%036%0.356CS..G310 helixtrans-74.1-10.6176.3-60.5178.4000113.6Q1706 H1707 T1711 S1712 R1719 I1807 P1828 V1831 D1832Q1706-L1709 WeakPolarHBondContact O-CB 3.05Å; Q1706-L1709 PolarHBondContact O-N 2.71Å; H1707-L1709 PolarHBondContact O-N 2.97Å; L1709-T1711 PolarHBondContact O-N 2.85Å; L1709-T1711 VanDerWaalsContact O-N 3.11Å; L1709-S1712 VanDerWaalsContact O-CB 3.3Å; L1709-S1712 WeakPolarHBondContact O-CB 3.45Å; L1709-S1712 PolarHBondContact O-N 2.7Å; L1709-S1712 PolarHBondContact O-OG 3.11Å; L1709-R1719 VanDerWaalsContact O-CD 3.3Å; L1709-R1719 WeakPolarHBondContact O-CD 3.49Å; L1709-I1807 HydrophobicContact CD1-CD1 3.81Å; L1709-I1807 HydrophobicContact CD1-CG1 4.1Å; L1709-I1807 HydrophobicContact CD1-CG2 4.08Å; L1709-P1828 HydrophobicContact CD2-CB 4.38Å; L1709-P1828 WeakPolarHBondContact CD2-O 3.38Å; L1709-V1831 HydrophobicContact CD1-CG1 4.2Å; L1709-V1831 HydrophobicContact CD2-CB 3.89Å; L1709-V1831 HydrophobicContact CD2-CG1 3.76Å; L1709-D1832 HydrophobicContact CD2-CB 4.38Å
1710S83.1Confident77.3Confident49 Ų4958 Ų5834%0.34333%0.334SS..G310 helixtrans-55.9-27.7172.559.20000112.6H1707 F1708 S1712 V1713H1707-S1710 VanDerWaalsContact O-CB 3.26Å; H1707-S1710 WeakPolarHBondContact O-CB 3.41Å; H1707-S1710 PolarHBondContact O-N 3.33Å; H1707-S1710 PolarHBondContact O-OG 3.15Å; F1708-S1710 VanDerWaalsContact C-N 3.26Å; F1708-S1710 PolarHBondContact O-N 3.22Å; S1710-S1712 VanDerWaalsContact C-N 3.29Å; S1710-S1712 PolarHBondContact O-N 3.05Å; S1710-V1713 WeakPolarHBondContact O-CG2 3.43Å
1711T84.8Confident78.2Confident89 Ų8958.3 Ų58.355%0.54634%0.335SS..G310 helixtrans-78.5-2.3177.9650000114.8F1708 L1709 V1713 P1828F1708-T1711 PolarHBondContact O-OG1 2.94Å; L1709-T1711 PolarHBondContact O-N 2.85Å; L1709-T1711 VanDerWaalsContact O-N 3.11Å; T1711-V1713 VanDerWaalsContact C-N 3.28Å; T1711-P1828 WeakPolarHBondContact OG1-CB 3.34Å
1712S87.4Confident79.1Confident5 Ų554.3 Ų54.34%0.03532%0.319CS..G310 helixtrans-65.7-34.3175.267.90000112L1709 S1710 H1741 D1832L1709-S1712 VanDerWaalsContact O-CB 3.3Å; L1709-S1712 WeakPolarHBondContact O-CB 3.45Å; L1709-S1712 PolarHBondContact O-N 2.7Å; L1709-S1712 PolarHBondContact O-OG 3.11Å; S1710-S1712 VanDerWaalsContact C-N 3.29Å; S1710-S1712 PolarHBondContact O-N 3.05Å; S1712-H1741 PolarHBondContact O-NE2 3.41Å; S1712-D1832 WeakPolarHBondContact CB-OD2 3.38Å; S1712-D1832 PolarHBondContact OG-OD2 3.01Å
1713V88.6Confident79.7Confident14 Ų1460.5 Ų60.59%0.08536%0.359CS..SBendtrans-100.5157.8178.1-68.60000111.6S1710 T1711 W1717 R1719 Y1729 P1742S1710-V1713 WeakPolarHBondContact O-CG2 3.43Å; T1711-V1713 VanDerWaalsContact C-N 3.28Å; V1713-W1717 HydrophobicContact CB-CB 4.03Å; V1713-W1717 HydrophobicContact CG1-CB 4.3Å; V1713-R1719 HydrophobicContact CG2-CB 3.94Å; V1713-Y1729 HydrophobicContact CG1-CD1 3.83Å; V1713-Y1729 HydrophobicContact CG1-CE1 4.15Å; V1713-P1742 HydrophobicContact CG1-CG 3.9Å
1714Q83.7Confident80.7Confident153 Ų15358.1 Ų58.172%0.71534%0.339SS*.  trans-126.6147.6174.5-65.8-177.9-12.600108.6W1717Q1714-W1717 WeakPolarHBondContact O-CB 3.33Å; Q1714-W1717 PolarHBondContact O-N 3.47Å
1715G77.1Confident82Confident75 Ų7560.4 Ų60.477%0.77334%0.336SS*.THydrogen-bonded Turntrans-51.2134.4176.900000111.3
1716P87Confident83.1Confident52 Ų5259 Ų5934%0.33833%0.326SS..THydrogen-bonded Turncis-87.611.217.136-38.5000116.2H1732 E1733P1716-H1732 PolarHBondContact O-CD2 3.3Å; P1716-H1732 PolarHBondContact O-N 3.47Å; P1716-E1733 HydrophobicContact CB-CB 3.89Å; P1716-E1733 HydrophobicContact CG-CB 3.87Å
1717W90.1Very high83.9Confident63 Ų6358.2 Ų58.224%0.23932%0.323CS..EExtended strand (participates in β ladder)trans-91139.7-179.9-68.989.1000113.5V1713 Q1714 I1730 N1731 C1738 P1742V1713-W1717 HydrophobicContact CB-CB 4.03Å; V1713-W1717 HydrophobicContact CG1-CB 4.3Å; Q1714-W1717 WeakPolarHBondContact O-CB 3.33Å; Q1714-W1717 PolarHBondContact O-N 3.47Å; W1717-I1730 CarbonylContact C-O 3.59Å; W1717-I1730 WeakPolarHBondContact CA-O 3.46Å; W1717-N1731 HydrophobicContact CD2-CB 3.91Å; W1717-N1731 HydrophobicContact CE3-CB 3.79Å; W1717-N1731 HydrophobicContact CH2-CB 3.71Å; W1717-N1731 HydrophobicContact CZ2-CB 3.79Å; W1717-N1731 WeakPolarHBondContact CZ2-ND2 3.32Å; W1717-N1731 HydrophobicContact CZ3-CB 3.69Å; W1717-C1738 VanDerWaalsContact CZ3-SG 3.5Å; W1717-P1742 HydrophobicContact CB-CG 4.23Å; W1717-P1742 HydrophobicContact CD2-CB 3.88Å; W1717-P1742 HydrophobicContact CD2-CG 3.87Å; W1717-P1742 HydrophobicContact CE3-CB 4.42Å; W1717-P1742 HydrophobicContact CE3-CG 4.28Å; W1717-P1742 HydrophobicContact CG-CB 4.12Å; W1717-P1742 HydrophobicContact CG-CG 3.85Å; W1717-P1742 HydrophobicContact CZ2-CB 4.09Å
1718E89.5Confident84.9Confident95 Ų9556.6 Ų56.644%0.44431%0.313SS..EExtended strand (participates in β ladder)trans-122.5147.1172.7-175.5-177.8161.700110.9Y1729 I1730 H1732E1718-Y1729 CarbonylContact O-C 3.57Å; E1718-Y1729 WeakPolarHBondContact O-CA 3.4Å; E1718-I1730 HydrophobicContact CB-CB 4.42Å; E1718-I1730 PolarHBondContact N-O 3.36Å; E1718-I1730 PolarHBondContact O-N 3.33Å; E1718-H1732 IonicContact OE2-CD2 2.68Å; E1718-H1732 IonicContact OE2-CE1 3.15Å; E1718-H1732 PolarHBondContact OE2-CE1 3.24Å; E1718-H1732 IonicContact OE2-NE2 2.74Å; E1718-H1732 PolarHBondContact OE2-NE2 3.46Å
1719R89.4Confident85.5Confident24 Ų2453 Ų539%0.09130%0.297CS..EExtended strand (participates in β ladder)trans-104116.5177.1-179.5-170.7-169.9-84.12.3110.2Q1706 L1709 V1713 Y1729 D1832Q1706-R1719 VanDerWaalsContact OE1-NH2 3.08Å; L1709-R1719 VanDerWaalsContact O-CD 3.3Å; L1709-R1719 WeakPolarHBondContact O-CD 3.49Å; V1713-R1719 HydrophobicContact CG2-CB 3.94Å; R1719-Y1729 HydrophobicContact CB-CD1 4.17Å; R1719-Y1729 HydrophobicContact CB-CE1 4.19Å; R1719-Y1729 HydrophobicContact CG-CD1 4.22Å; R1719-Y1729 HydrophobicContact CG-CE1 3.83Å; R1719-D1832 VanDerWaalsContact CD-OD2 3.26Å; R1719-D1832 WeakPolarHBondContact CD-OD2 3.47Å; R1719-D1832 IonicContact CZ-OD1 3.92Å; R1719-D1832 VanDerWaalsContact CZ-OD1 3.27Å; R1719-D1832 IonicContact CZ-OD2 3.85Å; R1719-D1832 IonicContact NE-OD1 2.79Å; R1719-D1832 PolarHBondContact NE-OD1 3.37Å; R1719-D1832 IonicContact NE-OD2 3.53Å; R1719-D1832 PolarHBondContact NE-OD2 2.69Å; R1719-D1832 IonicContact NH2-OD1 3.94Å; R1719-D1832 PolarHBondContact NH2-OD1 2.94Å
1720A87.3Confident85.7Confident16 Ų1654.7 Ų54.713%0.13231%0.306CS..EExtended strand (participates in β ladder)trans-115.9169.7176.900000111.6P1727 Y1728 I1730A1720-P1727 WeakPolarHBondContact O-CA 3.44Å; A1720-Y1728 HydrophobicContact CB-CD1 4.19Å; A1720-Y1728 HydrophobicContact CB-CD2 4.19Å; A1720-Y1728 HydrophobicContact CB-CE1 3.67Å; A1720-Y1728 HydrophobicContact CB-CE2 3.67Å; A1720-Y1728 HydrophobicContact CB-CG 4.43Å; A1720-Y1728 PolarHBondContact N-O 3.04Å; A1720-Y1728 PolarHBondContact O-N 3.48Å; A1720-Y1728 VanDerWaalsContact O-O 3.04Å; A1720-I1730 HydrophobicContact CB-CD1 3.96Å; A1720-I1730 HydrophobicContact CB-CG1 4.36Å
1721I83.4Confident86.1Confident68 Ų6853 Ų5335%0.34929%0.293SS..EExtended strand (participates in β ladder)trans-131.8130.9-174.9-56.3173.4000109.6Q1706 K1725Q1706-I1721 HydrophobicContact CB-CD1 3.96Å; Q1706-I1721 HydrophobicContact CG-CD1 4.2Å; I1721-K1725 HydrophobicContact CG2-CB 4.46Å; I1721-K1725 HydrophobicContact CG2-CD 4.38Å
1722S82.5Confident86Confident12 Ų1253.9 Ų53.98%0.08429%0.291CS..  trans-74.3168.2178.170.10000112.6N1724 K1725 V1726S1722-N1724 PolarHBondContact O-N 3.4Å; S1722-N1724 PolarHBondContact OG-OD1 3.07Å; S1722-K1725 WeakPolarHBondContact O-CA 3.28Å; S1722-K1725 PolarHBondContact O-N 3.27Å; S1722-V1726 WeakPolarHBondContact CB-O 3.33Å; S1722-V1726 PolarHBondContact N-O 2.82Å; S1722-V1726 WeakPolarHBondContact OG-CA 3.29Å; S1722-V1726 WeakPolarHBondContact OG-CB 3.48Å; S1722-V1726 PolarHBondContact OG-N 2.84Å; S1722-V1726 PolarHBondContact OG-O 2.62Å; S1722-V1726 VanDerWaalsContact OG-O 3.07Å
1723P73.7Confident85.8Confident134 Ų13461 Ų6187%0.8732%0.324SS*.THydrogen-bonded Turntrans-56.3-35.3176.8-27.736.6000114.1K1725P1723-K1725 VanDerWaalsContact C-N 3.25Å; P1723-K1725 PolarHBondContact O-N 3.14Å
1724N76.1Confident85.6Confident75 Ų7564.1 Ų64.140%0.40134%0.343SS..THydrogen-bonded Turntrans-88.721.6175.163.7-7.8000113.9S1722 V1726 R1846S1722-N1724 PolarHBondContact O-N 3.4Å; S1722-N1724 PolarHBondContact OG-OD1 3.07Å; N1724-V1726 VanDerWaalsContact C-N 3.27Å; N1724-V1726 PolarHBondContact O-N 2.97Å; N1724-R1846 PolarHBondContact ND2-O 3.13Å
1725K81.2Confident85.7Confident116 Ų11665.4 Ų65.450%0.50435%0.349SS..SBendtrans68.712.2172.7-49.7-58.4-177.1177.70116.1I1721 S1722 P1723 I1803I1721-K1725 HydrophobicContact CG2-CB 4.46Å; I1721-K1725 HydrophobicContact CG2-CD 4.38Å; S1722-K1725 WeakPolarHBondContact O-CA 3.28Å; S1722-K1725 PolarHBondContact O-N 3.27Å; P1723-K1725 VanDerWaalsContact C-N 3.25Å; P1723-K1725 PolarHBondContact O-N 3.14Å; K1725-I1803 VanDerWaalsContact O-CD1 3.29Å; K1725-I1803 WeakPolarHBondContact O-CD1 3.33Å; K1725-I1803 WeakPolarHBondContact O-CG2 3.47Å
1726V87.3Confident85.9Confident2 Ų265.4 Ų65.41%0.01233%0.334CS..  trans-77.4126.1175-175.80000110S1722 N1724 W1739 I1803 L1839 R1846S1722-V1726 WeakPolarHBondContact CB-O 3.33Å; S1722-V1726 PolarHBondContact N-O 2.82Å; S1722-V1726 WeakPolarHBondContact OG-CA 3.29Å; S1722-V1726 WeakPolarHBondContact OG-CB 3.48Å; S1722-V1726 PolarHBondContact OG-N 2.84Å; S1722-V1726 PolarHBondContact OG-O 2.62Å; S1722-V1726 VanDerWaalsContact OG-O 3.07Å; N1724-V1726 VanDerWaalsContact C-N 3.27Å; N1724-V1726 PolarHBondContact O-N 2.97Å; V1726-W1739 HydrophobicContact CB-CZ3 4.01Å; V1726-W1739 HydrophobicContact CG1-CE3 3.77Å; V1726-W1739 HydrophobicContact CG1-CZ3 3.56Å; V1726-I1803 HydrophobicContact CB-CD1 4.17Å; V1726-I1803 HydrophobicContact CG2-CD1 3.82Å; V1726-L1839 HydrophobicContact CG1-CD1 4.41Å; V1726-R1846 HydrophobicContact CG1-CB 4.44Å; V1726-R1846 HydrophobicContact CG2-CB 4.38Å
1727P90.3Very high86Confident2 Ų267.5 Ų67.51%0.01335%0.346CS..EExtended strand (participates in β ladder)trans-70.7141.3175.229.5-34.2000111.3A1720 L1835 L1839A1720-P1727 WeakPolarHBondContact O-CA 3.44Å; P1727-L1835 HydrophobicContact CG-CD2 3.95Å; P1727-L1839 HydrophobicContact CG-CD1 4.35Å
1728Y92.7Very high85.9Confident68 Ų6866.3 Ų66.327%0.26735%0.346SS..EExtended strand (participates in β ladder)trans-137.5160.2169.369.6-84.3000109.4A1720 I1730 T1737A1720-Y1728 HydrophobicContact CB-CD1 4.19Å; A1720-Y1728 HydrophobicContact CB-CD2 4.19Å; A1720-Y1728 HydrophobicContact CB-CE1 3.67Å; A1720-Y1728 HydrophobicContact CB-CE2 3.67Å; A1720-Y1728 HydrophobicContact CB-CG 4.43Å; A1720-Y1728 PolarHBondContact N-O 3.04Å; A1720-Y1728 PolarHBondContact O-N 3.48Å; A1720-Y1728 VanDerWaalsContact O-O 3.04Å; Y1728-I1730 HydrophobicContact CD2-CG1 4.2Å; Y1728-I1730 HydrophobicContact CE2-CD1 4Å; Y1728-I1730 HydrophobicContact CE2-CG1 3.88Å; Y1728-T1737 HydrophobicContact CE2-CG2 4.48Å
1729Y94.4Very high86Confident0 Ų067 Ų670%035%0.345CS..EExtended strand (participates in β ladder)trans-122138.5-169.8-52.5-85.7000109.9V1713 E1718 R1719 T1737 C1738 D1740 H1741 D1832V1713-Y1729 HydrophobicContact CG1-CD1 3.83Å; V1713-Y1729 HydrophobicContact CG1-CE1 4.15Å; E1718-Y1729 CarbonylContact O-C 3.57Å; E1718-Y1729 WeakPolarHBondContact O-CA 3.4Å; R1719-Y1729 HydrophobicContact CB-CD1 4.17Å; R1719-Y1729 HydrophobicContact CB-CE1 4.19Å; R1719-Y1729 HydrophobicContact CG-CD1 4.22Å; R1719-Y1729 HydrophobicContact CG-CE1 3.83Å; Y1729-T1737 CarbonylContact O-C 3.57Å; Y1729-T1737 VanDerWaalsContact O-CA 3.22Å; Y1729-T1737 WeakPolarHBondContact O-CA 3.49Å; Y1729-C1738 PolarHBondContact N-O 3.48Å; Y1729-C1738 PolarHBondContact O-N 2.94Å; Y1729-D1740 VanDerWaalsContact CD2-C 3.41Å; Y1729-D1740 WeakPolarHBondContact CD2-O 3.39Å; Y1729-H1741 HydrophobicContact CD2-CB 4.39Å; Y1729-H1741 HydrophobicContact CE1-CB 4.13Å; Y1729-H1741 AromaticContact CE1-CD2 3.52Å; Y1729-H1741 VanDerWaalsContact CE2-CA 3.46Å; Y1729-H1741 HydrophobicContact CE2-CB 3.81Å; Y1729-H1741 VanDerWaalsContact CE2-N 3.33Å; Y1729-H1741 AromaticContact CZ-CD2 3.79Å; Y1729-D1832 PolarHBondContact OH-OD2 3.29Å
1730I91.2Very high86.1Confident37 Ų3768 Ų6819%0.1935%0.352CS..EExtended strand (participates in β ladder)trans-114125.9-176.5-50.1178.9000107.3W1717 E1718 A1720 Y1728 T1737W1717-I1730 CarbonylContact C-O 3.59Å; W1717-I1730 WeakPolarHBondContact CA-O 3.46Å; E1718-I1730 HydrophobicContact CB-CB 4.42Å; E1718-I1730 PolarHBondContact N-O 3.36Å; E1718-I1730 PolarHBondContact O-N 3.33Å; A1720-I1730 HydrophobicContact CB-CD1 3.96Å; A1720-I1730 HydrophobicContact CB-CG1 4.36Å; Y1728-I1730 HydrophobicContact CD2-CG1 4.2Å; Y1728-I1730 HydrophobicContact CE2-CD1 4Å; Y1728-I1730 HydrophobicContact CE2-CG1 3.88Å; I1730-T1737 HydrophobicContact CB-CG2 4.46Å; I1730-T1737 HydrophobicContact CG1-CG2 4.05Å; I1730-T1737 HydrophobicContact CG2-CG2 4.29Å
1731N89.6Confident86.5Confident13 Ų1367.3 Ų67.37%0.0735%0.346CS..EExtended strand (participates in β ladder)trans-100.4109.9170-173.4-11.4000109.4W1717 E1733 T1734 Q1735 T1736W1717-N1731 HydrophobicContact CD2-CB 3.91Å; W1717-N1731 HydrophobicContact CE3-CB 3.79Å; W1717-N1731 HydrophobicContact CH2-CB 3.71Å; W1717-N1731 HydrophobicContact CZ2-CB 3.79Å; W1717-N1731 WeakPolarHBondContact CZ2-ND2 3.32Å; W1717-N1731 HydrophobicContact CZ3-CB 3.69Å; N1731-E1733 VanDerWaalsContact C-N 3.3Å; N1731-E1733 PolarHBondContact O-N 2.84Å; N1731-E1733 WeakPolarHBondContact OD1-CB 3.45Å; N1731-E1733 PolarHBondContact OD1-N 2.97Å; N1731-T1734 WeakPolarHBondContact CB-OG1 3.44Å; N1731-T1734 VanDerWaalsContact CG-OG1 3.23Å; N1731-T1734 PolarHBondContact ND2-OG1 3.22Å; N1731-Q1735 WeakPolarHBondContact O-CA 3.25Å; N1731-Q1735 PolarHBondContact O-N 2.92Å; N1731-T1736 PolarHBondContact N-O 2.97Å; N1731-T1736 PolarHBondContact O-N 3.15Å
1732H83Confident86.9Confident107 Ų10764.6 Ų64.650%0.49533%0.333SS..THydrogen-bonded Turntrans-72-21.7-180-68.7-68.5000113.5P1716 E1718P1716-H1732 PolarHBondContact O-CD2 3.3Å; P1716-H1732 PolarHBondContact O-N 3.47Å; E1718-H1732 IonicContact OE2-CD2 2.68Å; E1718-H1732 IonicContact OE2-CE1 3.15Å; E1718-H1732 PolarHBondContact OE2-CE1 3.24Å; E1718-H1732 IonicContact OE2-NE2 2.74Å; E1718-H1732 PolarHBondContact OE2-NE2 3.46Å
1733E84.8Confident87.3Confident155 Ų15567.9 Ų67.972%0.72435%0.346SS*.THydrogen-bonded Turntrans-76-38.5176.7-173.4179-167.300112P1716 N1731P1716-E1733 HydrophobicContact CB-CB 3.89Å; P1716-E1733 HydrophobicContact CG-CB 3.87Å; N1731-E1733 VanDerWaalsContact C-N 3.3Å; N1731-E1733 PolarHBondContact O-N 2.84Å; N1731-E1733 WeakPolarHBondContact OD1-CB 3.45Å; N1731-E1733 PolarHBondContact OD1-N 2.97Å
1734T84Confident88.3Confident79 Ų7961.5 Ų61.549%0.48531%0.305SS..THydrogen-bonded Turntrans-102.4-3.3-179.458.40000114.4N1731 T1736N1731-T1734 WeakPolarHBondContact CB-OG1 3.44Å; N1731-T1734 VanDerWaalsContact CG-OG1 3.23Å; N1731-T1734 PolarHBondContact ND2-OG1 3.22Å; T1734-T1736 VanDerWaalsContact C-N 3.25Å; T1734-T1736 PolarHBondContact O-N 2.84Å; T1734-T1736 PolarHBondContact OG1-OG1 3.22Å
1735Q85.3Confident88.9Confident181 Ų18159.9 Ų59.985%0.84630%0.298SS*.THydrogen-bonded Turntrans53.838.5-176.1-57.5-177.8-2.100113.4N1731N1731-Q1735 WeakPolarHBondContact O-CA 3.25Å; N1731-Q1735 PolarHBondContact O-N 2.92Å
1736T82Confident89.4Confident74 Ų7459.9 Ų59.945%0.45430%0.299SS..EExtended strand (participates in β ladder)trans-121.3152.9-179.551.90000111.8N1731 T1734N1731-T1736 PolarHBondContact N-O 2.97Å; N1731-T1736 PolarHBondContact O-N 3.15Å; T1734-T1736 VanDerWaalsContact C-N 3.25Å; T1734-T1736 PolarHBondContact O-N 2.84Å; T1734-T1736 PolarHBondContact OG1-OG1 3.22Å
1737T88.5Confident89.6Confident97 Ų9760.5 Ų60.560%0.59530%0.302SS*.EExtended strand (participates in β ladder)trans-118.4141.5173.861.40000111Y1728 Y1729 I1730Y1728-T1737 HydrophobicContact CE2-CG2 4.48Å; Y1729-T1737 CarbonylContact O-C 3.57Å; Y1729-T1737 VanDerWaalsContact O-CA 3.22Å; Y1729-T1737 WeakPolarHBondContact O-CA 3.49Å; I1730-T1737 HydrophobicContact CB-CG2 4.46Å; I1730-T1737 HydrophobicContact CG1-CG2 4.05Å; I1730-T1737 HydrophobicContact CG2-CG2 4.29Å
1738C88.5Confident89.6Confident37 Ų3762.5 Ų62.525%0.2531%0.31CS..EExtended strand (participates in β ladder)trans-139.9155.7176.660.10000112.9W1717 Y1729 D1740W1717-C1738 VanDerWaalsContact CZ3-SG 3.5Å; Y1729-C1738 PolarHBondContact N-O 3.48Å; Y1729-C1738 PolarHBondContact O-N 2.94Å; C1738-D1740 PolarHBondContact SG-O 3.36Å
1739W91.6Very high89.5Confident109 Ų10965.9 Ų65.941%0.41333%0.328SS..SBendtrans-79.8-21.7175-64109.8000113.2V1726 N1836 R1846V1726-W1739 HydrophobicContact CB-CZ3 4.01Å; V1726-W1739 HydrophobicContact CG1-CE3 3.77Å; V1726-W1739 HydrophobicContact CG1-CZ3 3.56Å; W1739-N1836 PolarHBondContact O-ND2 2.73Å; W1739-R1846 VanDerWaalsContact CB-NH2 3.3Å; W1739-R1846 HydrophobicContact CD2-CG 4.26Å; W1739-R1846 HydrophobicContact CZ2-CG 4.49Å
1740D91.4Very high89.3Confident46 Ų4667.8 Ų67.825%0.24634%0.342CS..SBendtrans-86.6136.9179-65.2-42.7000110.6Y1729 C1738 T1745 N1840Y1729-D1740 VanDerWaalsContact CD2-C 3.41Å; Y1729-D1740 WeakPolarHBondContact CD2-O 3.39Å; C1738-D1740 PolarHBondContact SG-O 3.36Å; D1740-T1745 WeakPolarHBondContact CB-OG1 3.2Å; D1740-N1840 PolarHBondContact OD1-ND2 3.49Å
1741H94.5Very high89.3Confident1 Ų166.3 Ų66.31%0.00533%0.334CS..  trans-64141.2172.1-179.8-78.6000109.1S1712 Y1729 K1743 M1744 T1745 D1832 N1836S1712-H1741 PolarHBondContact O-NE2 3.41Å; Y1729-H1741 HydrophobicContact CD2-CB 4.39Å; Y1729-H1741 HydrophobicContact CE1-CB 4.13Å; Y1729-H1741 AromaticContact CE1-CD2 3.52Å; Y1729-H1741 VanDerWaalsContact CE2-CA 3.46Å; Y1729-H1741 HydrophobicContact CE2-CB 3.81Å; Y1729-H1741 VanDerWaalsContact CE2-N 3.33Å; Y1729-H1741 AromaticContact CZ-CD2 3.79Å; H1741-K1743 PolarHBondContact ND1-N 2.96Å; H1741-K1743 VanDerWaalsContact ND1-N 3.2Å; H1741-K1743 PolarHBondContact O-N 3.37Å; H1741-M1744 HydrophobicContact CB-CB 4.01Å; H1741-M1744 CarbonylContact O-C 3.59Å; H1741-M1744 VanDerWaalsContact O-CA 3.28Å; H1741-M1744 WeakPolarHBondContact O-CA 3.44Å; H1741-M1744 VanDerWaalsContact O-CB 3.24Å; H1741-M1744 WeakPolarHBondContact O-CB 3.47Å; H1741-M1744 PolarHBondContact O-N 2.97Å; H1741-T1745 PolarHBondContact O-N 3.25Å; H1741-T1745 PolarHBondContact O-OG1 2.83Å; H1741-D1832 IonicContact CD2-OD2 2.78Å; H1741-N1836 HydrophobicContact CB-CB 4.43Å; H1741-N1836 PolarHBondContact N-OD1 3.39Å
1742P92.6Very high89.1Confident12 Ų1268.1 Ų68.18%0.07835%0.351CS..Hα-helixtrans-52.7-47.7-175.215.5-30.4000113.8V1713 W1717 M1744 T1745 E1746V1713-P1742 HydrophobicContact CG1-CG 3.9Å; W1717-P1742 HydrophobicContact CB-CG 4.23Å; W1717-P1742 HydrophobicContact CD2-CB 3.88Å; W1717-P1742 HydrophobicContact CD2-CG 3.87Å; W1717-P1742 HydrophobicContact CE3-CB 4.42Å; W1717-P1742 HydrophobicContact CE3-CG 4.28Å; W1717-P1742 HydrophobicContact CG-CB 4.12Å; W1717-P1742 HydrophobicContact CG-CG 3.85Å; W1717-P1742 HydrophobicContact CZ2-CB 4.09Å; P1742-M1744 PolarHBondContact O-N 3.49Å; P1742-T1745 WeakPolarHBondContact O-CB 3.42Å; P1742-T1745 PolarHBondContact O-N 3.11Å; P1742-T1745 VanDerWaalsContact O-N 3.13Å; P1742-E1746 WeakPolarHBondContact O-CG 3.5Å; P1742-E1746 PolarHBondContact O-N 2.96Å
1743K91.7Very high89.2Confident80 Ų8067.4 Ų67.435%0.34835%0.351SS..Hα-helixtrans-64.2-22.9173.3-66.1-174.4-177.91670114.7H1741 L1747 L1829 M1833H1741-K1743 PolarHBondContact ND1-N 2.96Å; H1741-K1743 VanDerWaalsContact ND1-N 3.2Å; H1741-K1743 PolarHBondContact O-N 3.37Å; K1743-L1747 VanDerWaalsContact O-CB 3.24Å; K1743-L1747 WeakPolarHBondContact O-CB 3.43Å; K1743-L1747 PolarHBondContact O-N 3.02Å; K1743-L1829 HydrophobicContact CD-CD1 3.88Å; K1743-L1829 HydrophobicContact CD-CD2 3.96Å; K1743-M1833 HydrophobicContact CB-CE 4.17Å; K1743-M1833 HydrophobicContact CB-SD 3.88Å
1744M93Very high89.4Confident0 Ų061.1 Ų61.10%032%0.322CS..Hα-helixtrans-78.6-37.4173.2-166.160.8-123.700110.7H1741 P1742 L1747 Y1748 L1771 M1833 N1836H1741-M1744 HydrophobicContact CB-CB 4.01Å; H1741-M1744 CarbonylContact O-C 3.59Å; H1741-M1744 VanDerWaalsContact O-CA 3.28Å; H1741-M1744 WeakPolarHBondContact O-CA 3.44Å; H1741-M1744 VanDerWaalsContact O-CB 3.24Å; H1741-M1744 WeakPolarHBondContact O-CB 3.47Å; H1741-M1744 PolarHBondContact O-N 2.97Å; P1742-M1744 PolarHBondContact O-N 3.49Å; M1744-L1747 HydrophobicContact CE-CB 4.09Å; M1744-L1747 HydrophobicContact CE-CD2 3.69Å; M1744-L1747 HydrophobicContact CE-CG 3.91Å; M1744-L1747 PolarHBondContact O-N 3.4Å; M1744-L1747 HydrophobicContact SD-CD2 3.91Å; M1744-Y1748 HydrophobicContact CE-CD1 3.97Å; M1744-Y1748 HydrophobicContact CE-CD2 3.64Å; M1744-Y1748 HydrophobicContact CE-CE1 3.78Å; M1744-Y1748 HydrophobicContact CE-CE2 3.44Å; M1744-Y1748 VanDerWaalsContact CE-CE2 3.44Å; M1744-Y1748 HydrophobicContact CE-CG 3.9Å; M1744-Y1748 HydrophobicContact CG-CD2 4.08Å; M1744-Y1748 HydrophobicContact CG-CE2 3.77Å; M1744-Y1748 WeakPolarHBondContact O-CD2 3.42Å; M1744-Y1748 PolarHBondContact O-N 2.75Å; M1744-Y1748 HydrophobicContact SD-CE2 4.43Å; M1744-L1771 HydrophobicContact CE-CD1 3.78Å; M1744-L1771 HydrophobicContact SD-CD1 4.27Å; M1744-M1833 HydrophobicContact SD-CE 4.19Å; M1744-N1836 WeakPolarHBondContact CG-OD1 3.05Å
1745T90.1Very high89.4Confident42 Ų4261.4 Ų61.426%0.25832%0.321SS..Hα-helixtrans-61.5-48.4169-49.40000111.4D1740 H1741 P1742 L1747 Y1748 Q1749D1740-T1745 WeakPolarHBondContact CB-OG1 3.2Å; H1741-T1745 PolarHBondContact O-N 3.25Å; H1741-T1745 PolarHBondContact O-OG1 2.83Å; P1742-T1745 WeakPolarHBondContact O-CB 3.42Å; P1742-T1745 PolarHBondContact O-N 3.11Å; P1742-T1745 VanDerWaalsContact O-N 3.13Å; T1745-L1747 VanDerWaalsContact C-N 3.29Å; T1745-L1747 PolarHBondContact O-N 3.37Å; T1745-Y1748 PolarHBondContact O-N 2.93Å; T1745-Q1749 WeakPolarHBondContact O-CB 3.48Å; T1745-Q1749 WeakPolarHBondContact O-CG 3.45Å; T1745-Q1749 PolarHBondContact O-N 3.35Å
1746E91.8Very high89.2Confident116 Ų11659.1 Ų59.154%0.54231%0.314SS..Hα-helixtrans-55.8-44.1172.4-71.3170.3-165.800111.6P1742 Q1749 S1750P1742-E1746 WeakPolarHBondContact O-CG 3.5Å; P1742-E1746 PolarHBondContact O-N 2.96Å; E1746-Q1749 PolarHBondContact O-N 3.04Å; E1746-S1750 VanDerWaalsContact O-CB 3.29Å; E1746-S1750 WeakPolarHBondContact O-CB 3.48Å; E1746-S1750 PolarHBondContact O-N 3.35Å; E1746-S1750 PolarHBondContact O-OG 3.13Å
1747L91.3Very high89.4Confident14 Ų1456.2 Ų56.27%0.07330%0.296CS..Hα-helixtrans-61.6-51.4176.8179.554.4000110.9K1743 M1744 T1745 Q1749 S1750 L1751 R1770 L1771 A1774 M1833K1743-L1747 VanDerWaalsContact O-CB 3.24Å; K1743-L1747 WeakPolarHBondContact O-CB 3.43Å; K1743-L1747 PolarHBondContact O-N 3.02Å; M1744-L1747 HydrophobicContact CE-CB 4.09Å; M1744-L1747 HydrophobicContact CE-CD2 3.69Å; M1744-L1747 HydrophobicContact CE-CG 3.91Å; M1744-L1747 PolarHBondContact O-N 3.4Å; M1744-L1747 HydrophobicContact SD-CD2 3.91Å; T1745-L1747 VanDerWaalsContact C-N 3.29Å; T1745-L1747 PolarHBondContact O-N 3.37Å; L1747-Q1749 PolarHBondContact O-N 2.83Å; L1747-S1750 PolarHBondContact O-N 3.33Å; L1747-S1750 VanDerWaalsContact O-N 3.12Å; L1747-S1750 PolarHBondContact O-OG 2.67Å; L1747-L1751 HydrophobicContact CD1-CD2 4.29Å; L1747-L1751 WeakPolarHBondContact O-CG 3.48Å; L1747-L1751 PolarHBondContact O-N 2.79Å; L1747-R1770 HydrophobicContact CD1-CG 4.2Å; L1747-L1771 HydrophobicContact CD2-CD1 3.83Å; L1747-A1774 HydrophobicContact CD1-CB 4.15Å; L1747-A1774 HydrophobicContact CD2-CB 3.46Å; L1747-A1774 VanDerWaalsContact CD2-CB 3.46Å; L1747-A1774 HydrophobicContact CG-CB 4.46Å; L1747-M1833 HydrophobicContact CD2-CE 4.19Å
1748Y90Very high89.1Confident45 Ų4560 Ų6018%0.17630%0.3CS..Hα-helixtrans-59.1-44.4177.1-78.4-55.7000113M1744 T1745 S1750 L1751 Q1903 L1904M1744-Y1748 HydrophobicContact CE-CD1 3.97Å; M1744-Y1748 HydrophobicContact CE-CD2 3.64Å; M1744-Y1748 HydrophobicContact CE-CE1 3.78Å; M1744-Y1748 HydrophobicContact CE-CE2 3.44Å; M1744-Y1748 VanDerWaalsContact CE-CE2 3.44Å; M1744-Y1748 HydrophobicContact CE-CG 3.9Å; M1744-Y1748 HydrophobicContact CG-CD2 4.08Å; M1744-Y1748 HydrophobicContact CG-CE2 3.77Å; M1744-Y1748 WeakPolarHBondContact O-CD2 3.42Å; M1744-Y1748 PolarHBondContact O-N 2.75Å; M1744-Y1748 HydrophobicContact SD-CE2 4.43Å; T1745-Y1748 PolarHBondContact O-N 2.93Å; Y1748-S1750 VanDerWaalsContact C-N 3.31Å; Y1748-S1750 PolarHBondContact O-N 3.47Å; Y1748-L1751 HydrophobicContact CD1-CD1 4.23Å; Y1748-L1751 WeakPolarHBondContact O-CB 3.38Å; Y1748-L1751 PolarHBondContact O-N 3.3Å; Y1748-Q1903 WeakPolarHBondContact OH-CG 3.41Å; Y1748-Q1903 PolarHBondContact OH-NE2 3.02Å; Y1748-Q1903 VanDerWaalsContact OH-NE2 3.12Å; Y1748-L1904 HydrophobicContact CE1-CD2 4.34Å
1749Q90.5Very high89Confident138 Ų13860.9 Ų60.965%0.64530%0.299SS*.Hα-helixtrans-58-46.3173.2-73.2176.68.400110.7T1745 E1746 L1747 L1751 A1752T1745-Q1749 WeakPolarHBondContact O-CB 3.48Å; T1745-Q1749 WeakPolarHBondContact O-CG 3.45Å; T1745-Q1749 PolarHBondContact O-N 3.35Å; E1746-Q1749 PolarHBondContact O-N 3.04Å; L1747-Q1749 PolarHBondContact O-N 2.83Å; Q1749-L1751 VanDerWaalsContact C-N 3.28Å; Q1749-L1751 PolarHBondContact O-N 3.06Å; Q1749-A1752 VanDerWaalsContact O-CB 3.25Å; Q1749-A1752 WeakPolarHBondContact O-CB 3.45Å; Q1749-A1752 PolarHBondContact O-N 2.88Å; Q1749-A1752 VanDerWaalsContact O-N 3.15Å
1750S90.4Very high88.9Confident41 Ų4157.2 Ų57.229%0.28729%0.29SS..Hα-helixtrans-62.3-35.4179.581.90000111.8E1746 L1747 Y1748 A1752 D1753 R1770E1746-S1750 VanDerWaalsContact O-CB 3.29Å; E1746-S1750 WeakPolarHBondContact O-CB 3.48Å; E1746-S1750 PolarHBondContact O-N 3.35Å; E1746-S1750 PolarHBondContact O-OG 3.13Å; L1747-S1750 PolarHBondContact O-N 3.33Å; L1747-S1750 VanDerWaalsContact O-N 3.12Å; L1747-S1750 PolarHBondContact O-OG 2.67Å; Y1748-S1750 VanDerWaalsContact C-N 3.31Å; Y1748-S1750 PolarHBondContact O-N 3.47Å; S1750-A1752 PolarHBondContact O-N 3.05Å; S1750-D1753 PolarHBondContact O-N 3.13Å; S1750-D1753 VanDerWaalsContact O-N 3.16Å; S1750-R1770 PolarHBondContact O-NH2 2.95Å; S1750-R1770 PolarHBondContact OG-NH1 3.48Å
1751L89.9Confident88.7Confident6 Ų655.1 Ų55.13%0.03128%0.279CS..G310 helixtrans-60.2-14.9178.1-66.1-170.8000113.9L1747 Y1748 Q1749 D1753 L1754 K1767 R1770 L1904L1747-L1751 HydrophobicContact CD1-CD2 4.29Å; L1747-L1751 WeakPolarHBondContact O-CG 3.48Å; L1747-L1751 PolarHBondContact O-N 2.79Å; Y1748-L1751 HydrophobicContact CD1-CD1 4.23Å; Y1748-L1751 WeakPolarHBondContact O-CB 3.38Å; Y1748-L1751 PolarHBondContact O-N 3.3Å; Q1749-L1751 VanDerWaalsContact C-N 3.28Å; Q1749-L1751 PolarHBondContact O-N 3.06Å; L1751-D1753 VanDerWaalsContact C-N 3.25Å; L1751-D1753 PolarHBondContact O-N 3.26Å; L1751-L1754 PolarHBondContact O-N 3.22Å; L1751-K1767 HydrophobicContact CB-CG 4.24Å; L1751-K1767 HydrophobicContact CD1-CB 4.19Å; L1751-K1767 HydrophobicContact CD1-CG 4.36Å; L1751-K1767 HydrophobicContact CD2-CB 4.37Å; L1751-K1767 HydrophobicContact CD2-CG 4.41Å; L1751-K1767 WeakPolarHBondContact O-CE 3.31Å; L1751-R1770 HydrophobicContact CD2-CB 3.81Å; L1751-R1770 HydrophobicContact CD2-CG 4.07Å; L1751-L1904 HydrophobicContact CD1-CD2 3.8Å
1752A85.8Confident88.5Confident51 Ų5156.2 Ų56.242%0.42128%0.284SS..G310 helixtrans-67.4-23176.200000113.1Q1749 S1750 L1754 N1755Q1749-A1752 VanDerWaalsContact O-CB 3.25Å; Q1749-A1752 WeakPolarHBondContact O-CB 3.45Å; Q1749-A1752 PolarHBondContact O-N 2.88Å; Q1749-A1752 VanDerWaalsContact O-N 3.15Å; S1750-A1752 PolarHBondContact O-N 3.05Å; A1752-L1754 PolarHBondContact O-N 2.91Å; A1752-N1755 WeakPolarHBondContact O-CB 3.47Å; A1752-N1755 PolarHBondContact O-N 2.75Å; A1752-N1755 PolarHBondContact O-ND2 2.88Å
1753D85.2Confident88.5Confident92 Ų9257.7 Ų57.749%0.49229%0.288SS..G310 helixtrans-59.9-34.7176.371.2-16.8000112.5S1750 L1751 N1755 N1756 R1770S1750-D1753 PolarHBondContact O-N 3.13Å; S1750-D1753 VanDerWaalsContact O-N 3.16Å; L1751-D1753 VanDerWaalsContact C-N 3.25Å; L1751-D1753 PolarHBondContact O-N 3.26Å; D1753-N1755 PolarHBondContact O-N 3.02Å; D1753-N1756 PolarHBondContact O-ND2 2.88Å; D1753-R1770 IonicContact OD1-CZ 3.61Å; D1753-R1770 IonicContact OD1-NH2 3.52Å; D1753-R1770 PolarHBondContact OD1-NH2 3.17Å; D1753-R1770 IonicContact OD2-CZ 2.73Å; D1753-R1770 IonicContact OD2-NH2 3.54Å; D1753-R1770 PolarHBondContact OD2-NH2 3.2Å; D1753-R1770 VanDerWaalsContact OD2-NH2 3.08Å
1754L88.4Confident88.6Confident23 Ų2353.9 Ų53.912%0.1227%0.271CS..G310 helixtrans-72-11176.2-64.7177.3000113.4L1751 A1752 N1756 V1757 R1763 M1766 K1767L1751-L1754 PolarHBondContact O-N 3.22Å; A1752-L1754 PolarHBondContact O-N 2.91Å; L1754-N1756 PolarHBondContact O-N 2.91Å; L1754-N1756 VanDerWaalsContact O-N 3.09Å; L1754-V1757 VanDerWaalsContact O-CB 3.31Å; L1754-V1757 WeakPolarHBondContact O-CB 3.36Å; L1754-V1757 WeakPolarHBondContact O-CG2 3.37Å; L1754-V1757 PolarHBondContact O-N 3.5Å; L1754-R1763 WeakPolarHBondContact O-CD 3.44Å; L1754-R1763 WeakPolarHBondContact O-CG 3.47Å; L1754-M1766 VanDerWaalsContact CD1-C 3.41Å; L1754-M1766 HydrophobicContact CD1-CB 3.66Å; L1754-M1766 HydrophobicContact CD2-CB 4.04Å; L1754-M1766 HydrophobicContact CD2-CE 4.24Å; L1754-M1766 HydrophobicContact CD2-SD 4.33Å; L1754-M1766 HydrophobicContact CG-CB 4.43Å; L1754-K1767 HydrophobicContact CB-CG 4.24Å; L1754-K1767 HydrophobicContact CD1-CB 4.29Å; L1754-K1767 HydrophobicContact CD1-CG 3.75Å; L1754-K1767 VanDerWaalsContact CD1-N 3.35Å
1755N85Confident88.6Confident85 Ų8553.9 Ų53.946%0.45527%0.271SS..G310 helixtrans-60.2-23177.9-69.7-19.5000112.7A1752 D1753 V1757 K1767A1752-N1755 WeakPolarHBondContact O-CB 3.47Å; A1752-N1755 PolarHBondContact O-N 2.75Å; A1752-N1755 PolarHBondContact O-ND2 2.88Å; D1753-N1755 PolarHBondContact O-N 3.02Å; N1755-V1757 PolarHBondContact O-N 3.05Å; N1755-K1767 VanDerWaalsContact OD1-CE 3.24Å; N1755-K1767 WeakPolarHBondContact OD1-CE 3.46Å; N1755-K1767 PolarHBondContact OD1-NZ 2.74Å
1756N81.2Confident88.8Confident133 Ų13353.5 Ų53.571%0.71127%0.267SS*.G310 helixtrans-67.8-11.9173-64.4-67.6000114.5D1753 L1754 R1758D1753-N1756 PolarHBondContact O-ND2 2.88Å; L1754-N1756 PolarHBondContact O-N 2.91Å; L1754-N1756 VanDerWaalsContact O-N 3.09Å; N1756-R1758 PolarHBondContact O-N 3.42Å
1757V87.1Confident88.9Confident12 Ų1248.6 Ų48.67%0.07324%0.244CC..  trans-73.8111.5173.9176.50000108.9L1754 N1755 F1759 R1763 M1766 F1998L1754-V1757 VanDerWaalsContact O-CB 3.31Å; L1754-V1757 WeakPolarHBondContact O-CB 3.36Å; L1754-V1757 WeakPolarHBondContact O-CG2 3.37Å; L1754-V1757 PolarHBondContact O-N 3.5Å; N1755-V1757 PolarHBondContact O-N 3.05Å; V1757-F1759 VanDerWaalsContact C-N 3.28Å; V1757-F1759 PolarHBondContact O-N 3.33Å; V1757-R1763 HydrophobicContact CB-CB 3.92Å; V1757-R1763 HydrophobicContact CB-CG 4.3Å; V1757-R1763 HydrophobicContact CG1-CB 3.95Å; V1757-R1763 PolarHBondContact O-NH1 2.87Å; V1757-M1766 HydrophobicContact CG2-SD 4.04Å; V1757-F1998 HydrophobicContact CG1-CB 4.08Å; V1757-F1998 HydrophobicContact CG1-CD2 4.26Å; V1757-F1998 HydrophobicContact CG1-CG 4.05Å; V1757-F1998 HydrophobicContact CG2-CB 4.35Å; V1757-F1998 HydrophobicContact CG2-CD2 4.27Å
1758R81.5Confident89.1Confident178 Ų17848 Ų4867%0.67224%0.24SC*.SBendtrans-64.9-28.2-172.5-172.6176.2-178.5167.75.8114.2N1756 F1998N1756-R1758 PolarHBondContact O-N 3.42Å; R1758-F1998 VanDerWaalsContact CB-O 3.3Å; R1758-F1998 WeakPolarHBondContact CB-O 3.39Å; R1758-F1998 PolarHBondContact N-O 3.04Å
1759F86.4Confident89.4Confident55 Ų5547.1 Ų47.124%0.24124%0.237CC..SBendtrans-99.1112.3-175.8-59-67.4000110.5V1757 A1761 Y1762 R1763 F1997V1757-F1759 VanDerWaalsContact C-N 3.28Å; V1757-F1759 PolarHBondContact O-N 3.33Å; F1759-A1761 PolarHBondContact O-N 2.82Å; F1759-Y1762 HydrophobicContact CB-CD2 3.71Å; F1759-Y1762 HydrophobicContact CB-CE2 4.45Å; F1759-Y1762 HydrophobicContact CG-CD2 4.46Å; F1759-Y1762 PolarHBondContact O-N 3.43Å; F1759-Y1762 VanDerWaalsContact O-N 3.13Å; F1759-R1763 PolarHBondContact O-N 3.14Å; F1759-F1997 HydrophobicContact CD2-CD1 4.34Å; F1759-F1997 AromaticContact CD2-CE1 3.93Å; F1759-F1997 HydrophobicContact CD2-CE1 3.93Å; F1759-F1997 HydrophobicContact CD2-CZ 4.39Å; F1759-F1997 AromaticContact CE2-CD1 3.99Å; F1759-F1997 HydrophobicContact CE2-CD1 3.99Å; F1759-F1997 HydrophobicContact CE2-CD2 4.49Å; F1759-F1997 AromaticContact CE2-CE1 3.61Å; F1759-F1997 HydrophobicContact CE2-CE1 3.61Å; F1759-F1997 HydrophobicContact CE2-CE2 4.16Å; F1759-F1997 HydrophobicContact CE2-CG 4.42Å; F1759-F1997 AromaticContact CE2-CZ 3.7Å; F1759-F1997 HydrophobicContact CE2-CZ 3.7Å; F1759-F1997 WeakPolarHBondContact CE2-O 3.42Å; F1759-F1997 HydrophobicContact CZ-CE1 4.38Å; F1759-F1997 HydrophobicContact CZ-CE2 4.38Å; F1759-F1997 HydrophobicContact CZ-CZ 4.04Å
1760S88.1Confident89.6Confident32 Ų3244.4 Ų44.422%0.22422%0.221CC..Hα-helixtrans-53.1-47.9-174.845.50000114Y1762 R1763 T1764 S1909S1760-Y1762 VanDerWaalsContact C-N 3.29Å; S1760-Y1762 PolarHBondContact O-N 2.89Å; S1760-R1763 WeakPolarHBondContact O-CB 3.2Å; S1760-R1763 PolarHBondContact O-N 2.89Å; S1760-T1764 PolarHBondContact O-N 3.29Å; S1760-T1764 PolarHBondContact O-OG1 3.05Å; S1760-T1764 VanDerWaalsContact O-OG1 3.04Å; S1760-S1909 VanDerWaalsContact CB-CB 3.41Å; S1760-S1909 WeakPolarHBondContact CB-OG 3.43Å; S1760-S1909 WeakPolarHBondContact OG-CB 3.41Å; S1760-S1909 PolarHBondContact OG-OG 3.46Å
1761A87.8Confident89.8Confident2 Ų242.4 Ų42.42%0.01721%0.207CC..Hα-helixtrans-55.2-40.7178.800000113.4F1759 A1765 F1910 V1949 V1953 Y2050F1759-A1761 PolarHBondContact O-N 2.82Å; A1761-A1765 WeakPolarHBondContact O-CB 3.24Å; A1761-A1765 PolarHBondContact O-N 3.22Å; A1761-A1765 VanDerWaalsContact O-N 3.09Å; A1761-F1910 HydrophobicContact CB-CE1 4.25Å; A1761-V1949 HydrophobicContact CB-CG1 4.3Å; A1761-V1953 HydrophobicContact CB-CG2 4.29Å; A1761-Y2050 HydrophobicContact CB-CE2 4.34Å
1762Y91Very high90Very high23 Ų2342.7 Ų42.79%0.0921%0.208CC..Hα-helixtrans-74.8-38.8174.5-64.1-88.3000111.9F1759 S1760 A1765 M1766 V1953 F1980 F1998 E2014F1759-Y1762 HydrophobicContact CB-CD2 3.71Å; F1759-Y1762 HydrophobicContact CB-CE2 4.45Å; F1759-Y1762 HydrophobicContact CG-CD2 4.46Å; F1759-Y1762 PolarHBondContact O-N 3.43Å; F1759-Y1762 VanDerWaalsContact O-N 3.13Å; S1760-Y1762 VanDerWaalsContact C-N 3.29Å; S1760-Y1762 PolarHBondContact O-N 2.89Å; Y1762-A1765 PolarHBondContact O-N 3.41Å; Y1762-M1766 WeakPolarHBondContact O-CB 3.28Å; Y1762-M1766 WeakPolarHBondContact O-CG 3.33Å; Y1762-M1766 PolarHBondContact O-N 3.09Å; Y1762-V1953 HydrophobicContact CD1-CG1 3.63Å; Y1762-V1953 HydrophobicContact CE1-CG1 3.9Å; Y1762-V1953 HydrophobicContact CG-CG1 4.06Å; Y1762-F1980 HydrophobicContact CD1-CE2 4.42Å; Y1762-F1980 HydrophobicContact CD1-CZ 4.4Å; Y1762-F1980 HydrophobicContact CE1-CE1 4.43Å; Y1762-F1980 HydrophobicContact CE1-CE2 4.47Å; Y1762-F1980 HydrophobicContact CE1-CZ 4.12Å; Y1762-F1998 AromaticContact CD1-CE1 3.48Å; Y1762-F1998 HydrophobicContact CD1-CE1 3.48Å; Y1762-F1998 VanDerWaalsContact CD1-CE1 3.48Å; Y1762-F1998 AromaticContact CD1-CZ 3.49Å; Y1762-F1998 HydrophobicContact CD1-CZ 3.49Å; Y1762-F1998 VanDerWaalsContact CD1-CZ 3.49Å; Y1762-F1998 HydrophobicContact CD2-CE1 4.19Å; Y1762-F1998 HydrophobicContact CE1-CE1 4.05Å; Y1762-F1998 HydrophobicContact CE1-CZ 4.27Å; Y1762-F1998 HydrophobicContact CG-CD1 4.38Å; Y1762-F1998 AromaticContact CG-CE1 3.57Å; Y1762-F1998 HydrophobicContact CG-CE1 3.57Å; Y1762-F1998 AromaticContact CG-CZ 3.86Å; Y1762-F1998 HydrophobicContact CG-CZ 3.86Å; Y1762-E2014 VanDerWaalsContact CE1-OE2 3.31Å; Y1762-E2014 WeakPolarHBondContact CE1-OE2 3.28Å; Y1762-E2014 PolarHBondContact OH-OE2 3.03Å
1763R92.9Very high90.4Very high44 Ų4444.3 Ų44.317%0.16621%0.205CC..Hα-helixtrans-59.1-52.2176.9-177.3171.859.5-127.67.3111.3L1754 V1757 F1759 S1760 M1766 K1767 E1906L1754-R1763 WeakPolarHBondContact O-CD 3.44Å; L1754-R1763 WeakPolarHBondContact O-CG 3.47Å; V1757-R1763 HydrophobicContact CB-CB 3.92Å; V1757-R1763 HydrophobicContact CB-CG 4.3Å; V1757-R1763 HydrophobicContact CG1-CB 3.95Å; V1757-R1763 PolarHBondContact O-NH1 2.87Å; F1759-R1763 PolarHBondContact O-N 3.14Å; S1760-R1763 WeakPolarHBondContact O-CB 3.2Å; S1760-R1763 PolarHBondContact O-N 2.89Å; R1763-M1766 PolarHBondContact O-N 3.28Å; R1763-K1767 HydrophobicContact CG-CD 4.44Å; R1763-K1767 WeakPolarHBondContact O-CB 3.16Å; R1763-K1767 WeakPolarHBondContact O-CG 3.4Å; R1763-K1767 PolarHBondContact O-N 3.13Å; R1763-E1906 VanDerWaalsContact CD-OE1 3.32Å; R1763-E1906 WeakPolarHBondContact CD-OE1 3.42Å; R1763-E1906 IonicContact CZ-OE1 2.7Å; R1763-E1906 IonicContact CZ-OE2 3.75Å; R1763-E1906 VanDerWaalsContact CZ-OE2 3.3Å; R1763-E1906 VanDerWaalsContact NE-CD 3.28Å; R1763-E1906 IonicContact NE-OE1 3.56Å; R1763-E1906 PolarHBondContact NE-OE1 3.5Å; R1763-E1906 IonicContact NE-OE2 3.51Å; R1763-E1906 PolarHBondContact NE-OE2 2.97Å; R1763-E1906 IonicContact NH2-OE1 3.09Å; R1763-E1906 IonicContact NH2-OE2 3.44Å; R1763-E1906 PolarHBondContact NH2-OE2 3.47Å
1764T93.4Very high90.8Very high0 Ų041.9 Ų41.90%020%0.198CC..Hα-helixtrans-60.7-45.2175.4-500000111.3S1760 M1766 K1767 L1768 P1901 L1904 E1906 F1910 W1950S1760-T1764 PolarHBondContact O-N 3.29Å; S1760-T1764 PolarHBondContact O-OG1 3.05Å; S1760-T1764 VanDerWaalsContact O-OG1 3.04Å; T1764-M1766 VanDerWaalsContact C-N 3.35Å; T1764-M1766 PolarHBondContact O-N 3.22Å; T1764-K1767 PolarHBondContact O-N 3.09Å; T1764-L1768 HydrophobicContact CG2-CD1 4.11Å; T1764-L1768 HydrophobicContact CG2-CG 4.48Å; T1764-L1768 WeakPolarHBondContact O-CB 3.38Å; T1764-L1768 VanDerWaalsContact O-CG 3.31Å; T1764-L1768 WeakPolarHBondContact O-CG 3.33Å; T1764-L1768 PolarHBondContact O-N 3.41Å; T1764-P1901 HydrophobicContact CG2-CB 4.08Å; T1764-L1904 HydrophobicContact CG2-CD1 4.21Å; T1764-E1906 HydrophobicContact CG2-CB 4.3Å; T1764-E1906 HydrophobicContact CG2-CG 4.42Å; T1764-E1906 VanDerWaalsContact OG1-CB 3.31Å; T1764-E1906 WeakPolarHBondContact OG1-CB 3.21Å; T1764-E1906 VanDerWaalsContact OG1-CG 3.32Å; T1764-E1906 WeakPolarHBondContact OG1-CG 3.36Å; T1764-F1910 HydrophobicContact CG2-CE2 3.88Å; T1764-F1910 HydrophobicContact CG2-CZ 4.07Å; T1764-F1910 VanDerWaalsContact OG1-CE2 3.26Å; T1764-F1910 WeakPolarHBondContact OG1-CE2 3.43Å; T1764-F1910 VanDerWaalsContact OG1-CZ 3.28Å; T1764-F1910 WeakPolarHBondContact OG1-CZ 3.07Å; T1764-W1950 HydrophobicContact CG2-CB 4.01Å
1765A93.6Very high91.1Very high0 Ų040.8 Ų40.80%019%0.192CC..Hα-helixtrans-61.9-38.5176.800000113.2A1761 Y1762 R1769 V1953 L1954 V1957A1761-A1765 WeakPolarHBondContact O-CB 3.24Å; A1761-A1765 PolarHBondContact O-N 3.22Å; A1761-A1765 VanDerWaalsContact O-N 3.09Å; Y1762-A1765 PolarHBondContact O-N 3.41Å; A1765-R1769 VanDerWaalsContact O-CB 3.28Å; A1765-R1769 WeakPolarHBondContact O-CB 3.32Å; A1765-R1769 PolarHBondContact O-N 2.88Å; A1765-V1953 HydrophobicContact CB-CB 3.96Å; A1765-V1953 HydrophobicContact CB-CG1 3.55Å; A1765-L1954 HydrophobicContact CB-CB 4.26Å; A1765-L1954 WeakPolarHBondContact O-CD1 3.32Å; A1765-V1957 HydrophobicContact CB-CG2 4.02Å
1766M93.2Very high91.6Very high34 Ų3437.3 Ų37.317%0.16718%0.175CC..Hα-helixtrans-71.6-38.2175.6-69.5176.996.100111.9L1754 V1757 Y1762 R1763 T1764 R1769 R1770 V1957 F1998L1754-M1766 VanDerWaalsContact CD1-C 3.41Å; L1754-M1766 HydrophobicContact CD1-CB 3.66Å; L1754-M1766 HydrophobicContact CD2-CB 4.04Å; L1754-M1766 HydrophobicContact CD2-CE 4.24Å; L1754-M1766 HydrophobicContact CD2-SD 4.33Å; L1754-M1766 HydrophobicContact CG-CB 4.43Å; V1757-M1766 HydrophobicContact CG2-SD 4.04Å; Y1762-M1766 WeakPolarHBondContact O-CB 3.28Å; Y1762-M1766 WeakPolarHBondContact O-CG 3.33Å; Y1762-M1766 PolarHBondContact O-N 3.09Å; R1763-M1766 PolarHBondContact O-N 3.28Å; T1764-M1766 VanDerWaalsContact C-N 3.35Å; T1764-M1766 PolarHBondContact O-N 3.22Å; M1766-R1769 PolarHBondContact O-N 3.14Å; M1766-R1770 PolarHBondContact O-N 3.33Å; M1766-V1957 HydrophobicContact CG-CG1 4.07Å; M1766-V1957 HydrophobicContact CG-CG2 4.16Å; M1766-F1998 HydrophobicContact CE-CD2 4.28Å; M1766-F1998 HydrophobicContact CE-CE2 3.9Å; M1766-F1998 HydrophobicContact SD-CD2 3.78Å; M1766-F1998 HydrophobicContact SD-CE2 3.38Å; M1766-F1998 WeakPolarHBondContact SD-CE2 3.41Å; M1766-F1998 HydrophobicContact SD-CZ 4.35Å
1767K95.3Very high92.2Very high13 Ų1331 Ų316%0.05714%0.141CC..Hα-helixtrans-59.9-49.1172.5-76.5179174.4176.60110.5L1751 L1754 N1755 R1763 T1764 R1769 R1770 L1771 L1904 E1906L1751-K1767 HydrophobicContact CB-CG 4.24Å; L1751-K1767 HydrophobicContact CD1-CB 4.19Å; L1751-K1767 HydrophobicContact CD1-CG 4.36Å; L1751-K1767 HydrophobicContact CD2-CB 4.37Å; L1751-K1767 HydrophobicContact CD2-CG 4.41Å; L1751-K1767 WeakPolarHBondContact O-CE 3.31Å; L1754-K1767 HydrophobicContact CB-CG 4.24Å; L1754-K1767 HydrophobicContact CD1-CB 4.29Å; L1754-K1767 HydrophobicContact CD1-CG 3.75Å; L1754-K1767 VanDerWaalsContact CD1-N 3.35Å; N1755-K1767 VanDerWaalsContact OD1-CE 3.24Å; N1755-K1767 WeakPolarHBondContact OD1-CE 3.46Å; N1755-K1767 PolarHBondContact OD1-NZ 2.74Å; R1763-K1767 HydrophobicContact CG-CD 4.44Å; R1763-K1767 WeakPolarHBondContact O-CB 3.16Å; R1763-K1767 WeakPolarHBondContact O-CG 3.4Å; R1763-K1767 PolarHBondContact O-N 3.13Å; T1764-K1767 PolarHBondContact O-N 3.09Å; K1767-R1769 PolarHBondContact O-N 2.99Å; K1767-R1770 PolarHBondContact O-N 3.41Å; K1767-L1771 WeakPolarHBondContact O-CB 3.45Å; K1767-L1771 PolarHBondContact O-N 3.13Å; K1767-L1904 HydrophobicContact CB-CD1 3.93Å; K1767-E1906 IonicContact NZ-OE1 3.32Å; K1767-E1906 PolarHBondContact NZ-OE1 3.14Å
1768L94.7Very high92.5Very high0 Ų032 Ų320%015%0.146CC..Hα-helixtrans-62.3-38.1174.4-70.7172.5000112.5T1764 R1770 L1771 Q1772 L1862 I1900 L1904 W1950 L1954T1764-L1768 HydrophobicContact CG2-CD1 4.11Å; T1764-L1768 HydrophobicContact CG2-CG 4.48Å; T1764-L1768 WeakPolarHBondContact O-CB 3.38Å; T1764-L1768 VanDerWaalsContact O-CG 3.31Å; T1764-L1768 WeakPolarHBondContact O-CG 3.33Å; T1764-L1768 PolarHBondContact O-N 3.41Å; L1768-R1770 VanDerWaalsContact C-N 3.34Å; L1768-R1770 PolarHBondContact O-N 3.34Å; L1768-L1771 HydrophobicContact CD2-CD2 4.21Å; L1768-L1771 PolarHBondContact O-N 3.14Å; L1768-Q1772 WeakPolarHBondContact O-CB 3.31Å; L1768-Q1772 PolarHBondContact O-N 2.79Å; L1768-L1862 HydrophobicContact CD2-CD2 4.42Å; L1768-I1900 HydrophobicContact CD1-CG2 4.17Å; L1768-I1900 HydrophobicContact CD2-CG2 3.45Å; L1768-I1900 VanDerWaalsContact CD2-CG2 3.45Å; L1768-I1900 HydrophobicContact CG-CG2 4.45Å; L1768-L1904 HydrophobicContact CD2-CD1 3.54Å; L1768-L1904 HydrophobicContact CG-CD1 3.63Å; L1768-W1950 HydrophobicContact CD1-CD2 4.2Å; L1768-W1950 HydrophobicContact CD1-CE3 3.4Å; L1768-W1950 VanDerWaalsContact CD1-CE3 3.4Å; L1768-W1950 HydrophobicContact CD1-CZ3 3.96Å; L1768-L1954 HydrophobicContact CB-CD1 4.29Å; L1768-L1954 HydrophobicContact CB-CD2 4.29Å
1769R95.2Very high93.1Very high28 Ų2825.1 Ų25.111%0.10612%0.122CC..Hα-helixtrans-65.9-37.1177.2-174.256.4174.3149.93.5112.3A1765 M1766 K1767 Q1772 K1773 D1778 L1954 V1957 E1961A1765-R1769 VanDerWaalsContact O-CB 3.28Å; A1765-R1769 WeakPolarHBondContact O-CB 3.32Å; A1765-R1769 PolarHBondContact O-N 2.88Å; M1766-R1769 PolarHBondContact O-N 3.14Å; K1767-R1769 PolarHBondContact O-N 2.99Å; R1769-Q1772 VanDerWaalsContact CD-OE1 3.26Å; R1769-K1773 VanDerWaalsContact CZ-CE 3.44Å; R1769-K1773 VanDerWaalsContact NH2-CE 3.28Å; R1769-K1773 PolarHBondContact O-N 3.27Å; R1769-D1778 IonicContact CZ-OD2 2.76Å; R1769-D1778 IonicContact NH1-OD2 3.86Å; R1769-D1778 PolarHBondContact NH1-OD2 3.37Å; R1769-D1778 IonicContact NH2-OD2 2.72Å; R1769-L1954 HydrophobicContact CB-CD1 3.63Å; R1769-L1954 HydrophobicContact CG-CD1 4.34Å; R1769-V1957 HydrophobicContact CB-CG1 4.21Å; R1769-V1957 HydrophobicContact CG-CG1 4.12Å; R1769-E1961 WeakPolarHBondContact CG-OE1 3.31Å; R1769-E1961 IonicContact CZ-OE2 3.71Å; R1769-E1961 VanDerWaalsContact CZ-OE2 3.32Å; R1769-E1961 IonicContact NE-OE1 2.83Å; R1769-E1961 PolarHBondContact NE-OE1 3.21Å; R1769-E1961 IonicContact NE-OE2 3.3Å; R1769-E1961 PolarHBondContact NE-OE2 3.47Å; R1769-E1961 IonicContact NH2-OE2 3.13Å; R1769-E1961 PolarHBondContact NH2-OE2 3.2Å
1770R94.8Very high93.5Very high80 Ų8022.6 Ų22.630%0.30211%0.111SC..Hα-helixtrans-68.8-44.9175.3-164.2115.686.974.53.6111.3L1747 S1750 L1751 D1753 M1766 K1767 L1768 K1773 A1774L1747-R1770 HydrophobicContact CD1-CG 4.2Å; S1750-R1770 PolarHBondContact O-NH2 2.95Å; S1750-R1770 PolarHBondContact OG-NH1 3.48Å; L1751-R1770 HydrophobicContact CD2-CB 3.81Å; L1751-R1770 HydrophobicContact CD2-CG 4.07Å; D1753-R1770 IonicContact OD1-CZ 3.61Å; D1753-R1770 IonicContact OD1-NH2 3.52Å; D1753-R1770 PolarHBondContact OD1-NH2 3.17Å; D1753-R1770 IonicContact OD2-CZ 2.73Å; D1753-R1770 IonicContact OD2-NH2 3.54Å; D1753-R1770 PolarHBondContact OD2-NH2 3.2Å; D1753-R1770 VanDerWaalsContact OD2-NH2 3.08Å; M1766-R1770 PolarHBondContact O-N 3.33Å; K1767-R1770 PolarHBondContact O-N 3.41Å; L1768-R1770 VanDerWaalsContact C-N 3.34Å; L1768-R1770 PolarHBondContact O-N 3.34Å; R1770-K1773 PolarHBondContact O-N 3.45Å; R1770-A1774 PolarHBondContact O-N 3.37Å; R1770-A1774 VanDerWaalsContact O-N 3.08Å
1771L95.1Very high93.8Very high0 Ų022.9 Ų22.90%011%0.113CC..Hα-helixtrans-59.2-49.2173.4177.169.8000112.3M1744 L1747 K1767 L1768 K1773 A1774 L1775 W1837 L1862M1744-L1771 HydrophobicContact CE-CD1 3.78Å; M1744-L1771 HydrophobicContact SD-CD1 4.27Å; L1747-L1771 HydrophobicContact CD2-CD1 3.83Å; K1767-L1771 WeakPolarHBondContact O-CB 3.45Å; K1767-L1771 PolarHBondContact O-N 3.13Å; L1768-L1771 HydrophobicContact CD2-CD2 4.21Å; L1768-L1771 PolarHBondContact O-N 3.14Å; L1771-K1773 VanDerWaalsContact C-N 3.26Å; L1771-K1773 PolarHBondContact O-N 3.12Å; L1771-A1774 PolarHBondContact O-N 3.27Å; L1771-A1774 VanDerWaalsContact O-N 3.11Å; L1771-L1775 HydrophobicContact CD1-CD1 3.83Å; L1771-L1775 HydrophobicContact CD1-CG 4.09Å; L1771-L1775 HydrophobicContact CG-CD1 4.04Å; L1771-L1775 HydrophobicContact CG-CG 4.48Å; L1771-L1775 WeakPolarHBondContact O-CG 3.32Å; L1771-L1775 PolarHBondContact O-N 2.77Å; L1771-W1837 HydrophobicContact CD1-CG 4.4Å; L1771-W1837 HydrophobicContact CD2-CD2 4.4Å; L1771-W1837 HydrophobicContact CD2-CG 4.39Å; L1771-W1837 HydrophobicContact CD2-CZ2 4.36Å; L1771-L1862 HydrophobicContact CD2-CD1 4.3Å
1772Q95.2Very high94Very high11 Ų1124.3 Ų24.35%0.05112%0.12CC..Hα-helixtrans-54.3-42179.9-171.6-163.919.100112L1768 R1769 C1776 L1777 D1778 L1862L1768-Q1772 WeakPolarHBondContact O-CB 3.31Å; L1768-Q1772 PolarHBondContact O-N 2.79Å; R1769-Q1772 VanDerWaalsContact CD-OE1 3.26Å; Q1772-C1776 PolarHBondContact O-N 3.31Å; Q1772-L1777 HydrophobicContact CG-CB 4.29Å; Q1772-L1777 PolarHBondContact O-N 3.15Å; Q1772-D1778 HydrophobicContact CG-CB 3.82Å; Q1772-L1862 HydrophobicContact CB-CD2 4.49Å; Q1772-L1862 HydrophobicContact CG-CB 4.25Å; Q1772-L1862 WeakPolarHBondContact CG-O 3.5Å; Q1772-L1862 PolarHBondContact NE2-O 2.88Å
1773K93.5Very high94.1Very high85 Ų8526.7 Ų26.737%0.3714%0.14SC..Hα-helixtrans-70.6-43176-78.9175172168.90113R1769 R1770 L1771 L1775 C1776 D1778 E1961R1769-K1773 VanDerWaalsContact CZ-CE 3.44Å; R1769-K1773 VanDerWaalsContact NH2-CE 3.28Å; R1769-K1773 PolarHBondContact O-N 3.27Å; R1770-K1773 PolarHBondContact O-N 3.45Å; L1771-K1773 VanDerWaalsContact C-N 3.26Å; L1771-K1773 PolarHBondContact O-N 3.12Å; K1773-L1775 VanDerWaalsContact C-N 3.25Å; K1773-L1775 PolarHBondContact O-N 3.46Å; K1773-C1776 PolarHBondContact O-N 2.96Å; K1773-D1778 WeakPolarHBondContact CG-OD2 3.15Å; K1773-E1961 IonicContact NZ-OE1 3.61Å; K1773-E1961 PolarHBondContact NZ-OE1 3.16Å; K1773-E1961 IonicContact NZ-OE2 3.77Å; K1773-E1961 PolarHBondContact NZ-OE2 3.42Å
1774A93.9Very high94Very high41 Ų4125.4 Ų25.434%0.33914%0.14SC..Hα-helixtrans-66.1-29.417900000112.7L1747 R1770 L1771L1747-A1774 HydrophobicContact CD1-CB 4.15Å; L1747-A1774 HydrophobicContact CD2-CB 3.46Å; L1747-A1774 VanDerWaalsContact CD2-CB 3.46Å; L1747-A1774 HydrophobicContact CG-CB 4.46Å; R1770-A1774 PolarHBondContact O-N 3.37Å; R1770-A1774 VanDerWaalsContact O-N 3.08Å; L1771-A1774 PolarHBondContact O-N 3.27Å; L1771-A1774 VanDerWaalsContact O-N 3.11Å
1775L94.7Very high94Very high0 Ų025.4 Ų25.40%014%0.14CC..THydrogen-bonded Turntrans-89.14.6171.6-59.4-178.2000113.4L1771 K1773 L1777 Y1814 M1833 C1834 W1837L1771-L1775 HydrophobicContact CD1-CD1 3.83Å; L1771-L1775 HydrophobicContact CD1-CG 4.09Å; L1771-L1775 HydrophobicContact CG-CD1 4.04Å; L1771-L1775 HydrophobicContact CG-CG 4.48Å; L1771-L1775 WeakPolarHBondContact O-CG 3.32Å; L1771-L1775 PolarHBondContact O-N 2.77Å; K1773-L1775 VanDerWaalsContact C-N 3.25Å; K1773-L1775 PolarHBondContact O-N 3.46Å; L1775-L1777 HydrophobicContact CB-CD1 4.13Å; L1775-L1777 HydrophobicContact CB-CG 3.99Å; L1775-L1777 HydrophobicContact CD1-CD1 4.22Å; L1775-L1777 PolarHBondContact O-N 2.68Å; L1775-Y1814 WeakPolarHBondContact O-CE1 3.24Å; L1775-Y1814 PolarHBondContact O-OH 2.99Å; L1775-M1833 HydrophobicContact CD2-CB 3.7Å; L1775-M1833 HydrophobicContact CD2-CE 4.46Å; L1775-C1834 HydrophobicContact CD2-CB 4.39Å; L1775-W1837 HydrophobicContact CD1-CB 3.98Å; L1775-W1837 HydrophobicContact CD1-CD2 3.87Å; L1775-W1837 HydrophobicContact CD1-CE3 3.78Å; L1775-W1837 HydrophobicContact CD1-CG 3.93Å
1776C94.8Very high93.9Very high13 Ų1326.7 Ų26.79%0.08815%0.148CC..THydrogen-bonded Turntrans55.113-176.2-57.30000116Q1772 K1773 D1778 L1779 Y1814Q1772-C1776 PolarHBondContact O-N 3.31Å; K1773-C1776 PolarHBondContact O-N 2.96Å; C1776-D1778 PolarHBondContact O-N 3.39Å; C1776-L1779 HydrophobicContact CB-CD1 4.2Å; C1776-L1779 WeakPolarHBondContact O-CB 3.33Å; C1776-L1779 PolarHBondContact O-N 3.44Å; C1776-Y1814 HydrophobicContact CB-CE1 4.33Å
1777L94.8Very high93.8Very high0 Ų029 Ų290%016%0.161CC..THydrogen-bonded Turntrans-71.3-14.1-178.4-66.5176.9000112.8Q1772 L1775 L1779 L1780 W1837 I1859 L1862 C1863Q1772-L1777 HydrophobicContact CG-CB 4.29Å; Q1772-L1777 PolarHBondContact O-N 3.15Å; L1775-L1777 HydrophobicContact CB-CD1 4.13Å; L1775-L1777 HydrophobicContact CB-CG 3.99Å; L1775-L1777 HydrophobicContact CD1-CD1 4.22Å; L1775-L1777 PolarHBondContact O-N 2.68Å; L1777-L1779 PolarHBondContact O-N 3.45Å; L1777-L1780 HydrophobicContact CD2-CD2 3.9Å; L1777-L1780 PolarHBondContact O-N 3.45Å; L1777-W1837 HydrophobicContact CD1-CZ3 4.42Å; L1777-I1859 HydrophobicContact CD1-CD1 4.48Å; L1777-I1859 HydrophobicContact CD2-CD1 4.26Å; L1777-L1862 CarbonylContact C-O 3.58Å; L1777-L1862 HydrophobicContact CB-CB 4.1Å; L1777-L1862 HydrophobicContact CD1-CB 3.76Å; L1777-L1862 HydrophobicContact CD1-CD1 4.08Å; L1777-C1863 CarbonylContact O-C 3.59Å; L1777-C1863 WeakPolarHBondContact O-CA 3.4Å
1778D93.8Very high93.6Very high33 Ų3328.4 Ų28.418%0.17616%0.159CC..THydrogen-bonded Turntrans-77.3-4.9170.272.9-38.6000114.5R1769 Q1772 K1773 C1776 K1864R1769-D1778 IonicContact CZ-OD2 2.76Å; R1769-D1778 IonicContact NH1-OD2 3.86Å; R1769-D1778 PolarHBondContact NH1-OD2 3.37Å; R1769-D1778 IonicContact NH2-OD2 2.72Å; Q1772-D1778 HydrophobicContact CG-CB 3.82Å; K1773-D1778 WeakPolarHBondContact CG-OD2 3.15Å; C1776-D1778 PolarHBondContact O-N 3.39Å; D1778-K1864 WeakPolarHBondContact O-CD 3.38Å
1779L93.2Very high93.4Very high33 Ų3328.6 Ų28.617%0.17316%0.16CC..THydrogen-bonded Turntrans-89.8-38168.4-53.7178.9000111.4C1776 L1777 S1781 L1817 H1821 L1824 V1825C1776-L1779 HydrophobicContact CB-CD1 4.2Å; C1776-L1779 WeakPolarHBondContact O-CB 3.33Å; C1776-L1779 PolarHBondContact O-N 3.44Å; L1777-L1779 PolarHBondContact O-N 3.45Å; L1779-S1781 PolarHBondContact O-N 3.27Å; L1779-L1817 HydrophobicContact CB-CD2 4.09Å; L1779-H1821 HydrophobicContact CD1-CB 4.25Å; L1779-L1824 HydrophobicContact CD1-CD1 4.43Å; L1779-V1825 HydrophobicContact CD1-CG2 4.23Å
1780L94.9Very high93.1Very high2 Ų231.4 Ų31.41%0.0118%0.177CC..  trans-59.6109.1-175.7-178.856.6000113.9L1777 A1784 A1785 I1813 L1817 I1859 C1863 K1864L1777-L1780 HydrophobicContact CD2-CD2 3.9Å; L1777-L1780 PolarHBondContact O-N 3.45Å; L1780-A1784 HydrophobicContact CD1-CB 4.09Å; L1780-A1785 HydrophobicContact CD1-CB 4.18Å; L1780-A1785 HydrophobicContact CD2-CB 4.05Å; L1780-A1785 HydrophobicContact CG-CB 4.09Å; L1780-I1813 HydrophobicContact CD1-CG2 3.86Å; L1780-I1813 HydrophobicContact CD2-CG2 3.81Å; L1780-I1813 HydrophobicContact CG-CG2 4.42Å; L1780-L1817 HydrophobicContact CB-CD1 4.16Å; L1780-L1817 HydrophobicContact CD1-CD1 4.41Å; L1780-I1859 HydrophobicContact CD2-CG2 3.8Å; L1780-C1863 HydrophobicContact CD2-CB 4.5Å; L1780-C1863 HydrophobicContact CG-CB 4.38Å; L1780-C1863 WeakPolarHBondContact O-CB 3.43Å; L1780-K1864 WeakPolarHBondContact O-CA 3.22Å; L1780-K1864 VanDerWaalsContact O-CB 3.3Å; L1780-K1864 WeakPolarHBondContact O-CB 3.48Å; L1780-K1864 PolarHBondContact O-N 3.16Å
1781S93.8Very high92.9Very high38 Ų3832.7 Ų32.727%0.26619%0.186SC..BIsolated β-bridgetrans-69.9150.9173.372.80000112.7L1779 S1783 A1784 A1785L1779-S1781 PolarHBondContact O-N 3.27Å; S1781-S1783 VanDerWaalsContact C-N 3.27Å; S1781-S1783 PolarHBondContact O-N 3.45Å; S1781-S1783 PolarHBondContact OG-OG 3.38Å; S1781-A1784 PolarHBondContact O-N 3.19Å; S1781-A1784 VanDerWaalsContact OG-CB 3.29Å; S1781-A1784 WeakPolarHBondContact OG-CB 3.33Å; S1781-A1784 PolarHBondContact OG-N 3.14Å; S1781-A1785 PolarHBondContact O-N 2.98Å
1782L92.8Very high92.6Very high32 Ų3235.4 Ų35.417%0.16820%0.199CC..Hα-helixtrans-58.7-35.7176.1-177.759.1000113.1C1786 I1860 K1864 A1865 D1869 Y1873L1782-C1786 PolarHBondContact O-N 3.41Å; L1782-C1786 VanDerWaalsContact O-N 3.08Å; L1782-C1786 PolarHBondContact O-SG 3.07Å; L1782-I1860 HydrophobicContact CD1-CD1 3.55Å; L1782-I1860 HydrophobicContact CD1-CG2 4.06Å; L1782-K1864 PolarHBondContact N-O 3.5Å; L1782-A1865 HydrophobicContact CB-CB 3.87Å; L1782-A1865 HydrophobicContact CD2-CB 4.15Å; L1782-D1869 HydrophobicContact CD2-CB 3.98Å; L1782-Y1873 HydrophobicContact CD1-CD2 4.35Å; L1782-Y1873 HydrophobicContact CD1-CG 4.41Å
1783S92.5Very high92.2Very high73 Ų7340.4 Ų40.451%0.5123%0.226SC..Hα-helixtrans-67.5-49.8176.652.30000111.2S1781 A1785 C1786 D1787S1781-S1783 VanDerWaalsContact C-N 3.27Å; S1781-S1783 PolarHBondContact O-N 3.45Å; S1781-S1783 PolarHBondContact OG-OG 3.38Å; S1783-A1785 PolarHBondContact O-N 3.04Å; S1783-C1786 WeakPolarHBondContact O-CA 3.42Å; S1783-C1786 WeakPolarHBondContact O-CB 3.26Å; S1783-C1786 PolarHBondContact O-N 2.65Å; S1783-D1787 PolarHBondContact O-N 3.41Å
1784A91.4Very high91.8Very high18 Ų1837 Ų3715%0.14921%0.212CC..Hα-helixtrans-60.4-35.4179.200000112.5L1780 S1781 A1788L1780-A1784 HydrophobicContact CD1-CB 4.09Å; S1781-A1784 PolarHBondContact O-N 3.19Å; S1781-A1784 VanDerWaalsContact OG-CB 3.29Å; S1781-A1784 WeakPolarHBondContact OG-CB 3.33Å; S1781-A1784 PolarHBondContact OG-N 3.14Å; A1784-A1788 PolarHBondContact O-N 3.04Å; A1784-A1788 VanDerWaalsContact O-N 3.09Å
1785A92.6Very high91.1Very high0 Ų041.3 Ų41.30%022%0.223CC..Hα-helixtrans-63.3-47.7171.600000112.1L1780 S1781 S1783 A1788 L1789 I1860L1780-A1785 HydrophobicContact CD1-CB 4.18Å; L1780-A1785 HydrophobicContact CD2-CB 4.05Å; L1780-A1785 HydrophobicContact CG-CB 4.09Å; S1781-A1785 PolarHBondContact O-N 2.98Å; S1783-A1785 PolarHBondContact O-N 3.04Å; A1785-A1788 PolarHBondContact O-N 3.05Å; A1785-L1789 WeakPolarHBondContact O-CB 3.47Å; A1785-L1789 WeakPolarHBondContact O-CD1 3.44Å; A1785-L1789 WeakPolarHBondContact O-CG 3.4Å; A1785-L1789 PolarHBondContact O-N 3.31Å; A1785-I1860 HydrophobicContact CB-CD1 4.08Å
1786C91.4Very high90.5Very high27 Ų2747.9 Ų47.918%0.18225%0.254CS..Hα-helixtrans-59.1-46.8174.6-67.90000112.1L1782 S1783 A1788 L1789 D1790 Y1873L1782-C1786 PolarHBondContact O-N 3.41Å; L1782-C1786 VanDerWaalsContact O-N 3.08Å; L1782-C1786 PolarHBondContact O-SG 3.07Å; S1783-C1786 WeakPolarHBondContact O-CA 3.42Å; S1783-C1786 WeakPolarHBondContact O-CB 3.26Å; S1783-C1786 PolarHBondContact O-N 2.65Å; C1786-A1788 VanDerWaalsContact C-N 3.28Å; C1786-A1788 PolarHBondContact O-N 3Å; C1786-L1789 PolarHBondContact O-N 3.05Å; C1786-L1789 VanDerWaalsContact O-N 3.14Å; C1786-D1790 PolarHBondContact O-N 3.35Å; C1786-Y1873 WeakPolarHBondContact SG-CE2 3.4Å
1787D90.9Very high90.1Very high83 Ų8348.5 Ų48.544%0.44426%0.256SS..Hα-helixtrans-62.4-35-177.9-61.4-32.6000111.9S1783 Q1791S1783-D1787 PolarHBondContact O-N 3.41Å; D1787-Q1791 WeakPolarHBondContact O-CG 3.46Å; D1787-Q1791 PolarHBondContact O-N 3.28Å; D1787-Q1791 PolarHBondContact O-NE2 3.47Å
1788A91.1Very high89.5Confident0 Ų054.4 Ų54.40%029%0.287CS..Hα-helixtrans-72.1-44.4172.400000112.3A1784 A1785 C1786 D1790 Q1791 H1792 T1812 I1813A1784-A1788 PolarHBondContact O-N 3.04Å; A1784-A1788 VanDerWaalsContact O-N 3.09Å; A1785-A1788 PolarHBondContact O-N 3.05Å; C1786-A1788 VanDerWaalsContact C-N 3.28Å; C1786-A1788 PolarHBondContact O-N 3Å; A1788-D1790 VanDerWaalsContact C-N 3.33Å; A1788-D1790 PolarHBondContact O-N 2.96Å; A1788-Q1791 PolarHBondContact O-N 3.14Å; A1788-H1792 PolarHBondContact O-CD2 3.45Å; A1788-H1792 PolarHBondContact O-N 3Å; A1788-T1812 HydrophobicContact CB-CG2 4.19Å; A1788-I1813 HydrophobicContact CB-CD1 4.3Å; A1788-I1813 HydrophobicContact CB-CG1 3.54Å
1789L91.8Very high89.1Confident4 Ų456.4 Ų56.42%0.02130%0.296CS..Hα-helixtrans-60.7-40.2178.2-71.5166.9000112.5A1785 C1786 N1793 L1794 F1855 K1856 I1860 Y1873A1785-L1789 WeakPolarHBondContact O-CB 3.47Å; A1785-L1789 WeakPolarHBondContact O-CD1 3.44Å; A1785-L1789 WeakPolarHBondContact O-CG 3.4Å; A1785-L1789 PolarHBondContact O-N 3.31Å; C1786-L1789 PolarHBondContact O-N 3.05Å; C1786-L1789 VanDerWaalsContact O-N 3.14Å; L1789-N1793 PolarHBondContact O-N 3.43Å; L1789-L1794 HydrophobicContact CD2-CD1 3.84Å; L1789-L1794 PolarHBondContact O-N 3.06Å; L1789-L1794 VanDerWaalsContact O-N 3.13Å; L1789-F1855 HydrophobicContact CD2-CD1 3.94Å; L1789-F1855 HydrophobicContact CD2-CE1 3.62Å; L1789-K1856 HydrophobicContact CD1-CG 4.05Å; L1789-K1856 HydrophobicContact CD2-CG 4Å; L1789-I1860 HydrophobicContact CD1-CD1 4.47Å; L1789-Y1873 WeakPolarHBondContact CD1-OH 3.4Å
1790D87.9Confident88.8Confident87 Ų8758 Ų5847%0.46531%0.308SS..Hα-helixtrans-71-33.7178.2-87.8-43.5000112.4C1786 A1788 N1793 K1795C1786-D1790 PolarHBondContact O-N 3.35Å; A1788-D1790 VanDerWaalsContact C-N 3.33Å; A1788-D1790 PolarHBondContact O-N 2.96Å; D1790-N1793 PolarHBondContact O-N 3.25Å; D1790-N1793 VanDerWaalsContact O-N 3.12Å; D1790-K1795 WeakPolarHBondContact OD1-CE 3.27Å
1791Q90.4Very high88.5Confident106 Ų10658 Ų5850%0.49531%0.308SS..Hα-helixtrans-67.3-34.9175.8-76.7166.612.700113D1787 A1788 N1793 R1816D1787-Q1791 WeakPolarHBondContact O-CG 3.46Å; D1787-Q1791 PolarHBondContact O-N 3.28Å; D1787-Q1791 PolarHBondContact O-NE2 3.47Å; A1788-Q1791 PolarHBondContact O-N 3.14Å; Q1791-N1793 PolarHBondContact O-N 3.04Å; Q1791-R1816 VanDerWaalsContact CD-NH2 3.31Å
1792H90.1Very high88.3Confident58 Ų5859.2 Ų59.227%0.26931%0.312SS..THydrogen-bonded Turntrans-82.611172.6-72.4-79.8000113.3A1788 L1794 N1808 C1809 T1812A1788-H1792 PolarHBondContact O-CD2 3.45Å; A1788-H1792 PolarHBondContact O-N 3Å; H1792-L1794 HydrophobicContact CB-CD1 4.02Å; H1792-L1794 HydrophobicContact CB-CD2 4.46Å; H1792-L1794 HydrophobicContact CB-CG 3.84Å; H1792-L1794 PolarHBondContact O-N 3.13Å; H1792-L1794 VanDerWaalsContact O-N 3.14Å; H1792-N1808 PolarHBondContact CE1-O 3.12Å; H1792-N1808 PolarHBondContact NE2-O 3.13Å; H1792-C1809 HydrophobicContact CB-CB 4.46Å; H1792-T1812 PolarHBondContact NE2-OG1 3.03Å
1793N86.3Confident88.2Confident115 Ų11557.8 Ų57.862%0.61530%0.304SS*.THydrogen-bonded Turntrans55.326.6178.4-68.7-67.2000115L1789 D1790 Q1791 K1795L1789-N1793 PolarHBondContact O-N 3.43Å; D1790-N1793 PolarHBondContact O-N 3.25Å; D1790-N1793 VanDerWaalsContact O-N 3.12Å; Q1791-N1793 PolarHBondContact O-N 3.04Å; N1793-K1795 PolarHBondContact O-N 3.06Å
1794L85.4Confident87.9Confident14 Ų1456.7 Ų56.77%0.07329%0.292CS..  trans-77.760-173.5-58177.9000112.1L1789 H1792 M1801 C1809 V1852 F1855 K1856L1789-L1794 HydrophobicContact CD2-CD1 3.84Å; L1789-L1794 PolarHBondContact O-N 3.06Å; L1789-L1794 VanDerWaalsContact O-N 3.13Å; H1792-L1794 HydrophobicContact CB-CD1 4.02Å; H1792-L1794 HydrophobicContact CB-CD2 4.46Å; H1792-L1794 HydrophobicContact CB-CG 3.84Å; H1792-L1794 PolarHBondContact O-N 3.13Å; H1792-L1794 VanDerWaalsContact O-N 3.14Å; L1794-M1801 HydrophobicContact CD1-CE 3.56Å; L1794-M1801 HydrophobicContact CD1-SD 3.97Å; L1794-M1801 HydrophobicContact CD2-CE 3.8Å; L1794-M1801 HydrophobicContact CD2-CG 4.29Å; L1794-M1801 HydrophobicContact CD2-SD 3.99Å; L1794-M1801 HydrophobicContact CG-CE 4.36Å; L1794-C1809 HydrophobicContact CD1-CB 4.31Å; L1794-V1852 HydrophobicContact CB-CG1 4.05Å; L1794-V1852 HydrophobicContact CD2-CG2 4.27Å; L1794-F1855 HydrophobicContact CD1-CD1 4.28Å; L1794-F1855 HydrophobicContact CD1-CE1 4.13Å; L1794-K1856 WeakPolarHBondContact O-CE 3.39Å; L1794-K1856 PolarHBondContact O-NZ 3Å
1795K78.2Confident87.8Confident131 Ų13159.1 Ų59.157%0.5730%0.301SS*.  trans-94.4-30.3-173.3-68.9177.6-179.9167.40113.6D1790 N1793D1790-K1795 WeakPolarHBondContact OD1-CE 3.27Å; N1793-K1795 PolarHBondContact O-N 3.06Å
1796Q82.9Confident87.8Confident139 Ų13959.1 Ų59.165%0.6530%0.301SS*.  trans-88114.4178.1-65.9-171.5-1.100110.5Q1799 V1852Q1796-Q1799 HydrophobicContact CB-CB 4.13Å; Q1796-Q1799 PolarHBondContact O-N 3.29Å; Q1796-V1852 VanDerWaalsContact O-CB 3.25Å; Q1796-V1852 WeakPolarHBondContact O-CB 3.31Å; Q1796-V1852 WeakPolarHBondContact O-CG2 3.45Å
1797N85.7Confident87.8Confident26 Ų2657.9 Ų57.914%0.13929%0.292CS..THydrogen-bonded Turntrans-78-25.9-170.7-76.3-21.5000114.4Q1799 L1853 K1856 Q1877N1797-Q1799 VanDerWaalsContact C-N 3.33Å; N1797-L1853 HydrophobicContact CB-CB 4.1Å; N1797-L1853 HydrophobicContact CB-CD1 4.42Å; N1797-L1853 WeakPolarHBondContact O-CB 3.36Å; N1797-L1853 PolarHBondContact O-N 3.25Å; N1797-K1856 PolarHBondContact OD1-NZ 3.25Å; N1797-Q1877 WeakPolarHBondContact ND2-CA 3.41Å; N1797-Q1877 PolarHBondContact ND2-O 3.05Å; N1797-Q1877 PolarHBondContact ND2-OE1 3.45Å; N1797-Q1877 VanDerWaalsContact ND2-OE1 3.11Å; N1797-Q1877 PolarHBondContact OD1-OE1 3.15Å
1798D81.4Confident87.8Confident123 Ų12357.5 Ų57.566%0.65829%0.29SS*.THydrogen-bonded Turntrans-81.3-11.3176.5-60.5-46.4000113.3
1799Q85.8Confident87.9Confident76 Ų7657.5 Ų57.536%0.35529%0.29SS..SBendtrans-67.1132.9-179.3-173.9178.3-1.200110.5Q1796 N1797 R1851 V1852Q1796-Q1799 HydrophobicContact CB-CB 4.13Å; Q1796-Q1799 PolarHBondContact O-N 3.29Å; N1797-Q1799 VanDerWaalsContact C-N 3.33Å; Q1799-R1851 WeakPolarHBondContact O-CA 3.49Å; Q1799-V1852 HydrophobicContact CB-CG2 4.16Å; Q1799-V1852 WeakPolarHBondContact O-CG2 3.45Å; Q1799-V1852 PolarHBondContact O-N 3.07Å
1800P87.2Confident88Confident67 Ų6757.3 Ų57.344%0.43529%0.289SS..EExtended strand (participates in β ladder)trans-73.8126.7168.129.7-32.2000110R1849 I1850P1800-R1849 HydrophobicContact CB-CB 4.35Å; P1800-I1850 CarbonylContact C-O 3.58Å
1801M89.1Confident88.2Confident1 Ų154.3 Ų54.31%0.00527%0.274CS..EExtended strand (participates in β ladder)trans-85133.6165.4-61.6179.563.300109.5L1794 Q1805 I1806 R1849 I1850 V1852 F1855L1794-M1801 HydrophobicContact CD1-CE 3.56Å; L1794-M1801 HydrophobicContact CD1-SD 3.97Å; L1794-M1801 HydrophobicContact CD2-CE 3.8Å; L1794-M1801 HydrophobicContact CD2-CG 4.29Å; L1794-M1801 HydrophobicContact CD2-SD 3.99Å; L1794-M1801 HydrophobicContact CG-CE 4.36Å; M1801-Q1805 VanDerWaalsContact CA-OE1 3.29Å; M1801-Q1805 HydrophobicContact CB-CB 4.48Å; M1801-Q1805 HydrophobicContact CE-CB 4.25Å; M1801-I1806 HydrophobicContact CB-CG1 4.02Å; M1801-I1806 HydrophobicContact CE-CG1 4Å; M1801-R1849 VanDerWaalsContact O-CA 3.24Å; M1801-R1849 WeakPolarHBondContact O-CA 3.33Å; M1801-I1850 PolarHBondContact N-O 3.43Å; M1801-I1850 PolarHBondContact O-N 3.33Å; M1801-I1850 VanDerWaalsContact O-N 3.09Å; M1801-V1852 HydrophobicContact CG-CB 4.41Å; M1801-V1852 HydrophobicContact CG-CG2 3.46Å; M1801-V1852 VanDerWaalsContact CG-CG2 3.46Å; M1801-V1852 HydrophobicContact SD-CB 4.38Å; M1801-V1852 HydrophobicContact SD-CG2 3.84Å; M1801-F1855 HydrophobicContact CE-CD1 4.04Å; M1801-F1855 HydrophobicContact CE-CE1 4.25Å; M1801-F1855 HydrophobicContact CE-CG 4.28Å; M1801-F1855 HydrophobicContact SD-CB 3.8Å; M1801-F1855 HydrophobicContact SD-CD1 3.75Å; M1801-F1855 HydrophobicContact SD-CG 3.81Å
1802D89.7Confident88.3Confident64 Ų6450.7 Ų50.734%0.34226%0.259SS..EExtended strand (participates in β ladder)trans-81.4166.7165.570.350.1000112L1804 Q1805 I1806D1802-L1804 VanDerWaalsContact C-N 3.26Å; D1802-L1804 PolarHBondContact O-N 3.05Å; D1802-L1804 WeakPolarHBondContact OD1-CA 3.42Å; D1802-L1804 WeakPolarHBondContact OD1-CB 3.47Å; D1802-L1804 PolarHBondContact OD1-N 3.49Å; D1802-Q1805 WeakPolarHBondContact O-CB 3.38Å; D1802-Q1805 PolarHBondContact O-N 3.27Å; D1802-Q1805 PolarHBondContact OD1-N 3.5Å; D1802-I1806 VanDerWaalsContact O-CG1 3.31Å; D1802-I1806 WeakPolarHBondContact O-CG1 2.77Å; D1802-I1806 PolarHBondContact O-N 3.31Å
1803I89.6Confident88.5Confident1 Ų148 Ų481%0.00525%0.247CC..Hα-helixtrans-60.2-31.7-178.3-75.6173.9000113.7K1725 V1726 I1806 I1807 L1835 L1839 G1848K1725-I1803 VanDerWaalsContact O-CD1 3.29Å; K1725-I1803 WeakPolarHBondContact O-CD1 3.33Å; K1725-I1803 WeakPolarHBondContact O-CG2 3.47Å; V1726-I1803 HydrophobicContact CB-CD1 4.17Å; V1726-I1803 HydrophobicContact CG2-CD1 3.82Å; I1803-I1806 HydrophobicContact CG1-CD1 4.41Å; I1803-I1806 PolarHBondContact O-N 3.3Å; I1803-I1807 HydrophobicContact CG2-CD1 3.68Å; I1803-I1807 HydrophobicContact CG2-CG1 4.31Å; I1803-I1807 WeakPolarHBondContact O-CB 3.18Å; I1803-I1807 VanDerWaalsContact O-CG1 3.27Å; I1803-I1807 WeakPolarHBondContact O-CG1 3.29Å; I1803-I1807 PolarHBondContact O-N 3.38Å; I1803-L1835 HydrophobicContact CG1-CD1 4.44Å; I1803-L1835 HydrophobicContact CG2-CD1 4.23Å; I1803-L1835 HydrophobicContact CG2-CD2 4.06Å; I1803-L1839 HydrophobicContact CD1-CD1 3.76Å; I1803-L1839 HydrophobicContact CD1-CD2 4.04Å; I1803-L1839 HydrophobicContact CG1-CD1 4.31Å; I1803-L1839 HydrophobicContact CG1-CD2 4.09Å; I1803-G1848 PolarHBondContact N-O 3.45Å
1804L88.1Confident89Confident50 Ų5042.5 Ų42.526%0.26222%0.217SC..Hα-helixtrans-72-39.6179.1-169.367.5000110.8A1704 Q1706 D1802 I1806 I1807 N1808A1704-L1804 HydrophobicContact CB-CD2 3.92Å; A1704-L1804 WeakPolarHBondContact O-CD1 3.46Å; Q1706-L1804 HydrophobicContact CG-CD1 4.27Å; D1802-L1804 VanDerWaalsContact C-N 3.26Å; D1802-L1804 PolarHBondContact O-N 3.05Å; D1802-L1804 WeakPolarHBondContact OD1-CA 3.42Å; D1802-L1804 WeakPolarHBondContact OD1-CB 3.47Å; D1802-L1804 PolarHBondContact OD1-N 3.49Å; L1804-I1806 VanDerWaalsContact C-N 3.32Å; L1804-I1806 PolarHBondContact O-N 3.05Å; L1804-I1807 PolarHBondContact O-N 3.16Å; L1804-N1808 WeakPolarHBondContact O-CB 3.43Å; L1804-N1808 PolarHBondContact O-N 2.84Å; L1804-N1808 PolarHBondContact O-ND2 3.05Å; L1804-N1808 PolarHBondContact O-OD1 3.39Å
1805Q88.5Confident89.2Confident70 Ų7044.8 Ų44.833%0.32723%0.229SC..Hα-helixtrans-61.8-39.4172.1-66.7173.1-25.700112.1M1801 D1802 C1809M1801-Q1805 VanDerWaalsContact CA-OE1 3.29Å; M1801-Q1805 HydrophobicContact CB-CB 4.48Å; M1801-Q1805 HydrophobicContact CE-CB 4.25Å; D1802-Q1805 WeakPolarHBondContact O-CB 3.38Å; D1802-Q1805 PolarHBondContact O-N 3.27Å; D1802-Q1805 PolarHBondContact OD1-N 3.5Å; Q1805-C1809 WeakPolarHBondContact O-CB 3.33Å; Q1805-C1809 PolarHBondContact O-N 3.41Å; Q1805-C1809 VanDerWaalsContact O-N 3.12Å
1806I92.8Very high89.8Confident0 Ų042 Ų420%022%0.215CC..Hα-helixtrans-63.8-49.4174.2-60.4163.7000110.4M1801 D1802 I1803 L1804 N1808 C1809 L1810 L1835 L1838 I1850 F1855M1801-I1806 HydrophobicContact CB-CG1 4.02Å; M1801-I1806 HydrophobicContact CE-CG1 4Å; D1802-I1806 VanDerWaalsContact O-CG1 3.31Å; D1802-I1806 WeakPolarHBondContact O-CG1 2.77Å; D1802-I1806 PolarHBondContact O-N 3.31Å; I1803-I1806 HydrophobicContact CG1-CD1 4.41Å; I1803-I1806 PolarHBondContact O-N 3.3Å; L1804-I1806 VanDerWaalsContact C-N 3.32Å; L1804-I1806 PolarHBondContact O-N 3.05Å; I1806-N1808 PolarHBondContact O-N 3.42Å; I1806-C1809 PolarHBondContact O-N 3.39Å; I1806-L1810 HydrophobicContact CG2-CD1 3.79Å; I1806-L1810 HydrophobicContact CG2-CG 4.22Å; I1806-L1810 WeakPolarHBondContact O-CB 3.48Å; I1806-L1810 VanDerWaalsContact O-CG 3.32Å; I1806-L1810 WeakPolarHBondContact O-CG 3.43Å; I1806-L1810 PolarHBondContact O-N 3.44Å; I1806-L1835 HydrophobicContact CB-CD1 4.13Å; I1806-L1835 HydrophobicContact CD1-CD1 4.39Å; I1806-L1835 HydrophobicContact CG2-CD1 3.62Å; I1806-L1838 HydrophobicContact CG2-CD1 4.34Å; I1806-I1850 HydrophobicContact CD1-CD1 3.67Å; I1806-I1850 HydrophobicContact CD1-CG1 3.66Å; I1806-I1850 HydrophobicContact CG1-CD1 4.24Å; I1806-I1850 HydrophobicContact CG1-CG1 4.33Å; I1806-F1855 HydrophobicContact CG2-CD2 4.17Å; I1806-F1855 HydrophobicContact CG2-CE2 3.84Å
1807I91.9Very high90.2Very high1 Ų135.6 Ų35.61%0.00519%0.185CC..Hα-helixtrans-58.5-47.8178.9-73.8166.1000111Q1706 F1708 L1709 I1803 L1804 C1809 L1810 T1811 V1831 L1835Q1706-I1807 HydrophobicContact CG-CD1 3.75Å; F1708-I1807 HydrophobicContact CE1-CG2 4.13Å; F1708-I1807 HydrophobicContact CZ-CG2 4.06Å; L1709-I1807 HydrophobicContact CD1-CD1 3.81Å; L1709-I1807 HydrophobicContact CD1-CG1 4.1Å; L1709-I1807 HydrophobicContact CD1-CG2 4.08Å; I1803-I1807 HydrophobicContact CG2-CD1 3.68Å; I1803-I1807 HydrophobicContact CG2-CG1 4.31Å; I1803-I1807 WeakPolarHBondContact O-CB 3.18Å; I1803-I1807 VanDerWaalsContact O-CG1 3.27Å; I1803-I1807 WeakPolarHBondContact O-CG1 3.29Å; I1803-I1807 PolarHBondContact O-N 3.38Å; L1804-I1807 PolarHBondContact O-N 3.16Å; I1807-C1809 VanDerWaalsContact C-N 3.31Å; I1807-C1809 PolarHBondContact O-N 3.01Å; I1807-L1810 PolarHBondContact O-N 3.3Å; I1807-T1811 WeakPolarHBondContact O-CB 3.24Å; I1807-T1811 PolarHBondContact O-N 2.93Å; I1807-T1811 PolarHBondContact O-OG1 3.27Å; I1807-V1831 HydrophobicContact CG1-CG1 4.5Å; I1807-V1831 HydrophobicContact CG2-CG1 4.23Å; I1807-L1835 HydrophobicContact CD1-CD2 3.87Å; I1807-L1835 HydrophobicContact CG1-CD2 3.76Å
1808N89.9Confident90.5Very high74 Ų7437.7 Ų37.740%0.39619%0.194SC..Hα-helixtrans-61.2-41.7-179.5-68.5-10.1000111.5H1792 L1804 I1806 T1811 T1812H1792-N1808 PolarHBondContact CE1-O 3.12Å; H1792-N1808 PolarHBondContact NE2-O 3.13Å; L1804-N1808 WeakPolarHBondContact O-CB 3.43Å; L1804-N1808 PolarHBondContact O-N 2.84Å; L1804-N1808 PolarHBondContact O-ND2 3.05Å; L1804-N1808 PolarHBondContact O-OD1 3.39Å; I1806-N1808 PolarHBondContact O-N 3.42Å; N1808-T1811 PolarHBondContact O-N 3.49Å; N1808-T1812 PolarHBondContact O-N 3.39Å; N1808-T1812 VanDerWaalsContact O-N 3.14Å; N1808-T1812 PolarHBondContact O-OG1 3.08Å; N1808-T1812 VanDerWaalsContact O-OG1 3.12Å
1809C92.5Very high90.8Very high0 Ų039.2 Ų39.20%020%0.198CC..Hα-helixtrans-66-46.3176.6-164.40000112.4H1792 L1794 Q1805 I1806 I1807 T1811 T1812 I1813 F1855H1792-C1809 HydrophobicContact CB-CB 4.46Å; L1794-C1809 HydrophobicContact CD1-CB 4.31Å; Q1805-C1809 WeakPolarHBondContact O-CB 3.33Å; Q1805-C1809 PolarHBondContact O-N 3.41Å; Q1805-C1809 VanDerWaalsContact O-N 3.12Å; I1806-C1809 PolarHBondContact O-N 3.39Å; I1807-C1809 VanDerWaalsContact C-N 3.31Å; I1807-C1809 PolarHBondContact O-N 3.01Å; C1809-T1811 VanDerWaalsContact C-N 3.35Å; C1809-T1811 PolarHBondContact O-N 2.85Å; C1809-T1812 PolarHBondContact O-N 3.36Å; C1809-I1813 WeakPolarHBondContact O-CG1 3.31Å; C1809-I1813 PolarHBondContact O-N 3.19Å; C1809-I1813 VanDerWaalsContact O-N 3.13Å; C1809-F1855 HydrophobicContact CB-CE1 4.24Å; C1809-F1855 HydrophobicContact CB-CZ 4.07Å
1810L95.5Very high90.9Very high0 Ų041.8 Ų41.80%021%0.21CC..Hα-helixtrans-63.4-38.8176.3-70.5177000112.2I1806 I1807 I1813 Y1814 V1831 C1834 L1835 L1838 F1855 I1859I1806-L1810 HydrophobicContact CG2-CD1 3.79Å; I1806-L1810 HydrophobicContact CG2-CG 4.22Å; I1806-L1810 WeakPolarHBondContact O-CB 3.48Å; I1806-L1810 VanDerWaalsContact O-CG 3.32Å; I1806-L1810 WeakPolarHBondContact O-CG 3.43Å; I1806-L1810 PolarHBondContact O-N 3.44Å; I1807-L1810 PolarHBondContact O-N 3.3Å; L1810-I1813 WeakPolarHBondContact O-CB 3.4Å; L1810-I1813 PolarHBondContact O-N 3.28Å; L1810-I1813 VanDerWaalsContact O-N 3.14Å; L1810-Y1814 HydrophobicContact CB-CD2 4.4Å; L1810-Y1814 HydrophobicContact CB-CE2 4.39Å; L1810-Y1814 HydrophobicContact CD2-CE2 4.28Å; L1810-Y1814 WeakPolarHBondContact O-CD2 3.46Å; L1810-Y1814 PolarHBondContact O-N 3.14Å; L1810-V1831 HydrophobicContact CB-CG1 4.11Å; L1810-V1831 HydrophobicContact CB-CG2 4.27Å; L1810-C1834 HydrophobicContact CD1-CB 4.18Å; L1810-C1834 HydrophobicContact CD2-CB 4.32Å; L1810-L1835 HydrophobicContact CD1-CB 4.04Å; L1810-L1838 HydrophobicContact CD1-CD1 4.22Å; L1810-L1838 HydrophobicContact CD2-CD1 4.34Å; L1810-F1855 HydrophobicContact CD2-CE2 3.99Å; L1810-F1855 HydrophobicContact CD2-CZ 4.1Å; L1810-F1855 HydrophobicContact CG-CE2 4.18Å; L1810-F1855 HydrophobicContact CG-CZ 4.35Å; L1810-I1859 HydrophobicContact CD2-CD1 3.96Å
1811T91.8Very high90.8Very high24 Ų2441.5 Ų41.515%0.14720%0.203CC..Hα-helixtrans-62.9-48.1178.6-52.70000109.8F1708 I1807 N1808 C1809 I1813 Y1814 D1815 V1827F1708-T1811 HydrophobicContact CE2-CG2 4.35Å; F1708-T1811 HydrophobicContact CZ-CG2 4.18Å; F1708-T1811 WeakPolarHBondContact CZ-OG1 3.3Å; I1807-T1811 WeakPolarHBondContact O-CB 3.24Å; I1807-T1811 PolarHBondContact O-N 2.93Å; I1807-T1811 PolarHBondContact O-OG1 3.27Å; N1808-T1811 PolarHBondContact O-N 3.49Å; C1809-T1811 VanDerWaalsContact C-N 3.35Å; C1809-T1811 PolarHBondContact O-N 2.85Å; T1811-I1813 PolarHBondContact O-N 3.47Å; T1811-Y1814 PolarHBondContact O-N 2.87Å; T1811-Y1814 VanDerWaalsContact O-N 3.1Å; T1811-D1815 WeakPolarHBondContact O-CB 3.21Å; T1811-D1815 PolarHBondContact O-N 2.93Å; T1811-V1827 HydrophobicContact CG2-CG1 4.25Å
1812T92.2Very high90.4Very high30 Ų3046.7 Ų46.718%0.18423%0.23CC..Hα-helixtrans-57.9-32.5173.4-590000113.6A1788 H1792 N1808 C1809A1788-T1812 HydrophobicContact CB-CG2 4.19Å; H1792-T1812 PolarHBondContact NE2-OG1 3.03Å; N1808-T1812 PolarHBondContact O-N 3.39Å; N1808-T1812 VanDerWaalsContact O-N 3.14Å; N1808-T1812 PolarHBondContact O-OG1 3.08Å; N1808-T1812 VanDerWaalsContact O-OG1 3.12Å; C1809-T1812 PolarHBondContact O-N 3.36Å
1813I94.6Very high90.2Very high2 Ų251.3 Ų51.31%0.0126%0.255CS..Hα-helixtrans-70.1-50174.5-72168.6000110.6L1780 A1788 C1809 L1810 T1811 R1816 L1817L1780-I1813 HydrophobicContact CD1-CG2 3.86Å; L1780-I1813 HydrophobicContact CD2-CG2 3.81Å; L1780-I1813 HydrophobicContact CG-CG2 4.42Å; A1788-I1813 HydrophobicContact CB-CD1 4.3Å; A1788-I1813 HydrophobicContact CB-CG1 3.54Å; C1809-I1813 WeakPolarHBondContact O-CG1 3.31Å; C1809-I1813 PolarHBondContact O-N 3.19Å; C1809-I1813 VanDerWaalsContact O-N 3.13Å; L1810-I1813 WeakPolarHBondContact O-CB 3.4Å; L1810-I1813 PolarHBondContact O-N 3.28Å; L1810-I1813 VanDerWaalsContact O-N 3.14Å; T1811-I1813 PolarHBondContact O-N 3.47Å; I1813-R1816 PolarHBondContact O-N 3.49Å; I1813-L1817 HydrophobicContact CG2-CD1 4.04Å; I1813-L1817 WeakPolarHBondContact O-CG 3.42Å; I1813-L1817 PolarHBondContact O-N 3.46Å
1814Y95.7Very high89.8Confident0 Ų057 Ų570%028%0.284CS..Hα-helixtrans-76.3-30.8-175.1-70.2-64.1000113.6L1775 C1776 L1810 T1811 R1816 L1817 E1818 V1825 C1830 V1831 C1834L1775-Y1814 WeakPolarHBondContact O-CE1 3.24Å; L1775-Y1814 PolarHBondContact O-OH 2.99Å; C1776-Y1814 HydrophobicContact CB-CE1 4.33Å; L1810-Y1814 HydrophobicContact CB-CD2 4.4Å; L1810-Y1814 HydrophobicContact CB-CE2 4.39Å; L1810-Y1814 HydrophobicContact CD2-CE2 4.28Å; L1810-Y1814 WeakPolarHBondContact O-CD2 3.46Å; L1810-Y1814 PolarHBondContact O-N 3.14Å; T1811-Y1814 PolarHBondContact O-N 2.87Å; T1811-Y1814 VanDerWaalsContact O-N 3.1Å; Y1814-R1816 VanDerWaalsContact C-N 3.27Å; Y1814-R1816 PolarHBondContact O-N 3.46Å; Y1814-L1817 HydrophobicContact CD1-CD1 3.79Å; Y1814-L1817 HydrophobicContact CE1-CD1 4.01Å; Y1814-L1817 CarbonylContact O-C 3.57Å; Y1814-L1817 PolarHBondContact O-N 3.37Å; Y1814-L1817 VanDerWaalsContact O-N 3.09Å; Y1814-E1818 PolarHBondContact O-N 3.01Å; Y1814-V1825 HydrophobicContact CD1-CG1 4.17Å; Y1814-C1830 HydrophobicContact CD1-CB 3.54Å; Y1814-C1830 HydrophobicContact CD2-CB 3.96Å; Y1814-C1830 HydrophobicContact CE1-CB 3.65Å; Y1814-C1830 HydrophobicContact CE2-CB 4.03Å; Y1814-C1830 WeakPolarHBondContact CE2-O 3.44Å; Y1814-C1830 HydrophobicContact CG-CB 3.73Å; Y1814-V1831 HydrophobicContact CD2-CB 4.44Å; Y1814-V1831 HydrophobicContact CD2-CG2 3.68Å; Y1814-V1831 HydrophobicContact CG-CG2 4.45Å; Y1814-C1834 HydrophobicContact CE2-CB 3.93Å; Y1814-C1834 WeakPolarHBondContact OH-CB 3.29Å; Y1814-C1834 PolarHBondContact OH-SG 2.96Å
1815D91.1Very high89.9Confident61 Ų6154.9 Ų54.933%0.32627%0.274SS..Hα-helixtrans-56.5-42171-68-23.5000111.3T1811 E1818 Q1819 V1827T1811-D1815 WeakPolarHBondContact O-CB 3.21Å; T1811-D1815 PolarHBondContact O-N 2.93Å; D1815-E1818 PolarHBondContact O-N 2.86Å; D1815-Q1819 VanDerWaalsContact O-CG 3.28Å; D1815-Q1819 WeakPolarHBondContact O-CG 3.46Å; D1815-Q1819 PolarHBondContact O-N 3.12Å; D1815-Q1819 VanDerWaalsContact O-N 3.1Å; D1815-Q1819 PolarHBondContact O-NE2 3.38Å; D1815-V1827 WeakPolarHBondContact OD1-CG1 3.35Å
1816R90Very high90Very high72 Ų7255.5 Ų55.527%0.27228%0.279SS..Hα-helixtrans-67.6-39.8175-73.4-175.5173.9139.623.6112.3Q1791 I1813 Y1814 E1818 Q1819 E1820Q1791-R1816 VanDerWaalsContact CD-NH2 3.31Å; I1813-R1816 PolarHBondContact O-N 3.49Å; Y1814-R1816 VanDerWaalsContact C-N 3.27Å; Y1814-R1816 PolarHBondContact O-N 3.46Å; R1816-E1818 VanDerWaalsContact C-N 3.33Å; R1816-Q1819 WeakPolarHBondContact O-CB 3.33Å; R1816-Q1819 PolarHBondContact O-N 2.94Å; R1816-E1820 PolarHBondContact O-N 3.08Å; R1816-E1820 VanDerWaalsContact O-N 3.14Å
1817L91.7Very high89.9Confident5 Ų555.9 Ų55.93%0.02628%0.282CS..Hα-helixtrans-69.7-31.7177.9-67.3171.7000112L1779 L1780 I1813 Y1814 E1820 H1821 V1825L1779-L1817 HydrophobicContact CB-CD2 4.09Å; L1780-L1817 HydrophobicContact CB-CD1 4.16Å; L1780-L1817 HydrophobicContact CD1-CD1 4.41Å; I1813-L1817 HydrophobicContact CG2-CD1 4.04Å; I1813-L1817 WeakPolarHBondContact O-CG 3.42Å; I1813-L1817 PolarHBondContact O-N 3.46Å; Y1814-L1817 HydrophobicContact CD1-CD1 3.79Å; Y1814-L1817 HydrophobicContact CE1-CD1 4.01Å; Y1814-L1817 CarbonylContact O-C 3.57Å; Y1814-L1817 PolarHBondContact O-N 3.37Å; Y1814-L1817 VanDerWaalsContact O-N 3.09Å; L1817-E1820 PolarHBondContact O-N 3.31Å; L1817-H1821 WeakPolarHBondContact O-CA 3.36Å; L1817-H1821 VanDerWaalsContact O-CB 3.28Å; L1817-H1821 WeakPolarHBondContact O-CB 3.44Å; L1817-H1821 PolarHBondContact O-N 3.46Å; L1817-V1825 HydrophobicContact CB-CG1 4.3Å; L1817-V1825 HydrophobicContact CB-CG2 4Å
1818E91.3Very high90Very high70 Ų7057.1 Ų57.133%0.32729%0.29SS..Hα-helixtrans-66.8-41171.2-171.3-174.9-113.600111.1Y1814 D1815 R1816 E1820 H1821 N1822 V1825 V1827Y1814-E1818 PolarHBondContact O-N 3.01Å; D1815-E1818 PolarHBondContact O-N 2.86Å; R1816-E1818 VanDerWaalsContact C-N 3.33Å; E1818-E1820 VanDerWaalsContact C-N 3.3Å; E1818-E1820 PolarHBondContact O-N 2.72Å; E1818-H1821 CarbonylContact O-C 3.35Å; E1818-H1821 PolarHBondContact O-N 3.44Å; E1818-N1822 WeakPolarHBondContact O-CA 3.35Å; E1818-N1822 WeakPolarHBondContact O-CB 3.45Å; E1818-N1822 PolarHBondContact O-N 2.87Å; E1818-V1825 HydrophobicContact CB-CB 4.39Å; E1818-V1825 HydrophobicContact CB-CG1 4.27Å; E1818-V1827 HydrophobicContact CB-CG2 3.82Å; E1818-V1827 HydrophobicContact CG-CG2 4.3Å
1819Q88.7Confident90.1Very high156 Ų15654.9 Ų54.973%0.72928%0.278SS*.Hα-helixtrans-60-37.3174.4-70163.828.100112.7D1815 R1816D1815-Q1819 VanDerWaalsContact O-CG 3.28Å; D1815-Q1819 WeakPolarHBondContact O-CG 3.46Å; D1815-Q1819 PolarHBondContact O-N 3.12Å; D1815-Q1819 VanDerWaalsContact O-N 3.1Å; D1815-Q1819 PolarHBondContact O-NE2 3.38Å; R1816-Q1819 WeakPolarHBondContact O-CB 3.33Å; R1816-Q1819 PolarHBondContact O-N 2.94Å
1820E86.2Confident90.2Very high130 Ų13055.2 Ų55.261%0.60728%0.28SS*.Hα-helixtrans-84.1-30.4176.7-67-174.5-177.600113.6R1816 L1817 E1818R1816-E1820 PolarHBondContact O-N 3.08Å; R1816-E1820 VanDerWaalsContact O-N 3.14Å; L1817-E1820 PolarHBondContact O-N 3.31Å; E1818-E1820 VanDerWaalsContact C-N 3.3Å; E1818-E1820 PolarHBondContact O-N 2.72Å
1821H86.4Confident90.2Very high61 Ų6155.2 Ų55.228%0.28228%0.28SS..Hα-helixtrans-142.440.4-165-60.2-36.5000113.9L1779 L1817 E1818 N1823 L1824 V1825L1779-H1821 HydrophobicContact CD1-CB 4.25Å; L1817-H1821 WeakPolarHBondContact O-CA 3.36Å; L1817-H1821 VanDerWaalsContact O-CB 3.28Å; L1817-H1821 WeakPolarHBondContact O-CB 3.44Å; L1817-H1821 PolarHBondContact O-N 3.46Å; E1818-H1821 CarbonylContact O-C 3.35Å; E1818-H1821 PolarHBondContact O-N 3.44Å; H1821-N1823 VanDerWaalsContact C-N 3.26Å; H1821-N1823 PolarHBondContact O-N 3.03Å; H1821-L1824 HydrophobicContact CB-CB 4.47Å; H1821-L1824 PolarHBondContact O-N 3.26Å; H1821-V1825 HydrophobicContact CB-CG2 4.19Å; H1821-V1825 PolarHBondContact O-N 3.39Å
1822N80.9Confident90.3Very high109 Ų10954 Ų5458%0.58327%0.273SS*.THydrogen-bonded Turntrans-39.3-46.3-176.1-166-33.5000114.8E1818 L1824E1818-N1822 WeakPolarHBondContact O-CA 3.35Å; E1818-N1822 WeakPolarHBondContact O-CB 3.45Å; E1818-N1822 PolarHBondContact O-N 2.87Å; N1822-L1824 PolarHBondContact O-N 3.11Å; N1822-L1824 VanDerWaalsContact O-N 3.09Å
1823N83.8Confident90.5Very high161 Ų16153.1 Ų53.186%0.86127%0.267SS*.THydrogen-bonded Turntrans-70.3-5-179-62.9-4.5000115.4H1821H1821-N1823 VanDerWaalsContact C-N 3.26Å; H1821-N1823 PolarHBondContact O-N 3.03Å
1824L83Confident90.5Very high120 Ų12053 Ų5363%0.62827%0.266SS*.THydrogen-bonded Turntrans-121.7-19.5-174.2-61.4177.6000113.7L1779 H1821 N1822L1779-L1824 HydrophobicContact CD1-CD1 4.43Å; H1821-L1824 HydrophobicContact CB-CB 4.47Å; H1821-L1824 PolarHBondContact O-N 3.26Å; N1822-L1824 PolarHBondContact O-N 3.11Å; N1822-L1824 VanDerWaalsContact O-N 3.09Å
1825V89.9Confident90.5Very high6 Ų653 Ų534%0.03627%0.266CS..  trans-115.3120.7-171.6-179.20000108.7L1779 Y1814 L1817 E1818 H1821 V1827L1779-V1825 HydrophobicContact CD1-CG2 4.23Å; Y1814-V1825 HydrophobicContact CD1-CG1 4.17Å; L1817-V1825 HydrophobicContact CB-CG1 4.3Å; L1817-V1825 HydrophobicContact CB-CG2 4Å; E1818-V1825 HydrophobicContact CB-CB 4.39Å; E1818-V1825 HydrophobicContact CB-CG1 4.27Å; H1821-V1825 HydrophobicContact CB-CG2 4.19Å; H1821-V1825 PolarHBondContact O-N 3.39Å; V1825-V1827 HydrophobicContact CG1-CG2 4.43Å
1826N91Very high90.7Very high83 Ų8350.2 Ų50.244%0.44425%0.251SS..  trans-107.3105.7168.8175.2-69.4000106.7P1828 L1829 C1830N1826-P1828 WeakPolarHBondContact OD1-CD 3.26Å; N1826-L1829 HydrophobicContact CB-CB 4.17Å; N1826-L1829 PolarHBondContact O-N 2.97Å; N1826-L1829 WeakPolarHBondContact OD1-CB 3.35Å; N1826-L1829 PolarHBondContact OD1-N 2.98Å; N1826-C1830 WeakPolarHBondContact O-CB 3.27Å; N1826-C1830 PolarHBondContact O-N 3.08Å; N1826-C1830 PolarHBondContact O-SG 3.46Å
1827V90.6Very high91Very high9 Ų947 Ų476%0.05524%0.239CC..Hα-helixtrans-55.7-51.9-169.6176.70000112.8T1811 D1815 E1818 V1825 L1829 C1830 V1831T1811-V1827 HydrophobicContact CG2-CG1 4.25Å; D1815-V1827 WeakPolarHBondContact OD1-CG1 3.35Å; E1818-V1827 HydrophobicContact CB-CG2 3.82Å; E1818-V1827 HydrophobicContact CG-CG2 4.3Å; V1825-V1827 HydrophobicContact CG1-CG2 4.43Å; V1827-L1829 PolarHBondContact O-N 2.74Å; V1827-C1830 PolarHBondContact O-N 3.41Å; V1827-V1831 HydrophobicContact CG1-CG2 4.06Å; V1827-V1831 WeakPolarHBondContact O-CB 3.45Å; V1827-V1831 VanDerWaalsContact O-CG2 3.25Å; V1827-V1831 WeakPolarHBondContact O-CG2 3.37Å; V1827-V1831 PolarHBondContact O-N 3.48Å
1828P92.1Very high91.2Very high27 Ų2746.7 Ų46.718%0.17524%0.238CC..Hα-helixtrans-56.9-45.8179.6-25.234.1000113.3F1708 L1709 T1711 N1826 D1832F1708-P1828 HydrophobicContact CD2-CG 4.34Å; L1709-P1828 HydrophobicContact CD2-CB 4.38Å; L1709-P1828 WeakPolarHBondContact CD2-O 3.38Å; T1711-P1828 WeakPolarHBondContact OG1-CB 3.34Å; N1826-P1828 WeakPolarHBondContact OD1-CD 3.26Å; P1828-D1832 WeakPolarHBondContact O-CB 3.3Å; P1828-D1832 PolarHBondContact O-N 3.41Å; P1828-D1832 VanDerWaalsContact O-N 3.1Å
1829L93Very high91.4Very high26 Ų2643.5 Ų43.514%0.13622%0.222CC..Hα-helixtrans-67.2-44.3179.9178.464.1000112.4K1743 N1826 V1827 D1832 M1833K1743-L1829 HydrophobicContact CD-CD1 3.88Å; K1743-L1829 HydrophobicContact CD-CD2 3.96Å; N1826-L1829 HydrophobicContact CB-CB 4.17Å; N1826-L1829 PolarHBondContact O-N 2.97Å; N1826-L1829 WeakPolarHBondContact OD1-CB 3.35Å; N1826-L1829 PolarHBondContact OD1-N 2.98Å; V1827-L1829 PolarHBondContact O-N 2.74Å; L1829-D1832 PolarHBondContact O-N 2.82Å; L1829-M1833 HydrophobicContact CD1-CG 3.8Å; L1829-M1833 HydrophobicContact CD1-SD 3.75Å; L1829-M1833 HydrophobicContact CG-CG 4.32Å; L1829-M1833 HydrophobicContact CG-SD 4.02Å; L1829-M1833 WeakPolarHBondContact O-CB 3.48Å; L1829-M1833 WeakPolarHBondContact O-CG 3.45Å; L1829-M1833 PolarHBondContact O-N 3.12Å
1830C94.2Very high91.6Very high7 Ų736.2 Ų36.25%0.04719%0.189CC..Hα-helixtrans-66.7-39.3-178.7-70.30000111.9Y1814 N1826 V1827 C1834Y1814-C1830 HydrophobicContact CD1-CB 3.54Å; Y1814-C1830 HydrophobicContact CD2-CB 3.96Å; Y1814-C1830 HydrophobicContact CE1-CB 3.65Å; Y1814-C1830 HydrophobicContact CE2-CB 4.03Å; Y1814-C1830 WeakPolarHBondContact CE2-O 3.44Å; Y1814-C1830 HydrophobicContact CG-CB 3.73Å; N1826-C1830 WeakPolarHBondContact O-CB 3.27Å; N1826-C1830 PolarHBondContact O-N 3.08Å; N1826-C1830 PolarHBondContact O-SG 3.46Å; V1827-C1830 PolarHBondContact O-N 3.41Å; C1830-C1834 WeakPolarHBondContact O-CB 3.44Å; C1830-C1834 PolarHBondContact O-N 3.29Å
1831V95.4Very high92Very high0 Ų030.3 Ų30.30%016%0.161CC..Hα-helixtrans-60.8-52.41731720000110.4L1709 I1807 L1810 Y1814 V1827 C1834 L1835L1709-V1831 HydrophobicContact CD1-CG1 4.2Å; L1709-V1831 HydrophobicContact CD2-CB 3.89Å; L1709-V1831 HydrophobicContact CD2-CG1 3.76Å; I1807-V1831 HydrophobicContact CG1-CG1 4.5Å; I1807-V1831 HydrophobicContact CG2-CG1 4.23Å; L1810-V1831 HydrophobicContact CB-CG1 4.11Å; L1810-V1831 HydrophobicContact CB-CG2 4.27Å; Y1814-V1831 HydrophobicContact CD2-CB 4.44Å; Y1814-V1831 HydrophobicContact CD2-CG2 3.68Å; Y1814-V1831 HydrophobicContact CG-CG2 4.45Å; V1827-V1831 HydrophobicContact CG1-CG2 4.06Å; V1827-V1831 WeakPolarHBondContact O-CB 3.45Å; V1827-V1831 VanDerWaalsContact O-CG2 3.25Å; V1827-V1831 WeakPolarHBondContact O-CG2 3.37Å; V1827-V1831 PolarHBondContact O-N 3.48Å; V1831-C1834 PolarHBondContact O-N 3.11Å; V1831-L1835 VanDerWaalsContact O-CB 3.32Å; V1831-L1835 WeakPolarHBondContact O-CB 3.47Å; V1831-L1835 PolarHBondContact O-N 2.84Å
1832D95.1Very high92.4Very high0 Ų029 Ų290%015%0.154CC..Hα-helixtrans-70.3-40.7-172.7-147.131.1000112.2L1709 S1712 R1719 Y1729 H1741 P1828 L1829 L1835 N1836L1709-D1832 HydrophobicContact CD2-CB 4.38Å; S1712-D1832 WeakPolarHBondContact CB-OD2 3.38Å; S1712-D1832 PolarHBondContact OG-OD2 3.01Å; R1719-D1832 VanDerWaalsContact CD-OD2 3.26Å; R1719-D1832 WeakPolarHBondContact CD-OD2 3.47Å; R1719-D1832 IonicContact CZ-OD1 3.92Å; R1719-D1832 VanDerWaalsContact CZ-OD1 3.27Å; R1719-D1832 IonicContact CZ-OD2 3.85Å; R1719-D1832 IonicContact NE-OD1 2.79Å; R1719-D1832 PolarHBondContact NE-OD1 3.37Å; R1719-D1832 IonicContact NE-OD2 3.53Å; R1719-D1832 PolarHBondContact NE-OD2 2.69Å; R1719-D1832 IonicContact NH2-OD1 3.94Å; R1719-D1832 PolarHBondContact NH2-OD1 2.94Å; Y1729-D1832 PolarHBondContact OH-OD2 3.29Å; H1741-D1832 IonicContact CD2-OD2 2.78Å; P1828-D1832 WeakPolarHBondContact O-CB 3.3Å; P1828-D1832 PolarHBondContact O-N 3.41Å; P1828-D1832 VanDerWaalsContact O-N 3.1Å; L1829-D1832 PolarHBondContact O-N 2.82Å; D1832-L1835 PolarHBondContact O-N 3.23Å; D1832-N1836 WeakPolarHBondContact O-CB 3.19Å; D1832-N1836 PolarHBondContact O-N 3.38Å
1833M94.8Very high93Very high11 Ų1124.1 Ų24.15%0.05413%0.128CC..Hα-helixtrans-64.6-39173.1-73.7-170.265.800112.5K1743 M1744 L1747 L1775 L1829 N1836 W1837K1743-M1833 HydrophobicContact CB-CE 4.17Å; K1743-M1833 HydrophobicContact CB-SD 3.88Å; M1744-M1833 HydrophobicContact SD-CE 4.19Å; L1747-M1833 HydrophobicContact CD2-CE 4.19Å; L1775-M1833 HydrophobicContact CD2-CB 3.7Å; L1775-M1833 HydrophobicContact CD2-CE 4.46Å; L1829-M1833 HydrophobicContact CD1-CG 3.8Å; L1829-M1833 HydrophobicContact CD1-SD 3.75Å; L1829-M1833 HydrophobicContact CG-CG 4.32Å; L1829-M1833 HydrophobicContact CG-SD 4.02Å; L1829-M1833 WeakPolarHBondContact O-CB 3.48Å; L1829-M1833 WeakPolarHBondContact O-CG 3.45Å; L1829-M1833 PolarHBondContact O-N 3.12Å; M1833-N1836 PolarHBondContact O-N 3.04Å; M1833-W1837 PolarHBondContact O-N 3.31Å
1834C96.2Very high93Very high0 Ų020.9 Ų20.90%011%0.114CC..Hα-helixtrans-71.8-39.6179.1-169.90000111.7L1775 L1810 Y1814 C1830 V1831 W1837 L1838L1775-C1834 HydrophobicContact CD2-CB 4.39Å; L1810-C1834 HydrophobicContact CD1-CB 4.18Å; L1810-C1834 HydrophobicContact CD2-CB 4.32Å; Y1814-C1834 HydrophobicContact CE2-CB 3.93Å; Y1814-C1834 WeakPolarHBondContact OH-CB 3.29Å; Y1814-C1834 PolarHBondContact OH-SG 2.96Å; C1830-C1834 WeakPolarHBondContact O-CB 3.44Å; C1830-C1834 PolarHBondContact O-N 3.29Å; V1831-C1834 PolarHBondContact O-N 3.11Å; C1834-W1837 PolarHBondContact O-N 3.44Å; C1834-L1838 WeakPolarHBondContact O-CB 3.36Å; C1834-L1838 WeakPolarHBondContact O-CD1 3.48Å; C1834-L1838 VanDerWaalsContact O-CG 3.27Å; C1834-L1838 WeakPolarHBondContact O-CG 3.4Å; C1834-L1838 PolarHBondContact O-N 2.94Å
1835L95.9Very high93.2Very high0 Ų018 Ų180%011%0.114CC..Hα-helixtrans-58.4-49.3170.1173.767.4000110.6P1727 I1803 I1806 I1807 L1810 V1831 D1832 W1837 L1838 L1839P1727-L1835 HydrophobicContact CG-CD2 3.95Å; I1803-L1835 HydrophobicContact CG1-CD1 4.44Å; I1803-L1835 HydrophobicContact CG2-CD1 4.23Å; I1803-L1835 HydrophobicContact CG2-CD2 4.06Å; I1806-L1835 HydrophobicContact CB-CD1 4.13Å; I1806-L1835 HydrophobicContact CD1-CD1 4.39Å; I1806-L1835 HydrophobicContact CG2-CD1 3.62Å; I1807-L1835 HydrophobicContact CD1-CD2 3.87Å; I1807-L1835 HydrophobicContact CG1-CD2 3.76Å; L1810-L1835 HydrophobicContact CD1-CB 4.04Å; V1831-L1835 VanDerWaalsContact O-CB 3.32Å; V1831-L1835 WeakPolarHBondContact O-CB 3.47Å; V1831-L1835 PolarHBondContact O-N 2.84Å; D1832-L1835 PolarHBondContact O-N 3.23Å; L1835-W1837 VanDerWaalsContact C-N 3.34Å; L1835-W1837 PolarHBondContact O-N 3.03Å; L1835-L1838 PolarHBondContact O-N 2.96Å; L1835-L1839 HydrophobicContact CD1-CD1 3.88Å; L1835-L1839 HydrophobicContact CD1-CG 4.05Å; L1835-L1839 HydrophobicContact CG-CD1 3.93Å; L1835-L1839 HydrophobicContact CG-CG 4.42Å; L1835-L1839 WeakPolarHBondContact O-CG 3.43Å; L1835-L1839 PolarHBondContact O-N 3.22Å
1836N94.9Very high93.1Very high2 Ų219.7 Ų19.71%0.01112%0.119CC..Hα-helixtrans-58.8-45.2-179.8-167.6-120.5000111.7W1739 H1741 M1744 D1832 M1833 N1840W1739-N1836 PolarHBondContact O-ND2 2.73Å; H1741-N1836 HydrophobicContact CB-CB 4.43Å; H1741-N1836 PolarHBondContact N-OD1 3.39Å; M1744-N1836 WeakPolarHBondContact CG-OD1 3.05Å; D1832-N1836 WeakPolarHBondContact O-CB 3.19Å; D1832-N1836 PolarHBondContact O-N 3.38Å; M1833-N1836 PolarHBondContact O-N 3.04Å; N1836-N1840 WeakPolarHBondContact O-CB 3.46Å; N1836-N1840 PolarHBondContact O-N 3.03Å; N1836-N1840 PolarHBondContact O-OD1 3.17Å
1837W95.9Very high92.9Very high3 Ų319.7 Ų19.71%0.01112%0.122CC..Hα-helixtrans-61.4-45.9173.5173.362.6000113L1771 L1775 L1777 M1833 C1834 L1835 L1839 N1840 V1841 L1862 I1900L1771-W1837 HydrophobicContact CD1-CG 4.4Å; L1771-W1837 HydrophobicContact CD2-CD2 4.4Å; L1771-W1837 HydrophobicContact CD2-CG 4.39Å; L1771-W1837 HydrophobicContact CD2-CZ2 4.36Å; L1775-W1837 HydrophobicContact CD1-CB 3.98Å; L1775-W1837 HydrophobicContact CD1-CD2 3.87Å; L1775-W1837 HydrophobicContact CD1-CE3 3.78Å; L1775-W1837 HydrophobicContact CD1-CG 3.93Å; L1777-W1837 HydrophobicContact CD1-CZ3 4.42Å; M1833-W1837 PolarHBondContact O-N 3.31Å; C1834-W1837 PolarHBondContact O-N 3.44Å; L1835-W1837 VanDerWaalsContact C-N 3.34Å; L1835-W1837 PolarHBondContact O-N 3.03Å; W1837-L1839 PolarHBondContact O-N 3.23Å; W1837-N1840 WeakPolarHBondContact O-CB 3.46Å; W1837-N1840 PolarHBondContact O-N 3.18Å; W1837-V1841 HydrophobicContact CD2-CG2 4.45Å; W1837-V1841 HydrophobicContact CZ2-CG2 4.05Å; W1837-V1841 VanDerWaalsContact NE1-CG2 3.31Å; W1837-V1841 WeakPolarHBondContact O-CG2 3.47Å; W1837-V1841 PolarHBondContact O-N 3.4Å; W1837-L1862 HydrophobicContact CH2-CD1 3.48Å; W1837-L1862 VanDerWaalsContact CH2-CD1 3.48Å; W1837-L1862 HydrophobicContact CH2-CG 4.13Å; W1837-L1862 HydrophobicContact CZ2-CD1 3.73Å; W1837-L1862 HydrophobicContact CZ3-CD1 3.96Å; W1837-I1900 HydrophobicContact CZ2-CG1 4.35Å
1838L96.2Very high92.8Very high0 Ų019.4 Ų19.40%012%0.122CC..Hα-helixtrans-62.4-43.5179.6-76.2163.5000112.3I1806 L1810 C1834 L1835 N1840 V1841 Y1842 I1850 F1855 I1859I1806-L1838 HydrophobicContact CG2-CD1 4.34Å; L1810-L1838 HydrophobicContact CD1-CD1 4.22Å; L1810-L1838 HydrophobicContact CD2-CD1 4.34Å; C1834-L1838 WeakPolarHBondContact O-CB 3.36Å; C1834-L1838 WeakPolarHBondContact O-CD1 3.48Å; C1834-L1838 VanDerWaalsContact O-CG 3.27Å; C1834-L1838 WeakPolarHBondContact O-CG 3.4Å; C1834-L1838 PolarHBondContact O-N 2.94Å; L1835-L1838 PolarHBondContact O-N 2.96Å; L1838-N1840 VanDerWaalsContact C-N 3.33Å; L1838-V1841 PolarHBondContact O-N 2.96Å; L1838-Y1842 HydrophobicContact CD2-CD2 4.2Å; L1838-Y1842 HydrophobicContact CD2-CE2 4.22Å; L1838-Y1842 WeakPolarHBondContact O-CB 3.25Å; L1838-Y1842 PolarHBondContact O-N 2.91Å; L1838-I1850 HydrophobicContact CB-CD1 4.45Å; L1838-F1855 HydrophobicContact CD1-CD2 3.69Å; L1838-F1855 HydrophobicContact CD1-CE2 3.59Å; L1838-F1855 HydrophobicContact CD2-CD2 4.4Å; L1838-I1859 HydrophobicContact CD1-CD1 4.25Å
1839L95.3Very high92.6Very high2 Ų225.7 Ų25.71%0.0114%0.142CC..Hα-helixtrans-65.6-36.8175.6-65.7174.5000111.3V1726 P1727 I1803 L1835 W1837 V1841 D1843 I1850V1726-L1839 HydrophobicContact CG1-CD1 4.41Å; P1727-L1839 HydrophobicContact CG-CD1 4.35Å; I1803-L1839 HydrophobicContact CD1-CD1 3.76Å; I1803-L1839 HydrophobicContact CD1-CD2 4.04Å; I1803-L1839 HydrophobicContact CG1-CD1 4.31Å; I1803-L1839 HydrophobicContact CG1-CD2 4.09Å; L1835-L1839 HydrophobicContact CD1-CD1 3.88Å; L1835-L1839 HydrophobicContact CD1-CG 4.05Å; L1835-L1839 HydrophobicContact CG-CD1 3.93Å; L1835-L1839 HydrophobicContact CG-CG 4.42Å; L1835-L1839 WeakPolarHBondContact O-CG 3.43Å; L1835-L1839 PolarHBondContact O-N 3.22Å; W1837-L1839 PolarHBondContact O-N 3.23Å; L1839-V1841 VanDerWaalsContact C-N 3.33Å; L1839-V1841 PolarHBondContact O-N 2.95Å; L1839-D1843 HydrophobicContact CB-CB 4.37Å; L1839-D1843 HydrophobicContact CD2-CB 3.77Å; L1839-D1843 CarbonylContact O-C 3.56Å; L1839-D1843 VanDerWaalsContact O-CA 3.26Å; L1839-D1843 WeakPolarHBondContact O-CA 3.21Å; L1839-D1843 PolarHBondContact O-N 3.45Å; L1839-I1850 HydrophobicContact CD2-CG2 4.37Å
1840N93.3Very high92.5Very high4 Ų424.8 Ų24.82%0.02114%0.137CC..Hα-helixtrans-64.4-34.3174.2-76.3-3.8000113.4D1740 N1836 W1837 L1838 T1844 R1846 Q1903D1740-N1840 PolarHBondContact OD1-ND2 3.49Å; N1836-N1840 WeakPolarHBondContact O-CB 3.46Å; N1836-N1840 PolarHBondContact O-N 3.03Å; N1836-N1840 PolarHBondContact O-OD1 3.17Å; W1837-N1840 WeakPolarHBondContact O-CB 3.46Å; W1837-N1840 PolarHBondContact O-N 3.18Å; L1838-N1840 VanDerWaalsContact C-N 3.33Å; N1840-T1844 WeakPolarHBondContact O-CG2 3.47Å; N1840-R1846 VanDerWaalsContact OD1-CZ 3.23Å; N1840-R1846 PolarHBondContact OD1-NH1 3.05Å; N1840-R1846 PolarHBondContact OD1-NH2 3.37Å; N1840-Q1903 HydrophobicContact CB-CG 4.17Å; N1840-Q1903 PolarHBondContact O-OE1 2.66Å
1841V94.2Very high92.5Very high5 Ų527.8 Ų27.83%0.0315%0.147CC..Hα-helixtrans-81.9-40.6178.51780000112.2W1837 L1838 L1839 Q1899 I1900 Q1903W1837-V1841 HydrophobicContact CD2-CG2 4.45Å; W1837-V1841 HydrophobicContact CZ2-CG2 4.05Å; W1837-V1841 VanDerWaalsContact NE1-CG2 3.31Å; W1837-V1841 WeakPolarHBondContact O-CG2 3.47Å; W1837-V1841 PolarHBondContact O-N 3.4Å; L1838-V1841 PolarHBondContact O-N 2.96Å; L1839-V1841 VanDerWaalsContact C-N 3.33Å; L1839-V1841 PolarHBondContact O-N 2.95Å; V1841-Q1899 HydrophobicContact CG1-CB 3.62Å; V1841-I1900 HydrophobicContact CG1-CG1 4.03Å; V1841-Q1903 HydrophobicContact CG2-CB 3.87Å; V1841-Q1903 HydrophobicContact CG2-CG 3.94Å
1842Y94.5Very high92.4Very high34 Ų3427.8 Ų27.813%0.13315%0.147CC..Hα-helixtrans-119.9-10.8-165-62.6-61.7000115.6L1838 S1854 D1896 Q1899L1838-Y1842 HydrophobicContact CD2-CD2 4.2Å; L1838-Y1842 HydrophobicContact CD2-CE2 4.22Å; L1838-Y1842 WeakPolarHBondContact O-CB 3.25Å; L1838-Y1842 PolarHBondContact O-N 2.91Å; Y1842-S1854 VanDerWaalsContact CE2-O 3.26Å; Y1842-S1854 WeakPolarHBondContact CE2-O 3.31Å; Y1842-D1896 HydrophobicContact CE1-CB 4.07Å; Y1842-D1896 WeakPolarHBondContact CE1-O 3.3Å; Y1842-D1896 PolarHBondContact OH-O 3.46Å; Y1842-Q1899 HydrophobicContact CD1-CB 4.37Å; Y1842-Q1899 HydrophobicContact CD1-CG 4.38Å; Y1842-Q1899 HydrophobicContact CE1-CB 4.09Å; Y1842-Q1899 HydrophobicContact CE1-CG 4.28Å
1843D92.7Very high92.3Very high6 Ų628 Ų283%0.03215%0.148CC..  trans-131.154.9177.4-17228.7000110.8L1839 G1845 R1846 T1847 G1848 I1850L1839-D1843 HydrophobicContact CB-CB 4.37Å; L1839-D1843 HydrophobicContact CD2-CB 3.77Å; L1839-D1843 CarbonylContact O-C 3.56Å; L1839-D1843 VanDerWaalsContact O-CA 3.26Å; L1839-D1843 WeakPolarHBondContact O-CA 3.21Å; L1839-D1843 PolarHBondContact O-N 3.45Å; D1843-G1845 PolarHBondContact O-N 2.68Å; D1843-R1846 PolarHBondContact O-N 3.33Å; D1843-R1846 PolarHBondContact OD1-N 3.3Å; D1843-R1846 WeakPolarHBondContact OD2-CA 3.34Å; D1843-T1847 VanDerWaalsContact CG-N 3.26Å; D1843-T1847 WeakPolarHBondContact OD1-CB 3.34Å; D1843-T1847 PolarHBondContact OD1-N 2.85Å; D1843-T1847 PolarHBondContact OD1-OG1 3.5Å; D1843-T1847 PolarHBondContact OD2-N 3.02Å; D1843-G1848 PolarHBondContact OD2-N 3.22Å; D1843-I1850 HydrophobicContact CB-CG2 3.79Å
1844T85.4Confident92.2Very high93 Ų9327.7 Ų27.757%0.57115%0.147SC*.THydrogen-bonded Turntrans-61.5-29.1179.354.70000112.6N1840 R1846N1840-T1844 WeakPolarHBondContact O-CG2 3.47Å; T1844-R1846 PolarHBondContact O-N 3.17Å
1845G85.7Confident92.2Very high60 Ų6027.7 Ų27.762%0.61915%0.147SC*.THydrogen-bonded Turntrans-75.7-1.6172.200000114.9D1843 T1847D1843-G1845 PolarHBondContact O-N 2.68Å; G1845-T1847 VanDerWaalsContact C-N 3.27Å; G1845-T1847 PolarHBondContact O-N 2.75Å
1846R89.7Confident92.1Very high42 Ų4228 Ų2816%0.15815%0.149CC..  trans51.443.3-178.5-51.8-56.1-171.9-168.74.3112.7N1724 V1726 W1739 N1840 D1843 T1844 G1848N1724-R1846 PolarHBondContact ND2-O 3.13Å; V1726-R1846 HydrophobicContact CG1-CB 4.44Å; V1726-R1846 HydrophobicContact CG2-CB 4.38Å; W1739-R1846 VanDerWaalsContact CB-NH2 3.3Å; W1739-R1846 HydrophobicContact CD2-CG 4.26Å; W1739-R1846 HydrophobicContact CZ2-CG 4.49Å; N1840-R1846 VanDerWaalsContact OD1-CZ 3.23Å; N1840-R1846 PolarHBondContact OD1-NH1 3.05Å; N1840-R1846 PolarHBondContact OD1-NH2 3.37Å; D1843-R1846 PolarHBondContact O-N 3.33Å; D1843-R1846 PolarHBondContact OD1-N 3.3Å; D1843-R1846 WeakPolarHBondContact OD2-CA 3.34Å; T1844-R1846 PolarHBondContact O-N 3.17Å; R1846-G1848 VanDerWaalsContact C-N 3.29Å
1847T86.8Confident92.1Very high82 Ų8227.9 Ų27.950%0.50315%0.148SC..  trans-72.5-21.217967.20000113.3D1843 G1845 R1849D1843-T1847 VanDerWaalsContact CG-N 3.26Å; D1843-T1847 WeakPolarHBondContact OD1-CB 3.34Å; D1843-T1847 PolarHBondContact OD1-N 2.85Å; D1843-T1847 PolarHBondContact OD1-OG1 3.5Å; D1843-T1847 PolarHBondContact OD2-N 3.02Å; G1845-T1847 VanDerWaalsContact C-N 3.27Å; G1845-T1847 PolarHBondContact O-N 2.75Å; T1847-R1849 PolarHBondContact OG1-N 3.49Å; T1847-R1849 PolarHBondContact OG1-O 3.01Å
1848G86.9Confident92Very high4 Ų427.8 Ų27.84%0.04115%0.148CC..SBendtrans84.213.5-173.800000114.1I1803 D1843 R1846I1803-G1848 PolarHBondContact N-O 3.45Å; D1843-G1848 PolarHBondContact OD2-N 3.22Å; R1846-G1848 VanDerWaalsContact C-N 3.29Å
1849R87.9Confident91.9Very high158 Ų15827.8 Ų27.860%0.59615%0.148SC*.EExtended strand (participates in β ladder)trans-141.5141.6-177.7-62.4-178.5-179.9178.50.1112.4P1800 M1801 T1847P1800-R1849 HydrophobicContact CB-CB 4.35Å; M1801-R1849 VanDerWaalsContact O-CA 3.24Å; M1801-R1849 WeakPolarHBondContact O-CA 3.33Å; T1847-R1849 PolarHBondContact OG1-N 3.49Å; T1847-R1849 PolarHBondContact OG1-O 3.01Å
1850I92Very high91.9Very high7 Ų727.7 Ų27.74%0.03615%0.147CC..EExtended strand (participates in β ladder)trans-134.1154.2169.467.1-178.3000109.9P1800 M1801 I1806 L1838 L1839 D1843 F1855P1800-I1850 CarbonylContact C-O 3.58Å; M1801-I1850 PolarHBondContact N-O 3.43Å; M1801-I1850 PolarHBondContact O-N 3.33Å; M1801-I1850 VanDerWaalsContact O-N 3.09Å; I1806-I1850 HydrophobicContact CD1-CD1 3.67Å; I1806-I1850 HydrophobicContact CD1-CG1 3.66Å; I1806-I1850 HydrophobicContact CG1-CD1 4.24Å; I1806-I1850 HydrophobicContact CG1-CG1 4.33Å; L1838-I1850 HydrophobicContact CB-CD1 4.45Å; L1839-I1850 HydrophobicContact CD2-CG2 4.37Å; D1843-I1850 HydrophobicContact CB-CG2 3.79Å; I1850-F1855 HydrophobicContact CD1-CB 3.85Å; I1850-F1855 HydrophobicContact CD1-CD2 4.09Å; I1850-F1855 HydrophobicContact CD1-CG 4.45Å; I1850-F1855 HydrophobicContact CG1-CB 4.35Å
1851R93Very high91.9Very high70 Ų7027.5 Ų27.526%0.26415%0.146SC..EExtended strand (participates in β ladder)trans-69147.8175.5-58-178.8-68.8-154.6-1.4111.1Q1799 L1853 S1854 F1855 D1896Q1799-R1851 WeakPolarHBondContact O-CA 3.49Å; R1851-L1853 HydrophobicContact CB-CB 4.48Å; R1851-L1853 PolarHBondContact O-N 3.01Å; R1851-S1854 PolarHBondContact NE-OG 2.93Å; R1851-S1854 WeakPolarHBondContact O-CB 3.37Å; R1851-S1854 PolarHBondContact O-N 3.17Å; R1851-F1855 PolarHBondContact O-N 3.49Å; R1851-D1896 IonicContact CZ-OD1 2.7Å; R1851-D1896 IonicContact NH2-OD1 3.04Å; R1851-D1896 PolarHBondContact NH2-OD1 3.28Å; R1851-D1896 IonicContact NH2-OD2 3.53Å
1852V93.4Very high91.9Very high0 Ų027.2 Ų27.20%015%0.145CC..Hα-helixtrans-52.5-40.2168.7170.40000111L1794 Q1796 Q1799 M1801 S1854 K1856L1794-V1852 HydrophobicContact CB-CG1 4.05Å; L1794-V1852 HydrophobicContact CD2-CG2 4.27Å; Q1796-V1852 VanDerWaalsContact O-CB 3.25Å; Q1796-V1852 WeakPolarHBondContact O-CB 3.31Å; Q1796-V1852 WeakPolarHBondContact O-CG2 3.45Å; Q1799-V1852 HydrophobicContact CB-CG2 4.16Å; Q1799-V1852 WeakPolarHBondContact O-CG2 3.45Å; Q1799-V1852 PolarHBondContact O-N 3.07Å; M1801-V1852 HydrophobicContact CG-CB 4.41Å; M1801-V1852 HydrophobicContact CG-CG2 3.46Å; M1801-V1852 VanDerWaalsContact CG-CG2 3.46Å; M1801-V1852 HydrophobicContact SD-CB 4.38Å; M1801-V1852 HydrophobicContact SD-CG2 3.84Å; V1852-S1854 VanDerWaalsContact C-N 3.33Å; V1852-S1854 PolarHBondContact O-N 3.02Å; V1852-K1856 HydrophobicContact CG1-CD 4.01Å; V1852-K1856 HydrophobicContact CG1-CG 4.42Å; V1852-K1856 WeakPolarHBondContact O-CB 3.49Å; V1852-K1856 VanDerWaalsContact O-CG 3.32Å; V1852-K1856 WeakPolarHBondContact O-CG 3.34Å; V1852-K1856 PolarHBondContact O-N 3.29Å
1853L92.6Very high91.9Very high4 Ų425.7 Ų25.72%0.02114%0.139CC..Hα-helixtrans-57-45.9175.2-175.960.4000112.3N1797 R1851 K1856 T1857 Q1877 V1878 L1892N1797-L1853 HydrophobicContact CB-CB 4.1Å; N1797-L1853 HydrophobicContact CB-CD1 4.42Å; N1797-L1853 WeakPolarHBondContact O-CB 3.36Å; N1797-L1853 PolarHBondContact O-N 3.25Å; R1851-L1853 HydrophobicContact CB-CB 4.48Å; R1851-L1853 PolarHBondContact O-N 3.01Å; L1853-K1856 PolarHBondContact O-N 3.22Å; L1853-T1857 VanDerWaalsContact O-CB 3.3Å; L1853-T1857 WeakPolarHBondContact O-CB 3.47Å; L1853-T1857 PolarHBondContact O-N 2.84Å; L1853-T1857 PolarHBondContact O-OG1 3.49Å; L1853-Q1877 HydrophobicContact CD1-CB 3.73Å; L1853-V1878 HydrophobicContact CD1-CG1 3.84Å; L1853-V1878 HydrophobicContact CD2-CG1 3.93Å; L1853-L1892 HydrophobicContact CD2-CB 4.16Å
1854S94.4Very high91.9Very high5 Ų531.2 Ų31.24%0.03516%0.163CC..Hα-helixtrans-69.9-44.2-176.4-46.70000110.9Y1842 R1851 V1852 K1856 T1857 G1858 D1896Y1842-S1854 VanDerWaalsContact CE2-O 3.26Å; Y1842-S1854 WeakPolarHBondContact CE2-O 3.31Å; R1851-S1854 PolarHBondContact NE-OG 2.93Å; R1851-S1854 WeakPolarHBondContact O-CB 3.37Å; R1851-S1854 PolarHBondContact O-N 3.17Å; V1852-S1854 VanDerWaalsContact C-N 3.33Å; V1852-S1854 PolarHBondContact O-N 3.02Å; S1854-K1856 PolarHBondContact O-N 3.33Å; S1854-T1857 PolarHBondContact O-N 2.72Å; S1854-G1858 PolarHBondContact O-N 3.08Å; S1854-D1896 VanDerWaalsContact CA-OD2 3.25Å; S1854-D1896 WeakPolarHBondContact CA-OD2 3.47Å; S1854-D1896 VanDerWaalsContact CB-OD2 3.32Å; S1854-D1896 WeakPolarHBondContact CB-OD2 3.46Å; S1854-D1896 PolarHBondContact N-OD2 3.31Å; S1854-D1896 PolarHBondContact OG-OD2 2.75Å
1855F95.5Very high92.2Very high0 Ų028.1 Ų28.10%015%0.146CC..Hα-helixtrans-54.9-52.4172179.1-109000112L1789 L1794 M1801 I1806 C1809 L1810 L1838 I1850 R1851 T1857 G1858 I1859L1789-F1855 HydrophobicContact CD2-CD1 3.94Å; L1789-F1855 HydrophobicContact CD2-CE1 3.62Å; L1794-F1855 HydrophobicContact CD1-CD1 4.28Å; L1794-F1855 HydrophobicContact CD1-CE1 4.13Å; M1801-F1855 HydrophobicContact CE-CD1 4.04Å; M1801-F1855 HydrophobicContact CE-CE1 4.25Å; M1801-F1855 HydrophobicContact CE-CG 4.28Å; M1801-F1855 HydrophobicContact SD-CB 3.8Å; M1801-F1855 HydrophobicContact SD-CD1 3.75Å; M1801-F1855 HydrophobicContact SD-CG 3.81Å; I1806-F1855 HydrophobicContact CG2-CD2 4.17Å; I1806-F1855 HydrophobicContact CG2-CE2 3.84Å; C1809-F1855 HydrophobicContact CB-CE1 4.24Å; C1809-F1855 HydrophobicContact CB-CZ 4.07Å; L1810-F1855 HydrophobicContact CD2-CE2 3.99Å; L1810-F1855 HydrophobicContact CD2-CZ 4.1Å; L1810-F1855 HydrophobicContact CG-CE2 4.18Å; L1810-F1855 HydrophobicContact CG-CZ 4.35Å; L1838-F1855 HydrophobicContact CD1-CD2 3.69Å; L1838-F1855 HydrophobicContact CD1-CE2 3.59Å; L1838-F1855 HydrophobicContact CD2-CD2 4.4Å; I1850-F1855 HydrophobicContact CD1-CB 3.85Å; I1850-F1855 HydrophobicContact CD1-CD2 4.09Å; I1850-F1855 HydrophobicContact CD1-CG 4.45Å; I1850-F1855 HydrophobicContact CG1-CB 4.35Å; R1851-F1855 PolarHBondContact O-N 3.49Å; F1855-T1857 VanDerWaalsContact C-N 3.34Å; F1855-T1857 PolarHBondContact O-N 3.01Å; F1855-G1858 PolarHBondContact O-N 3.49Å; F1855-I1859 HydrophobicContact CD2-CG1 4.44Å; F1855-I1859 HydrophobicContact CE2-CD1 4.47Å; F1855-I1859 HydrophobicContact CE2-CG1 4.07Å; F1855-I1859 HydrophobicContact CZ-CG1 4.11Å; F1855-I1859 WeakPolarHBondContact O-CG1 3.25Å; F1855-I1859 PolarHBondContact O-N 3.27Å; F1855-I1859 VanDerWaalsContact O-N 3.14Å
1856K94.7Very high92.5Very high7 Ų732.3 Ų32.33%0.0315%0.15CC..Hα-helixtrans-59.4-43.4175.9-73.5175.2177.7174.10112.2L1789 L1794 N1797 V1852 L1853 S1854 G1858 I1859 I1860 Q1877L1789-K1856 HydrophobicContact CD1-CG 4.05Å; L1789-K1856 HydrophobicContact CD2-CG 4Å; L1794-K1856 WeakPolarHBondContact O-CE 3.39Å; L1794-K1856 PolarHBondContact O-NZ 3Å; N1797-K1856 PolarHBondContact OD1-NZ 3.25Å; V1852-K1856 HydrophobicContact CG1-CD 4.01Å; V1852-K1856 HydrophobicContact CG1-CG 4.42Å; V1852-K1856 WeakPolarHBondContact O-CB 3.49Å; V1852-K1856 VanDerWaalsContact O-CG 3.32Å; V1852-K1856 WeakPolarHBondContact O-CG 3.34Å; V1852-K1856 PolarHBondContact O-N 3.29Å; L1853-K1856 PolarHBondContact O-N 3.22Å; S1854-K1856 PolarHBondContact O-N 3.33Å; K1856-G1858 PolarHBondContact O-N 2.72Å; K1856-I1859 PolarHBondContact O-N 3.21Å; K1856-I1860 VanDerWaalsContact O-CB 3.23Å; K1856-I1860 WeakPolarHBondContact O-CB 3.43Å; K1856-I1860 WeakPolarHBondContact O-CG1 3.37Å; K1856-I1860 PolarHBondContact O-N 2.93Å; K1856-Q1877 HydrophobicContact CD-CG 4.25Å
1857T93.4Very high92.5Very high0 Ų032.3 Ų32.30%015%0.152CC..Hα-helixtrans-62.3-43.3-178.2-61.30000111L1853 S1854 F1855 S1861 L1874 L1893 D1896L1853-T1857 VanDerWaalsContact O-CB 3.3Å; L1853-T1857 WeakPolarHBondContact O-CB 3.47Å; L1853-T1857 PolarHBondContact O-N 2.84Å; L1853-T1857 PolarHBondContact O-OG1 3.49Å; S1854-T1857 PolarHBondContact O-N 2.72Å; F1855-T1857 VanDerWaalsContact C-N 3.34Å; F1855-T1857 PolarHBondContact O-N 3.01Å; T1857-S1861 WeakPolarHBondContact O-CB 3.46Å; T1857-S1861 PolarHBondContact O-N 3.17Å; T1857-S1861 VanDerWaalsContact O-N 3.07Å; T1857-S1861 PolarHBondContact O-OG 2.92Å; T1857-L1874 HydrophobicContact CG2-CD2 4.32Å; T1857-L1893 HydrophobicContact CG2-CD1 4.36Å; T1857-D1896 HydrophobicContact CG2-CB 4.06Å
1858G93.9Very high92.7Very high0 Ų031.6 Ų31.60%014%0.143CC..Hα-helixtrans-60.9-56.117500000113.2S1854 F1855 K1856 L1862S1854-G1858 PolarHBondContact O-N 3.08Å; F1855-G1858 PolarHBondContact O-N 3.49Å; K1856-G1858 PolarHBondContact O-N 2.72Å; G1858-L1862 PolarHBondContact O-N 3Å
1859I95.7Very high93Very high0 Ų034.3 Ų34.30%016%0.157CC..Hα-helixtrans-61.7-47.5-177.7-63.2-61.5000111.8L1777 L1780 L1810 L1838 F1855 K1856 S1861 L1862 C1863L1777-I1859 HydrophobicContact CD1-CD1 4.48Å; L1777-I1859 HydrophobicContact CD2-CD1 4.26Å; L1780-I1859 HydrophobicContact CD2-CG2 3.8Å; L1810-I1859 HydrophobicContact CD2-CD1 3.96Å; L1838-I1859 HydrophobicContact CD1-CD1 4.25Å; F1855-I1859 HydrophobicContact CD2-CG1 4.44Å; F1855-I1859 HydrophobicContact CE2-CD1 4.47Å; F1855-I1859 HydrophobicContact CE2-CG1 4.07Å; F1855-I1859 HydrophobicContact CZ-CG1 4.11Å; F1855-I1859 WeakPolarHBondContact O-CG1 3.25Å; F1855-I1859 PolarHBondContact O-N 3.27Å; F1855-I1859 VanDerWaalsContact O-N 3.14Å; K1856-I1859 PolarHBondContact O-N 3.21Å; I1859-S1861 PolarHBondContact O-N 3.48Å; I1859-L1862 CarbonylContact O-C 3.6Å; I1859-L1862 PolarHBondContact O-N 2.73Å; I1859-C1863 PolarHBondContact O-N 3.05Å
1860I95Very high93.3Very high0 Ų026.8 Ų26.80%013%0.129CC..Hα-helixtrans-73-32.4-174.4-58.9-74.6000111.4L1782 A1785 L1789 K1856 L1862 C1863 K1870 Y1873 L1874L1782-I1860 HydrophobicContact CD1-CD1 3.55Å; L1782-I1860 HydrophobicContact CD1-CG2 4.06Å; A1785-I1860 HydrophobicContact CB-CD1 4.08Å; L1789-I1860 HydrophobicContact CD1-CD1 4.47Å; K1856-I1860 VanDerWaalsContact O-CB 3.23Å; K1856-I1860 WeakPolarHBondContact O-CB 3.43Å; K1856-I1860 WeakPolarHBondContact O-CG1 3.37Å; K1856-I1860 PolarHBondContact O-N 2.93Å; I1860-L1862 PolarHBondContact O-N 2.65Å; I1860-C1863 PolarHBondContact O-SG 2.99Å; I1860-K1870 WeakPolarHBondContact O-CD 3.45Å; I1860-K1870 VanDerWaalsContact O-CE 3.25Å; I1860-K1870 WeakPolarHBondContact O-CE 3.45Å; I1860-Y1873 HydrophobicContact CB-CD1 4.28Å; I1860-Y1873 HydrophobicContact CB-CE1 4.47Å; I1860-Y1873 HydrophobicContact CD1-CD1 4.17Å; I1860-Y1873 HydrophobicContact CD1-CE1 3.91Å; I1860-Y1873 HydrophobicContact CG1-CD1 3.9Å; I1860-Y1873 HydrophobicContact CG1-CE1 3.64Å; I1860-Y1873 HydrophobicContact CG2-CD1 3.78Å; I1860-Y1873 HydrophobicContact CG2-CE1 4.42Å; I1860-Y1873 HydrophobicContact CG2-CG 4.28Å; I1860-L1874 HydrophobicContact CB-CD2 4.33Å; I1860-L1874 HydrophobicContact CG2-CD2 4.29Å; I1860-L1874 HydrophobicContact CG2-CG 4.35Å
1861S93.1Very high93.4Very high0 Ų027 Ų270%013%0.129CC..Hα-helixtrans-59.2-36.5172.9-67.60000111.9T1857 I1859 K1870T1857-S1861 WeakPolarHBondContact O-CB 3.46Å; T1857-S1861 PolarHBondContact O-N 3.17Å; T1857-S1861 VanDerWaalsContact O-N 3.07Å; T1857-S1861 PolarHBondContact O-OG 2.92Å; I1859-S1861 PolarHBondContact O-N 3.48Å; S1861-K1870 PolarHBondContact O-NZ 3.23Å
1862L94.1Very high93.4Very high0 Ų028.4 Ų28.40%013%0.134CC..Hα-helixtrans-100.1-8.7-177.8-64.2-171.2000115.4L1768 L1771 Q1772 L1777 W1837 G1858 I1859 I1860 L1954L1768-L1862 HydrophobicContact CD2-CD2 4.42Å; L1771-L1862 HydrophobicContact CD2-CD1 4.3Å; Q1772-L1862 HydrophobicContact CB-CD2 4.49Å; Q1772-L1862 HydrophobicContact CG-CB 4.25Å; Q1772-L1862 WeakPolarHBondContact CG-O 3.5Å; Q1772-L1862 PolarHBondContact NE2-O 2.88Å; L1777-L1862 CarbonylContact C-O 3.58Å; L1777-L1862 HydrophobicContact CB-CB 4.1Å; L1777-L1862 HydrophobicContact CD1-CB 3.76Å; L1777-L1862 HydrophobicContact CD1-CD1 4.08Å; W1837-L1862 HydrophobicContact CH2-CD1 3.48Å; W1837-L1862 VanDerWaalsContact CH2-CD1 3.48Å; W1837-L1862 HydrophobicContact CH2-CG 4.13Å; W1837-L1862 HydrophobicContact CZ2-CD1 3.73Å; W1837-L1862 HydrophobicContact CZ3-CD1 3.96Å; G1858-L1862 PolarHBondContact O-N 3Å; I1859-L1862 CarbonylContact O-C 3.6Å; I1859-L1862 PolarHBondContact O-N 2.73Å; I1860-L1862 PolarHBondContact O-N 2.65Å; L1862-L1954 HydrophobicContact CD2-CD2 3.92Å
1863C94.5Very high93.4Very high1 Ų130 Ų301%0.00714%0.141CC..SBendtrans-63.6169.4177.377.20000114.5L1777 L1780 I1859 I1860 K1870L1777-C1863 CarbonylContact O-C 3.59Å; L1777-C1863 WeakPolarHBondContact O-CA 3.4Å; L1780-C1863 HydrophobicContact CD2-CB 4.5Å; L1780-C1863 HydrophobicContact CG-CB 4.38Å; L1780-C1863 WeakPolarHBondContact O-CB 3.43Å; I1859-C1863 PolarHBondContact O-N 3.05Å; I1860-C1863 PolarHBondContact O-SG 2.99Å; C1863-K1870 WeakPolarHBondContact O-CE 3.35Å; C1863-K1870 PolarHBondContact O-NZ 3.3Å
1864K92.3Very high93.5Very high123 Ų12330 Ų3054%0.53514%0.14SC..BIsolated β-bridgetrans-86.7108171.7-174-171.9-177.2177.40111D1778 L1780 L1782D1778-K1864 WeakPolarHBondContact O-CD 3.38Å; L1780-K1864 WeakPolarHBondContact O-CA 3.22Å; L1780-K1864 VanDerWaalsContact O-CB 3.3Å; L1780-K1864 WeakPolarHBondContact O-CB 3.48Å; L1780-K1864 PolarHBondContact O-N 3.16Å; L1782-K1864 PolarHBondContact N-O 3.5Å
1865A92.3Very high93.4Very high27 Ų2730 Ų3022%0.22314%0.14CC..SBendtrans-158.4167.1179.600000111L1782 K1870 H1955L1782-A1865 HydrophobicContact CB-CB 3.87Å; L1782-A1865 HydrophobicContact CD2-CB 4.15Å; A1865-K1870 HydrophobicContact CB-CG 3.84Å; A1865-H1955 PolarHBondContact O-CE1 3.35Å; A1865-H1955 VanDerWaalsContact O-CE1 3.29Å
1866H90.5Very high93.3Very high149 Ų14937.6 Ų37.669%0.6917%0.173SC*.  trans-68.5144.1161.7-68.6-75000110.3E1868 D1869 K1870H1866-E1868 PolarHBondContact O-N 3.09Å; H1866-D1869 PolarHBondContact O-N 3.34Å; H1866-D1869 VanDerWaalsContact O-N 3.1Å; H1866-K1870 PolarHBondContact O-N 2.85Å
1867L90.7Very high93.1Very high41 Ų4138.5 Ų38.522%0.21518%0.177CC..Hα-helixtrans-59.1-42.8-174.1-177.966.7000113.2D1869 K1870 Y1871 L1951 P1952L1867-D1869 VanDerWaalsContact C-N 3.26Å; L1867-D1869 PolarHBondContact O-N 3.32Å; L1867-K1870 WeakPolarHBondContact O-CB 3.45Å; L1867-K1870 PolarHBondContact O-N 3.5Å; L1867-Y1871 HydrophobicContact CD1-CD1 4.37Å; L1867-Y1871 HydrophobicContact CD1-CE1 3.58Å; L1867-Y1871 HydrophobicContact CD1-CE2 4.25Å; L1867-Y1871 HydrophobicContact CD2-CE2 4.05Å; L1867-Y1871 HydrophobicContact CG-CD2 4.38Å; L1867-Y1871 HydrophobicContact CG-CE1 4Å; L1867-Y1871 HydrophobicContact CG-CE2 3.74Å; L1867-Y1871 PolarHBondContact O-N 3.12Å; L1867-Y1871 VanDerWaalsContact O-N 3.08Å; L1867-L1951 HydrophobicContact CD1-CG 4.05Å; L1867-P1952 HydrophobicContact CD2-CB 3.82Å
1868E90.9Very high93Very high67 Ų6739 Ų3931%0.31318%0.18SC..Hα-helixtrans-64.9-30.4177.7-64.1-162.2163.100112.8H1866 Y1871 R1872 L1938 R1942H1866-E1868 PolarHBondContact O-N 3.09Å; E1868-Y1871 PolarHBondContact O-N 3.28Å; E1868-R1872 VanDerWaalsContact O-CG 3.31Å; E1868-R1872 WeakPolarHBondContact O-CG 3.39Å; E1868-R1872 PolarHBondContact O-N 3.04Å; E1868-R1872 IonicContact OE2-CZ 2.68Å; E1868-R1872 IonicContact OE2-NH1 2.85Å; E1868-R1872 IonicContact OE2-NH2 3.16Å; E1868-R1872 PolarHBondContact OE2-NH2 2.97Å; E1868-L1938 HydrophobicContact CB-CD2 4.4Å; E1868-R1942 IonicContact OE1-CZ 3.27Å; E1868-R1942 VanDerWaalsContact OE1-CZ 3.32Å; E1868-R1942 IonicContact OE1-NE 2.78Å; E1868-R1942 PolarHBondContact OE1-NE 3.35Å; E1868-R1942 VanDerWaalsContact OE1-NE 3.09Å; E1868-R1942 IonicContact OE1-NH2 2.94Å; E1868-R1942 PolarHBondContact OE1-NH2 2.88Å; E1868-R1942 IonicContact OE2-NH2 3.95Å
1869D93.3Very high92.8Very high61 Ų6140 Ų4033%0.32619%0.188SC..Hα-helixtrans-75.3-34.2-179.9-60.4-31000111.2L1782 H1866 L1867 R1872 Y1873L1782-D1869 HydrophobicContact CD2-CB 3.98Å; H1866-D1869 PolarHBondContact O-N 3.34Å; H1866-D1869 VanDerWaalsContact O-N 3.1Å; L1867-D1869 VanDerWaalsContact C-N 3.26Å; L1867-D1869 PolarHBondContact O-N 3.32Å; D1869-R1872 PolarHBondContact O-N 3.35Å; D1869-R1872 IonicContact OD1-CZ 2.8Å; D1869-R1872 IonicContact OD1-NH1 3.53Å; D1869-R1872 PolarHBondContact OD1-NH1 3.31Å; D1869-Y1873 WeakPolarHBondContact O-CB 3.45Å; D1869-Y1873 PolarHBondContact O-N 2.82Å
1870K94Very high92.3Very high1 Ų140.8 Ų40.80%0.00419%0.194CC..Hα-helixtrans-58.8-48.6165.5-63.7-172.3172-171.90111.1I1860 S1861 C1863 A1865 H1866 L1867 R1872 Y1873 L1874 H1955I1860-K1870 WeakPolarHBondContact O-CD 3.45Å; I1860-K1870 VanDerWaalsContact O-CE 3.25Å; I1860-K1870 WeakPolarHBondContact O-CE 3.45Å; S1861-K1870 PolarHBondContact O-NZ 3.23Å; C1863-K1870 WeakPolarHBondContact O-CE 3.35Å; C1863-K1870 PolarHBondContact O-NZ 3.3Å; A1865-K1870 HydrophobicContact CB-CG 3.84Å; H1866-K1870 PolarHBondContact O-N 2.85Å; L1867-K1870 WeakPolarHBondContact O-CB 3.45Å; L1867-K1870 PolarHBondContact O-N 3.5Å; K1870-R1872 PolarHBondContact O-N 3.42Å; K1870-Y1873 PolarHBondContact O-N 2.81Å; K1870-L1874 WeakPolarHBondContact O-CB 3.46Å; K1870-L1874 VanDerWaalsContact O-CG 3.3Å; K1870-L1874 WeakPolarHBondContact O-CG 3.39Å; K1870-L1874 PolarHBondContact O-N 2.88Å; K1870-H1955 PolarHBondContact NZ-NE2 3.13Å
1871Y94.1Very high91.6Very high10 Ų1047.2 Ų47.24%0.03924%0.239CC..Hα-helixtrans-61.2-43.6179.7-64-16.1000112L1867 E1868 F1875 L1938 M1941 L1951 P1952L1867-Y1871 HydrophobicContact CD1-CD1 4.37Å; L1867-Y1871 HydrophobicContact CD1-CE1 3.58Å; L1867-Y1871 HydrophobicContact CD1-CE2 4.25Å; L1867-Y1871 HydrophobicContact CD2-CE2 4.05Å; L1867-Y1871 HydrophobicContact CG-CD2 4.38Å; L1867-Y1871 HydrophobicContact CG-CE1 4Å; L1867-Y1871 HydrophobicContact CG-CE2 3.74Å; L1867-Y1871 PolarHBondContact O-N 3.12Å; L1867-Y1871 VanDerWaalsContact O-N 3.08Å; E1868-Y1871 PolarHBondContact O-N 3.28Å; Y1871-F1875 VanDerWaalsContact O-CB 3.26Å; Y1871-F1875 WeakPolarHBondContact O-CB 3.37Å; Y1871-F1875 PolarHBondContact O-N 2.93Å; Y1871-L1938 HydrophobicContact CD2-CD2 3.99Å; Y1871-L1938 HydrophobicContact CG-CD2 4.29Å; Y1871-M1941 HydrophobicContact CD1-CE 3.73Å; Y1871-M1941 HydrophobicContact CD2-CB 3.83Å; Y1871-M1941 HydrophobicContact CD2-CE 4.38Å; Y1871-M1941 HydrophobicContact CD2-CG 4.36Å; Y1871-M1941 HydrophobicContact CE1-CE 3.3Å; Y1871-M1941 HydrophobicContact CE2-CB 3.68Å; Y1871-M1941 HydrophobicContact CE2-CE 4Å; Y1871-M1941 HydrophobicContact CE2-CG 4.43Å; Y1871-M1941 HydrophobicContact CG-CE 4.25Å; Y1871-M1941 VanDerWaalsContact CZ-CE 3.42Å; Y1871-L1951 HydrophobicContact CE1-CD2 3.9Å; Y1871-L1951 HydrophobicContact CE1-CG 4.3Å; Y1871-P1952 WeakPolarHBondContact OH-CD 3.28Å
1872R93.6Very high91.2Very high101 Ų10151.9 Ų51.938%0.38127%0.267SS..Hα-helixtrans-60.1-45.3173.6-73.8173.4-172.7108.615.6111.9E1868 D1869 K1870 K1876 L1938E1868-R1872 VanDerWaalsContact O-CG 3.31Å; E1868-R1872 WeakPolarHBondContact O-CG 3.39Å; E1868-R1872 PolarHBondContact O-N 3.04Å; E1868-R1872 IonicContact OE2-CZ 2.68Å; E1868-R1872 IonicContact OE2-NH1 2.85Å; E1868-R1872 IonicContact OE2-NH2 3.16Å; E1868-R1872 PolarHBondContact OE2-NH2 2.97Å; D1869-R1872 PolarHBondContact O-N 3.35Å; D1869-R1872 IonicContact OD1-CZ 2.8Å; D1869-R1872 IonicContact OD1-NH1 3.53Å; D1869-R1872 PolarHBondContact OD1-NH1 3.31Å; K1870-R1872 PolarHBondContact O-N 3.42Å; R1872-K1876 WeakPolarHBondContact O-CB 3.39Å; R1872-K1876 PolarHBondContact O-N 3.32Å; R1872-L1938 HydrophobicContact CG-CD1 3.89Å; R1872-L1938 HydrophobicContact CG-CD2 4.37Å
1873Y93.6Very high90.8Very high34 Ų3453.7 Ų53.713%0.13329%0.286CS..Hα-helixtrans-64.2-49.3179.7-175.6-82000111.8L1782 C1786 L1789 I1860 D1869 K1870 K1876 Q1877L1782-Y1873 HydrophobicContact CD1-CD2 4.35Å; L1782-Y1873 HydrophobicContact CD1-CG 4.41Å; C1786-Y1873 WeakPolarHBondContact SG-CE2 3.4Å; L1789-Y1873 WeakPolarHBondContact CD1-OH 3.4Å; I1860-Y1873 HydrophobicContact CB-CD1 4.28Å; I1860-Y1873 HydrophobicContact CB-CE1 4.47Å; I1860-Y1873 HydrophobicContact CD1-CD1 4.17Å; I1860-Y1873 HydrophobicContact CD1-CE1 3.91Å; I1860-Y1873 HydrophobicContact CG1-CD1 3.9Å; I1860-Y1873 HydrophobicContact CG1-CE1 3.64Å; I1860-Y1873 HydrophobicContact CG2-CD1 3.78Å; I1860-Y1873 HydrophobicContact CG2-CE1 4.42Å; I1860-Y1873 HydrophobicContact CG2-CG 4.28Å; D1869-Y1873 WeakPolarHBondContact O-CB 3.45Å; D1869-Y1873 PolarHBondContact O-N 2.82Å; K1870-Y1873 PolarHBondContact O-N 2.81Å; Y1873-K1876 WeakPolarHBondContact O-CB 3.07Å; Y1873-K1876 PolarHBondContact O-N 3.08Å; Y1873-K1876 VanDerWaalsContact O-N 3.16Å; Y1873-Q1877 HydrophobicContact CD1-CG 4.01Å; Y1873-Q1877 HydrophobicContact CE1-CG 3.62Å; Y1873-Q1877 VanDerWaalsContact CE1-NE2 3.29Å; Y1873-Q1877 WeakPolarHBondContact O-CG 3.14Å; Y1873-Q1877 PolarHBondContact O-N 2.97Å; Y1873-Q1877 VanDerWaalsContact O-N 3.11Å; Y1873-Q1877 PolarHBondContact O-NE2 3.12Å
1874L93.2Very high90.6Very high3 Ų356.8 Ų56.82%0.01630%0.299CS..Hα-helixtrans-62.2-44.4180-71.4174.7000111.3T1857 I1860 K1870 K1876 Q1877 L1893T1857-L1874 HydrophobicContact CG2-CD2 4.32Å; I1860-L1874 HydrophobicContact CB-CD2 4.33Å; I1860-L1874 HydrophobicContact CG2-CD2 4.29Å; I1860-L1874 HydrophobicContact CG2-CG 4.35Å; K1870-L1874 WeakPolarHBondContact O-CB 3.46Å; K1870-L1874 VanDerWaalsContact O-CG 3.3Å; K1870-L1874 WeakPolarHBondContact O-CG 3.39Å; K1870-L1874 PolarHBondContact O-N 2.88Å; L1874-K1876 VanDerWaalsContact C-N 3.32Å; L1874-K1876 PolarHBondContact O-N 3.32Å; L1874-Q1877 PolarHBondContact O-N 3.45Å; L1874-Q1877 VanDerWaalsContact O-N 3.11Å; L1874-L1893 HydrophobicContact CB-CD1 3.93Å; L1874-L1893 HydrophobicContact CB-CD2 4.11Å; L1874-L1893 HydrophobicContact CD2-CD1 4.16Å; L1874-L1893 HydrophobicContact CG-CD1 4.47Å
1875F93.6Very high90.6Very high5 Ų550.9 Ų50.92%0.02227%0.274CS..Hα-helixtrans-58-44.5172.7-175.4-88.9000111.7Y1871 Q1877 V1878 A1879 C1885 I1932 A1934 F1937Y1871-F1875 VanDerWaalsContact O-CB 3.26Å; Y1871-F1875 WeakPolarHBondContact O-CB 3.37Å; Y1871-F1875 PolarHBondContact O-N 2.93Å; F1875-Q1877 PolarHBondContact O-N 2.89Å; F1875-V1878 PolarHBondContact O-N 3.32Å; F1875-V1878 VanDerWaalsContact O-N 3.14Å; F1875-A1879 HydrophobicContact CD1-CB 4.15Å; F1875-A1879 HydrophobicContact CE1-CB 3.87Å; F1875-A1879 WeakPolarHBondContact O-CB 3.42Å; F1875-A1879 PolarHBondContact O-N 2.88Å; F1875-C1885 HydrophobicContact CD2-CB 4.44Å; F1875-C1885 HydrophobicContact CE1-CB 4.41Å; F1875-C1885 HydrophobicContact CE2-CB 3.51Å; F1875-C1885 HydrophobicContact CZ-CB 3.48Å; F1875-C1885 VanDerWaalsContact CZ-CB 3.48Å; F1875-I1932 HydrophobicContact CE2-CD1 4.2Å; F1875-I1932 HydrophobicContact CE2-CG1 4.09Å; F1875-I1932 HydrophobicContact CZ-CG1 4.42Å; F1875-I1932 WeakPolarHBondContact CZ-O 3.33Å; F1875-A1934 HydrophobicContact CD1-CB 3.55Å; F1875-A1934 HydrophobicContact CE1-CB 3.69Å; F1875-A1934 VanDerWaalsContact CE1-N 3.32Å; F1875-A1934 HydrophobicContact CG-CB 4.23Å; F1875-A1934 HydrophobicContact CZ-CB 4.45Å; F1875-F1937 HydrophobicContact CB-CD1 3.8Å; F1875-F1937 HydrophobicContact CB-CE1 3.98Å; F1875-F1937 HydrophobicContact CD2-CB 3.56Å; F1875-F1937 AromaticContact CD2-CD1 3.53Å; F1875-F1937 HydrophobicContact CD2-CD1 3.53Å; F1875-F1937 HydrophobicContact CD2-CD2 4.13Å; F1875-F1937 HydrophobicContact CD2-CE1 4.23Å; F1875-F1937 AromaticContact CD2-CG 3.46Å; F1875-F1937 HydrophobicContact CD2-CG 3.46Å; F1875-F1937 VanDerWaalsContact CD2-CG 3.46Å; F1875-F1937 HydrophobicContact CE2-CB 3.65Å; F1875-F1937 HydrophobicContact CE2-CD1 4.47Å; F1875-F1937 HydrophobicContact CE2-CG 4.01Å; F1875-F1937 HydrophobicContact CG-CB 4.47Å; F1875-F1937 AromaticContact CG-CD1 3.98Å; F1875-F1937 HydrophobicContact CG-CD1 3.98Å; F1875-F1937 HydrophobicContact CG-CG 4.34Å
1876K91.7Very high90.5Very high160 Ų16051.3 Ų51.370%0.69627%0.273SS*.Hα-helixtrans-61.6-25.8177.2-174-177.2176-170.80113.3R1872 Y1873 L1874R1872-K1876 WeakPolarHBondContact O-CB 3.39Å; R1872-K1876 PolarHBondContact O-N 3.32Å; Y1873-K1876 WeakPolarHBondContact O-CB 3.07Å; Y1873-K1876 PolarHBondContact O-N 3.08Å; Y1873-K1876 VanDerWaalsContact O-N 3.16Å; L1874-K1876 VanDerWaalsContact C-N 3.32Å; L1874-K1876 PolarHBondContact O-N 3.32Å
1877Q91.8Very high90.4Very high26 Ų2648.3 Ų48.312%0.12126%0.259CS..Hα-helixtrans-72.9-27.8176.5-61.6-43.5-60.500113.3N1797 L1853 K1856 Y1873 L1874 F1875N1797-Q1877 WeakPolarHBondContact ND2-CA 3.41Å; N1797-Q1877 PolarHBondContact ND2-O 3.05Å; N1797-Q1877 PolarHBondContact ND2-OE1 3.45Å; N1797-Q1877 VanDerWaalsContact ND2-OE1 3.11Å; N1797-Q1877 PolarHBondContact OD1-OE1 3.15Å; L1853-Q1877 HydrophobicContact CD1-CB 3.73Å; K1856-Q1877 HydrophobicContact CD-CG 4.25Å; Y1873-Q1877 HydrophobicContact CD1-CG 4.01Å; Y1873-Q1877 HydrophobicContact CE1-CG 3.62Å; Y1873-Q1877 VanDerWaalsContact CE1-NE2 3.29Å; Y1873-Q1877 WeakPolarHBondContact O-CG 3.14Å; Y1873-Q1877 PolarHBondContact O-N 2.97Å; Y1873-Q1877 VanDerWaalsContact O-N 3.11Å; Y1873-Q1877 PolarHBondContact O-NE2 3.12Å; L1874-Q1877 PolarHBondContact O-N 3.45Å; L1874-Q1877 VanDerWaalsContact O-N 3.11Å; F1875-Q1877 PolarHBondContact O-N 2.89Å
1878V90.5Very high90.2Very high9 Ų954 Ų546%0.05528%0.277CS..Hα-helixtrans-105-16.1178.6-64.90000113.8L1853 F1875 R1889 L1893L1853-V1878 HydrophobicContact CD1-CG1 3.84Å; L1853-V1878 HydrophobicContact CD2-CG1 3.93Å; F1875-V1878 PolarHBondContact O-N 3.32Å; F1875-V1878 VanDerWaalsContact O-N 3.14Å; V1878-R1889 HydrophobicContact CB-CB 4.17Å; V1878-R1889 WeakPolarHBondContact CB-O 3.32Å; V1878-R1889 WeakPolarHBondContact O-CB 3.34Å; V1878-R1889 WeakPolarHBondContact O-CD 3.48Å; V1878-R1889 WeakPolarHBondContact O-CG 3.4Å; V1878-L1893 HydrophobicContact CB-CB 4.45Å; V1878-L1893 HydrophobicContact CG1-CB 3.79Å; V1878-L1893 HydrophobicContact CG2-CB 3.91Å; V1878-L1893 HydrophobicContact CG2-CD2 4.01Å
1879A90Very high90Very high21 Ų2154.9 Ų54.917%0.17428%0.278CS..SBendtrans-60.2149172.400000112.4F1875 F1884F1875-A1879 HydrophobicContact CD1-CB 4.15Å; F1875-A1879 HydrophobicContact CE1-CB 3.87Å; F1875-A1879 WeakPolarHBondContact O-CB 3.42Å; F1875-A1879 PolarHBondContact O-N 2.88Å; A1879-F1884 CarbonylContact C-O 3.47Å; A1879-F1884 WeakPolarHBondContact CA-O 3.47Å
1880S85Confident89.9Confident17 Ų1752 Ų5212%0.11926%0.262CS..  trans-60.1167.6168.9680000112T1882 G1883 F1884S1880-T1882 PolarHBondContact O-N 3.21Å; S1880-T1882 VanDerWaalsContact O-N 3.14Å; S1880-T1882 PolarHBondContact OG-N 3.46Å; S1880-T1882 VanDerWaalsContact OG-N 3.12Å; S1880-T1882 PolarHBondContact OG-OG1 3.45Å; S1880-G1883 PolarHBondContact O-N 3.46Å; S1880-G1883 PolarHBondContact OG-N 3.1Å; S1880-F1884 WeakPolarHBondContact CB-O 3.25Å; S1880-F1884 PolarHBondContact N-O 2.87Å; S1880-F1884 PolarHBondContact OG-N 2.93Å; S1880-F1884 PolarHBondContact OG-O 3.33Å; S1880-F1884 VanDerWaalsContact OG-O 3.09Å
1881S80.7Confident89.7Confident136 Ų13652.3 Ų52.395%0.95127%0.266SS*.THydrogen-bonded Turntrans-58.7-18.6165.6500000113.8
1882T84.8Confident89.4Confident97 Ų9753.6 Ų53.660%0.59527%0.274SS*.THydrogen-bonded Turntrans-87.1-3.7173.155.20000113.7S1880 F1884S1880-T1882 PolarHBondContact O-N 3.21Å; S1880-T1882 VanDerWaalsContact O-N 3.14Å; S1880-T1882 PolarHBondContact OG-N 3.46Å; S1880-T1882 VanDerWaalsContact OG-N 3.12Å; S1880-T1882 PolarHBondContact OG-OG1 3.45Å; T1882-F1884 VanDerWaalsContact O-CD2 3.3Å; T1882-F1884 WeakPolarHBondContact O-CD2 3.41Å
1883G86.2Confident89.3Confident38 Ų3848.9 Ų48.939%0.39226%0.256SS..SBendtrans87.69.7178.600000115.3S1880S1880-G1883 PolarHBondContact O-N 3.46Å; S1880-G1883 PolarHBondContact OG-N 3.1Å
1884F90.5Very high89.2Confident66 Ų6647.3 Ų47.329%0.28925%0.25SS..EExtended strand (participates in β ladder)trans-108.2145.5-175.5-72.2-85.4000111.6A1879 S1880 T1882 E1931 I1932 E1933A1879-F1884 CarbonylContact C-O 3.47Å; A1879-F1884 WeakPolarHBondContact CA-O 3.47Å; S1880-F1884 WeakPolarHBondContact CB-O 3.25Å; S1880-F1884 PolarHBondContact N-O 2.87Å; S1880-F1884 PolarHBondContact OG-N 2.93Å; S1880-F1884 PolarHBondContact OG-O 3.33Å; S1880-F1884 VanDerWaalsContact OG-O 3.09Å; T1882-F1884 VanDerWaalsContact O-CD2 3.3Å; T1882-F1884 WeakPolarHBondContact O-CD2 3.41Å; F1884-E1931 HydrophobicContact CB-CB 4.07Å; F1884-E1931 HydrophobicContact CB-CG 4.45Å; F1884-E1931 HydrophobicContact CD1-CB 4.17Å; F1884-E1931 HydrophobicContact CG-CB 4.48Å; F1884-I1932 WeakPolarHBondContact CA-O 3.21Å; F1884-E1933 HydrophobicContact CD1-CG 3.79Å; F1884-E1933 HydrophobicContact CE1-CG 3.36Å; F1884-E1933 HydrophobicContact CZ-CG 4.07Å
1885C90.7Very high88.9Confident0 Ų049.1 Ų49.10%026%0.258CS..EExtended strand (participates in β ladder)trans-118130.1177.6-171.10000110.6F1875 R1889 L1890 F1923 E1931 I1932F1875-C1885 HydrophobicContact CD2-CB 4.44Å; F1875-C1885 HydrophobicContact CE1-CB 4.41Å; F1875-C1885 HydrophobicContact CE2-CB 3.51Å; F1875-C1885 HydrophobicContact CZ-CB 3.48Å; F1875-C1885 VanDerWaalsContact CZ-CB 3.48Å; C1885-R1889 VanDerWaalsContact SG-CB 3.53Å; C1885-L1890 PolarHBondContact SG-N 3.37Å; C1885-F1923 WeakPolarHBondContact O-CZ 3.3Å; C1885-E1931 CarbonylContact O-C 3.55Å; C1885-E1931 WeakPolarHBondContact O-CA 3.47Å; C1885-I1932 HydrophobicContact CB-CG1 4.09Å; C1885-I1932 PolarHBondContact N-O 2.97Å; C1885-I1932 WeakPolarHBondContact O-CG1 3.24Å; C1885-I1932 PolarHBondContact O-N 3.39Å
1886D90.6Very high88.8Confident36 Ų3649 Ų4919%0.19326%0.258CS..  trans-89.8176.1170.862.453.8000111.7R1888 R1889 L1890D1886-R1888 VanDerWaalsContact C-N 3.35Å; D1886-R1888 PolarHBondContact O-N 3Å; D1886-R1888 WeakPolarHBondContact OD1-CA 3.46Å; D1886-R1888 WeakPolarHBondContact OD1-CB 3.05Å; D1886-R1888 PolarHBondContact OD1-N 2.98Å; D1886-R1889 WeakPolarHBondContact OD1-CB 3.26Å; D1886-R1889 PolarHBondContact OD1-N 3.41Å; D1886-R1889 WeakPolarHBondContact OD2-CD 3.49Å; D1886-R1889 IonicContact OD2-CZ 3.77Å; D1886-R1889 IonicContact OD2-NE 2.76Å; D1886-R1889 IonicContact OD2-NH1 2.71Å; D1886-R1889 PolarHBondContact OD2-NH1 3.39Å; D1886-L1890 WeakPolarHBondContact O-CB 3.28Å; D1886-L1890 PolarHBondContact O-N 2.76Å
1887Q89.3Confident88.9Confident86 Ų8641.3 Ų41.340%0.40222%0.224SC..Hα-helixtrans-61-40.2-179.6-74.1-176.8-12.300112.7L1890 G1891 V1919 F1923Q1887-L1890 PolarHBondContact O-N 2.95Å; Q1887-G1891 PolarHBondContact O-N 3.31Å; Q1887-V1919 HydrophobicContact CB-CG1 3.7Å; Q1887-V1919 HydrophobicContact CG-CG1 3.87Å; Q1887-V1919 WeakPolarHBondContact O-CG1 3.35Å; Q1887-F1923 HydrophobicContact CB-CE2 4.32Å; Q1887-F1923 HydrophobicContact CB-CZ 4.4Å; Q1887-F1923 HydrophobicContact CG-CB 4.41Å; Q1887-F1923 HydrophobicContact CG-CD1 3.57Å; Q1887-F1923 HydrophobicContact CG-CD2 3.61Å; Q1887-F1923 HydrophobicContact CG-CE1 3.69Å; Q1887-F1923 HydrophobicContact CG-CE2 3.7Å; Q1887-F1923 HydrophobicContact CG-CG 3.55Å; Q1887-F1923 HydrophobicContact CG-CZ 3.77Å; Q1887-F1923 VanDerWaalsContact N-CZ 3.33Å
1888R85.7Confident88.8Confident160 Ų16040.2 Ų40.260%0.60422%0.219SC*.Hα-helixtrans-67.9-45.8-177.8-167.1-177.781.1134.46.8110.9D1886 G1891 L1892 M2062D1886-R1888 VanDerWaalsContact C-N 3.35Å; D1886-R1888 PolarHBondContact O-N 3Å; D1886-R1888 WeakPolarHBondContact OD1-CA 3.46Å; D1886-R1888 WeakPolarHBondContact OD1-CB 3.05Å; D1886-R1888 PolarHBondContact OD1-N 2.98Å; R1888-G1891 WeakPolarHBondContact O-CA 3.23Å; R1888-G1891 PolarHBondContact O-N 3.49Å; R1888-L1892 WeakPolarHBondContact O-CG 3.44Å; R1888-L1892 PolarHBondContact O-N 2.74Å; R1888-M2062 HydrophobicContact CG-CE 4.04Å
1889R88.1Confident88.9Confident85 Ų8540.3 Ų40.332%0.32122%0.219SC..Hα-helixtrans-61.7-43.1175.8-78.9169.1167.4139.9-9.3112.3V1878 C1885 D1886 G1891 L1892 L1893V1878-R1889 HydrophobicContact CB-CB 4.17Å; V1878-R1889 WeakPolarHBondContact CB-O 3.32Å; V1878-R1889 WeakPolarHBondContact O-CB 3.34Å; V1878-R1889 WeakPolarHBondContact O-CD 3.48Å; V1878-R1889 WeakPolarHBondContact O-CG 3.4Å; C1885-R1889 VanDerWaalsContact SG-CB 3.53Å; D1886-R1889 WeakPolarHBondContact OD1-CB 3.26Å; D1886-R1889 PolarHBondContact OD1-N 3.41Å; D1886-R1889 WeakPolarHBondContact OD2-CD 3.49Å; D1886-R1889 IonicContact OD2-CZ 3.77Å; D1886-R1889 IonicContact OD2-NE 2.76Å; D1886-R1889 IonicContact OD2-NH1 2.71Å; D1886-R1889 PolarHBondContact OD2-NH1 3.39Å; R1889-G1891 VanDerWaalsContact C-N 3.32Å; R1889-L1892 PolarHBondContact O-N 2.73Å; R1889-L1893 PolarHBondContact O-N 3.3Å
1890L90.9Very high89.1Confident0 Ų039.4 Ų39.40%021%0.211CC..Hα-helixtrans-65.4-39.5173.9-176.263.5000111C1885 D1886 Q1887 L1892 L1893 L1894 C1922 F1923 I1932 F1937C1885-L1890 PolarHBondContact SG-N 3.37Å; D1886-L1890 WeakPolarHBondContact O-CB 3.28Å; D1886-L1890 PolarHBondContact O-N 2.76Å; Q1887-L1890 PolarHBondContact O-N 2.95Å; L1890-L1892 PolarHBondContact O-N 2.67Å; L1890-L1893 PolarHBondContact O-N 3.26Å; L1890-L1894 HydrophobicContact CD1-CD1 4.44Å; L1890-L1894 HydrophobicContact CD1-CG 4.37Å; L1890-L1894 HydrophobicContact CD2-CD1 4.47Å; L1890-L1894 HydrophobicContact CG-CD1 4.04Å; L1890-L1894 HydrophobicContact CG-CG 4.36Å; L1890-L1894 WeakPolarHBondContact O-CG 3.11Å; L1890-L1894 PolarHBondContact O-N 2.98Å; L1890-C1922 HydrophobicContact CD2-CB 3.61Å; L1890-F1923 HydrophobicContact CB-CE2 4.15Å; L1890-F1923 HydrophobicContact CD2-CD2 4Å; L1890-F1923 HydrophobicContact CD2-CE2 3.65Å; L1890-I1932 HydrophobicContact CD2-CD1 4.18Å; L1890-F1937 HydrophobicContact CD1-CD2 4.01Å; L1890-F1937 HydrophobicContact CD1-CE2 3.78Å
1891G89.2Confident89.3Confident9 Ų938.6 Ų38.69%0.09321%0.206CC..Hα-helixtrans-57.5-44.8174.600000112.8Q1887 R1888 R1889 L1893 L1894 H1895Q1887-G1891 PolarHBondContact O-N 3.31Å; R1888-G1891 WeakPolarHBondContact O-CA 3.23Å; R1888-G1891 PolarHBondContact O-N 3.49Å; R1889-G1891 VanDerWaalsContact C-N 3.32Å; G1891-L1893 PolarHBondContact O-N 2.93Å; G1891-L1894 PolarHBondContact O-N 3.4Å; G1891-H1895 WeakPolarHBondContact O-CB 3.25Å; G1891-H1895 PolarHBondContact O-N 3.45Å
1892L88.4Confident89.8Confident36 Ų3637.8 Ų37.819%0.18818%0.182CC..Hα-helixtrans-59.5-44.5174.9-70.3170.9000112.4L1853 R1888 R1889 L1890 H1895 D1896L1853-L1892 HydrophobicContact CD2-CB 4.16Å; R1888-L1892 WeakPolarHBondContact O-CG 3.44Å; R1888-L1892 PolarHBondContact O-N 2.74Å; R1889-L1892 PolarHBondContact O-N 2.73Å; L1890-L1892 PolarHBondContact O-N 2.67Å; L1892-H1895 PolarHBondContact O-N 3.12Å; L1892-D1896 PolarHBondContact O-N 3.2Å
1893L90.4Very high90.1Very high2 Ų236 Ų361%0.0117%0.167CC..Hα-helixtrans-63.9-45.3176.6175.160.8000112T1857 L1874 V1878 R1889 L1890 G1891 H1895 S1897 F1937T1857-L1893 HydrophobicContact CG2-CD1 4.36Å; L1874-L1893 HydrophobicContact CB-CD1 3.93Å; L1874-L1893 HydrophobicContact CB-CD2 4.11Å; L1874-L1893 HydrophobicContact CD2-CD1 4.16Å; L1874-L1893 HydrophobicContact CG-CD1 4.47Å; V1878-L1893 HydrophobicContact CB-CB 4.45Å; V1878-L1893 HydrophobicContact CG1-CB 3.79Å; V1878-L1893 HydrophobicContact CG2-CB 3.91Å; V1878-L1893 HydrophobicContact CG2-CD2 4.01Å; R1889-L1893 PolarHBondContact O-N 3.3Å; L1890-L1893 PolarHBondContact O-N 3.26Å; G1891-L1893 PolarHBondContact O-N 2.93Å; L1893-H1895 VanDerWaalsContact C-N 3.34Å; L1893-S1897 VanDerWaalsContact O-CB 3.28Å; L1893-S1897 WeakPolarHBondContact O-CB 3.42Å; L1893-S1897 PolarHBondContact O-N 2.85Å; L1893-S1897 PolarHBondContact O-OG 2.98Å; L1893-F1937 HydrophobicContact CD2-CZ 4.31Å
1894L91Very high90.3Very high2 Ų235.1 Ų35.11%0.0115%0.153CC..Hα-helixtrans-67.9-36179.7-68.3178000111.3L1890 G1891 S1897 I1898 I1915 V1919 W1940 M1948L1890-L1894 HydrophobicContact CD1-CD1 4.44Å; L1890-L1894 HydrophobicContact CD1-CG 4.37Å; L1890-L1894 HydrophobicContact CD2-CD1 4.47Å; L1890-L1894 HydrophobicContact CG-CD1 4.04Å; L1890-L1894 HydrophobicContact CG-CG 4.36Å; L1890-L1894 WeakPolarHBondContact O-CG 3.11Å; L1890-L1894 PolarHBondContact O-N 2.98Å; G1891-L1894 PolarHBondContact O-N 3.4Å; L1894-S1897 PolarHBondContact O-N 3.28Å; L1894-I1898 WeakPolarHBondContact O-CB 3.32Å; L1894-I1898 PolarHBondContact O-N 2.78Å; L1894-I1915 HydrophobicContact CB-CB 3.99Å; L1894-I1915 HydrophobicContact CB-CG1 4.46Å; L1894-I1915 HydrophobicContact CB-CG2 4.11Å; L1894-V1919 HydrophobicContact CD1-CG2 3.87Å; L1894-W1940 HydrophobicContact CD1-CH2 4.32Å; L1894-M1948 HydrophobicContact CD2-CG 3.67Å; L1894-M1948 HydrophobicContact CD2-SD 3.79Å
1895H88.4Confident90.2Very high40 Ų4035.1 Ų35.119%0.18517%0.172CC..Hα-helixtrans-61.4-51.4174-178-94.3000111.5G1891 L1892 L1893 S1897 I1898 Q1899 I1915 E2063G1891-H1895 WeakPolarHBondContact O-CB 3.25Å; G1891-H1895 PolarHBondContact O-N 3.45Å; L1892-H1895 PolarHBondContact O-N 3.12Å; L1893-H1895 VanDerWaalsContact C-N 3.34Å; H1895-S1897 PolarHBondContact O-N 2.75Å; H1895-I1898 WeakPolarHBondContact O-CG2 3.39Å; H1895-I1898 PolarHBondContact O-N 3.02Å; H1895-Q1899 PolarHBondContact CE1-NE2 2.93Å; H1895-Q1899 PolarHBondContact NE2-NE2 3.1Å; H1895-Q1899 WeakPolarHBondContact O-CG 3.5Å; H1895-Q1899 PolarHBondContact O-N 2.89Å; H1895-Q1899 PolarHBondContact O-NE2 3.27Å; H1895-I1915 HydrophobicContact CB-CG1 4.16Å; H1895-E2063 IonicContact CE1-OE1 2.96Å; H1895-E2063 PolarHBondContact CE1-OE1 2.86Å; H1895-E2063 VanDerWaalsContact CE1-OE1 3.31Å; H1895-E2063 IonicContact NE2-OE1 3.55Å
1896D91.5Very high90Very high2 Ų235.6 Ų35.61%0.01117%0.174CC..Hα-helixtrans-66.8-26.5178.1-759.7000111.9Y1842 R1851 S1854 T1857 L1892Y1842-D1896 HydrophobicContact CE1-CB 4.07Å; Y1842-D1896 WeakPolarHBondContact CE1-O 3.3Å; Y1842-D1896 PolarHBondContact OH-O 3.46Å; R1851-D1896 IonicContact CZ-OD1 2.7Å; R1851-D1896 IonicContact NH2-OD1 3.04Å; R1851-D1896 PolarHBondContact NH2-OD1 3.28Å; R1851-D1896 IonicContact NH2-OD2 3.53Å; S1854-D1896 VanDerWaalsContact CA-OD2 3.25Å; S1854-D1896 WeakPolarHBondContact CA-OD2 3.47Å; S1854-D1896 VanDerWaalsContact CB-OD2 3.32Å; S1854-D1896 WeakPolarHBondContact CB-OD2 3.46Å; S1854-D1896 PolarHBondContact N-OD2 3.31Å; S1854-D1896 PolarHBondContact OG-OD2 2.75Å; T1857-D1896 HydrophobicContact CG2-CB 4.06Å; L1892-D1896 PolarHBondContact O-N 3.2Å
1897S92.5Very high89.8Confident0 Ų035.1 Ų35.10%017%0.172CC..Hα-helixtrans-75.4-35.2174.2-59.30000112.9L1893 L1894 H1895 I1900 P1901 M1948 W1950L1893-S1897 VanDerWaalsContact O-CB 3.28Å; L1893-S1897 WeakPolarHBondContact O-CB 3.42Å; L1893-S1897 PolarHBondContact O-N 2.85Å; L1893-S1897 PolarHBondContact O-OG 2.98Å; L1894-S1897 PolarHBondContact O-N 3.28Å; H1895-S1897 PolarHBondContact O-N 2.75Å; S1897-I1900 PolarHBondContact O-N 3.22Å; S1897-P1901 VanDerWaalsContact O-CD 3.3Å; S1897-P1901 WeakPolarHBondContact O-CD 3.44Å; S1897-M1948 WeakPolarHBondContact CB-SD 3.2Å; S1897-W1950 WeakPolarHBondContact O-CZ2 3.31Å
1898I91.2Very high89.4Confident2 Ų235.3 Ų35.31%0.0119%0.188CC..Hα-helixtrans-78.2-18.7-177.2-148.870000113.3L1894 H1895 I1900 P1901 R1902 V1907 F1910 I1915 S1947L1894-I1898 WeakPolarHBondContact O-CB 3.32Å; L1894-I1898 PolarHBondContact O-N 2.78Å; H1895-I1898 WeakPolarHBondContact O-CG2 3.39Å; H1895-I1898 PolarHBondContact O-N 3.02Å; I1898-I1900 PolarHBondContact O-N 2.98Å; I1898-P1901 HydrophobicContact CD1-CG 3.97Å; I1898-P1901 HydrophobicContact CG1-CG 4.33Å; I1898-P1901 WeakPolarHBondContact O-CD 3.45Å; I1898-P1901 VanDerWaalsContact O-CG 3.29Å; I1898-P1901 WeakPolarHBondContact O-CG 3.36Å; I1898-R1902 PolarHBondContact O-N 3.4Å; I1898-R1902 VanDerWaalsContact O-N 3.15Å; I1898-V1907 HydrophobicContact CG1-CG2 3.99Å; I1898-F1910 HydrophobicContact CD1-CB 3.99Å; I1898-I1915 HydrophobicContact CB-CG2 4.08Å; I1898-I1915 HydrophobicContact CG2-CG2 3.78Å; I1898-S1947 WeakPolarHBondContact CD1-O 3.47Å
1899Q91.9Very high89.1Confident12 Ų1229.4 Ų29.46%0.05617%0.172CC..Hα-helixtrans-63-29172.8-53.9-44.9-39.700112.3V1841 Y1842 H1895 R1902 Q1903V1841-Q1899 HydrophobicContact CG1-CB 3.62Å; Y1842-Q1899 HydrophobicContact CD1-CB 4.37Å; Y1842-Q1899 HydrophobicContact CD1-CG 4.38Å; Y1842-Q1899 HydrophobicContact CE1-CB 4.09Å; Y1842-Q1899 HydrophobicContact CE1-CG 4.28Å; H1895-Q1899 PolarHBondContact CE1-NE2 2.93Å; H1895-Q1899 PolarHBondContact NE2-NE2 3.1Å; H1895-Q1899 WeakPolarHBondContact O-CG 3.5Å; H1895-Q1899 PolarHBondContact O-N 2.89Å; H1895-Q1899 PolarHBondContact O-NE2 3.27Å; Q1899-R1902 WeakPolarHBondContact O-CB 3.36Å; Q1899-R1902 PolarHBondContact O-N 2.98Å; Q1899-Q1903 PolarHBondContact O-N 3.23Å
1900I93.3Very high89Confident1 Ų125.5 Ų25.51%0.00516%0.157CC..Hα-helixtrans-61.3-55.1178.4-64.6174.2000111.9L1768 W1837 V1841 S1897 I1898 R1902 Q1903 W1950L1768-I1900 HydrophobicContact CD1-CG2 4.17Å; L1768-I1900 HydrophobicContact CD2-CG2 3.45Å; L1768-I1900 VanDerWaalsContact CD2-CG2 3.45Å; L1768-I1900 HydrophobicContact CG-CG2 4.45Å; W1837-I1900 HydrophobicContact CZ2-CG1 4.35Å; V1841-I1900 HydrophobicContact CG1-CG1 4.03Å; S1897-I1900 PolarHBondContact O-N 3.22Å; I1898-I1900 PolarHBondContact O-N 2.98Å; I1900-R1902 VanDerWaalsContact C-N 3.3Å; I1900-R1902 PolarHBondContact O-N 2.97Å; I1900-Q1903 PolarHBondContact O-N 3.13Å; I1900-W1950 HydrophobicContact CB-CH2 4.5Å; I1900-W1950 HydrophobicContact CD1-CH2 4.08Å; I1900-W1950 HydrophobicContact CG2-CH2 4.47Å; I1900-W1950 HydrophobicContact CG2-CZ3 4.42Å
1901P90.8Very high88.1Confident0 Ų026.1 Ų26.10%016%0.163CC..Hα-helixtrans-69.2-22.2172.525.3-33.5000114T1764 S1897 I1898 L1904 G1905 E1906 V1907 F1910T1764-P1901 HydrophobicContact CG2-CB 4.08Å; S1897-P1901 VanDerWaalsContact O-CD 3.3Å; S1897-P1901 WeakPolarHBondContact O-CD 3.44Å; I1898-P1901 HydrophobicContact CD1-CG 3.97Å; I1898-P1901 HydrophobicContact CG1-CG 4.33Å; I1898-P1901 WeakPolarHBondContact O-CD 3.45Å; I1898-P1901 VanDerWaalsContact O-CG 3.29Å; I1898-P1901 WeakPolarHBondContact O-CG 3.36Å; P1901-L1904 PolarHBondContact O-N 2.89Å; P1901-G1905 PolarHBondContact O-N 3.23Å; P1901-E1906 PolarHBondContact O-N 3.33Å; P1901-V1907 PolarHBondContact O-N 3.39Å; P1901-F1910 HydrophobicContact CB-CD2 3.73Å; P1901-F1910 HydrophobicContact CB-CE2 3.91Å; P1901-F1910 HydrophobicContact CG-CD2 4.24Å
1902R90.6Very high87.5Confident119 Ų11926.8 Ų26.845%0.44917%0.17SC..Hα-helixtrans-62-49.2170.7-175.4-171.9-178.3176.90.4111.2I1898 Q1899 I1900 L1904 G1905 V1907I1898-R1902 PolarHBondContact O-N 3.4Å; I1898-R1902 VanDerWaalsContact O-N 3.15Å; Q1899-R1902 WeakPolarHBondContact O-CB 3.36Å; Q1899-R1902 PolarHBondContact O-N 2.98Å; I1900-R1902 VanDerWaalsContact C-N 3.3Å; I1900-R1902 PolarHBondContact O-N 2.97Å; R1902-L1904 PolarHBondContact O-N 2.74Å; R1902-L1904 VanDerWaalsContact O-N 3.13Å; R1902-G1905 PolarHBondContact O-N 3.4Å; R1902-V1907 HydrophobicContact CB-CB 4.01Å; R1902-V1907 HydrophobicContact CB-CG1 4.16Å; R1902-V1907 HydrophobicContact CB-CG2 4.41Å; R1902-V1907 HydrophobicContact CG-CG1 4.16Å
1903Q91.7Very high86.8Confident61 Ų6128.1 Ų28.129%0.28518%0.183SC..Hα-helixtrans-66.1-14.8179.3-174.352.521.700113.9Y1748 N1840 V1841 Q1899 I1900Y1748-Q1903 WeakPolarHBondContact OH-CG 3.41Å; Y1748-Q1903 PolarHBondContact OH-NE2 3.02Å; Y1748-Q1903 VanDerWaalsContact OH-NE2 3.12Å; N1840-Q1903 HydrophobicContact CB-CG 4.17Å; N1840-Q1903 PolarHBondContact O-OE1 2.66Å; V1841-Q1903 HydrophobicContact CG2-CB 3.87Å; V1841-Q1903 HydrophobicContact CG2-CG 3.94Å; Q1899-Q1903 PolarHBondContact O-N 3.23Å; I1900-Q1903 PolarHBondContact O-N 3.13Å
1904L89.5Confident86Confident18 Ų1830.9 Ų30.99%0.09420%0.197CC..THydrogen-bonded Turntrans-94.60.8172.4-64.6-179.1000114.1Y1748 L1751 T1764 K1767 L1768 P1901 R1902 E1906Y1748-L1904 HydrophobicContact CE1-CD2 4.34Å; L1751-L1904 HydrophobicContact CD1-CD2 3.8Å; T1764-L1904 HydrophobicContact CG2-CD1 4.21Å; K1767-L1904 HydrophobicContact CB-CD1 3.93Å; L1768-L1904 HydrophobicContact CD2-CD1 3.54Å; L1768-L1904 HydrophobicContact CG-CD1 3.63Å; P1901-L1904 PolarHBondContact O-N 2.89Å; R1902-L1904 PolarHBondContact O-N 2.74Å; R1902-L1904 VanDerWaalsContact O-N 3.13Å; L1904-E1906 HydrophobicContact CB-CG 4.22Å
1905G88.6Confident85.7Confident67 Ų6732 Ų3269%0.69120%0.203SC*.THydrogen-bonded Turntrans73.920.8-176.800000114.5P1901 R1902P1901-G1905 PolarHBondContact O-N 3.23Å; R1902-G1905 PolarHBondContact O-N 3.4Å
1906E87.4Confident85.3Confident10 Ų1032.8 Ų32.85%0.04721%0.207CC..  trans-114.1-4.4-170.5-59.3-76.6179.700113.9R1763 T1764 K1767 P1901 L1904 A1908 S1909 F1910R1763-E1906 VanDerWaalsContact CD-OE1 3.32Å; R1763-E1906 WeakPolarHBondContact CD-OE1 3.42Å; R1763-E1906 IonicContact CZ-OE1 2.7Å; R1763-E1906 IonicContact CZ-OE2 3.75Å; R1763-E1906 VanDerWaalsContact CZ-OE2 3.3Å; R1763-E1906 VanDerWaalsContact NE-CD 3.28Å; R1763-E1906 IonicContact NE-OE1 3.56Å; R1763-E1906 PolarHBondContact NE-OE1 3.5Å; R1763-E1906 IonicContact NE-OE2 3.51Å; R1763-E1906 PolarHBondContact NE-OE2 2.97Å; R1763-E1906 IonicContact NH2-OE1 3.09Å; R1763-E1906 IonicContact NH2-OE2 3.44Å; R1763-E1906 PolarHBondContact NH2-OE2 3.47Å; T1764-E1906 HydrophobicContact CG2-CB 4.3Å; T1764-E1906 HydrophobicContact CG2-CG 4.42Å; T1764-E1906 VanDerWaalsContact OG1-CB 3.31Å; T1764-E1906 WeakPolarHBondContact OG1-CB 3.21Å; T1764-E1906 VanDerWaalsContact OG1-CG 3.32Å; T1764-E1906 WeakPolarHBondContact OG1-CG 3.36Å; K1767-E1906 IonicContact NZ-OE1 3.32Å; K1767-E1906 PolarHBondContact NZ-OE1 3.14Å; P1901-E1906 PolarHBondContact O-N 3.33Å; L1904-E1906 HydrophobicContact CB-CG 4.22Å; E1906-A1908 VanDerWaalsContact C-N 3.26Å; E1906-A1908 PolarHBondContact O-N 3.49Å; E1906-A1908 VanDerWaalsContact O-N 3.12Å; E1906-S1909 VanDerWaalsContact O-CB 3.31Å; E1906-S1909 WeakPolarHBondContact O-CB 3.5Å; E1906-S1909 PolarHBondContact O-N 3.48Å; E1906-F1910 HydrophobicContact CB-CE2 3.88Å; E1906-F1910 VanDerWaalsContact O-CD2 3.29Å; E1906-F1910 WeakPolarHBondContact O-CD2 3.37Å
1907V86Confident84.9Confident25 Ų2533.7 Ų33.715%0.15221%0.213CC..G310 helixtrans-52.6-35.5-173.359.30000114.7I1898 P1901 R1902 S1909 F1910 G1912I1898-V1907 HydrophobicContact CG1-CG2 3.99Å; P1901-V1907 PolarHBondContact O-N 3.39Å; R1902-V1907 HydrophobicContact CB-CB 4.01Å; R1902-V1907 HydrophobicContact CB-CG1 4.16Å; R1902-V1907 HydrophobicContact CB-CG2 4.41Å; R1902-V1907 HydrophobicContact CG-CG1 4.16Å; V1907-S1909 PolarHBondContact O-N 2.57Å; V1907-S1909 VanDerWaalsContact O-N 3.11Å; V1907-F1910 PolarHBondContact O-N 3.27Å; V1907-G1912 WeakPolarHBondContact CG2-O 3.38Å; V1907-G1912 PolarHBondContact O-N 3.21Å; V1907-G1912 VanDerWaalsContact O-N 3.15Å
1908A80.7Confident84.6Confident90 Ų9033.8 Ų33.874%0.74421%0.213SC*.G310 helixtrans-57.8-27176.400000113.2E1906 F1910E1906-A1908 VanDerWaalsContact C-N 3.26Å; E1906-A1908 PolarHBondContact O-N 3.49Å; E1906-A1908 VanDerWaalsContact O-N 3.12Å; A1908-F1910 VanDerWaalsContact C-N 3.29Å; A1908-F1910 PolarHBondContact O-N 3.15Å
1909S80.2Confident84.5Confident37 Ų3733.7 Ų33.726%0.25921%0.213SC..G310 helixtrans-74.2-17.4175.8-68.40000114.2S1760 E1906 V1907 Q1946S1760-S1909 VanDerWaalsContact CB-CB 3.41Å; S1760-S1909 WeakPolarHBondContact CB-OG 3.43Å; S1760-S1909 WeakPolarHBondContact OG-CB 3.41Å; S1760-S1909 PolarHBondContact OG-OG 3.46Å; E1906-S1909 VanDerWaalsContact O-CB 3.31Å; E1906-S1909 WeakPolarHBondContact O-CB 3.5Å; E1906-S1909 PolarHBondContact O-N 3.48Å; V1907-S1909 PolarHBondContact O-N 2.57Å; V1907-S1909 VanDerWaalsContact O-N 3.11Å; S1909-Q1946 PolarHBondContact O-NE2 3.46Å
1910F84.5Confident84.2Confident3 Ų338.7 Ų38.71%0.01323%0.231CC..G310 helixtrans-113.114-169-57.2-67.4000113.9A1761 T1764 I1898 P1901 E1906 V1907 A1908 Q1946 S1947 V1949 W1950A1761-F1910 HydrophobicContact CB-CE1 4.25Å; T1764-F1910 HydrophobicContact CG2-CE2 3.88Å; T1764-F1910 HydrophobicContact CG2-CZ 4.07Å; T1764-F1910 VanDerWaalsContact OG1-CE2 3.26Å; T1764-F1910 WeakPolarHBondContact OG1-CE2 3.43Å; T1764-F1910 VanDerWaalsContact OG1-CZ 3.28Å; T1764-F1910 WeakPolarHBondContact OG1-CZ 3.07Å; I1898-F1910 HydrophobicContact CD1-CB 3.99Å; P1901-F1910 HydrophobicContact CB-CD2 3.73Å; P1901-F1910 HydrophobicContact CB-CE2 3.91Å; P1901-F1910 HydrophobicContact CG-CD2 4.24Å; E1906-F1910 HydrophobicContact CB-CE2 3.88Å; E1906-F1910 VanDerWaalsContact O-CD2 3.29Å; E1906-F1910 WeakPolarHBondContact O-CD2 3.37Å; V1907-F1910 PolarHBondContact O-N 3.27Å; A1908-F1910 VanDerWaalsContact C-N 3.29Å; A1908-F1910 PolarHBondContact O-N 3.15Å; F1910-Q1946 VanDerWaalsContact CD1-O 3.3Å; F1910-Q1946 WeakPolarHBondContact CD1-O 3.37Å; F1910-S1947 WeakPolarHBondContact O-CA 3.46Å; F1910-S1947 PolarHBondContact O-N 2.91Å; F1910-V1949 HydrophobicContact CD1-CG1 4.01Å; F1910-V1949 HydrophobicContact CE1-CG1 3.94Å; F1910-W1950 HydrophobicContact CE1-CB 4.13Å; F1910-W1950 HydrophobicContact CZ-CB 4.04Å
1911G72.3Confident83.9Confident12 Ų1239.5 Ų39.512%0.12424%0.237CC..THydrogen-bonded Turntrans108.70.3-179.400000114.4
1912G76.8Confident83.8Confident23 Ų2339.6 Ų39.624%0.23724%0.238CC..  trans80.6-172.3-173.200000112.2V1907 N1914V1907-G1912 WeakPolarHBondContact CG2-O 3.38Å; V1907-G1912 PolarHBondContact O-N 3.21Å; V1907-G1912 VanDerWaalsContact O-N 3.15Å; G1912-N1914 PolarHBondContact O-N 3.43Å
1913S73.5Confident83.8Confident65 Ų6534 Ų3446%0.45522%0.217SC..SBendtrans-71-20.6179.3-47.80000112.8I1915S1913-I1915 PolarHBondContact O-N 2.87Å
1914N74.5Confident83.5Confident60 Ų6036.8 Ų36.832%0.32123%0.23SC..  trans-77105.6-178.4-174.6-4.7000111.1G1912 E1916 L2057G1912-N1914 PolarHBondContact O-N 3.43Å; N1914-E1916 WeakPolarHBondContact OD1-CB 3.44Å; N1914-E1916 PolarHBondContact OD1-N 3.44Å; N1914-L2057 PolarHBondContact ND2-O 3.49Å
1915I82.7Confident83.3Confident25 Ų2540.2 Ų40.213%0.12824%0.244CC..  trans-84.4-10.7-179.255.362.9000114L1894 H1895 I1898 S1913 S1918 V1919L1894-I1915 HydrophobicContact CB-CB 3.99Å; L1894-I1915 HydrophobicContact CB-CG1 4.46Å; L1894-I1915 HydrophobicContact CB-CG2 4.11Å; H1895-I1915 HydrophobicContact CB-CG1 4.16Å; I1898-I1915 HydrophobicContact CB-CG2 4.08Å; I1898-I1915 HydrophobicContact CG2-CG2 3.78Å; S1913-I1915 PolarHBondContact O-N 2.87Å; I1915-S1918 WeakPolarHBondContact O-CA 3.15Å; I1915-S1918 VanDerWaalsContact O-CB 3.28Å; I1915-S1918 WeakPolarHBondContact O-CB 3.46Å; I1915-S1918 PolarHBondContact O-N 2.99Å; I1915-V1919 HydrophobicContact CD1-CG2 3.94Å; I1915-V1919 PolarHBondContact O-N 2.98Å; I1915-V1919 VanDerWaalsContact O-N 3.1Å
1916E80.6Confident83.2Confident56 Ų5637.1 Ų37.126%0.26221%0.212SC..Hα-helixtrans-59.6-42.4-169.8175.859.9-175.200113.7N1914 S1918 V1919 R1920N1914-E1916 WeakPolarHBondContact OD1-CB 3.44Å; N1914-E1916 PolarHBondContact OD1-N 3.44Å; E1916-S1918 PolarHBondContact O-N 3.35Å; E1916-V1919 WeakPolarHBondContact O-CB 3.4Å; E1916-V1919 PolarHBondContact O-N 2.72Å; E1916-R1920 WeakPolarHBondContact O-CG 3.14Å; E1916-R1920 PolarHBondContact O-N 3.25Å; E1916-R1920 IonicContact OE1-CZ 3.92Å; E1916-R1920 IonicContact OE1-NE 3.32Å; E1916-R1920 PolarHBondContact OE1-NE 2.99Å; E1916-R1920 IonicContact OE1-NH2 2.73Å; E1916-R1920 PolarHBondContact OE1-NH2 3.01Å
1917P82.7Confident83.1Confident22 Ų2243.4 Ų43.414%0.14325%0.246CC..Hα-helixtrans-73.5-16.4179.33.211.9000112S1921 V2053 Q2054P1917-S1921 VanDerWaalsContact O-CB 3.24Å; P1917-S1921 WeakPolarHBondContact O-CB 3.49Å; P1917-S1921 PolarHBondContact O-N 3.46Å; P1917-V2053 HydrophobicContact CB-CG1 3.51Å; P1917-V2053 HydrophobicContact CG-CG1 3.72Å; P1917-Q2054 WeakPolarHBondContact CB-O 3.28Å; P1917-Q2054 VanDerWaalsContact CG-O 3.25Å; P1917-Q2054 WeakPolarHBondContact CG-O 3.47Å
1918S86Confident83Confident1 Ų147.6 Ų47.61%0.00727%0.267CS..Hα-helixtrans-74.9-42168.7-64.30000111.6I1915 E1916 S1921 C1922 W1940 S1947 V2053I1915-S1918 WeakPolarHBondContact O-CA 3.15Å; I1915-S1918 VanDerWaalsContact O-CB 3.28Å; I1915-S1918 WeakPolarHBondContact O-CB 3.46Å; I1915-S1918 PolarHBondContact O-N 2.99Å; E1916-S1918 PolarHBondContact O-N 3.35Å; S1918-S1921 WeakPolarHBondContact O-CB 3.49Å; S1918-S1921 PolarHBondContact O-N 3.11Å; S1918-C1922 PolarHBondContact O-N 2.75Å; S1918-W1940 WeakPolarHBondContact O-CZ2 3.48Å; S1918-S1947 VanDerWaalsContact CB-OG 3.3Å; S1918-S1947 WeakPolarHBondContact CB-OG 3.38Å; S1918-S1947 VanDerWaalsContact OG-CB 3.3Å; S1918-S1947 WeakPolarHBondContact OG-CB 3.46Å; S1918-S1947 PolarHBondContact OG-OG 3.27Å; S1918-V2053 WeakPolarHBondContact OG-CG2 3.36Å
1919V89.1Confident83Confident0 Ų048.6 Ų48.60%026%0.255CS..Hα-helixtrans-58.1-53.8172.1175.80000109.6Q1887 L1894 I1915 E1916 S1921 C1922 F1923Q1887-V1919 HydrophobicContact CB-CG1 3.7Å; Q1887-V1919 HydrophobicContact CG-CG1 3.87Å; Q1887-V1919 WeakPolarHBondContact O-CG1 3.35Å; L1894-V1919 HydrophobicContact CD1-CG2 3.87Å; I1915-V1919 HydrophobicContact CD1-CG2 3.94Å; I1915-V1919 PolarHBondContact O-N 2.98Å; I1915-V1919 VanDerWaalsContact O-N 3.1Å; E1916-V1919 WeakPolarHBondContact O-CB 3.4Å; E1916-V1919 PolarHBondContact O-N 2.72Å; V1919-S1921 VanDerWaalsContact C-N 3.26Å; V1919-S1921 PolarHBondContact O-N 3.5Å; V1919-C1922 PolarHBondContact O-N 3.26Å; V1919-C1922 VanDerWaalsContact O-N 3.12Å; V1919-F1923 HydrophobicContact CG1-CD2 4.09Å; V1919-F1923 HydrophobicContact CG1-CE2 4.36Å; V1919-F1923 WeakPolarHBondContact O-CD2 3.37Å; V1919-F1923 PolarHBondContact O-N 3.01Å
1920R86.5Confident83.2Confident118 Ų11852.1 Ų52.145%0.44528%0.277SS..Hα-helixtrans-54.3-42.1176.3-68.5177.5-174.3174.88.3112E1916 F1923 Q1924E1916-R1920 WeakPolarHBondContact O-CG 3.14Å; E1916-R1920 PolarHBondContact O-N 3.25Å; E1916-R1920 IonicContact OE1-CZ 3.92Å; E1916-R1920 IonicContact OE1-NE 3.32Å; E1916-R1920 PolarHBondContact OE1-NE 2.99Å; E1916-R1920 IonicContact OE1-NH2 2.73Å; E1916-R1920 PolarHBondContact OE1-NH2 3.01Å; R1920-F1923 PolarHBondContact O-N 2.82Å; R1920-Q1924 WeakPolarHBondContact O-CB 3.37Å; R1920-Q1924 VanDerWaalsContact O-CG 3.23Å; R1920-Q1924 WeakPolarHBondContact O-CG 3.42Å; R1920-Q1924 PolarHBondContact O-N 3.01Å
1921S86Confident83.4Confident18 Ų1855.7 Ų55.713%0.12629%0.294CS..Hα-helixtrans-61.9-44.2177.7-174.10000113.2P1917 S1918 V1919 F1923 Q1924 F1925 L2051P1917-S1921 VanDerWaalsContact O-CB 3.24Å; P1917-S1921 WeakPolarHBondContact O-CB 3.49Å; P1917-S1921 PolarHBondContact O-N 3.46Å; S1918-S1921 WeakPolarHBondContact O-CB 3.49Å; S1918-S1921 PolarHBondContact O-N 3.11Å; V1919-S1921 VanDerWaalsContact C-N 3.26Å; V1919-S1921 PolarHBondContact O-N 3.5Å; S1921-F1923 VanDerWaalsContact C-N 3.35Å; S1921-Q1924 PolarHBondContact O-N 2.72Å; S1921-F1925 WeakPolarHBondContact O-CB 3.33Å; S1921-F1925 PolarHBondContact O-N 2.89Å; S1921-L2051 WeakPolarHBondContact OG-CD2 3.3Å
1922C89Confident84.3Confident2 Ų255.1 Ų55.11%0.01429%0.288CS..Hα-helixtrans-63.6-41.2176-171.70000111.8L1890 S1918 V1919 F1925 A1926 I1932 W1940L1890-C1922 HydrophobicContact CD2-CB 3.61Å; S1918-C1922 PolarHBondContact O-N 2.75Å; V1919-C1922 PolarHBondContact O-N 3.26Å; V1919-C1922 VanDerWaalsContact O-N 3.12Å; C1922-F1925 PolarHBondContact O-N 3.42Å; C1922-A1926 PolarHBondContact O-N 3.26Å; C1922-A1926 VanDerWaalsContact O-N 3.13Å; C1922-I1932 VanDerWaalsContact SG-CD1 3.57Å; C1922-W1940 HydrophobicContact CB-CD2 3.64Å; C1922-W1940 HydrophobicContact CB-CE3 3.97Å; C1922-W1940 HydrophobicContact CB-CG 4.06Å; C1922-W1940 HydrophobicContact CB-CH2 4.23Å; C1922-W1940 HydrophobicContact CB-CZ2 3.91Å; C1922-W1940 HydrophobicContact CB-CZ3 4.25Å
1923F90.9Very high85Confident1 Ų158.6 Ų58.60%0.00430%0.298CS..Hα-helixtrans-71.7-37.6179.6-85.3-99000112.6C1885 Q1887 L1890 V1919 R1920 S1921 F1925 A1926 N1927 N1928 K1929 P1930 I1932C1885-F1923 WeakPolarHBondContact O-CZ 3.3Å; Q1887-F1923 HydrophobicContact CB-CE2 4.32Å; Q1887-F1923 HydrophobicContact CB-CZ 4.4Å; Q1887-F1923 HydrophobicContact CG-CB 4.41Å; Q1887-F1923 HydrophobicContact CG-CD1 3.57Å; Q1887-F1923 HydrophobicContact CG-CD2 3.61Å; Q1887-F1923 HydrophobicContact CG-CE1 3.69Å; Q1887-F1923 HydrophobicContact CG-CE2 3.7Å; Q1887-F1923 HydrophobicContact CG-CG 3.55Å; Q1887-F1923 HydrophobicContact CG-CZ 3.77Å; Q1887-F1923 VanDerWaalsContact N-CZ 3.33Å; L1890-F1923 HydrophobicContact CB-CE2 4.15Å; L1890-F1923 HydrophobicContact CD2-CD2 4Å; L1890-F1923 HydrophobicContact CD2-CE2 3.65Å; V1919-F1923 HydrophobicContact CG1-CD2 4.09Å; V1919-F1923 HydrophobicContact CG1-CE2 4.36Å; V1919-F1923 WeakPolarHBondContact O-CD2 3.37Å; V1919-F1923 PolarHBondContact O-N 3.01Å; R1920-F1923 PolarHBondContact O-N 2.82Å; S1921-F1923 VanDerWaalsContact C-N 3.35Å; F1923-F1925 VanDerWaalsContact C-N 3.35Å; F1923-F1925 PolarHBondContact O-N 2.97Å; F1923-A1926 CarbonylContact O-C 3.55Å; F1923-A1926 WeakPolarHBondContact O-CA 3.2Å; F1923-A1926 PolarHBondContact O-N 3.29Å; F1923-A1926 VanDerWaalsContact O-N 3.13Å; F1923-N1927 PolarHBondContact O-N 3.26Å; F1923-N1928 WeakPolarHBondContact O-CA 3.25Å; F1923-N1928 PolarHBondContact O-N 3.43Å; F1923-K1929 WeakPolarHBondContact CD1-O 3.21Å; F1923-K1929 WeakPolarHBondContact CE1-O 3.36Å; F1923-P1930 WeakPolarHBondContact CE1-O 3.49Å; F1923-I1932 HydrophobicContact CD1-CG2 4.24Å; F1923-I1932 HydrophobicContact CE1-CG2 3.91Å; F1923-I1932 HydrophobicContact CE2-CD1 4.07Å; F1923-I1932 HydrophobicContact CE2-CG1 4.34Å; F1923-I1932 HydrophobicContact CE2-CG2 4.46Å; F1923-I1932 HydrophobicContact CZ-CD1 4.27Å; F1923-I1932 HydrophobicContact CZ-CG1 4.03Å; F1923-I1932 HydrophobicContact CZ-CG2 4.02Å
1924Q86.5Confident85.7Confident120 Ų12057.2 Ų57.256%0.56129%0.29SS*.Hα-helixtrans-61.5-41.3170.5-75.71733.800112R1920 S1921 A1926 N1927 N1928R1920-Q1924 WeakPolarHBondContact O-CB 3.37Å; R1920-Q1924 VanDerWaalsContact O-CG 3.23Å; R1920-Q1924 WeakPolarHBondContact O-CG 3.42Å; R1920-Q1924 PolarHBondContact O-N 3.01Å; S1921-Q1924 PolarHBondContact O-N 2.72Å; Q1924-A1926 PolarHBondContact O-N 3.11Å; Q1924-N1927 WeakPolarHBondContact O-CA 3.4Å; Q1924-N1927 PolarHBondContact O-N 2.96Å; Q1924-N1928 WeakPolarHBondContact CA-OD1 3.43Å; Q1924-N1928 WeakPolarHBondContact CG-OD1 3.41Å
1925F85.7Confident86.5Confident89 Ų8957 Ų5739%0.3930%0.297SS..Hα-helixtrans-61.6-32.9173.9-177.7-102.9000112.4S1921 C1922 F1923 N1927 D1939 W1940 L1943S1921-F1925 WeakPolarHBondContact O-CB 3.33Å; S1921-F1925 PolarHBondContact O-N 2.89Å; C1922-F1925 PolarHBondContact O-N 3.42Å; F1923-F1925 VanDerWaalsContact C-N 3.35Å; F1923-F1925 PolarHBondContact O-N 2.97Å; F1925-N1927 PolarHBondContact O-N 2.89Å; F1925-D1939 HydrophobicContact CE1-CB 3.87Å; F1925-D1939 HydrophobicContact CZ-CB 4.23Å; F1925-W1940 HydrophobicContact CD1-CB 3.79Å; F1925-W1940 HydrophobicContact CD1-CG 4.47Å; F1925-W1940 HydrophobicContact CE1-CB 4.17Å; F1925-W1940 HydrophobicContact CG-CB 4.46Å; F1925-L1943 HydrophobicContact CD2-CD1 3.92Å; F1925-L1943 HydrophobicContact CE2-CD1 3.68Å; F1925-L1943 HydrophobicContact CZ-CD1 4.18Å
1926A85.4Confident86.8Confident2 Ų258 Ų582%0.01730%0.302CS..THydrogen-bonded Turntrans-81.816.7171.800000114.6C1922 F1923 Q1924 N1928 K1929 I1932 L1936C1922-A1926 PolarHBondContact O-N 3.26Å; C1922-A1926 VanDerWaalsContact O-N 3.13Å; F1923-A1926 CarbonylContact O-C 3.55Å; F1923-A1926 WeakPolarHBondContact O-CA 3.2Å; F1923-A1926 PolarHBondContact O-N 3.29Å; F1923-A1926 VanDerWaalsContact O-N 3.13Å; Q1924-A1926 PolarHBondContact O-N 3.11Å; A1926-N1928 VanDerWaalsContact C-N 3.34Å; A1926-N1928 PolarHBondContact O-N 3.44Å; A1926-K1929 WeakPolarHBondContact O-CG 3.36Å; A1926-K1929 PolarHBondContact O-N 3.43Å; A1926-I1932 HydrophobicContact CB-CG2 3.46Å; A1926-I1932 VanDerWaalsContact CB-CG2 3.46Å; A1926-L1936 HydrophobicContact CB-CD1 4.38Å; A1926-L1936 HydrophobicContact CB-CD2 4.47Å
1927N84.9Confident87.4Confident142 Ų14255.6 Ų55.676%0.75929%0.291SS*.THydrogen-bonded Turntrans58.836.3-175.5-60.5-51000114.4F1923 Q1924 F1925 K1929F1923-N1927 PolarHBondContact O-N 3.26Å; Q1924-N1927 WeakPolarHBondContact O-CA 3.4Å; Q1924-N1927 PolarHBondContact O-N 2.96Å; F1925-N1927 PolarHBondContact O-N 2.89Å; N1927-K1929 PolarHBondContact O-N 3.01Å
1928N84.8Confident87.8Confident113 Ų11355.1 Ų55.160%0.60429%0.287SS*.THydrogen-bonded Turntrans56.229.9-179.3-56.7-48.3000114.5F1923 Q1924 A1926F1923-N1928 WeakPolarHBondContact O-CA 3.25Å; F1923-N1928 PolarHBondContact O-N 3.43Å; Q1924-N1928 WeakPolarHBondContact CA-OD1 3.43Å; Q1924-N1928 WeakPolarHBondContact CG-OD1 3.41Å; A1926-N1928 VanDerWaalsContact C-N 3.34Å; A1926-N1928 PolarHBondContact O-N 3.44Å
1929K80.8Confident88Confident111 Ų11158.3 Ų58.348%0.48330%0.304SS..  trans-58.9138.9166.2-72.6177.4175.5-172.20109.6F1923 A1926 N1927 E1931F1923-K1929 WeakPolarHBondContact CD1-O 3.21Å; F1923-K1929 WeakPolarHBondContact CE1-O 3.36Å; A1926-K1929 WeakPolarHBondContact O-CG 3.36Å; A1926-K1929 PolarHBondContact O-N 3.43Å; N1927-K1929 PolarHBondContact O-N 3.01Å; K1929-E1931 WeakPolarHBondContact CB-O 3.4Å; K1929-E1931 PolarHBondContact O-N 3.29Å
1930P83.3Confident88.1Confident111 Ų11158.3 Ų58.372%0.72130%0.304SS*.SBendtrans-66.3-21.1-177.728.1-36.1000113.2F1923F1923-P1930 WeakPolarHBondContact CE1-O 3.49Å
1931E88.6Confident88.2Confident79 Ų7952.9 Ų52.937%0.36928%0.284SS..SBendtrans-134.6147.8175.7-65.9-174.3149.900110.3F1884 C1885 K1929F1884-E1931 HydrophobicContact CB-CB 4.07Å; F1884-E1931 HydrophobicContact CB-CG 4.45Å; F1884-E1931 HydrophobicContact CD1-CB 4.17Å; F1884-E1931 HydrophobicContact CG-CB 4.48Å; C1885-E1931 CarbonylContact O-C 3.55Å; C1885-E1931 WeakPolarHBondContact O-CA 3.47Å; K1929-E1931 WeakPolarHBondContact CB-O 3.4Å; K1929-E1931 PolarHBondContact O-N 3.29Å
1932I92Very high88.2Confident0 Ų058.4 Ų58.40%030%0.302CS..EExtended strand (participates in β ladder)trans-118.8152.7176.463.7173.4000111.6F1875 F1884 C1885 L1890 C1922 F1923 A1926 F1937F1875-I1932 HydrophobicContact CE2-CD1 4.2Å; F1875-I1932 HydrophobicContact CE2-CG1 4.09Å; F1875-I1932 HydrophobicContact CZ-CG1 4.42Å; F1875-I1932 WeakPolarHBondContact CZ-O 3.33Å; F1884-I1932 WeakPolarHBondContact CA-O 3.21Å; C1885-I1932 HydrophobicContact CB-CG1 4.09Å; C1885-I1932 PolarHBondContact N-O 2.97Å; C1885-I1932 WeakPolarHBondContact O-CG1 3.24Å; C1885-I1932 PolarHBondContact O-N 3.39Å; L1890-I1932 HydrophobicContact CD2-CD1 4.18Å; C1922-I1932 VanDerWaalsContact SG-CD1 3.57Å; F1923-I1932 HydrophobicContact CD1-CG2 4.24Å; F1923-I1932 HydrophobicContact CE1-CG2 3.91Å; F1923-I1932 HydrophobicContact CE2-CD1 4.07Å; F1923-I1932 HydrophobicContact CE2-CG1 4.34Å; F1923-I1932 HydrophobicContact CE2-CG2 4.46Å; F1923-I1932 HydrophobicContact CZ-CD1 4.27Å; F1923-I1932 HydrophobicContact CZ-CG1 4.03Å; F1923-I1932 HydrophobicContact CZ-CG2 4.02Å; A1926-I1932 HydrophobicContact CB-CG2 3.46Å; A1926-I1932 VanDerWaalsContact CB-CG2 3.46Å; I1932-F1937 HydrophobicContact CD1-CB 4.27Å
1933E90.5Very high88.1Confident96 Ų9661.9 Ų61.945%0.44932%0.32SS..EExtended strand (participates in β ladder)trans-97.5161.3172.9-67.3172.9-153.600111.2F1884 A1935 L1936 F1937F1884-E1933 HydrophobicContact CD1-CG 3.79Å; F1884-E1933 HydrophobicContact CE1-CG 3.36Å; F1884-E1933 HydrophobicContact CZ-CG 4.07Å; E1933-A1935 PolarHBondContact O-N 3.3Å; E1933-A1935 VanDerWaalsContact O-N 3.11Å; E1933-L1936 PolarHBondContact O-N 3.48Å; E1933-L1936 VanDerWaalsContact O-N 3.09Å; E1933-F1937 PolarHBondContact O-N 2.95Å; E1933-F1937 VanDerWaalsContact O-N 3.14Å
1934A90.2Very high87.9Confident35 Ų3564.2 Ų64.229%0.28933%0.331SS..Hα-helixtrans-54.5-33.5178.800000113.5F1875 F1937 L1938F1875-A1934 HydrophobicContact CD1-CB 3.55Å; F1875-A1934 HydrophobicContact CE1-CB 3.69Å; F1875-A1934 VanDerWaalsContact CE1-N 3.32Å; F1875-A1934 HydrophobicContact CG-CB 4.23Å; F1875-A1934 HydrophobicContact CZ-CB 4.45Å; A1934-F1937 PolarHBondContact O-N 3.4Å; A1934-L1938 WeakPolarHBondContact O-CB 3.42Å; A1934-L1938 VanDerWaalsContact O-CG 3.22Å; A1934-L1938 WeakPolarHBondContact O-CG 3.31Å; A1934-L1938 PolarHBondContact O-N 3.42Å
1935A89.7Confident87.9Confident56 Ų5658.6 Ų58.646%0.46331%0.305SS..Hα-helixtrans-64.7-45.8177.900000112.4E1933 L1938 D1939E1933-A1935 PolarHBondContact O-N 3.3Å; E1933-A1935 VanDerWaalsContact O-N 3.11Å; A1935-L1938 PolarHBondContact O-N 2.76Å; A1935-D1939 PolarHBondContact O-N 3.31Å
1936L90.6Very high87.8Confident47 Ų4756.5 Ų56.525%0.24630%0.296CS..Hα-helixtrans-64.6-40.4177.1-77.1160.4000111.6A1926 E1933 D1939 W1940A1926-L1936 HydrophobicContact CB-CD1 4.38Å; A1926-L1936 HydrophobicContact CB-CD2 4.47Å; E1933-L1936 PolarHBondContact O-N 3.48Å; E1933-L1936 VanDerWaalsContact O-N 3.09Å; L1936-D1939 PolarHBondContact O-N 2.85Å; L1936-W1940 PolarHBondContact O-N 2.97Å
1937F92.1Very high87.9Confident4 Ų456.6 Ų56.62%0.01830%0.296CS..Hα-helixtrans-62.7-43.9173.8174-106.6000112.1F1875 L1890 L1893 I1932 E1933 A1934 D1939 W1940 M1941F1875-F1937 HydrophobicContact CB-CD1 3.8Å; F1875-F1937 HydrophobicContact CB-CE1 3.98Å; F1875-F1937 HydrophobicContact CD2-CB 3.56Å; F1875-F1937 AromaticContact CD2-CD1 3.53Å; F1875-F1937 HydrophobicContact CD2-CD1 3.53Å; F1875-F1937 HydrophobicContact CD2-CD2 4.13Å; F1875-F1937 HydrophobicContact CD2-CE1 4.23Å; F1875-F1937 AromaticContact CD2-CG 3.46Å; F1875-F1937 HydrophobicContact CD2-CG 3.46Å; F1875-F1937 VanDerWaalsContact CD2-CG 3.46Å; F1875-F1937 HydrophobicContact CE2-CB 3.65Å; F1875-F1937 HydrophobicContact CE2-CD1 4.47Å; F1875-F1937 HydrophobicContact CE2-CG 4.01Å; F1875-F1937 HydrophobicContact CG-CB 4.47Å; F1875-F1937 AromaticContact CG-CD1 3.98Å; F1875-F1937 HydrophobicContact CG-CD1 3.98Å; F1875-F1937 HydrophobicContact CG-CG 4.34Å; L1890-F1937 HydrophobicContact CD1-CD2 4.01Å; L1890-F1937 HydrophobicContact CD1-CE2 3.78Å; L1893-F1937 HydrophobicContact CD2-CZ 4.31Å; I1932-F1937 HydrophobicContact CD1-CB 4.27Å; E1933-F1937 PolarHBondContact O-N 2.95Å; E1933-F1937 VanDerWaalsContact O-N 3.14Å; A1934-F1937 PolarHBondContact O-N 3.4Å; F1937-D1939 PolarHBondContact O-N 3.08Å; F1937-W1940 HydrophobicContact CD2-CE3 4.16Å; F1937-W1940 HydrophobicContact CE2-CE3 4.12Å; F1937-W1940 HydrophobicContact CE2-CZ3 4.09Å; F1937-W1940 PolarHBondContact O-N 2.71Å; F1937-M1941 HydrophobicContact CD1-CG 4.23Å; F1937-M1941 HydrophobicContact CD2-CG 4.15Å; F1937-M1941 HydrophobicContact CE1-CG 3.81Å; F1937-M1941 HydrophobicContact CE2-CG 3.71Å; F1937-M1941 HydrophobicContact CE2-SD 3.93Å; F1937-M1941 HydrophobicContact CG-CG 4.39Å; F1937-M1941 HydrophobicContact CZ-CE 4.38Å; F1937-M1941 HydrophobicContact CZ-CG 3.54Å; F1937-M1941 HydrophobicContact CZ-SD 3.83Å; F1937-M1941 WeakPolarHBondContact O-CB 3.32Å; F1937-M1941 VanDerWaalsContact O-CG 3.27Å; F1937-M1941 WeakPolarHBondContact O-CG 3.11Å; F1937-M1941 PolarHBondContact O-N 3.16Å
1938L91.2Very high88.1Confident12 Ų1250.1 Ų50.16%0.06326%0.262CS..Hα-helixtrans-62.4-41.4175.8-73.6169.7000112.1E1868 Y1871 R1872 A1934 A1935 W1940 M1941 R1942E1868-L1938 HydrophobicContact CB-CD2 4.4Å; Y1871-L1938 HydrophobicContact CD2-CD2 3.99Å; Y1871-L1938 HydrophobicContact CG-CD2 4.29Å; R1872-L1938 HydrophobicContact CG-CD1 3.89Å; R1872-L1938 HydrophobicContact CG-CD2 4.37Å; A1934-L1938 WeakPolarHBondContact O-CB 3.42Å; A1934-L1938 VanDerWaalsContact O-CG 3.22Å; A1934-L1938 WeakPolarHBondContact O-CG 3.31Å; A1934-L1938 PolarHBondContact O-N 3.42Å; A1935-L1938 PolarHBondContact O-N 2.76Å; L1938-W1940 VanDerWaalsContact C-N 3.35Å; L1938-M1941 PolarHBondContact O-N 3.05Å; L1938-R1942 VanDerWaalsContact O-CG 3.26Å; L1938-R1942 WeakPolarHBondContact O-CG 3.42Å; L1938-R1942 PolarHBondContact O-N 2.97Å
1939D89.5Confident88.4Confident68 Ų6844.8 Ų44.836%0.36423%0.233SC..Hα-helixtrans-64.9-36.9176.1-76.9-25.5000112.5F1925 A1935 L1936 F1937 R1942F1925-D1939 HydrophobicContact CE1-CB 3.87Å; F1925-D1939 HydrophobicContact CZ-CB 4.23Å; A1935-D1939 PolarHBondContact O-N 3.31Å; L1936-D1939 PolarHBondContact O-N 2.85Å; F1937-D1939 PolarHBondContact O-N 3.08Å; D1939-R1942 IonicContact OD1-CZ 2.76Å; D1939-R1942 IonicContact OD1-NH1 2.69Å; D1939-R1942 PolarHBondContact OD1-NH1 3.46Å
1940W91.6Very high88.9Confident1 Ų139.5 Ų39.50%0.00421%0.21CC..Hα-helixtrans-67.1-44.3171.1179.775.5000112.2L1894 S1918 C1922 F1925 L1936 F1937 L1938 R1942 L1943 P1945L1894-W1940 HydrophobicContact CD1-CH2 4.32Å; S1918-W1940 WeakPolarHBondContact O-CZ2 3.48Å; C1922-W1940 HydrophobicContact CB-CD2 3.64Å; C1922-W1940 HydrophobicContact CB-CE3 3.97Å; C1922-W1940 HydrophobicContact CB-CG 4.06Å; C1922-W1940 HydrophobicContact CB-CH2 4.23Å; C1922-W1940 HydrophobicContact CB-CZ2 3.91Å; C1922-W1940 HydrophobicContact CB-CZ3 4.25Å; F1925-W1940 HydrophobicContact CD1-CB 3.79Å; F1925-W1940 HydrophobicContact CD1-CG 4.47Å; F1925-W1940 HydrophobicContact CE1-CB 4.17Å; F1925-W1940 HydrophobicContact CG-CB 4.46Å; L1936-W1940 PolarHBondContact O-N 2.97Å; F1937-W1940 HydrophobicContact CD2-CE3 4.16Å; F1937-W1940 HydrophobicContact CE2-CE3 4.12Å; F1937-W1940 HydrophobicContact CE2-CZ3 4.09Å; F1937-W1940 PolarHBondContact O-N 2.71Å; L1938-W1940 VanDerWaalsContact C-N 3.35Å; W1940-R1942 PolarHBondContact O-N 3.49Å; W1940-L1943 VanDerWaalsContact O-CB 3.26Å; W1940-L1943 WeakPolarHBondContact O-CB 3.27Å; W1940-L1943 PolarHBondContact O-N 3.27Å; W1940-P1945 HydrophobicContact CD2-CB 4.43Å; W1940-P1945 HydrophobicContact CD2-CG 4.09Å; W1940-P1945 HydrophobicContact CE3-CG 3.94Å; W1940-P1945 HydrophobicContact CH2-CB 3.67Å; W1940-P1945 HydrophobicContact CH2-CG 3.54Å; W1940-P1945 HydrophobicContact CZ2-CB 3.37Å; W1940-P1945 HydrophobicContact CZ2-CG 3.69Å; W1940-P1945 HydrophobicContact CZ3-CB 4.3Å; W1940-P1945 HydrophobicContact CZ3-CG 3.67Å
1941M90.1Very high89.4Confident3 Ų334.2 Ų34.22%0.01518%0.176CC..Hα-helixtrans-64.1-27.9177.9-71.2-66.5-72.700113Y1871 F1937 L1938 L1943 E1944 P1945 M1948Y1871-M1941 HydrophobicContact CD1-CE 3.73Å; Y1871-M1941 HydrophobicContact CD2-CB 3.83Å; Y1871-M1941 HydrophobicContact CD2-CE 4.38Å; Y1871-M1941 HydrophobicContact CD2-CG 4.36Å; Y1871-M1941 HydrophobicContact CE1-CE 3.3Å; Y1871-M1941 HydrophobicContact CE2-CB 3.68Å; Y1871-M1941 HydrophobicContact CE2-CE 4Å; Y1871-M1941 HydrophobicContact CE2-CG 4.43Å; Y1871-M1941 HydrophobicContact CG-CE 4.25Å; Y1871-M1941 VanDerWaalsContact CZ-CE 3.42Å; F1937-M1941 HydrophobicContact CD1-CG 4.23Å; F1937-M1941 HydrophobicContact CD2-CG 4.15Å; F1937-M1941 HydrophobicContact CE1-CG 3.81Å; F1937-M1941 HydrophobicContact CE2-CG 3.71Å; F1937-M1941 HydrophobicContact CE2-SD 3.93Å; F1937-M1941 HydrophobicContact CG-CG 4.39Å; F1937-M1941 HydrophobicContact CZ-CE 4.38Å; F1937-M1941 HydrophobicContact CZ-CG 3.54Å; F1937-M1941 HydrophobicContact CZ-SD 3.83Å; F1937-M1941 WeakPolarHBondContact O-CB 3.32Å; F1937-M1941 VanDerWaalsContact O-CG 3.27Å; F1937-M1941 WeakPolarHBondContact O-CG 3.11Å; F1937-M1941 PolarHBondContact O-N 3.16Å; L1938-M1941 PolarHBondContact O-N 3.05Å; M1941-L1943 PolarHBondContact O-N 3.18Å; M1941-E1944 PolarHBondContact O-N 3.29Å; M1941-E1944 VanDerWaalsContact O-N 3.09Å; M1941-P1945 HydrophobicContact SD-CG 3.97Å; M1941-M1948 HydrophobicContact CE-CB 3.74Å; M1941-M1948 HydrophobicContact CE-CE 4.21Å; M1941-M1948 HydrophobicContact CE-CG 3.97Å; M1941-M1948 HydrophobicContact SD-CB 4.18Å; M1941-M1948 HydrophobicContact SD-CG 4.12Å
1942R86.1Confident89.5Confident135 Ų13530.6 Ų30.651%0.50916%0.159SC..THydrogen-bonded Turntrans-66.7-14.5171.1-74.5165.7179.9160.6-3.2113.5E1868 L1938 D1939 W1940 E1944E1868-R1942 IonicContact OE1-CZ 3.27Å; E1868-R1942 VanDerWaalsContact OE1-CZ 3.32Å; E1868-R1942 IonicContact OE1-NE 2.78Å; E1868-R1942 PolarHBondContact OE1-NE 3.35Å; E1868-R1942 VanDerWaalsContact OE1-NE 3.09Å; E1868-R1942 IonicContact OE1-NH2 2.94Å; E1868-R1942 PolarHBondContact OE1-NH2 2.88Å; E1868-R1942 IonicContact OE2-NH2 3.95Å; L1938-R1942 VanDerWaalsContact O-CG 3.26Å; L1938-R1942 WeakPolarHBondContact O-CG 3.42Å; L1938-R1942 PolarHBondContact O-N 2.97Å; D1939-R1942 IonicContact OD1-CZ 2.76Å; D1939-R1942 IonicContact OD1-NH1 2.69Å; D1939-R1942 PolarHBondContact OD1-NH1 3.46Å; W1940-R1942 PolarHBondContact O-N 3.49Å; R1942-E1944 VanDerWaalsContact C-N 3.28Å
1943L85Confident89.6Confident74 Ų7430.6 Ų30.639%0.38716%0.159SC..THydrogen-bonded Turntrans-83.7-1.7171.1-54.5177.5000113.2F1925 W1940 M1941F1925-L1943 HydrophobicContact CD2-CD1 3.92Å; F1925-L1943 HydrophobicContact CE2-CD1 3.68Å; F1925-L1943 HydrophobicContact CZ-CD1 4.18Å; W1940-L1943 VanDerWaalsContact O-CB 3.26Å; W1940-L1943 WeakPolarHBondContact O-CB 3.27Å; W1940-L1943 PolarHBondContact O-N 3.27Å; M1941-L1943 PolarHBondContact O-N 3.18Å
1944E86.8Confident89.8Confident50 Ų5026.1 Ų26.123%0.23414%0.138CC..  trans52.664.6-177.7-61.8-170.2-168.800113M1941 R1942 V1949 P1952 R1956M1941-E1944 PolarHBondContact O-N 3.29Å; M1941-E1944 VanDerWaalsContact O-N 3.09Å; R1942-E1944 VanDerWaalsContact C-N 3.28Å; E1944-V1949 HydrophobicContact CB-CG2 3.84Å; E1944-P1952 HydrophobicContact CG-CB 4.41Å; E1944-P1952 HydrophobicContact CG-CG 4.03Å; E1944-R1956 IonicContact OE1-CZ 3.77Å; E1944-R1956 IonicContact OE1-NH1 3.26Å; E1944-R1956 PolarHBondContact OE1-NH1 2.66Å; E1944-R1956 IonicContact OE1-NH2 2.71Å; E1944-R1956 IonicContact OE2-CZ 3.18Å; E1944-R1956 IonicContact OE2-NH1 3.48Å; E1944-R1956 PolarHBondContact OE2-NH1 3.07Å; E1944-R1956 IonicContact OE2-NH2 2.63Å; E1944-R1956 PolarHBondContact OE2-NH2 2.74Å
1945P87.2Confident89.9Confident2 Ų226.7 Ų26.71%0.01314%0.135CC..  trans-62.6145.7-17926.9-34.5000111.8W1940 M1941 S1947 M1948 V1949W1940-P1945 HydrophobicContact CD2-CB 4.43Å; W1940-P1945 HydrophobicContact CD2-CG 4.09Å; W1940-P1945 HydrophobicContact CE3-CG 3.94Å; W1940-P1945 HydrophobicContact CH2-CB 3.67Å; W1940-P1945 HydrophobicContact CH2-CG 3.54Å; W1940-P1945 HydrophobicContact CZ2-CB 3.37Å; W1940-P1945 HydrophobicContact CZ2-CG 3.69Å; W1940-P1945 HydrophobicContact CZ3-CB 4.3Å; W1940-P1945 HydrophobicContact CZ3-CG 3.67Å; M1941-P1945 HydrophobicContact SD-CG 3.97Å; P1945-S1947 VanDerWaalsContact C-N 3.3Å; P1945-S1947 PolarHBondContact O-N 2.83Å; P1945-M1948 HydrophobicContact CG-CB 4.38Å; P1945-M1948 PolarHBondContact O-N 2.89Å; P1945-V1949 PolarHBondContact O-N 3.38Å
1946Q84.4Confident90.1Very high46 Ų4626.4 Ų26.422%0.21512%0.122CC..THydrogen-bonded Turntrans-57.5-37.8-167.3-174.5176.40.400113.7S1909 F1910 M1948 V2053S1909-Q1946 PolarHBondContact O-NE2 3.46Å; F1910-Q1946 VanDerWaalsContact CD1-O 3.3Å; F1910-Q1946 WeakPolarHBondContact CD1-O 3.37Å; Q1946-M1948 VanDerWaalsContact C-N 3.29Å; Q1946-M1948 PolarHBondContact O-N 2.83Å; Q1946-V2053 HydrophobicContact CB-CG2 4.07Å
1947S86.2Confident90.2Very high3 Ų324.5 Ų24.52%0.02111%0.112CC..THydrogen-bonded Turntrans-65.3-26.4178.540.30000114.6I1898 F1910 S1918 P1945 W1950I1898-S1947 WeakPolarHBondContact CD1-O 3.47Å; F1910-S1947 WeakPolarHBondContact O-CA 3.46Å; F1910-S1947 PolarHBondContact O-N 2.91Å; S1918-S1947 VanDerWaalsContact CB-OG 3.3Å; S1918-S1947 WeakPolarHBondContact CB-OG 3.38Å; S1918-S1947 VanDerWaalsContact OG-CB 3.3Å; S1918-S1947 WeakPolarHBondContact OG-CB 3.46Å; S1918-S1947 PolarHBondContact OG-OG 3.27Å; P1945-S1947 VanDerWaalsContact C-N 3.3Å; P1945-S1947 PolarHBondContact O-N 2.83Å; S1947-W1950 PolarHBondContact O-NE1 3.13Å
1948M89.9Confident90.2Very high7 Ų725.7 Ų25.73%0.03412%0.123CC..THydrogen-bonded Turntrans-114.5-6.4-174.3-65-59.3-67.500114.4L1894 S1897 M1941 P1945 Q1946 W1950 L1951 P1952L1894-M1948 HydrophobicContact CD2-CG 3.67Å; L1894-M1948 HydrophobicContact CD2-SD 3.79Å; S1897-M1948 WeakPolarHBondContact CB-SD 3.2Å; M1941-M1948 HydrophobicContact CE-CB 3.74Å; M1941-M1948 HydrophobicContact CE-CE 4.21Å; M1941-M1948 HydrophobicContact CE-CG 3.97Å; M1941-M1948 HydrophobicContact SD-CB 4.18Å; M1941-M1948 HydrophobicContact SD-CG 4.12Å; P1945-M1948 HydrophobicContact CG-CB 4.38Å; P1945-M1948 PolarHBondContact O-N 2.89Å; Q1946-M1948 VanDerWaalsContact C-N 3.29Å; Q1946-M1948 PolarHBondContact O-N 2.83Å; M1948-W1950 HydrophobicContact CE-CZ2 4.14Å; M1948-W1950 PolarHBondContact O-N 2.93Å; M1948-W1950 HydrophobicContact SD-CZ2 4.25Å; M1948-L1951 HydrophobicContact CE-CD2 4.13Å; M1948-L1951 WeakPolarHBondContact O-CB 3.32Å; M1948-L1951 PolarHBondContact O-N 2.89Å; M1948-P1952 WeakPolarHBondContact O-CD 3.26Å
1949V90.4Very high90.2Very high0 Ų026.9 Ų26.90%014%0.135CC..THydrogen-bonded Turntrans-63.7-18.9-168.670.70000115.4A1761 F1910 E1944 P1945 L1951 P1952 V1953 Y2050A1761-V1949 HydrophobicContact CB-CG1 4.3Å; F1910-V1949 HydrophobicContact CD1-CG1 4.01Å; F1910-V1949 HydrophobicContact CE1-CG1 3.94Å; E1944-V1949 HydrophobicContact CB-CG2 3.84Å; P1945-V1949 PolarHBondContact O-N 3.38Å; V1949-L1951 PolarHBondContact O-N 3.13Å; V1949-P1952 HydrophobicContact CG2-CG 4.28Å; V1949-P1952 VanDerWaalsContact O-CD 3.29Å; V1949-P1952 WeakPolarHBondContact O-CD 3.4Å; V1949-P1952 WeakPolarHBondContact O-CG 3.37Å; V1949-V1953 HydrophobicContact CG2-CG2 4.11Å; V1949-V1953 WeakPolarHBondContact O-CB 3.31Å; V1949-V1953 WeakPolarHBondContact O-CG2 3.41Å; V1949-V1953 PolarHBondContact O-N 3.45Å; V1949-Y2050 HydrophobicContact CB-CD1 4.11Å; V1949-Y2050 HydrophobicContact CB-CE1 4.27Å; V1949-Y2050 HydrophobicContact CG1-CD1 4.16Å; V1949-Y2050 HydrophobicContact CG1-CD2 4.29Å; V1949-Y2050 HydrophobicContact CG1-CE1 4.28Å; V1949-Y2050 HydrophobicContact CG1-CE2 4.39Å; V1949-Y2050 HydrophobicContact CG1-CG 4.15Å; V1949-Y2050 HydrophobicContact CG2-CD1 3.55Å; V1949-Y2050 HydrophobicContact CG2-CE1 3.32Å; V1949-Y2050 HydrophobicContact CG2-CG 4.36Å
1950W92.2Very high90.3Very high0 Ų023.7 Ų23.70%012%0.117CC..Hα-helixtrans-59.9-29.9170.853-94000112.6T1764 L1768 S1897 I1900 F1910 S1947 M1948 L1954T1764-W1950 HydrophobicContact CG2-CB 4.01Å; L1768-W1950 HydrophobicContact CD1-CD2 4.2Å; L1768-W1950 HydrophobicContact CD1-CE3 3.4Å; L1768-W1950 VanDerWaalsContact CD1-CE3 3.4Å; L1768-W1950 HydrophobicContact CD1-CZ3 3.96Å; S1897-W1950 WeakPolarHBondContact O-CZ2 3.31Å; I1900-W1950 HydrophobicContact CB-CH2 4.5Å; I1900-W1950 HydrophobicContact CD1-CH2 4.08Å; I1900-W1950 HydrophobicContact CG2-CH2 4.47Å; I1900-W1950 HydrophobicContact CG2-CZ3 4.42Å; F1910-W1950 HydrophobicContact CE1-CB 4.13Å; F1910-W1950 HydrophobicContact CZ-CB 4.04Å; S1947-W1950 PolarHBondContact O-NE1 3.13Å; M1948-W1950 HydrophobicContact CE-CZ2 4.14Å; M1948-W1950 PolarHBondContact O-N 2.93Å; M1948-W1950 HydrophobicContact SD-CZ2 4.25Å; W1950-L1954 WeakPolarHBondContact O-CB 3.37Å; W1950-L1954 PolarHBondContact O-N 3.04Å
1951L92.4Very high90.1Very high0 Ų027.1 Ų27.10%013%0.133CC..Hα-helixtrans-74.4-50.3-178.6-173.651.3000114L1867 Y1871 M1948 V1949 V1953 L1954 H1955L1867-L1951 HydrophobicContact CD1-CG 4.05Å; Y1871-L1951 HydrophobicContact CE1-CD2 3.9Å; Y1871-L1951 HydrophobicContact CE1-CG 4.3Å; M1948-L1951 HydrophobicContact CE-CD2 4.13Å; M1948-L1951 WeakPolarHBondContact O-CB 3.32Å; M1948-L1951 PolarHBondContact O-N 2.89Å; V1949-L1951 PolarHBondContact O-N 3.13Å; L1951-V1953 VanDerWaalsContact C-N 3.27Å; L1951-V1953 PolarHBondContact O-N 3.31Å; L1951-L1954 HydrophobicContact CD1-CD2 4.33Å; L1951-L1954 WeakPolarHBondContact O-CB 3.48Å; L1951-L1954 PolarHBondContact O-N 3.48Å; L1951-H1955 PolarHBondContact O-CD2 2.83Å; L1951-H1955 VanDerWaalsContact O-CD2 3.32Å; L1951-H1955 PolarHBondContact O-N 3.3Å
1952P92.7Very high89.9Confident3 Ų332.5 Ų32.52%0.01917%0.167CC..Hα-helixtrans-62-35.3170.721.6-29.8000111.9L1867 Y1871 E1944 M1948 V1949 H1955 R1956L1867-P1952 HydrophobicContact CD2-CB 3.82Å; Y1871-P1952 WeakPolarHBondContact OH-CD 3.28Å; E1944-P1952 HydrophobicContact CG-CB 4.41Å; E1944-P1952 HydrophobicContact CG-CG 4.03Å; M1948-P1952 WeakPolarHBondContact O-CD 3.26Å; V1949-P1952 HydrophobicContact CG2-CG 4.28Å; V1949-P1952 VanDerWaalsContact O-CD 3.29Å; V1949-P1952 WeakPolarHBondContact O-CD 3.4Å; V1949-P1952 WeakPolarHBondContact O-CG 3.37Å; P1952-H1955 PolarHBondContact O-N 3.17Å; P1952-R1956 PolarHBondContact O-N 3.4Å
1953V93.4Very high90Very high0 Ų026.1 Ų26.10%014%0.142CC..Hα-helixtrans-67.3-37.6176.5-179.50000111.4A1761 Y1762 A1765 V1949 L1951 H1955 R1956 V1957A1761-V1953 HydrophobicContact CB-CG2 4.29Å; Y1762-V1953 HydrophobicContact CD1-CG1 3.63Å; Y1762-V1953 HydrophobicContact CE1-CG1 3.9Å; Y1762-V1953 HydrophobicContact CG-CG1 4.06Å; A1765-V1953 HydrophobicContact CB-CB 3.96Å; A1765-V1953 HydrophobicContact CB-CG1 3.55Å; V1949-V1953 HydrophobicContact CG2-CG2 4.11Å; V1949-V1953 WeakPolarHBondContact O-CB 3.31Å; V1949-V1953 WeakPolarHBondContact O-CG2 3.41Å; V1949-V1953 PolarHBondContact O-N 3.45Å; L1951-V1953 VanDerWaalsContact C-N 3.27Å; L1951-V1953 PolarHBondContact O-N 3.31Å; V1953-H1955 VanDerWaalsContact C-N 3.33Å; V1953-H1955 PolarHBondContact O-N 3.49Å; V1953-R1956 PolarHBondContact O-N 2.95Å; V1953-R1956 VanDerWaalsContact O-N 3.12Å; V1953-V1957 HydrophobicContact CG1-CG2 4.31Å; V1953-V1957 WeakPolarHBondContact O-CG2 3.39Å; V1953-V1957 PolarHBondContact O-N 3.3Å
1954L94.7Very high90.2Very high2 Ų229 Ų291%0.0115%0.152CC..Hα-helixtrans-55.8-45.1171.8169.962.2000111.9A1765 L1768 R1769 L1862 W1950 L1951 V1957 A1958A1765-L1954 HydrophobicContact CB-CB 4.26Å; A1765-L1954 WeakPolarHBondContact O-CD1 3.32Å; L1768-L1954 HydrophobicContact CB-CD1 4.29Å; L1768-L1954 HydrophobicContact CB-CD2 4.29Å; R1769-L1954 HydrophobicContact CB-CD1 3.63Å; R1769-L1954 HydrophobicContact CG-CD1 4.34Å; L1862-L1954 HydrophobicContact CD2-CD2 3.92Å; W1950-L1954 WeakPolarHBondContact O-CB 3.37Å; W1950-L1954 PolarHBondContact O-N 3.04Å; L1951-L1954 HydrophobicContact CD1-CD2 4.33Å; L1951-L1954 WeakPolarHBondContact O-CB 3.48Å; L1951-L1954 PolarHBondContact O-N 3.48Å; L1954-V1957 PolarHBondContact O-N 3.31Å; L1954-A1958 WeakPolarHBondContact O-CB 3.43Å; L1954-A1958 PolarHBondContact O-N 2.71Å
1955H92.9Very high90.3Very high48 Ų4826.7 Ų26.722%0.22214%0.141CC..Hα-helixtrans-66-37176-78.3-117.3000112.3A1865 K1870 L1951 P1952 V1953 A1958 A1959A1865-H1955 PolarHBondContact O-CE1 3.35Å; A1865-H1955 VanDerWaalsContact O-CE1 3.29Å; K1870-H1955 PolarHBondContact NZ-NE2 3.13Å; L1951-H1955 PolarHBondContact O-CD2 2.83Å; L1951-H1955 VanDerWaalsContact O-CD2 3.32Å; L1951-H1955 PolarHBondContact O-N 3.3Å; P1952-H1955 PolarHBondContact O-N 3.17Å; V1953-H1955 VanDerWaalsContact C-N 3.33Å; V1953-H1955 PolarHBondContact O-N 3.49Å; H1955-A1958 PolarHBondContact O-N 3.01Å; H1955-A1959 PolarHBondContact O-N 3.31Å
1956R93.1Very high90.4Very high50 Ų5034.8 Ų34.819%0.18918%0.179CC..Hα-helixtrans-65.9-40.2173.3-69.1-160.2-70.2-86.713.4112.6E1944 P1952 V1953 A1959 A1960 F1980 E2014 C2016E1944-R1956 IonicContact OE1-CZ 3.77Å; E1944-R1956 IonicContact OE1-NH1 3.26Å; E1944-R1956 PolarHBondContact OE1-NH1 2.66Å; E1944-R1956 IonicContact OE1-NH2 2.71Å; E1944-R1956 IonicContact OE2-CZ 3.18Å; E1944-R1956 IonicContact OE2-NH1 3.48Å; E1944-R1956 PolarHBondContact OE2-NH1 3.07Å; E1944-R1956 IonicContact OE2-NH2 2.63Å; E1944-R1956 PolarHBondContact OE2-NH2 2.74Å; P1952-R1956 PolarHBondContact O-N 3.4Å; V1953-R1956 PolarHBondContact O-N 2.95Å; V1953-R1956 VanDerWaalsContact O-N 3.12Å; R1956-A1959 PolarHBondContact O-N 2.73Å; R1956-A1960 VanDerWaalsContact O-CB 3.31Å; R1956-A1960 WeakPolarHBondContact O-CB 3.29Å; R1956-A1960 PolarHBondContact O-N 3.29Å; R1956-F1980 HydrophobicContact CB-CE1 3.95Å; R1956-F1980 HydrophobicContact CB-CZ 3.94Å; R1956-F1980 WeakPolarHBondContact O-CZ 3.47Å; R1956-E2014 WeakPolarHBondContact CD-OE1 3.34Å; R1956-E2014 IonicContact NE-OE1 2.83Å; R1956-E2014 PolarHBondContact NE-OE1 2.82Å; R1956-C2016 HydrophobicContact CB-CB 4.4Å
1957V93.1Very high90.6Very high7 Ų733 Ų334%0.04217%0.172CC..Hα-helixtrans-60.9-49.1174.2171.90000109.9A1765 M1766 R1769 V1953 L1954 A1959 A1960 E1961 F1980A1765-V1957 HydrophobicContact CB-CG2 4.02Å; M1766-V1957 HydrophobicContact CG-CG1 4.07Å; M1766-V1957 HydrophobicContact CG-CG2 4.16Å; R1769-V1957 HydrophobicContact CB-CG1 4.21Å; R1769-V1957 HydrophobicContact CG-CG1 4.12Å; V1953-V1957 HydrophobicContact CG1-CG2 4.31Å; V1953-V1957 WeakPolarHBondContact O-CG2 3.39Å; V1953-V1957 PolarHBondContact O-N 3.3Å; L1954-V1957 PolarHBondContact O-N 3.31Å; V1957-A1959 VanDerWaalsContact C-N 3.33Å; V1957-A1959 PolarHBondContact O-N 2.96Å; V1957-A1960 PolarHBondContact O-N 2.98Å; V1957-A1960 VanDerWaalsContact O-N 3.13Å; V1957-E1961 WeakPolarHBondContact O-CG 3.47Å; V1957-E1961 PolarHBondContact O-N 3.17Å; V1957-F1980 HydrophobicContact CB-CE2 4.41Å; V1957-F1980 HydrophobicContact CG2-CE2 3.9Å; V1957-F1980 HydrophobicContact CG2-CZ 4.04Å
1958A92.1Very high90.8Very high28 Ų2838.7 Ų38.723%0.23120%0.196CC..Hα-helixtrans-59.6-39.5178.600000113.1L1954 H1955L1954-A1958 WeakPolarHBondContact O-CB 3.43Å; L1954-A1958 PolarHBondContact O-N 2.71Å; H1955-A1958 PolarHBondContact O-N 3.01Å
1959A89.8Confident91Very high38 Ų3838.3 Ų38.331%0.31420%0.195SC..Hα-helixtrans-66.2-43.9173.100000112.2H1955 R1956 V1957 E1961 T1962 C2016H1955-A1959 PolarHBondContact O-N 3.31Å; R1956-A1959 PolarHBondContact O-N 2.73Å; V1957-A1959 VanDerWaalsContact C-N 3.33Å; V1957-A1959 PolarHBondContact O-N 2.96Å; A1959-E1961 PolarHBondContact O-N 2.8Å; A1959-T1962 PolarHBondContact O-OG1 3.1Å; A1959-C2016 CarbonylContact C-O 3.58Å; A1959-C2016 HydrophobicContact CB-CB 4.42Å
1960A91.6Very high91.1Very high0 Ų040.4 Ų40.40%021%0.206CC..Hα-helixtrans-64.7-33.7-177.600000113.5R1956 V1957 T1962 A1963 G1979 F1980 C2016R1956-A1960 VanDerWaalsContact O-CB 3.31Å; R1956-A1960 WeakPolarHBondContact O-CB 3.29Å; R1956-A1960 PolarHBondContact O-N 3.29Å; V1957-A1960 PolarHBondContact O-N 2.98Å; V1957-A1960 VanDerWaalsContact O-N 3.13Å; A1960-T1962 PolarHBondContact O-N 2.91Å; A1960-A1963 WeakPolarHBondContact O-CB 3.46Å; A1960-A1963 PolarHBondContact O-N 3.37Å; A1960-G1979 VanDerWaalsContact O-CA 3.27Å; A1960-G1979 WeakPolarHBondContact O-CA 3.45Å; A1960-F1980 HydrophobicContact CB-CD1 3.96Å; A1960-F1980 HydrophobicContact CB-CD2 3.65Å; A1960-F1980 HydrophobicContact CB-CE1 4Å; A1960-F1980 HydrophobicContact CB-CE2 3.65Å; A1960-F1980 HydrophobicContact CB-CG 3.82Å; A1960-F1980 HydrophobicContact CB-CZ 3.85Å; A1960-C2016 VanDerWaalsContact CA-O 3.29Å; A1960-C2016 WeakPolarHBondContact CA-O 3.36Å; A1960-C2016 HydrophobicContact CB-CB 4.04Å; A1960-C2016 PolarHBondContact N-O 3.04Å
1961E88.8Confident91.1Very high73 Ų7342.1 Ų42.134%0.34122%0.215SC..THydrogen-bonded Turntrans-48.4-30.8-178.8-78.5176.6160.800114.6R1769 K1773 V1957 A1959R1769-E1961 WeakPolarHBondContact CG-OE1 3.31Å; R1769-E1961 IonicContact CZ-OE2 3.71Å; R1769-E1961 VanDerWaalsContact CZ-OE2 3.32Å; R1769-E1961 IonicContact NE-OE1 2.83Å; R1769-E1961 PolarHBondContact NE-OE1 3.21Å; R1769-E1961 IonicContact NE-OE2 3.3Å; R1769-E1961 PolarHBondContact NE-OE2 3.47Å; R1769-E1961 IonicContact NH2-OE2 3.13Å; R1769-E1961 PolarHBondContact NH2-OE2 3.2Å; K1773-E1961 IonicContact NZ-OE1 3.61Å; K1773-E1961 PolarHBondContact NZ-OE1 3.16Å; K1773-E1961 IonicContact NZ-OE2 3.77Å; K1773-E1961 PolarHBondContact NZ-OE2 3.42Å; V1957-E1961 WeakPolarHBondContact O-CG 3.47Å; V1957-E1961 PolarHBondContact O-N 3.17Å; A1959-E1961 PolarHBondContact O-N 2.8Å
1962T84.5Confident91.1Very high117 Ų11744.8 Ų44.872%0.71823%0.233SC*.THydrogen-bonded Turntrans-107.2-7.2-178.661.40000113.5A1959 A1960A1959-T1962 PolarHBondContact O-OG1 3.1Å; A1960-T1962 PolarHBondContact O-N 2.91Å
1963A89.1Confident91.2Very high0 Ų050.5 Ų50.50%026%0.257CS..  trans-72.5128.8-176.700000111.6A1960 I1978 G1979 C2016 P2018A1960-A1963 WeakPolarHBondContact O-CB 3.46Å; A1960-A1963 PolarHBondContact O-N 3.37Å; A1963-I1978 WeakPolarHBondContact O-CA 3.4Å; A1963-G1979 PolarHBondContact O-N 3.2Å; A1963-G1979 VanDerWaalsContact O-N 3.1Å; A1963-C2016 WeakPolarHBondContact CB-O 3.42Å; A1963-P2018 HydrophobicContact CB-CG 4.36Å
1964K90.2Very high91Very high135 Ų13555 Ų5559%0.58728%0.278SS*.EExtended strand (participates in β ladder)trans-119.8119.1174.2-62.7-175.3-178.1177.20109.4I1978K1964-I1978 HydrophobicContact CG-CG1 4.38Å
1965H88.6Confident90.6Very high2 Ų258.4 Ų58.41%0.00930%0.301CS..EExtended strand (participates in β ladder)trans-108.8126.3-179.2-59.2-96.5000110.3A1967 P1976 I1977 G1979 R1981 T2017 T2019H1965-A1967 PolarHBondContact O-N 3.47Å; H1965-P1976 CarbonylContact O-C 3.51Å; H1965-P1976 WeakPolarHBondContact O-CA 3.29Å; H1965-P1976 WeakPolarHBondContact O-CB 3.46Å; H1965-I1977 HydrophobicContact CB-CB 4.27Å; H1965-I1977 PolarHBondContact N-O 3.25Å; H1965-I1977 PolarHBondContact O-N 2.88Å; H1965-G1979 PolarHBondContact CD2-O 3.47Å; H1965-G1979 PolarHBondContact NE2-O 3Å; H1965-R1981 HydrophobicContact CB-CB 4.28Å; H1965-R1981 HydrophobicContact CB-CG 4.47Å; H1965-T2017 PolarHBondContact CE1-O 3.24Å; H1965-T2019 PolarHBondContact ND1-OG1 2.87Å
1966Q88.4Confident90.5Very high171 Ų17158.3 Ų58.380%0.79931%0.305SS*.SBendtrans-75.453.8175-61.7-64.6-6.400111.8
1967A87.9Confident90.5Very high10 Ų1055.9 Ų55.98%0.08330%0.296CS..  trans-128.7155.717900000109.4H1965 C1975 I1977H1965-A1967 PolarHBondContact O-N 3.47Å; A1967-C1975 PolarHBondContact O-SG 3.49Å; A1967-C1975 VanDerWaalsContact O-SG 3.4Å; A1967-I1977 HydrophobicContact CB-CD1 4.22Å; A1967-I1977 WeakPolarHBondContact O-CG1 3.46Å; A1967-I1977 PolarHBondContact O-N 2.95Å
1968K91.4Very high90.3Very high121 Ų12160 Ų6053%0.52632%0.316SS..  trans-108.5128.7179.5-179168.3-172.2166.90109.8N1970 K1973 E1974 C1975K1968-N1970 PolarHBondContact O-N 3.11Å; K1968-N1970 PolarHBondContact O-OD1 3.11Å; K1968-K1973 WeakPolarHBondContact CE-O 3.44Å; K1968-E1974 CarbonylContact C-O 3.58Å; K1968-E1974 WeakPolarHBondContact CA-O 3.2Å; K1968-C1975 HydrophobicContact CB-CB 3.97Å; K1968-C1975 HydrophobicContact CG-CB 4.05Å
1969C94.3Very high90.3Very high0 Ų058.8 Ų58.80%031%0.307CS..  trans-65.8125.7176.11790000110.9I1971 C1972 K1973 E1974 I1977 D1991 C1993C1969-I1971 PolarHBondContact O-N 3.42Å; C1969-I1971 VanDerWaalsContact O-N 3.15Å; C1969-I1971 PolarHBondContact SG-N 2.79Å; C1969-C1972 VanDerWaalsContact CB-SG 3.52Å; C1969-K1973 WeakPolarHBondContact O-CA 3.35Å; C1969-K1973 PolarHBondContact O-N 3.14Å; C1969-E1974 PolarHBondContact N-O 2.91Å; C1969-I1977 HydrophobicContact CB-CD1 4.19Å; C1969-I1977 HydrophobicContact CB-CG1 4.31Å; C1969-D1991 CarbonylContact C-O 3.53Å; C1969-C1993 HydrophobicContact CB-CB 4.12Å; C1969-C1993 PolarHBondContact SG-N 3.24Å; C1969-C1993 VanDerWaalsContact SG-N 3.43Å
1970N93.1Very high90.5Very high43 Ų4357 Ų5723%0.2329%0.292CS..THydrogen-bonded Turntrans-68.1-12.9178.6-68.162.8000113.2K1968 K1973 N1989 Y1990 D1991K1968-N1970 PolarHBondContact O-N 3.11Å; K1968-N1970 PolarHBondContact O-OD1 3.11Å; N1970-K1973 PolarHBondContact O-NZ 2.93Å; N1970-N1989 PolarHBondContact ND2-O 2.76Å; N1970-N1989 PolarHBondContact OD1-O 3.43Å; N1970-Y1990 HydrophobicContact CB-CD2 3.77Å; N1970-Y1990 HydrophobicContact CB-CE2 3.67Å; N1970-Y1990 HydrophobicContact CB-CG 4.25Å; N1970-Y1990 WeakPolarHBondContact OD1-CA 3.33Å; N1970-D1991 PolarHBondContact N-O 3.16Å; N1970-D1991 PolarHBondContact OD1-N 3.14Å; N1970-D1991 PolarHBondContact OD1-O 2.81Å; N1970-D1991 VanDerWaalsContact OD1-O 3.14Å
1971I91.5Very high90.4Very high36 Ų3657.3 Ų57.319%0.18529%0.293CS..THydrogen-bonded Turntrans-96.9-77.9179.9-51.5-170.1000110.7C1969 K1973 I1992 C1996 R2001 A2003C1969-I1971 PolarHBondContact O-N 3.42Å; C1969-I1971 VanDerWaalsContact O-N 3.15Å; C1969-I1971 PolarHBondContact SG-N 2.79Å; I1971-K1973 VanDerWaalsContact C-N 3.3Å; I1971-K1973 PolarHBondContact O-N 3.12Å; I1971-I1992 HydrophobicContact CD1-CD1 4.22Å; I1971-I1992 HydrophobicContact CD1-CG2 3.89Å; I1971-I1992 HydrophobicContact CG1-CG2 4.34Å; I1971-C1996 HydrophobicContact CB-CB 4.15Å; I1971-C1996 HydrophobicContact CD1-CB 4.27Å; I1971-C1996 HydrophobicContact CG2-CB 4.35Å; I1971-R2001 HydrophobicContact CD1-CB 4.37Å; I1971-R2001 WeakPolarHBondContact CD1-O 3.38Å; I1971-R2001 HydrophobicContact CG2-CB 4.11Å; I1971-A2003 HydrophobicContact CG1-CB 4.35Å
1972C93.1Very high90.5Very high56 Ų5654.1 Ų54.138%0.37828%0.278SS..THydrogen-bonded Turntrans-75.5-9.1-178.859.70000115C1969 E1974 C1993C1969-C1972 VanDerWaalsContact CB-SG 3.52Å; C1972-E1974 PolarHBondContact O-N 3.35Å; C1972-E1974 WeakPolarHBondContact SG-CB 3.3Å; C1972-E1974 PolarHBondContact SG-OE2 2.98Å; C1972-E1974 VanDerWaalsContact SG-OE2 3.39Å; C1972-C1993 PolarHBondContact SG-SG 3.24Å
1973K92.9Very high90.7Very high123 Ų12349.4 Ų49.454%0.53525%0.247SC..  trans66.95.7-177.9-46.9-51.1-174.1-175.20115.9K1968 C1969 N1970 I1971K1968-K1973 WeakPolarHBondContact CE-O 3.44Å; C1969-K1973 WeakPolarHBondContact O-CA 3.35Å; C1969-K1973 PolarHBondContact O-N 3.14Å; N1970-K1973 PolarHBondContact O-NZ 2.93Å; I1971-K1973 VanDerWaalsContact C-N 3.3Å; I1971-K1973 PolarHBondContact O-N 3.12Å
1974E89.4Confident90.6Very high94 Ų9449.5 Ų49.544%0.43925%0.248SC..  trans-56.3136.8171.7-169.6171-15600111.9K1968 C1969 C1972 C1993K1968-E1974 CarbonylContact C-O 3.58Å; K1968-E1974 WeakPolarHBondContact CA-O 3.2Å; C1969-E1974 PolarHBondContact N-O 2.91Å; C1972-E1974 PolarHBondContact O-N 3.35Å; C1972-E1974 WeakPolarHBondContact SG-CB 3.3Å; C1972-E1974 PolarHBondContact SG-OE2 2.98Å; C1972-E1974 VanDerWaalsContact SG-OE2 3.39Å; E1974-C1993 PolarHBondContact OE2-SG 3.37Å
1975C87.3Confident90.3Very high74 Ų7444 Ų4450%0.522%0.224SC..SBendtrans-161.3131.4-176.1-169.40000109.3A1967 K1968A1967-C1975 PolarHBondContact O-SG 3.49Å; A1967-C1975 VanDerWaalsContact O-SG 3.4Å; K1968-C1975 HydrophobicContact CB-CB 3.97Å; K1968-C1975 HydrophobicContact CG-CB 4.05Å
1976P91.6Very high89.9Confident46 Ų4647 Ų4730%0.29924%0.238SC..SBendcis-62.8156.9-8.128.8-35.6000111.9H1965 I1978H1965-P1976 CarbonylContact O-C 3.51Å; H1965-P1976 WeakPolarHBondContact O-CA 3.29Å; H1965-P1976 WeakPolarHBondContact O-CB 3.46Å; P1976-I1978 PolarHBondContact O-N 3.34Å
1977I91.7Very high89.5Confident0 Ų041.4 Ų41.40%021%0.212CC..EExtended strand (participates in β ladder)trans-74.4125.3168.9-68.8171.3000107.8H1965 A1967 C1969 R1981 D1991 C1993H1965-I1977 HydrophobicContact CB-CB 4.27Å; H1965-I1977 PolarHBondContact N-O 3.25Å; H1965-I1977 PolarHBondContact O-N 2.88Å; A1967-I1977 HydrophobicContact CB-CD1 4.22Å; A1967-I1977 WeakPolarHBondContact O-CG1 3.46Å; A1967-I1977 PolarHBondContact O-N 2.95Å; C1969-I1977 HydrophobicContact CB-CD1 4.19Å; C1969-I1977 HydrophobicContact CB-CG1 4.31Å; I1977-R1981 HydrophobicContact CD1-CG 4.41Å; I1977-R1981 HydrophobicContact CG2-CB 4.31Å; I1977-D1991 HydrophobicContact CD1-CB 4.21Å; I1977-C1993 HydrophobicContact CB-CB 4.48Å; I1977-C1993 HydrophobicContact CD1-CB 4.37Å; I1977-C1993 HydrophobicContact CG1-CB 4.03Å; I1977-C1993 HydrophobicContact CG2-CB 3.83Å
1978I88.7Confident89.2Confident92 Ų9246.4 Ų46.447%0.47223%0.232SC..EExtended strand (participates in β ladder)trans-108.4141.3173.3-52.3179.3000107.5A1963 K1964 P1976A1963-I1978 WeakPolarHBondContact O-CA 3.4Å; K1964-I1978 HydrophobicContact CG-CG1 4.38Å; P1976-I1978 PolarHBondContact O-N 3.34Å
1979G92.6Very high88.7Confident3 Ų344.5 Ų44.53%0.03123%0.227CC..SBendtrans82.3-158.7-168.200000111.9A1960 A1963 H1965 R1981A1960-G1979 VanDerWaalsContact O-CA 3.27Å; A1960-G1979 WeakPolarHBondContact O-CA 3.45Å; A1963-G1979 PolarHBondContact O-N 3.2Å; A1963-G1979 VanDerWaalsContact O-N 3.1Å; H1965-G1979 PolarHBondContact CD2-O 3.47Å; H1965-G1979 PolarHBondContact NE2-O 3Å; G1979-R1981 PolarHBondContact O-N 3.43Å
1980F93.2Very high88.4Confident1 Ų145.5 Ų45.50%0.00423%0.231CC..PPolyproline II helixtrans-59.1133.5-179.3-69.2-85.5000113.4Y1762 R1956 V1957 A1960 Y1982 Q1994 F1998 E2014 Y2015 C2016Y1762-F1980 HydrophobicContact CD1-CE2 4.42Å; Y1762-F1980 HydrophobicContact CD1-CZ 4.4Å; Y1762-F1980 HydrophobicContact CE1-CE1 4.43Å; Y1762-F1980 HydrophobicContact CE1-CE2 4.47Å; Y1762-F1980 HydrophobicContact CE1-CZ 4.12Å; R1956-F1980 HydrophobicContact CB-CE1 3.95Å; R1956-F1980 HydrophobicContact CB-CZ 3.94Å; R1956-F1980 WeakPolarHBondContact O-CZ 3.47Å; V1957-F1980 HydrophobicContact CB-CE2 4.41Å; V1957-F1980 HydrophobicContact CG2-CE2 3.9Å; V1957-F1980 HydrophobicContact CG2-CZ 4.04Å; A1960-F1980 HydrophobicContact CB-CD1 3.96Å; A1960-F1980 HydrophobicContact CB-CD2 3.65Å; A1960-F1980 HydrophobicContact CB-CE1 4Å; A1960-F1980 HydrophobicContact CB-CE2 3.65Å; A1960-F1980 HydrophobicContact CB-CG 3.82Å; A1960-F1980 HydrophobicContact CB-CZ 3.85Å; F1980-Y1982 HydrophobicContact CB-CD2 4.2Å; F1980-Y1982 HydrophobicContact CB-CE2 3.43Å; F1980-Y1982 VanDerWaalsContact CB-CE2 3.43Å; F1980-Y1982 HydrophobicContact CG-CE2 4.23Å; F1980-Y1982 WeakPolarHBondContact CG-OH 3.47Å; F1980-Q1994 HydrophobicContact CB-CB 4.15Å; F1980-Q1994 HydrophobicContact CB-CG 4.48Å; F1980-Q1994 HydrophobicContact CD2-CG 4.09Å; F1980-Q1994 PolarHBondContact O-N 3.4Å; F1980-F1998 AromaticContact CD2-CZ 3.87Å; F1980-F1998 HydrophobicContact CD2-CZ 3.87Å; F1980-F1998 HydrophobicContact CE2-CZ 4.02Å; F1980-E2014 VanDerWaalsContact CD1-CD 3.47Å; F1980-E2014 HydrophobicContact CD1-CG 3.59Å; F1980-E2014 WeakPolarHBondContact CD1-OE2 3.37Å; F1980-E2014 HydrophobicContact CE1-CG 3.91Å; F1980-E2014 WeakPolarHBondContact CE1-OE2 3.44Å; F1980-Y2015 WeakPolarHBondContact CA-O 3.42Å; F1980-C2016 HydrophobicContact CD1-CB 3.9Å; F1980-C2016 HydrophobicContact CE1-CB 3.65Å
1981R91.1Very high88.3Confident7 Ų743.8 Ų43.83%0.02622%0.222CC..EExtended strand (participates in β ladder)trans-103.8117.3167.1177.9-163.7-173.9-176.62.8109.6H1965 I1977 G1979 R1983 D1991 Y2015 T2019 D2024H1965-R1981 HydrophobicContact CB-CB 4.28Å; H1965-R1981 HydrophobicContact CB-CG 4.47Å; I1977-R1981 HydrophobicContact CD1-CG 4.41Å; I1977-R1981 HydrophobicContact CG2-CB 4.31Å; G1979-R1981 PolarHBondContact O-N 3.43Å; R1981-R1983 VanDerWaalsContact NH2-NE 3.13Å; R1981-R1983 VanDerWaalsContact NH2-NH2 3.11Å; R1981-D1991 IonicContact CZ-OD1 3.34Å; R1981-D1991 VanDerWaalsContact CZ-OD1 3.27Å; R1981-D1991 IonicContact NE-OD1 3.99Å; R1981-D1991 PolarHBondContact NE-OD1 3.36Å; R1981-D1991 IonicContact NH2-OD1 3.13Å; R1981-D1991 PolarHBondContact NH2-OD1 3.09Å; R1981-D1991 IonicContact NH2-OD2 3.36Å; R1981-Y2015 PolarHBondContact N-O 3.49Å; R1981-Y2015 PolarHBondContact O-N 2.89Å; R1981-T2019 PolarHBondContact NH1-OG1 3.32Å; R1981-D2024 IonicContact CZ-OD1 3.63Å; R1981-D2024 IonicContact NH1-OD1 3.69Å; R1981-D2024 PolarHBondContact NH1-OD1 3.21Å; R1981-D2024 VanDerWaalsContact NH1-OD1 3.13Å; R1981-D2024 IonicContact NH1-OD2 2.83Å; R1981-D2024 PolarHBondContact NH1-OD2 2.7Å; R1981-D2024 IonicContact NH2-OD1 2.7Å; R1981-D2024 PolarHBondContact NH2-OD1 2.89Å; R1981-D2024 IonicContact NH2-OD2 3.18Å
1982Y91Very high88.4Confident5 Ų542 Ų422%0.0221%0.213CC..EExtended strand (participates in β ladder)trans-102.4116.9174-62.9-81.4000111.1F1980 D1991 I1992 F1997 F1998 M2012 V2013 E2014F1980-Y1982 HydrophobicContact CB-CD2 4.2Å; F1980-Y1982 HydrophobicContact CB-CE2 3.43Å; F1980-Y1982 VanDerWaalsContact CB-CE2 3.43Å; F1980-Y1982 HydrophobicContact CG-CE2 4.23Å; F1980-Y1982 WeakPolarHBondContact CG-OH 3.47Å; Y1982-D1991 CarbonylContact O-C 3.42Å; Y1982-D1991 WeakPolarHBondContact O-CA 3.21Å; Y1982-I1992 PolarHBondContact N-O 3.15Å; Y1982-I1992 PolarHBondContact O-N 3.46Å; Y1982-F1997 HydrophobicContact CD1-CD1 4.07Å; Y1982-F1997 HydrophobicContact CD1-CD2 4.34Å; Y1982-F1997 HydrophobicContact CD1-CE1 4.08Å; Y1982-F1997 HydrophobicContact CD1-CE2 4.34Å; Y1982-F1997 HydrophobicContact CD1-CG 4.2Å; Y1982-F1997 HydrophobicContact CD1-CZ 4.21Å; Y1982-F1997 HydrophobicContact CD2-CB 3.43Å; Y1982-F1997 VanDerWaalsContact CD2-CB 3.43Å; Y1982-F1997 AromaticContact CD2-CD1 3.71Å; Y1982-F1997 HydrophobicContact CD2-CD1 3.71Å; Y1982-F1997 HydrophobicContact CD2-CD2 4.18Å; Y1982-F1997 AromaticContact CD2-CG 3.51Å; Y1982-F1997 HydrophobicContact CD2-CG 3.51Å; Y1982-F1997 AromaticContact CE1-CD1 3.67Å; Y1982-F1997 HydrophobicContact CE1-CD1 3.67Å; Y1982-F1997 AromaticContact CE1-CE1 3.56Å; Y1982-F1997 HydrophobicContact CE1-CE1 3.56Å; Y1982-F1997 HydrophobicContact CE1-CG 4.26Å; Y1982-F1997 HydrophobicContact CE1-CZ 4.07Å; Y1982-F1997 HydrophobicContact CE2-CB 3.61Å; Y1982-F1997 AromaticContact CE2-CD1 3.25Å; Y1982-F1997 HydrophobicContact CE2-CD1 3.25Å; Y1982-F1997 HydrophobicContact CE2-CE1 4.04Å; Y1982-F1997 AromaticContact CE2-CG 3.56Å; Y1982-F1997 HydrophobicContact CE2-CG 3.56Å; Y1982-F1997 HydrophobicContact CG-CB 4.18Å; Y1982-F1997 HydrophobicContact CG-CD1 4.1Å; Y1982-F1997 HydrophobicContact CG-CD2 4.07Å; Y1982-F1997 AromaticContact CG-CG 3.85Å; Y1982-F1997 HydrophobicContact CG-CG 3.85Å; Y1982-F1997 AromaticContact CZ-CD1 3.26Å; Y1982-F1997 AromaticContact CZ-CE1 3.56Å; Y1982-F1997 AromaticContact CZ-CG 3.97Å; Y1982-F1998 HydrophobicContact CE2-CE1 4.46Å; Y1982-F1998 WeakPolarHBondContact OH-CE1 3.49Å; Y1982-M2012 HydrophobicContact CG-CE 4.23Å; Y1982-V2013 WeakPolarHBondContact CA-O 3.28Å; Y1982-E2014 HydrophobicContact CD1-CB 4.09Å; Y1982-E2014 HydrophobicContact CD1-CG 4.43Å; Y1982-E2014 HydrophobicContact CE1-CB 3.77Å; Y1982-E2014 HydrophobicContact CE1-CG 3.78Å; Y1982-E2014 WeakPolarHBondContact CE1-OE2 3.42Å; Y1982-E2014 PolarHBondContact OH-OE2 3.03Å
1983R88.3Confident88.3Confident19 Ų1939.5 Ų39.57%0.07220%0.196CC..EExtended strand (participates in β ladder)trans-109126.8-176.8171.4155.5-87-136.3-22111.1R1981 L1985 N1989 D1991 M2012 V2013 Y2015 D2024R1981-R1983 VanDerWaalsContact NH2-NE 3.13Å; R1981-R1983 VanDerWaalsContact NH2-NH2 3.11Å; R1983-L1985 PolarHBondContact O-N 3.35Å; R1983-N1989 PolarHBondContact NH2-OD1 2.93Å; R1983-D1991 IonicContact CZ-OD1 3.28Å; R1983-D1991 IonicContact CZ-OD2 3.48Å; R1983-D1991 IonicContact NE-OD1 3.56Å; R1983-D1991 PolarHBondContact NE-OD1 2.82Å; R1983-D1991 IonicContact NE-OD2 3.8Å; R1983-D1991 PolarHBondContact NE-OD2 3.29Å; R1983-D1991 IonicContact NH2-OD1 3.69Å; R1983-D1991 PolarHBondContact NH2-OD1 3.04Å; R1983-D1991 IonicContact NH2-OD2 3.53Å; R1983-D1991 PolarHBondContact NH2-OD2 2.91Å; R1983-M2012 CarbonylContact O-C 3.59Å; R1983-M2012 VanDerWaalsContact O-CA 3.23Å; R1983-M2012 WeakPolarHBondContact O-CA 3.31Å; R1983-V2013 PolarHBondContact N-O 3.09Å; R1983-V2013 PolarHBondContact O-N 3.02Å; R1983-Y2015 HydrophobicContact CB-CE2 4.2Å; R1983-D2024 IonicContact CZ-OD1 2.69Å; R1983-D2024 IonicContact NE-OD1 2.72Å; R1983-D2024 VanDerWaalsContact NH1-CG 3.31Å; R1983-D2024 IonicContact NH1-OD1 3.67Å; R1983-D2024 PolarHBondContact NH1-OD1 3.08Å; R1983-D2024 IonicContact NH1-OD2 2.7Å
1984S86.1Confident88.3Confident1 Ų135.4 Ų35.41%0.00718%0.178CC..EExtended strand (participates in β ladder)trans-72.8122.8178.6-174.50000111.8K1986 H1987 Y1990 H2006 V2031S1984-K1986 PolarHBondContact O-N 3.43Å; S1984-K1986 VanDerWaalsContact O-N 3.13Å; S1984-K1986 PolarHBondContact OG-N 3.47Å; S1984-H1987 PolarHBondContact OG-N 2.83Å; S1984-Y1990 PolarHBondContact N-O 3.29Å; S1984-H2006 PolarHBondContact OG-CE1 3.29Å; S1984-V2031 WeakPolarHBondContact O-CG2 3.26Å
1985L84Confident88.3Confident19 Ų1934.5 Ų34.510%0.09918%0.182CC..SBendtrans-80.821.8170.2-60.1-173.2000113.9R1983 P2011 V2013 D2027 K2030 N2034R1983-L1985 PolarHBondContact O-N 3.35Å; L1985-P2011 HydrophobicContact CB-CB 4.28Å; L1985-P2011 PolarHBondContact N-O 3.35Å; L1985-V2013 HydrophobicContact CD1-CG2 3.61Å; L1985-V2013 HydrophobicContact CD2-CG2 3.68Å; L1985-V2013 HydrophobicContact CG-CG2 3.69Å; L1985-D2027 HydrophobicContact CD2-CB 4.08Å; L1985-D2027 WeakPolarHBondContact CD2-OD2 3.15Å; L1985-K2030 HydrophobicContact CD1-CB 4.24Å; L1985-K2030 HydrophobicContact CD1-CD 3.75Å; L1985-K2030 HydrophobicContact CD2-CB 3.88Å; L1985-K2030 HydrophobicContact CD2-CD 3.86Å; L1985-K2030 HydrophobicContact CG-CD 4.47Å; L1985-N2034 WeakPolarHBondContact CB-ND2 3.41Å; L1985-N2034 VanDerWaalsContact O-CB 3.23Å; L1985-N2034 WeakPolarHBondContact O-CB 3.44Å; L1985-N2034 PolarHBondContact O-ND2 3.29Å
1986K80.5Confident88.5Confident67 Ų6731.1 Ų31.129%0.29116%0.16SC..SBendtrans-130.3-42177.6-168.8-171.2178.8-172.30111.7S1984 Y2010S1984-K1986 PolarHBondContact O-N 3.43Å; S1984-K1986 VanDerWaalsContact O-N 3.13Å; S1984-K1986 PolarHBondContact OG-N 3.47Å; K1986-Y2010 HydrophobicContact CD-CD1 3.91Å; K1986-Y2010 HydrophobicContact CD-CD2 3.64Å; K1986-Y2010 HydrophobicContact CD-CE1 4.17Å; K1986-Y2010 HydrophobicContact CD-CE2 3.89Å; K1986-Y2010 HydrophobicContact CD-CG 3.66Å; K1986-Y2010 VanDerWaalsContact NZ-CE1 3.26Å; K1986-Y2010 PolarHBondContact NZ-OH 3.24Å
1987H80Confident88.3Confident53 Ų5330.1 Ų30.125%0.24515%0.151CC..SBendtrans-104.2119.1179-61.3171.3000109.2S1984 N1989 Y1990 G2005 H2006 Y2010S1984-H1987 PolarHBondContact OG-N 2.83Å; H1987-N1989 PolarHBondContact O-N 2.73Å; H1987-Y1990 HydrophobicContact CB-CG 4.17Å; H1987-Y1990 WeakPolarHBondContact O-CB 3.41Å; H1987-Y1990 PolarHBondContact O-N 3.1Å; H1987-G2005 PolarHBondContact CE1-O 3.4Å; H1987-H2006 AromaticContact CE1-ND1 3.87Å; H1987-H2006 AromaticContact ND1-CG 3.98Å; H1987-H2006 AromaticContact ND1-ND1 3.36Å; H1987-H2006 PolarHBondContact ND1-ND1 2.94Å; H1987-Y2010 AromaticContact CE1-CD2 3.85Å; H1987-Y2010 AromaticContact CE1-CE2 3.66Å; H1987-Y2010 AromaticContact NE2-CD2 3.96Å; H1987-Y2010 AromaticContact NE2-CE2 3.73Å
1988F80.7Confident88.2Confident115 Ų11530.6 Ų30.650%0.50415%0.153SC..THydrogen-bonded Turntrans-60.7134.1178.8176-109.7000110.9Y1990 F2028 V2031F1988-Y1990 PolarHBondContact O-N 3.42Å; F1988-F2028 AromaticContact CD2-CD2 3.7Å; F1988-F2028 HydrophobicContact CD2-CD2 3.7Å; F1988-F2028 AromaticContact CD2-CE2 3.97Å; F1988-F2028 HydrophobicContact CD2-CE2 3.97Å; F1988-F2028 AromaticContact CE2-CD2 3.49Å; F1988-F2028 HydrophobicContact CE2-CD2 3.49Å; F1988-F2028 VanDerWaalsContact CE2-CD2 3.49Å; F1988-F2028 AromaticContact CE2-CE2 3.73Å; F1988-F2028 HydrophobicContact CE2-CE2 3.73Å; F1988-V2031 HydrophobicContact CB-CG1 4.39Å
1989N81.4Confident88Confident81 Ų8128.5 Ų28.543%0.43315%0.146SC..THydrogen-bonded Turntrans45.846.1-176.6-70.2-13.2000113.4N1970 R1983 H1987N1970-N1989 PolarHBondContact ND2-O 2.76Å; N1970-N1989 PolarHBondContact OD1-O 3.43Å; R1983-N1989 PolarHBondContact NH2-OD1 2.93Å; H1987-N1989 PolarHBondContact O-N 2.73Å
1990Y88.7Confident87.5Confident20 Ų2029 Ų298%0.07815%0.151CC..  trans-110.299.9169.2-168.3-80000109.2N1970 S1984 H1987 F1988 I1992 A2003 H2006N1970-Y1990 HydrophobicContact CB-CD2 3.77Å; N1970-Y1990 HydrophobicContact CB-CE2 3.67Å; N1970-Y1990 HydrophobicContact CB-CG 4.25Å; N1970-Y1990 WeakPolarHBondContact OD1-CA 3.33Å; S1984-Y1990 PolarHBondContact N-O 3.29Å; H1987-Y1990 HydrophobicContact CB-CG 4.17Å; H1987-Y1990 WeakPolarHBondContact O-CB 3.41Å; H1987-Y1990 PolarHBondContact O-N 3.1Å; F1988-Y1990 PolarHBondContact O-N 3.42Å; Y1990-I1992 HydrophobicContact CD1-CD1 4.45Å; Y1990-I1992 HydrophobicContact CD1-CG1 4.17Å; Y1990-I1992 HydrophobicContact CE1-CD1 3.7Å; Y1990-I1992 HydrophobicContact CE1-CG1 3.69Å; Y1990-A2003 HydrophobicContact CE2-CB 4.27Å; Y1990-A2003 WeakPolarHBondContact OH-CB 3.42Å; Y1990-A2003 PolarHBondContact OH-N 2.83Å; Y1990-H2006 AromaticContact CD1-CE1 3.91Å; Y1990-H2006 AromaticContact CD1-ND1 3.71Å; Y1990-H2006 HydrophobicContact CE1-CB 3.96Å; Y1990-H2006 AromaticContact CE1-CD2 3.6Å; Y1990-H2006 AromaticContact CE1-CE1 3.85Å; Y1990-H2006 AromaticContact CE1-CG 3.45Å; Y1990-H2006 VanDerWaalsContact CE1-CG 3.45Å; Y1990-H2006 AromaticContact CE1-ND1 3.62Å; Y1990-H2006 AromaticContact CE1-NE2 3.87Å; Y1990-H2006 HydrophobicContact CE2-CB 3.89Å; Y1990-H2006 AromaticContact CZ-CD2 3.96Å; Y1990-H2006 AromaticContact CZ-CG 3.6Å
1991D91.3Very high87.1Confident7 Ų736.2 Ų36.24%0.03718%0.178CC..EExtended strand (participates in β ladder)trans-112144.1-177.5-64.3-93.2000110.2C1969 N1970 I1977 R1981 Y1982 R1983C1969-D1991 CarbonylContact C-O 3.53Å; N1970-D1991 PolarHBondContact N-O 3.16Å; N1970-D1991 PolarHBondContact OD1-N 3.14Å; N1970-D1991 PolarHBondContact OD1-O 2.81Å; N1970-D1991 VanDerWaalsContact OD1-O 3.14Å; I1977-D1991 HydrophobicContact CD1-CB 4.21Å; R1981-D1991 IonicContact CZ-OD1 3.34Å; R1981-D1991 VanDerWaalsContact CZ-OD1 3.27Å; R1981-D1991 IonicContact NE-OD1 3.99Å; R1981-D1991 PolarHBondContact NE-OD1 3.36Å; R1981-D1991 IonicContact NH2-OD1 3.13Å; R1981-D1991 PolarHBondContact NH2-OD1 3.09Å; R1981-D1991 IonicContact NH2-OD2 3.36Å; Y1982-D1991 CarbonylContact O-C 3.42Å; Y1982-D1991 WeakPolarHBondContact O-CA 3.21Å; R1983-D1991 IonicContact CZ-OD1 3.28Å; R1983-D1991 IonicContact CZ-OD2 3.48Å; R1983-D1991 IonicContact NE-OD1 3.56Å; R1983-D1991 PolarHBondContact NE-OD1 2.82Å; R1983-D1991 IonicContact NE-OD2 3.8Å; R1983-D1991 PolarHBondContact NE-OD2 3.29Å; R1983-D1991 IonicContact NH2-OD1 3.69Å; R1983-D1991 PolarHBondContact NH2-OD1 3.04Å; R1983-D1991 IonicContact NH2-OD2 3.53Å; R1983-D1991 PolarHBondContact NH2-OD2 2.91Å
1992I92.1Very high86.6Confident0 Ų039.5 Ų39.50%020%0.199CC..EExtended strand (participates in β ladder)trans-128.6132.7178.9-40.4-176.4000108.7I1971 Y1982 Y1990 C1996 F1997 M2008 M2012I1971-I1992 HydrophobicContact CD1-CD1 4.22Å; I1971-I1992 HydrophobicContact CD1-CG2 3.89Å; I1971-I1992 HydrophobicContact CG1-CG2 4.34Å; Y1982-I1992 PolarHBondContact N-O 3.15Å; Y1982-I1992 PolarHBondContact O-N 3.46Å; Y1990-I1992 HydrophobicContact CD1-CD1 4.45Å; Y1990-I1992 HydrophobicContact CD1-CG1 4.17Å; Y1990-I1992 HydrophobicContact CE1-CD1 3.7Å; Y1990-I1992 HydrophobicContact CE1-CG1 3.69Å; I1992-C1996 HydrophobicContact CG2-CB 3.47Å; I1992-C1996 VanDerWaalsContact CG2-CB 3.47Å; I1992-F1997 HydrophobicContact CG2-CB 4.27Å; I1992-M2008 HydrophobicContact CD1-CE 3.47Å; I1992-M2008 VanDerWaalsContact CD1-CE 3.47Å; I1992-M2012 HydrophobicContact CD1-CE 3.57Å; I1992-M2012 HydrophobicContact CD1-SD 3.9Å; I1992-M2012 HydrophobicContact CG1-CE 4.31Å; I1992-M2012 HydrophobicContact CG1-SD 4.41Å
1993C92.4Very high86.1Confident2 Ų240.7 Ų40.71%0.01421%0.21CC..EExtended strand (participates in β ladder)trans-75.5157.1171.468.60000111.2C1969 C1972 E1974 I1977 S1995 C1996 F1997C1969-C1993 HydrophobicContact CB-CB 4.12Å; C1969-C1993 PolarHBondContact SG-N 3.24Å; C1969-C1993 VanDerWaalsContact SG-N 3.43Å; C1972-C1993 PolarHBondContact SG-SG 3.24Å; E1974-C1993 PolarHBondContact OE2-SG 3.37Å; I1977-C1993 HydrophobicContact CB-CB 4.48Å; I1977-C1993 HydrophobicContact CD1-CB 4.37Å; I1977-C1993 HydrophobicContact CG1-CB 4.03Å; I1977-C1993 HydrophobicContact CG2-CB 3.83Å; C1993-S1995 VanDerWaalsContact C-N 3.32Å; C1993-S1995 PolarHBondContact O-N 3.33Å; C1993-C1996 PolarHBondContact O-N 2.99Å; C1993-C1996 VanDerWaalsContact O-N 3.11Å; C1993-F1997 PolarHBondContact O-N 2.92Å
1994Q91.7Very high85.6Confident37 Ų3750.2 Ų50.217%0.17325%0.251CS..Hα-helixtrans-36.5-58.2170.7-175.8175.3-49.600113.4F1980 C1996 F1997 F1998F1980-Q1994 HydrophobicContact CB-CB 4.15Å; F1980-Q1994 HydrophobicContact CB-CG 4.48Å; F1980-Q1994 HydrophobicContact CD2-CG 4.09Å; F1980-Q1994 PolarHBondContact O-N 3.4Å; Q1994-C1996 VanDerWaalsContact C-N 3.33Å; Q1994-C1996 PolarHBondContact O-N 3.32Å; Q1994-F1997 PolarHBondContact O-N 2.85Å; Q1994-F1997 VanDerWaalsContact O-N 3.1Å; Q1994-F1998 HydrophobicContact CG-CD2 3.64Å; Q1994-F1998 HydrophobicContact CG-CE1 4.49Å; Q1994-F1998 HydrophobicContact CG-CE2 3.28Å; Q1994-F1998 HydrophobicContact CG-CG 4.38Å; Q1994-F1998 HydrophobicContact CG-CZ 3.76Å; Q1994-F1998 WeakPolarHBondContact O-CB 3.43Å; Q1994-F1998 WeakPolarHBondContact O-CG 3.38Å; Q1994-F1998 PolarHBondContact O-N 3.05Å
1995S89.4Confident85Confident75 Ų7553.3 Ų53.352%0.52428%0.284SS..Hα-helixtrans-60.3-38.7-175.2-48.40000113.2C1993 S1999C1993-S1995 VanDerWaalsContact C-N 3.32Å; C1993-S1995 PolarHBondContact O-N 3.33Å; S1995-S1999 WeakPolarHBondContact O-CB 3.49Å; S1995-S1999 PolarHBondContact O-N 3.45Å; S1995-S1999 PolarHBondContact O-OG 2.94Å
1996C91.1Very high84.7Confident3 Ų352.8 Ų52.82%0.0228%0.281CS..Hα-helixtrans-75.3-32.5176.8-75.70000112.9I1971 I1992 C1993 Q1994 S1999 G2000 R2001I1971-C1996 HydrophobicContact CB-CB 4.15Å; I1971-C1996 HydrophobicContact CD1-CB 4.27Å; I1971-C1996 HydrophobicContact CG2-CB 4.35Å; I1992-C1996 HydrophobicContact CG2-CB 3.47Å; I1992-C1996 VanDerWaalsContact CG2-CB 3.47Å; C1993-C1996 PolarHBondContact O-N 2.99Å; C1993-C1996 VanDerWaalsContact O-N 3.11Å; Q1994-C1996 VanDerWaalsContact C-N 3.33Å; Q1994-C1996 PolarHBondContact O-N 3.32Å; C1996-S1999 PolarHBondContact O-OG 3.37Å; C1996-G2000 PolarHBondContact O-N 2.94Å; C1996-R2001 PolarHBondContact O-N 3.41Å
1997F89.3Confident84.4Confident26 Ų2655.2 Ų55.211%0.11429%0.291CS..Hα-helixtrans-72.8-48.4176.9-177.3-107.2000111.7F1759 Y1982 I1992 C1993 Q1994 S1999 G2000 M2008 M2012F1759-F1997 HydrophobicContact CD2-CD1 4.34Å; F1759-F1997 AromaticContact CD2-CE1 3.93Å; F1759-F1997 HydrophobicContact CD2-CE1 3.93Å; F1759-F1997 HydrophobicContact CD2-CZ 4.39Å; F1759-F1997 AromaticContact CE2-CD1 3.99Å; F1759-F1997 HydrophobicContact CE2-CD1 3.99Å; F1759-F1997 HydrophobicContact CE2-CD2 4.49Å; F1759-F1997 AromaticContact CE2-CE1 3.61Å; F1759-F1997 HydrophobicContact CE2-CE1 3.61Å; F1759-F1997 HydrophobicContact CE2-CE2 4.16Å; F1759-F1997 HydrophobicContact CE2-CG 4.42Å; F1759-F1997 AromaticContact CE2-CZ 3.7Å; F1759-F1997 HydrophobicContact CE2-CZ 3.7Å; F1759-F1997 WeakPolarHBondContact CE2-O 3.42Å; F1759-F1997 HydrophobicContact CZ-CE1 4.38Å; F1759-F1997 HydrophobicContact CZ-CE2 4.38Å; F1759-F1997 HydrophobicContact CZ-CZ 4.04Å; Y1982-F1997 HydrophobicContact CD1-CD1 4.07Å; Y1982-F1997 HydrophobicContact CD1-CD2 4.34Å; Y1982-F1997 HydrophobicContact CD1-CE1 4.08Å; Y1982-F1997 HydrophobicContact CD1-CE2 4.34Å; Y1982-F1997 HydrophobicContact CD1-CG 4.2Å; Y1982-F1997 HydrophobicContact CD1-CZ 4.21Å; Y1982-F1997 HydrophobicContact CD2-CB 3.43Å; Y1982-F1997 VanDerWaalsContact CD2-CB 3.43Å; Y1982-F1997 AromaticContact CD2-CD1 3.71Å; Y1982-F1997 HydrophobicContact CD2-CD1 3.71Å; Y1982-F1997 HydrophobicContact CD2-CD2 4.18Å; Y1982-F1997 AromaticContact CD2-CG 3.51Å; Y1982-F1997 HydrophobicContact CD2-CG 3.51Å; Y1982-F1997 AromaticContact CE1-CD1 3.67Å; Y1982-F1997 HydrophobicContact CE1-CD1 3.67Å; Y1982-F1997 AromaticContact CE1-CE1 3.56Å; Y1982-F1997 HydrophobicContact CE1-CE1 3.56Å; Y1982-F1997 HydrophobicContact CE1-CG 4.26Å; Y1982-F1997 HydrophobicContact CE1-CZ 4.07Å; Y1982-F1997 HydrophobicContact CE2-CB 3.61Å; Y1982-F1997 AromaticContact CE2-CD1 3.25Å; Y1982-F1997 HydrophobicContact CE2-CD1 3.25Å; Y1982-F1997 HydrophobicContact CE2-CE1 4.04Å; Y1982-F1997 AromaticContact CE2-CG 3.56Å; Y1982-F1997 HydrophobicContact CE2-CG 3.56Å; Y1982-F1997 HydrophobicContact CG-CB 4.18Å; Y1982-F1997 HydrophobicContact CG-CD1 4.1Å; Y1982-F1997 HydrophobicContact CG-CD2 4.07Å; Y1982-F1997 AromaticContact CG-CG 3.85Å; Y1982-F1997 HydrophobicContact CG-CG 3.85Å; Y1982-F1997 AromaticContact CZ-CD1 3.26Å; Y1982-F1997 AromaticContact CZ-CE1 3.56Å; Y1982-F1997 AromaticContact CZ-CG 3.97Å; I1992-F1997 HydrophobicContact CG2-CB 4.27Å; C1993-F1997 PolarHBondContact O-N 2.92Å; Q1994-F1997 PolarHBondContact O-N 2.85Å; Q1994-F1997 VanDerWaalsContact O-N 3.1Å; F1997-S1999 VanDerWaalsContact C-N 3.33Å; F1997-S1999 PolarHBondContact O-N 3.13Å; F1997-G2000 WeakPolarHBondContact O-CA 3.22Å; F1997-G2000 PolarHBondContact O-N 3.42Å; F1997-M2008 HydrophobicContact CD2-CE 4.31Å; F1997-M2008 HydrophobicContact CD2-SD 3.84Å; F1997-M2008 HydrophobicContact CE2-SD 3.85Å; F1997-M2012 HydrophobicContact CD2-CE 3.49Å; F1997-M2012 VanDerWaalsContact CD2-CE 3.49Å; F1997-M2012 HydrophobicContact CE2-CE 3.5Å
1998F89.2Confident84.1Confident10 Ų1054.3 Ų54.34%0.04429%0.288CS..Hα-helixtrans-64.5-33.5-179.7-69.7-7.6000113.6V1757 R1758 Y1762 M1766 F1980 Y1982 Q1994 G2000V1757-F1998 HydrophobicContact CG1-CB 4.08Å; V1757-F1998 HydrophobicContact CG1-CD2 4.26Å; V1757-F1998 HydrophobicContact CG1-CG 4.05Å; V1757-F1998 HydrophobicContact CG2-CB 4.35Å; V1757-F1998 HydrophobicContact CG2-CD2 4.27Å; R1758-F1998 VanDerWaalsContact CB-O 3.3Å; R1758-F1998 WeakPolarHBondContact CB-O 3.39Å; R1758-F1998 PolarHBondContact N-O 3.04Å; Y1762-F1998 AromaticContact CD1-CE1 3.48Å; Y1762-F1998 HydrophobicContact CD1-CE1 3.48Å; Y1762-F1998 VanDerWaalsContact CD1-CE1 3.48Å; Y1762-F1998 AromaticContact CD1-CZ 3.49Å; Y1762-F1998 HydrophobicContact CD1-CZ 3.49Å; Y1762-F1998 VanDerWaalsContact CD1-CZ 3.49Å; Y1762-F1998 HydrophobicContact CD2-CE1 4.19Å; Y1762-F1998 HydrophobicContact CE1-CE1 4.05Å; Y1762-F1998 HydrophobicContact CE1-CZ 4.27Å; Y1762-F1998 HydrophobicContact CG-CD1 4.38Å; Y1762-F1998 AromaticContact CG-CE1 3.57Å; Y1762-F1998 HydrophobicContact CG-CE1 3.57Å; Y1762-F1998 AromaticContact CG-CZ 3.86Å; Y1762-F1998 HydrophobicContact CG-CZ 3.86Å; M1766-F1998 HydrophobicContact CE-CD2 4.28Å; M1766-F1998 HydrophobicContact CE-CE2 3.9Å; M1766-F1998 HydrophobicContact SD-CD2 3.78Å; M1766-F1998 HydrophobicContact SD-CE2 3.38Å; M1766-F1998 WeakPolarHBondContact SD-CE2 3.41Å; M1766-F1998 HydrophobicContact SD-CZ 4.35Å; F1980-F1998 AromaticContact CD2-CZ 3.87Å; F1980-F1998 HydrophobicContact CD2-CZ 3.87Å; F1980-F1998 HydrophobicContact CE2-CZ 4.02Å; Y1982-F1998 HydrophobicContact CE2-CE1 4.46Å; Y1982-F1998 WeakPolarHBondContact OH-CE1 3.49Å; Q1994-F1998 HydrophobicContact CG-CD2 3.64Å; Q1994-F1998 HydrophobicContact CG-CE1 4.49Å; Q1994-F1998 HydrophobicContact CG-CE2 3.28Å; Q1994-F1998 HydrophobicContact CG-CG 4.38Å; Q1994-F1998 HydrophobicContact CG-CZ 3.76Å; Q1994-F1998 WeakPolarHBondContact O-CB 3.43Å; Q1994-F1998 WeakPolarHBondContact O-CG 3.38Å; Q1994-F1998 PolarHBondContact O-N 3.05Å; F1998-G2000 PolarHBondContact O-N 2.94Å
1999S84.8Confident83.6Confident48 Ų4854.4 Ų54.434%0.33629%0.29SS..THydrogen-bonded Turntrans-78.80.1170.757.10000113.8S1995 C1996 F1997 R2001S1995-S1999 WeakPolarHBondContact O-CB 3.49Å; S1995-S1999 PolarHBondContact O-N 3.45Å; S1995-S1999 PolarHBondContact O-OG 2.94Å; C1996-S1999 PolarHBondContact O-OG 3.37Å; F1997-S1999 VanDerWaalsContact C-N 3.33Å; F1997-S1999 PolarHBondContact O-N 3.13Å; S1999-R2001 PolarHBondContact O-N 3.46Å; S1999-R2001 WeakPolarHBondContact OG-CD 3.33Å; S1999-R2001 WeakPolarHBondContact OG-CG 3.08Å; S1999-R2001 PolarHBondContact OG-NE 3.32Å
2000G82Confident83.4Confident12 Ų1252.6 Ų52.612%0.12428%0.277CS..THydrogen-bonded Turntrans65.918.2177.600000115.2C1996 F1997 F1998C1996-G2000 PolarHBondContact O-N 2.94Å; F1997-G2000 WeakPolarHBondContact O-CA 3.22Å; F1997-G2000 PolarHBondContact O-N 3.42Å; F1998-G2000 PolarHBondContact O-N 2.94Å
2001R83.7Confident82.8Confident153 Ų15354 Ų5458%0.57729%0.288SS*.  trans-68.3143.9-177.3-66.5173.9-173.4-171.42110.7I1971 C1996 S1999 M2008I1971-R2001 HydrophobicContact CD1-CB 4.37Å; I1971-R2001 WeakPolarHBondContact CD1-O 3.38Å; I1971-R2001 HydrophobicContact CG2-CB 4.11Å; C1996-R2001 PolarHBondContact O-N 3.41Å; S1999-R2001 PolarHBondContact O-N 3.46Å; S1999-R2001 WeakPolarHBondContact OG-CD 3.33Å; S1999-R2001 WeakPolarHBondContact OG-CG 3.08Å; S1999-R2001 PolarHBondContact OG-NE 3.32Å; R2001-M2008 VanDerWaalsContact O-CE 3.26Å; R2001-M2008 WeakPolarHBondContact O-CE 3.45Å
2002V80Confident82.4Confident77 Ų7755.7 Ų55.747%0.46730%0.297SS..  trans-132.4141.6177.8-74.60000111.4M2008V2002-M2008 HydrophobicContact CG1-CB 4.5Å; V2002-M2008 HydrophobicContact CG1-CE 3.77Å; V2002-M2008 HydrophobicContact CG1-CG 3.61Å
2003A82.3Confident82.1Confident29 Ų2956.9 Ų56.924%0.2430%0.304CS..  trans-88155168.300000111.2I1971 Y1990 G2005 H2006I1971-A2003 HydrophobicContact CG1-CB 4.35Å; Y1990-A2003 HydrophobicContact CE2-CB 4.27Å; Y1990-A2003 WeakPolarHBondContact OH-CB 3.42Å; Y1990-A2003 PolarHBondContact OH-N 2.83Å; A2003-G2005 PolarHBondContact O-N 3.12Å; A2003-H2006 PolarHBondContact O-N 2.89Å; A2003-H2006 VanDerWaalsContact O-N 3.09Å
2004K76Confident81.9Confident219 Ų21959 Ų5995%0.95231%0.314SS*.THydrogen-bonded Turntrans-49.2127.2177.1-84.7-175.4174178.20111.1
2005G74.7Confident81.8Confident67 Ų6758.1 Ų58.169%0.69131%0.309SS*.THydrogen-bonded Turntrans94.5-22.2179.100000115.6H1987 A2003H1987-G2005 PolarHBondContact CE1-O 3.4Å; A2003-G2005 PolarHBondContact O-N 3.12Å
2006H77.1Confident81.7Confident8 Ų855.7 Ų55.74%0.03729%0.292CS..  trans-98.4147.8176.1-174.988000111.8S1984 H1987 Y1990 A2003 Y2010S1984-H2006 PolarHBondContact OG-CE1 3.29Å; H1987-H2006 AromaticContact CE1-ND1 3.87Å; H1987-H2006 AromaticContact ND1-CG 3.98Å; H1987-H2006 AromaticContact ND1-ND1 3.36Å; H1987-H2006 PolarHBondContact ND1-ND1 2.94Å; Y1990-H2006 AromaticContact CD1-CE1 3.91Å; Y1990-H2006 AromaticContact CD1-ND1 3.71Å; Y1990-H2006 HydrophobicContact CE1-CB 3.96Å; Y1990-H2006 AromaticContact CE1-CD2 3.6Å; Y1990-H2006 AromaticContact CE1-CE1 3.85Å; Y1990-H2006 AromaticContact CE1-CG 3.45Å; Y1990-H2006 VanDerWaalsContact CE1-CG 3.45Å; Y1990-H2006 AromaticContact CE1-ND1 3.62Å; Y1990-H2006 AromaticContact CE1-NE2 3.87Å; Y1990-H2006 HydrophobicContact CE2-CB 3.89Å; Y1990-H2006 AromaticContact CZ-CD2 3.96Å; Y1990-H2006 AromaticContact CZ-CG 3.6Å; A2003-H2006 PolarHBondContact O-N 2.89Å; A2003-H2006 VanDerWaalsContact O-N 3.09Å; H2006-Y2010 AromaticContact ND1-CD2 3.85Å
2007K74.4Confident81.5Confident117 Ų11759 Ų5951%0.50931%0.312SS..  trans-131136178.5-58.3-166.4177.7-164.70110H2009 Y2010K2007-H2009 WeakPolarHBondContact CD-CE1 3.39Å; K2007-H2009 PolarHBondContact O-N 2.87Å; K2007-Y2010 HydrophobicContact CB-CD1 4.36Å; K2007-Y2010 HydrophobicContact CB-CD2 4.31Å; K2007-Y2010 HydrophobicContact CB-CE1 4.07Å; K2007-Y2010 HydrophobicContact CB-CE2 4.04Å; K2007-Y2010 HydrophobicContact CB-CG 4.47Å; K2007-Y2010 HydrophobicContact CG-CE1 4.47Å; K2007-Y2010 HydrophobicContact CG-CE2 4.22Å; K2007-Y2010 WeakPolarHBondContact O-CB 3.25Å; K2007-Y2010 PolarHBondContact O-N 3.22Å
2008M73.1Confident81.3Confident35 Ų3561.6 Ų61.617%0.17233%0.331CS..THydrogen-bonded Turntrans-60.8-12.4-176.7-83-65.5139.700116.3I1992 F1997 R2001 V2002 Y2010 M2012 R2047I1992-M2008 HydrophobicContact CD1-CE 3.47Å; I1992-M2008 VanDerWaalsContact CD1-CE 3.47Å; F1997-M2008 HydrophobicContact CD2-CE 4.31Å; F1997-M2008 HydrophobicContact CD2-SD 3.84Å; F1997-M2008 HydrophobicContact CE2-SD 3.85Å; R2001-M2008 VanDerWaalsContact O-CE 3.26Å; R2001-M2008 WeakPolarHBondContact O-CE 3.45Å; V2002-M2008 HydrophobicContact CG1-CB 4.5Å; V2002-M2008 HydrophobicContact CG1-CE 3.77Å; V2002-M2008 HydrophobicContact CG1-CG 3.61Å; M2008-Y2010 VanDerWaalsContact C-N 3.32Å; M2008-M2012 HydrophobicContact SD-CE 4.43Å; M2008-R2047 PolarHBondContact O-NH2 3.4Å
2009H70.6Confident80.9Confident117 Ų11762.4 Ų62.454%0.54234%0.337SS..THydrogen-bonded Turntrans-86-1.9172.263.2-111.2000113.3K2007K2007-H2009 WeakPolarHBondContact CD-CE1 3.39Å; K2007-H2009 PolarHBondContact O-N 2.87Å
2010Y76.4Confident80.7Confident42 Ų4263.6 Ų63.617%0.16534%0.343CS..SBendtrans-72.4137.9173.7-64.9-16.2000109.9K1986 H1987 H2006 K2007 M2008 M2012K1986-Y2010 HydrophobicContact CD-CD1 3.91Å; K1986-Y2010 HydrophobicContact CD-CD2 3.64Å; K1986-Y2010 HydrophobicContact CD-CE1 4.17Å; K1986-Y2010 HydrophobicContact CD-CE2 3.89Å; K1986-Y2010 HydrophobicContact CD-CG 3.66Å; K1986-Y2010 VanDerWaalsContact NZ-CE1 3.26Å; K1986-Y2010 PolarHBondContact NZ-OH 3.24Å; H1987-Y2010 AromaticContact CE1-CD2 3.85Å; H1987-Y2010 AromaticContact CE1-CE2 3.66Å; H1987-Y2010 AromaticContact NE2-CD2 3.96Å; H1987-Y2010 AromaticContact NE2-CE2 3.73Å; H2006-Y2010 AromaticContact ND1-CD2 3.85Å; K2007-Y2010 HydrophobicContact CB-CD1 4.36Å; K2007-Y2010 HydrophobicContact CB-CD2 4.31Å; K2007-Y2010 HydrophobicContact CB-CE1 4.07Å; K2007-Y2010 HydrophobicContact CB-CE2 4.04Å; K2007-Y2010 HydrophobicContact CB-CG 4.47Å; K2007-Y2010 HydrophobicContact CG-CE1 4.47Å; K2007-Y2010 HydrophobicContact CG-CE2 4.22Å; K2007-Y2010 WeakPolarHBondContact O-CB 3.25Å; K2007-Y2010 PolarHBondContact O-N 3.22Å; M2008-Y2010 VanDerWaalsContact C-N 3.32Å; Y2010-M2012 WeakPolarHBondContact O-CG 3.19Å; Y2010-M2012 PolarHBondContact O-N 3.1Å
2011P76.3Confident80.3Confident49 Ų4967.9 Ų67.932%0.31837%0.371SS..  trans-56131-178.4-2634.8000111.2L1985 F2042L1985-P2011 HydrophobicContact CB-CB 4.28Å; L1985-P2011 PolarHBondContact N-O 3.35Å; P2011-F2042 HydrophobicContact CG-CD1 4.01Å; P2011-F2042 HydrophobicContact CG-CE1 3.93Å
2012M83.7Confident80.2Confident43 Ų4362 Ų6221%0.21236%0.358CS..EExtended strand (participates in β ladder)trans-127.6146.7177.8-63-128.2-72.800109.1Y1982 R1983 I1992 F1997 M2008 Y2010Y1982-M2012 HydrophobicContact CG-CE 4.23Å; R1983-M2012 CarbonylContact O-C 3.59Å; R1983-M2012 VanDerWaalsContact O-CA 3.23Å; R1983-M2012 WeakPolarHBondContact O-CA 3.31Å; I1992-M2012 HydrophobicContact CD1-CE 3.57Å; I1992-M2012 HydrophobicContact CD1-SD 3.9Å; I1992-M2012 HydrophobicContact CG1-CE 4.31Å; I1992-M2012 HydrophobicContact CG1-SD 4.41Å; F1997-M2012 HydrophobicContact CD2-CE 3.49Å; F1997-M2012 VanDerWaalsContact CD2-CE 3.49Å; F1997-M2012 HydrophobicContact CE2-CE 3.5Å; M2008-M2012 HydrophobicContact SD-CE 4.43Å; Y2010-M2012 WeakPolarHBondContact O-CG 3.19Å; Y2010-M2012 PolarHBondContact O-N 3.1Å
2013V85.4Confident80.1Confident26 Ų2660 Ų6016%0.15834%0.343CS..EExtended strand (participates in β ladder)trans-98.1132.3166.4172.30000107.8Y1982 R1983 L1985 Y2015 D2027Y1982-V2013 WeakPolarHBondContact CA-O 3.28Å; R1983-V2013 PolarHBondContact N-O 3.09Å; R1983-V2013 PolarHBondContact O-N 3.02Å; L1985-V2013 HydrophobicContact CD1-CG2 3.61Å; L1985-V2013 HydrophobicContact CD2-CG2 3.68Å; L1985-V2013 HydrophobicContact CG-CG2 3.69Å; V2013-Y2015 HydrophobicContact CB-CE2 4.09Å; V2013-Y2015 HydrophobicContact CG1-CD1 4.45Å; V2013-Y2015 HydrophobicContact CG1-CD2 3.9Å; V2013-Y2015 HydrophobicContact CG1-CE1 4.08Å; V2013-Y2015 HydrophobicContact CG1-CE2 3.46Å; V2013-Y2015 VanDerWaalsContact CG1-CE2 3.46Å; V2013-Y2015 HydrophobicContact CG1-CG 4.39Å; V2013-D2027 WeakPolarHBondContact CB-OD2 3.05Å
2014E88.7Confident79.8Confident47 Ų4761 Ų6122%0.2234%0.344CS..EExtended strand (participates in β ladder)trans-86134.8166.8175.2166.99000109.4Y1762 R1956 F1980 Y1982Y1762-E2014 VanDerWaalsContact CE1-OE2 3.31Å; Y1762-E2014 WeakPolarHBondContact CE1-OE2 3.28Å; Y1762-E2014 PolarHBondContact OH-OE2 3.03Å; R1956-E2014 WeakPolarHBondContact CD-OE1 3.34Å; R1956-E2014 IonicContact NE-OE1 2.83Å; R1956-E2014 PolarHBondContact NE-OE1 2.82Å; F1980-E2014 VanDerWaalsContact CD1-CD 3.47Å; F1980-E2014 HydrophobicContact CD1-CG 3.59Å; F1980-E2014 WeakPolarHBondContact CD1-OE2 3.37Å; F1980-E2014 HydrophobicContact CE1-CG 3.91Å; F1980-E2014 WeakPolarHBondContact CE1-OE2 3.44Å; Y1982-E2014 HydrophobicContact CD1-CB 4.09Å; Y1982-E2014 HydrophobicContact CD1-CG 4.43Å; Y1982-E2014 HydrophobicContact CE1-CB 3.77Å; Y1982-E2014 HydrophobicContact CE1-CG 3.78Å; Y1982-E2014 WeakPolarHBondContact CE1-OE2 3.42Å; Y1982-E2014 PolarHBondContact OH-OE2 3.03Å
2015Y89.7Confident79.8Confident17 Ų1755.2 Ų55.27%0.06733%0.327CS..EExtended strand (participates in β ladder)trans-122123.2164.4-64.9-81.6000109.3F1980 R1981 R1983 V2013 T2019 E2023 D2027F1980-Y2015 WeakPolarHBondContact CA-O 3.42Å; R1981-Y2015 PolarHBondContact N-O 3.49Å; R1981-Y2015 PolarHBondContact O-N 2.89Å; R1983-Y2015 HydrophobicContact CB-CE2 4.2Å; V2013-Y2015 HydrophobicContact CB-CE2 4.09Å; V2013-Y2015 HydrophobicContact CG1-CD1 4.45Å; V2013-Y2015 HydrophobicContact CG1-CD2 3.9Å; V2013-Y2015 HydrophobicContact CG1-CE1 4.08Å; V2013-Y2015 HydrophobicContact CG1-CE2 3.46Å; V2013-Y2015 VanDerWaalsContact CG1-CE2 3.46Å; V2013-Y2015 HydrophobicContact CG1-CG 4.39Å; Y2015-T2019 HydrophobicContact CD1-CG2 3.32Å; Y2015-T2019 HydrophobicContact CD2-CG2 3.61Å; Y2015-T2019 HydrophobicContact CE1-CG2 3.76Å; Y2015-T2019 HydrophobicContact CE2-CG2 4.03Å; Y2015-T2019 HydrophobicContact CG-CG2 3.21Å; Y2015-E2023 HydrophobicContact CE1-CB 3.95Å; Y2015-E2023 HydrophobicContact CE1-CG 4.14Å; Y2015-D2027 PolarHBondContact OH-OD1 2.87Å; Y2015-D2027 PolarHBondContact OH-OD2 2.86Å
2016C88Confident80.1Confident25 Ų2558.6 Ų58.617%0.16932%0.319CS..  trans-105.4-4.1173.356.90000113.2R1956 A1959 A1960 A1963 F1980R1956-C2016 HydrophobicContact CB-CB 4.4Å; A1959-C2016 CarbonylContact C-O 3.58Å; A1959-C2016 HydrophobicContact CB-CB 4.42Å; A1960-C2016 VanDerWaalsContact CA-O 3.29Å; A1960-C2016 WeakPolarHBondContact CA-O 3.36Å; A1960-C2016 HydrophobicContact CB-CB 4.04Å; A1960-C2016 PolarHBondContact N-O 3.04Å; A1963-C2016 WeakPolarHBondContact CB-O 3.42Å; F1980-C2016 HydrophobicContact CD1-CB 3.9Å; F1980-C2016 HydrophobicContact CE1-CB 3.65Å
2017T86.5Confident80.1Confident71 Ų7158.3 Ų58.344%0.43632%0.318SS..SBendtrans-124.3152.3177.752.30000110.2H1965 T2019H1965-T2017 PolarHBondContact CE1-O 3.24Å; T2017-T2019 PolarHBondContact O-N 3.29Å
2018P83.8Confident80.2Confident81 Ų8157.3 Ų57.353%0.52631%0.314SS..  trans-53.2112.2-179.1-28.236.1000112.8A1963 T2020A1963-P2018 HydrophobicContact CB-CG 4.36Å; P2018-T2020 PolarHBondContact O-N 3.31Å
2019T81.9Confident80.3Confident28 Ų2858.3 Ų58.317%0.17233%0.327CS..  trans-65.8130.4-174.240.50000112.9H1965 R1981 Y2015 T2017H1965-T2019 PolarHBondContact ND1-OG1 2.87Å; R1981-T2019 PolarHBondContact NH1-OG1 3.32Å; Y2015-T2019 HydrophobicContact CD1-CG2 3.32Å; Y2015-T2019 HydrophobicContact CD2-CG2 3.61Å; Y2015-T2019 HydrophobicContact CE1-CG2 3.76Å; Y2015-T2019 HydrophobicContact CE2-CG2 4.03Å; Y2015-T2019 HydrophobicContact CG-CG2 3.21Å; T2017-T2019 PolarHBondContact O-N 3.29Å
2020T79.5Confident80.7Confident73 Ų7356.6 Ų56.645%0.44832%0.319SS..  trans-85.9157.7176.162.40000112.4P2018 G2022 E2023 D2024P2018-T2020 PolarHBondContact O-N 3.31Å; T2020-G2022 PolarHBondContact O-N 3.41Å; T2020-E2023 PolarHBondContact N-OE2 3.06Å; T2020-E2023 WeakPolarHBondContact O-CB 3.5Å; T2020-E2023 PolarHBondContact O-N 3.44Å; T2020-E2023 WeakPolarHBondContact OG1-CG 3.48Å; T2020-E2023 PolarHBondContact OG1-N 2.8Å; T2020-E2023 PolarHBondContact OG1-OE2 3.36Å; T2020-D2024 PolarHBondContact O-N 2.97Å
2021S75.2Confident80.7Confident102 Ų10255 Ų5571%0.71331%0.313SS*.Hα-helixtrans-58.4-33.9174.853.90000112.9E2023 D2024 V2025S2021-E2023 VanDerWaalsContact C-N 3.3Å; S2021-E2023 PolarHBondContact O-N 3.23Å; S2021-D2024 PolarHBondContact O-N 3.21Å; S2021-V2025 WeakPolarHBondContact O-CG2 3.3Å; S2021-V2025 PolarHBondContact O-N 2.88Å; S2021-V2025 VanDerWaalsContact O-N 3.1Å
2022G79.9Confident80.7Confident29 Ų2956.4 Ų56.430%0.29932%0.318SS..Hα-helixtrans-66.2-28.7175.600000113.8T2020 R2026T2020-G2022 PolarHBondContact O-N 3.41Å; G2022-R2026 WeakPolarHBondContact O-CG 3.35Å; G2022-R2026 PolarHBondContact O-N 2.95Å; G2022-R2026 PolarHBondContact O-NH1 3.26Å
2023E78.6Confident80.2Confident36 Ų3660.6 Ų60.617%0.16834%0.335CS..Hα-helixtrans-73.4-44.4173.7-76.2164.5132.900111.8Y2015 T2020 S2021 V2025 R2026 D2027Y2015-E2023 HydrophobicContact CE1-CB 3.95Å; Y2015-E2023 HydrophobicContact CE1-CG 4.14Å; T2020-E2023 PolarHBondContact N-OE2 3.06Å; T2020-E2023 WeakPolarHBondContact O-CB 3.5Å; T2020-E2023 PolarHBondContact O-N 3.44Å; T2020-E2023 WeakPolarHBondContact OG1-CG 3.48Å; T2020-E2023 PolarHBondContact OG1-N 2.8Å; T2020-E2023 PolarHBondContact OG1-OE2 3.36Å; S2021-E2023 VanDerWaalsContact C-N 3.3Å; S2021-E2023 PolarHBondContact O-N 3.23Å; E2023-V2025 PolarHBondContact O-N 3.33Å; E2023-R2026 WeakPolarHBondContact O-CB 3.41Å; E2023-R2026 PolarHBondContact O-N 3.47Å; E2023-R2026 IonicContact OE1-NH2 2.67Å; E2023-D2027 PolarHBondContact O-N 3.49Å
2024D75.3Confident79.4Confident48 Ų4860 Ų6026%0.25733%0.331SS..Hα-helixtrans-60.8-33.6175.9-82.1-27.8000111.9R1981 R1983 T2020 S2021 F2028R1981-D2024 IonicContact CZ-OD1 3.63Å; R1981-D2024 IonicContact NH1-OD1 3.69Å; R1981-D2024 PolarHBondContact NH1-OD1 3.21Å; R1981-D2024 VanDerWaalsContact NH1-OD1 3.13Å; R1981-D2024 IonicContact NH1-OD2 2.83Å; R1981-D2024 PolarHBondContact NH1-OD2 2.7Å; R1981-D2024 IonicContact NH2-OD1 2.7Å; R1981-D2024 PolarHBondContact NH2-OD1 2.89Å; R1981-D2024 IonicContact NH2-OD2 3.18Å; R1983-D2024 IonicContact CZ-OD1 2.69Å; R1983-D2024 IonicContact NE-OD1 2.72Å; R1983-D2024 VanDerWaalsContact NH1-CG 3.31Å; R1983-D2024 IonicContact NH1-OD1 3.67Å; R1983-D2024 PolarHBondContact NH1-OD1 3.08Å; R1983-D2024 IonicContact NH1-OD2 2.7Å; T2020-D2024 PolarHBondContact O-N 2.97Å; S2021-D2024 PolarHBondContact O-N 3.21Å; D2024-F2028 VanDerWaalsContact O-CB 3.3Å; D2024-F2028 WeakPolarHBondContact O-CB 3.5Å; D2024-F2028 PolarHBondContact O-N 3.34Å
2025V77.4Confident78.4Confident98 Ų9864.7 Ų64.759%0.59435%0.35SS*.Hα-helixtrans-68-42.6171.3172.50000112.3S2021 E2023 D2027 F2028 A2029S2021-V2025 WeakPolarHBondContact O-CG2 3.3Å; S2021-V2025 PolarHBondContact O-N 2.88Å; S2021-V2025 VanDerWaalsContact O-N 3.1Å; E2023-V2025 PolarHBondContact O-N 3.33Å; V2025-D2027 VanDerWaalsContact C-N 3.34Å; V2025-D2027 PolarHBondContact O-N 2.93Å; V2025-F2028 PolarHBondContact O-N 3.31Å; V2025-A2029 PolarHBondContact O-N 3.01Å
2026R79.4Confident77.3Confident139 Ų13972 Ų7253%0.52538%0.383SS..Hα-helixtrans-62.4-42.5175.5-73.6-170.2-62.9-94.520.2111.3G2022 E2023 A2029 K2030G2022-R2026 WeakPolarHBondContact O-CG 3.35Å; G2022-R2026 PolarHBondContact O-N 2.95Å; G2022-R2026 PolarHBondContact O-NH1 3.26Å; E2023-R2026 WeakPolarHBondContact O-CB 3.41Å; E2023-R2026 PolarHBondContact O-N 3.47Å; E2023-R2026 IonicContact OE1-NH2 2.67Å; R2026-A2029 PolarHBondContact O-N 3.34Å; R2026-K2030 WeakPolarHBondContact O-CG 3.45Å; R2026-K2030 PolarHBondContact O-N 3.26Å
2027D77.7Confident76.2Confident1 Ų174.5 Ų74.51%0.00539%0.388CS..Hα-helixtrans-70.8-36.7178.7-94.725.4000112.4L1985 V2013 Y2015 E2023 V2025 A2029 K2030 V2031L1985-D2027 HydrophobicContact CD2-CB 4.08Å; L1985-D2027 WeakPolarHBondContact CD2-OD2 3.15Å; V2013-D2027 WeakPolarHBondContact CB-OD2 3.05Å; Y2015-D2027 PolarHBondContact OH-OD1 2.87Å; Y2015-D2027 PolarHBondContact OH-OD2 2.86Å; E2023-D2027 PolarHBondContact O-N 3.49Å; V2025-D2027 VanDerWaalsContact C-N 3.34Å; V2025-D2027 PolarHBondContact O-N 2.93Å; D2027-A2029 VanDerWaalsContact C-N 3.35Å; D2027-A2029 PolarHBondContact O-N 3.47Å; D2027-K2030 WeakPolarHBondContact O-CB 3.5Å; D2027-K2030 PolarHBondContact O-N 3.39Å; D2027-K2030 WeakPolarHBondContact OD1-CD 3.45Å; D2027-K2030 WeakPolarHBondContact OD1-CE 3.48Å; D2027-K2030 IonicContact OD1-NZ 3.61Å; D2027-K2030 PolarHBondContact OD1-NZ 2.73Å; D2027-V2031 VanDerWaalsContact O-CG2 3.3Å; D2027-V2031 WeakPolarHBondContact O-CG2 3.39Å; D2027-V2031 PolarHBondContact O-N 2.87Å
2028F75.9Confident75Confident96 Ų9675.8 Ų75.842%0.42140%0.397SS..Hα-helixtrans-57.3-46.5168.6175.8-110.9000112.1F1988 D2024 V2025 K2030 V2031 L2032F1988-F2028 AromaticContact CD2-CD2 3.7Å; F1988-F2028 HydrophobicContact CD2-CD2 3.7Å; F1988-F2028 AromaticContact CD2-CE2 3.97Å; F1988-F2028 HydrophobicContact CD2-CE2 3.97Å; F1988-F2028 AromaticContact CE2-CD2 3.49Å; F1988-F2028 HydrophobicContact CE2-CD2 3.49Å; F1988-F2028 VanDerWaalsContact CE2-CD2 3.49Å; F1988-F2028 AromaticContact CE2-CE2 3.73Å; F1988-F2028 HydrophobicContact CE2-CE2 3.73Å; D2024-F2028 VanDerWaalsContact O-CB 3.3Å; D2024-F2028 WeakPolarHBondContact O-CB 3.5Å; D2024-F2028 PolarHBondContact O-N 3.34Å; V2025-F2028 PolarHBondContact O-N 3.31Å; F2028-K2030 VanDerWaalsContact C-N 3.34Å; F2028-K2030 PolarHBondContact O-N 2.95Å; F2028-V2031 PolarHBondContact O-N 2.77Å; F2028-L2032 HydrophobicContact CD2-CD1 4.3Å; F2028-L2032 HydrophobicContact CE1-CD1 3.99Å; F2028-L2032 HydrophobicContact CE2-CD1 3.67Å; F2028-L2032 HydrophobicContact CZ-CD1 3.49Å; F2028-L2032 VanDerWaalsContact CZ-CD1 3.49Å; F2028-L2032 PolarHBondContact O-N 3.05Å
2029A77Confident73.9Confident56 Ų5681.5 Ų81.546%0.46341%0.413SS..Hα-helixtrans-62.4-38.817600000112.3V2025 R2026 D2027 L2032 K2033V2025-A2029 PolarHBondContact O-N 3.01Å; R2026-A2029 PolarHBondContact O-N 3.34Å; D2027-A2029 VanDerWaalsContact C-N 3.35Å; D2027-A2029 PolarHBondContact O-N 3.47Å; A2029-L2032 PolarHBondContact O-N 3.22Å; A2029-K2033 WeakPolarHBondContact O-CB 3.31Å; A2029-K2033 PolarHBondContact O-N 2.82Å
2030K78.5Confident72.9Confident82 Ų8290.5 Ų90.536%0.35744%0.444SS..Hα-helixtrans-64-43.2171.9-69.5173.7-160.4160.30112.1L1985 R2026 D2027 F2028 L2032 K2033 N2034L1985-K2030 HydrophobicContact CD1-CB 4.24Å; L1985-K2030 HydrophobicContact CD1-CD 3.75Å; L1985-K2030 HydrophobicContact CD2-CB 3.88Å; L1985-K2030 HydrophobicContact CD2-CD 3.86Å; L1985-K2030 HydrophobicContact CG-CD 4.47Å; R2026-K2030 WeakPolarHBondContact O-CG 3.45Å; R2026-K2030 PolarHBondContact O-N 3.26Å; D2027-K2030 WeakPolarHBondContact O-CB 3.5Å; D2027-K2030 PolarHBondContact O-N 3.39Å; D2027-K2030 WeakPolarHBondContact OD1-CD 3.45Å; D2027-K2030 WeakPolarHBondContact OD1-CE 3.48Å; D2027-K2030 IonicContact OD1-NZ 3.61Å; D2027-K2030 PolarHBondContact OD1-NZ 2.73Å; F2028-K2030 VanDerWaalsContact C-N 3.34Å; F2028-K2030 PolarHBondContact O-N 2.95Å; K2030-L2032 VanDerWaalsContact C-N 3.35Å; K2030-L2032 PolarHBondContact O-N 2.68Å; K2030-K2033 PolarHBondContact O-N 3.39Å; K2030-N2034 WeakPolarHBondContact O-CB 3.38Å; K2030-N2034 VanDerWaalsContact O-CG 3.25Å; K2030-N2034 PolarHBondContact O-N 3.42Å
2031V77.2Confident72.2Confident8 Ų890.1 Ų90.15%0.04844%0.435CS..Hα-helixtrans-59.4-45175.7170.70000110.5S1984 F1988 D2027 F2028 N2034 K2035S1984-V2031 WeakPolarHBondContact O-CG2 3.26Å; F1988-V2031 HydrophobicContact CB-CG1 4.39Å; D2027-V2031 VanDerWaalsContact O-CG2 3.3Å; D2027-V2031 WeakPolarHBondContact O-CG2 3.39Å; D2027-V2031 PolarHBondContact O-N 2.87Å; F2028-V2031 PolarHBondContact O-N 2.77Å; V2031-N2034 PolarHBondContact O-N 3.09Å; V2031-K2035 PolarHBondContact O-N 2.83Å
2032L75.1Confident71.4Confident79 Ų7988.6 Ų88.641%0.41442%0.415SS..Hα-helixtrans-58.3-55.4173.4-115.784.4000110.9F2028 A2029 K2030 N2034 K2035 F2036F2028-L2032 HydrophobicContact CD2-CD1 4.3Å; F2028-L2032 HydrophobicContact CE1-CD1 3.99Å; F2028-L2032 HydrophobicContact CE2-CD1 3.67Å; F2028-L2032 HydrophobicContact CZ-CD1 3.49Å; F2028-L2032 VanDerWaalsContact CZ-CD1 3.49Å; F2028-L2032 PolarHBondContact O-N 3.05Å; A2029-L2032 PolarHBondContact O-N 3.22Å; K2030-L2032 VanDerWaalsContact C-N 3.35Å; K2030-L2032 PolarHBondContact O-N 2.68Å; L2032-N2034 PolarHBondContact O-N 2.88Å; L2032-K2035 PolarHBondContact O-N 3.4Å; L2032-F2036 WeakPolarHBondContact O-CD2 3.29Å; L2032-F2036 PolarHBondContact O-N 2.96Å
2033K73.1Confident70.3Confident131 Ų13190.9 Ų90.957%0.5743%0.431SS*.Hα-helixtrans-56.6-37.1-179.1-167.9172-173.3172.40112A2029 K2030 R2037A2029-K2033 WeakPolarHBondContact O-CB 3.31Å; A2029-K2033 PolarHBondContact O-N 2.82Å; K2030-K2033 PolarHBondContact O-N 3.39Å; K2033-R2037 VanDerWaalsContact O-CD 3.25Å; K2033-R2037 WeakPolarHBondContact O-CD 3.37Å; K2033-R2037 VanDerWaalsContact O-CG 3.31Å; K2033-R2037 WeakPolarHBondContact O-CG 3.46Å
2034N69.1Low68.8Low14 Ų1497.8 Ų97.88%0.07546%0.461CS..Hα-helixtrans-76.2-30.9178.1-77.7-11.4000113.9L1985 K2030 V2031 L2032 F2036 R2037 F2042L1985-N2034 WeakPolarHBondContact CB-ND2 3.41Å; L1985-N2034 VanDerWaalsContact O-CB 3.23Å; L1985-N2034 WeakPolarHBondContact O-CB 3.44Å; L1985-N2034 PolarHBondContact O-ND2 3.29Å; K2030-N2034 WeakPolarHBondContact O-CB 3.38Å; K2030-N2034 VanDerWaalsContact O-CG 3.25Å; K2030-N2034 PolarHBondContact O-N 3.42Å; V2031-N2034 PolarHBondContact O-N 3.09Å; L2032-N2034 PolarHBondContact O-N 2.88Å; N2034-F2036 VanDerWaalsContact C-N 3.28Å; N2034-F2036 PolarHBondContact O-N 3.1Å; N2034-R2037 PolarHBondContact O-N 3.09Å; N2034-R2037 PolarHBondContact OD1-NH1 3.39Å; N2034-F2042 HydrophobicContact CB-CE1 4.41Å; N2034-F2042 HydrophobicContact CB-CZ 3.81Å
2035K66.9Low67.5Low144 Ų144100.5 Ų100.563%0.62647%0.472SS*.Hα-helixtrans-63.8-32.5171.8-82-171174.4-1720112.7V2031 L2032 R2037V2031-K2035 PolarHBondContact O-N 2.83Å; L2032-K2035 PolarHBondContact O-N 3.4Å; K2035-R2037 VanDerWaalsContact C-N 3.32Å
2036F68.1Low65.9Low172 Ų172100.9 Ų100.975%0.75448%0.476SS*.THydrogen-bonded Turntrans-81.4-4.8175.3-67.9-70.6000114.3L2032 N2034L2032-F2036 WeakPolarHBondContact O-CD2 3.29Å; L2032-F2036 PolarHBondContact O-N 2.96Å; N2034-F2036 VanDerWaalsContact C-N 3.28Å; N2034-F2036 PolarHBondContact O-N 3.1Å
2037R63.1Low64.2Low76 Ų76102.7 Ų102.729%0.28748%0.483SS..SBendtrans-91.7127-178-79.9161.1161.6-164.4-13111.2K2033 N2034 K2035 Y2041 F2042K2033-R2037 VanDerWaalsContact O-CD 3.25Å; K2033-R2037 WeakPolarHBondContact O-CD 3.37Å; K2033-R2037 VanDerWaalsContact O-CG 3.31Å; K2033-R2037 WeakPolarHBondContact O-CG 3.46Å; N2034-R2037 PolarHBondContact O-N 3.09Å; N2034-R2037 PolarHBondContact OD1-NH1 3.39Å; K2035-R2037 VanDerWaalsContact C-N 3.32Å; R2037-Y2041 HydrophobicContact CB-CD1 3.71Å; R2037-Y2041 HydrophobicContact CB-CG 3.92Å; R2037-Y2041 VanDerWaalsContact CD-CE1 3.45Å; R2037-Y2041 HydrophobicContact CG-CD1 3.76Å; R2037-Y2041 HydrophobicContact CG-CD2 4.37Å; R2037-Y2041 HydrophobicContact CG-CE1 4.17Å; R2037-Y2041 HydrophobicContact CG-CG 3.9Å; R2037-Y2041 VanDerWaalsContact CZ-CE1 3.42Å; R2037-Y2041 PolarHBondContact NH1-OH 3.49Å; R2037-Y2041 VanDerWaalsContact NH2-CZ 3.33Å; R2037-Y2041 PolarHBondContact NH2-OH 3.36Å; R2037-F2042 HydrophobicContact CB-CE2 3.77Å; R2037-F2042 HydrophobicContact CB-CZ 3.96Å; R2037-F2042 WeakPolarHBondContact O-CE2 3.31Å
2038T62.7Low62.3Low99 Ų99111 Ų11161%0.60752%0.524SS*.  trans-67.7160.9-176.959.40000112.4R2040 Y2041T2038-R2040 PolarHBondContact O-N 3.05Å; T2038-R2040 VanDerWaalsContact O-N 3.13Å; T2038-Y2041 VanDerWaalsContact O-CB 3.3Å; T2038-Y2041 WeakPolarHBondContact O-CB 3.2Å; T2038-Y2041 PolarHBondContact O-N 2.93Å
2039K60.2Low60.9Low200 Ų200108.9 Ų108.987%0.8753%0.529SS*.Hα-helixtrans-50.8-37.3173.9-89.4-174.6175.6179.10112.9Y2041 F2042 A2043K2039-Y2041 VanDerWaalsContact C-N 3.3Å; K2039-Y2041 PolarHBondContact O-N 3.28Å; K2039-F2042 PolarHBondContact O-N 3.44Å; K2039-A2043 PolarHBondContact O-N 3.21Å
2040R60.5Low59.9Low217 Ų217110.1 Ų110.182%0.81952%0.522SS*.Hα-helixtrans-62.8-31.6176-89.9-175.8173.7173.1-1.8113.2T2038 A2043 K2044T2038-R2040 PolarHBondContact O-N 3.05Å; T2038-R2040 VanDerWaalsContact O-N 3.13Å; R2040-A2043 PolarHBondContact O-N 2.97Å; R2040-K2044 PolarHBondContact O-N 2.88Å
2041Y65.4Low58.3Low65 Ų65108.8 Ų108.826%0.25552%0.519SS..Hα-helixtrans-64.2-47.4177.1-179.6-91.4000111.5R2037 T2038 K2039 A2043 K2044 H2045R2037-Y2041 HydrophobicContact CB-CD1 3.71Å; R2037-Y2041 HydrophobicContact CB-CG 3.92Å; R2037-Y2041 VanDerWaalsContact CD-CE1 3.45Å; R2037-Y2041 HydrophobicContact CG-CD1 3.76Å; R2037-Y2041 HydrophobicContact CG-CD2 4.37Å; R2037-Y2041 HydrophobicContact CG-CE1 4.17Å; R2037-Y2041 HydrophobicContact CG-CG 3.9Å; R2037-Y2041 VanDerWaalsContact CZ-CE1 3.42Å; R2037-Y2041 PolarHBondContact NH1-OH 3.49Å; R2037-Y2041 VanDerWaalsContact NH2-CZ 3.33Å; R2037-Y2041 PolarHBondContact NH2-OH 3.36Å; T2038-Y2041 VanDerWaalsContact O-CB 3.3Å; T2038-Y2041 WeakPolarHBondContact O-CB 3.2Å; T2038-Y2041 PolarHBondContact O-N 2.93Å; K2039-Y2041 VanDerWaalsContact C-N 3.3Å; K2039-Y2041 PolarHBondContact O-N 3.28Å; Y2041-A2043 PolarHBondContact O-N 2.91Å; Y2041-K2044 PolarHBondContact O-N 3.45Å; Y2041-H2045 AromaticContact CD2-CD2 3.91Å; Y2041-H2045 AromaticContact CE1-CD2 3.61Å; Y2041-H2045 AromaticContact CE2-CD2 3.3Å; Y2041-H2045 WeakPolarHBondContact CE2-CD2 3.16Å; Y2041-H2045 AromaticContact CE2-NE2 3.18Å; Y2041-H2045 WeakPolarHBondContact CE2-NE2 3.45Å; Y2041-H2045 AromaticContact CZ-CD2 3.1Å; Y2041-H2045 AromaticContact CZ-NE2 3.24Å; Y2041-H2045 PolarHBondContact O-N 3.2Å; Y2041-H2045 VanDerWaalsContact O-N 3.08Å; Y2041-H2045 PolarHBondContact OH-CD2 3.39Å; Y2041-H2045 PolarHBondContact OH-NE2 2.65Å
2042F59Low56.8Low71 Ų71113.7 Ų113.731%0.31155%0.551SS.*Hα-helixtrans-71.8-15.4177.7-63.7-73.2000114P2011 N2034 R2037 K2039 H2045P2011-F2042 HydrophobicContact CG-CD1 4.01Å; P2011-F2042 HydrophobicContact CG-CE1 3.93Å; N2034-F2042 HydrophobicContact CB-CE1 4.41Å; N2034-F2042 HydrophobicContact CB-CZ 3.81Å; R2037-F2042 HydrophobicContact CB-CE2 3.77Å; R2037-F2042 HydrophobicContact CB-CZ 3.96Å; R2037-F2042 WeakPolarHBondContact O-CE2 3.31Å; K2039-F2042 PolarHBondContact O-N 3.44Å; F2042-H2045 VanDerWaalsContact O-O 3.13Å
2043A55.2Low55.5Low76 Ų76110.6 Ų110.663%0.62854%0.535SS*.Hα-helixtrans-83.4-32.8169.200000112.4K2039 R2040 Y2041K2039-A2043 PolarHBondContact O-N 3.21Å; R2040-A2043 PolarHBondContact O-N 2.97Å; Y2041-A2043 PolarHBondContact O-N 2.91Å
2044K48.6Very low53.7Low181 Ų181112 Ų11279%0.78754%0.543SS*.Hα-helixtrans-80-14.8176.5-83.3-161.6170.3-163.70114.7R2040 Y2041 P2046R2040-K2044 PolarHBondContact O-N 2.88Å; Y2041-K2044 PolarHBondContact O-N 3.45Å; K2044-P2046 WeakPolarHBondContact O-CD 3.29Å
2045H48.1Very low52.3Low106 Ų106116 Ų11649%0.49157%0.569SS.*SBendtrans-113.388.7165.1-66.1-79.3000107.6Y2041 F2042Y2041-H2045 AromaticContact CD2-CD2 3.91Å; Y2041-H2045 AromaticContact CE1-CD2 3.61Å; Y2041-H2045 AromaticContact CE2-CD2 3.3Å; Y2041-H2045 WeakPolarHBondContact CE2-CD2 3.16Å; Y2041-H2045 AromaticContact CE2-NE2 3.18Å; Y2041-H2045 WeakPolarHBondContact CE2-NE2 3.45Å; Y2041-H2045 AromaticContact CZ-CD2 3.1Å; Y2041-H2045 AromaticContact CZ-NE2 3.24Å; Y2041-H2045 PolarHBondContact O-N 3.2Å; Y2041-H2045 VanDerWaalsContact O-N 3.08Å; Y2041-H2045 PolarHBondContact OH-CD2 3.39Å; Y2041-H2045 PolarHBondContact OH-NE2 2.65Å; F2042-H2045 VanDerWaalsContact O-O 3.13Å
2046P42.7Very low50.6Low105 Ų105114.6 Ų114.668%0.68257%0.572SS**  trans-53.5164.1171.7-22.433.7000110.7K2044 M2048K2044-P2046 WeakPolarHBondContact O-CD 3.29Å; P2046-M2048 PolarHBondContact O-N 3.3Å
2047R43.2Very low48.8Very low178 Ų178112.9 Ų112.967%0.67257%0.57SS**  trans-47.3142.7164.5-89.4177.6161.6177.6-8.2108.9M2008 G2049M2008-R2047 PolarHBondContact O-NH2 3.4Å; R2047-G2049 PolarHBondContact O-N 3.39Å
2048M39.6Very low47.4Very low176 Ų176118.7 Ų118.787%0.86760%0.6SS**  trans-58.690.8150.1-74.9-75.2-72.600106.2P2046P2046-M2048 PolarHBondContact O-N 3.3Å
2049G46.1Very low45.9Very low51 Ų51116.8 Ų116.853%0.52660%0.6SS.*  trans-75.4152154.700000107.4R2047R2047-G2049 PolarHBondContact O-N 3.39Å
2050Y56.4Low44.4Very low82 Ų82114.8 Ų114.832%0.32260%0.599SS.*  trans-55.7145165.5-50-58.5000108.8A1761 V1949 P2052A1761-Y2050 HydrophobicContact CB-CE2 4.34Å; V1949-Y2050 HydrophobicContact CB-CD1 4.11Å; V1949-Y2050 HydrophobicContact CB-CE1 4.27Å; V1949-Y2050 HydrophobicContact CG1-CD1 4.16Å; V1949-Y2050 HydrophobicContact CG1-CD2 4.29Å; V1949-Y2050 HydrophobicContact CG1-CE1 4.28Å; V1949-Y2050 HydrophobicContact CG1-CE2 4.39Å; V1949-Y2050 HydrophobicContact CG1-CG 4.15Å; V1949-Y2050 HydrophobicContact CG2-CD1 3.55Å; V1949-Y2050 HydrophobicContact CG2-CE1 3.32Å; V1949-Y2050 HydrophobicContact CG2-CG 4.36Å; Y2050-P2052 WeakPolarHBondContact O-CD 3.35Å
2051L45Very low43.1Very low54 Ų54111.6 Ų111.628%0.28360%0.598SS.*  trans-50.3111.1-175-173.555.3000109.5S1921 V2053S1921-L2051 WeakPolarHBondContact OG-CD2 3.3Å; L2051-V2053 WeakPolarHBondContact O-CG2 3.38Å; L2051-V2053 PolarHBondContact O-N 3.26Å
2052P45.6Very low41.7Very low111 Ų111115.9 Ų115.972%0.72162%0.623SS**  trans-67.5122.2-168.4-23.834.9000111.5Y2050Y2050-P2052 WeakPolarHBondContact O-CD 3.35Å
2053V47.8Very low40.3Very low13 Ų13118.3 Ų118.38%0.07964%0.635CS.*  trans-97.2112.5180177.30000107P1917 S1918 Q1946 L2051 T2055P1917-V2053 HydrophobicContact CB-CG1 3.51Å; P1917-V2053 HydrophobicContact CG-CG1 3.72Å; S1918-V2053 WeakPolarHBondContact OG-CG2 3.36Å; Q1946-V2053 HydrophobicContact CB-CG2 4.07Å; L2051-V2053 WeakPolarHBondContact O-CG2 3.38Å; L2051-V2053 PolarHBondContact O-N 3.26Å; V2053-T2055 PolarHBondContact O-N 2.92Å
2054Q34.3Very low39Very low160 Ų160119.3 Ų119.375%0.74863%0.633SS**  trans-78.3109-168.6-159.1168.17.200110.6P1917 V2056P1917-Q2054 WeakPolarHBondContact CB-O 3.28Å; P1917-Q2054 VanDerWaalsContact CG-O 3.25Å; P1917-Q2054 WeakPolarHBondContact CG-O 3.47Å; Q2054-V2056 VanDerWaalsContact C-N 3.3Å; Q2054-V2056 PolarHBondContact O-N 3.28Å
2055T40.6Very low37.9Very low100 Ų100116.6 Ų116.661%0.61363%0.634SS**  trans-86.724.8-168.754.20000115.1V2053V2053-T2055 PolarHBondContact O-N 2.92Å
2056V31Very low36.9Very low113 Ų113117 Ų11769%0.68564%0.644SS**  trans-105.6133178.1-175.10000108.3Q2054Q2054-V2056 VanDerWaalsContact C-N 3.3Å; Q2054-V2056 PolarHBondContact O-N 3.28Å
2057L29Very low36.2Very low137 Ų137117.3 Ų117.372%0.71764%0.644SS**  trans90.1102.8-168.2-55.9164.1000113.5N1914N1914-L2057 PolarHBondContact ND2-O 3.49Å
2058E35Very low35.3Very low198 Ų198117.5 Ų117.593%0.92566%0.657SS**  trans-63.6134.2156.9-66.3169.3161.500108
2059G30.3Very low34.6Very low59 Ų59115 Ų11561%0.60865%0.646SS**  trans-125.8149.7174.200000108.4
2060D28.7Very low33.6Very low157 Ų157119 Ų11984%0.8466%0.655SS**  trans-51.6144-166.4-59.6-52.3000114.2M2062D2060-M2062 PolarHBondContact O-N 3.4Å
2061N33.7Very low32Very low151 Ų151125.6 Ų125.681%0.80769%0.686SS**  trans-56.9112.7178.3-91.6-29.9000110.8E2063N2061-E2063 PolarHBondContact O-N 3.5Å
2062M34.8Very low31Very low155 Ų155134.1 Ų134.176%0.76472%0.715SS**  trans-8215.1177.2-75.2-78.9-112.600113.5R1888 D2060R1888-M2062 HydrophobicContact CG-CE 4.04Å; D2060-M2062 PolarHBondContact O-N 3.4Å
2063E30.5Very low30.3Very low122 Ų122134.4 Ų134.457%0.5772%0.717SS**SBendtrans-93128164.5-67.3-16915300108.9H1895 N2061H1895-E2063 IonicContact CE1-OE1 2.96Å; H1895-E2063 PolarHBondContact CE1-OE1 2.86Å; H1895-E2063 VanDerWaalsContact CE1-OE1 3.31Å; H1895-E2063 IonicContact NE2-OE1 3.55Å; N2061-E2063 PolarHBondContact O-N 3.5Å
2064T27.8Very low29.3Very low97 Ų97140 Ų14060%0.59575%0.751SS**SBendtrans77.4115.2-177.3-25.40000115.5V2066T2064-V2066 VanDerWaalsContact C-N 3.27Å; T2064-V2066 PolarHBondContact O-N 3.43Å
2065P25.7Very low28.9Very low123 Ų123139.6 Ų139.680%0.79975%0.754SS**  trans-73.686.916032.1-30.7000108.4T2067P2065-T2067 PolarHBondContact O-N 3.11Å
2066V27.5Very low28.2Very low115 Ų115141 Ų14170%0.69777%0.768SS**  trans-52.9124.7161.3177.90000106.6T2064 L2068T2064-V2066 VanDerWaalsContact C-N 3.27Å; T2064-V2066 PolarHBondContact O-N 3.43Å; V2066-L2068 PolarHBondContact O-N 3.3Å
2067T27.1Very low28Very low112 Ų112140.3 Ų140.369%0.68777%0.773SS**  trans-59.5100-163.241.10000112.4P2065 I2069P2065-T2067 PolarHBondContact O-N 3.11Å; T2067-I2069 PolarHBondContact O-N 3.25Å
2068L25.5Very low28.2Very low182 Ų182140 Ų14095%0.95378%0.78SS**  trans-69.666.5160.9-98166.7000109.6V2066V2066-L2068 PolarHBondContact O-N 3.3Å
2069I23.8Very low27.8Very low122 Ų122135.5 Ų135.563%0.62678%0.776SS**  trans-122.6109.5172.8-67.6-177.1000107.4T2067T2067-I2069 PolarHBondContact O-N 3.25Å
2070N24.8Very low27.5Very low135 Ų135138.1 Ų138.172%0.72279%0.785SS**  trans7960.3157.4-54.9-11.6000119.4
2071F23.4Very low27.4Very low221 Ų221136.4 Ų136.497%0.96979%0.786SS**  trans-99.156.8134.7-103.2-75.2000110.8
2072W23.7Very low27.6Very low233 Ų233134.6 Ų134.688%0.88378%0.782SS**SBendtrans-122.1132161.3-94.258.6000108.2
2073P30.3Very low27.3Very low118 Ų118135.6 Ų135.677%0.76679%0.785SS**  trans-75.5132.9-166.3-13.729.7000112.5
2074V28.2Very low27.3Very low130 Ų130138.3 Ų138.379%0.78880%0.802SS**  trans21.3104.9143-171.20000116.4
2075D25.8Very low27.4Very low152 Ų152138.6 Ų138.681%0.81381%0.808SS**  trans-177.8107.3130.4-96.1-23.1000111
2076S26.3Very low27.7Very low130 Ų130138.5 Ų138.591%0.90980%0.797SS**  trans160.6146.5149.8-76.40000111.9
2077A25.9Very low28Very low97 Ų97140 Ų14080%0.80280%0.801SS**  trans-75.5156.1-163.600000115.5
2078P33.1Very low28.8Very low131 Ų131139.1 Ų139.185%0.85179%0.792SS**  trans-79.8140.9-171.332.1-35.7000113.5
2079A27Very low29.5Very low103 Ų103135 Ų13585%0.85177%0.774SS**  trans-110132.6167.100000110.2
2080S24.4Very low30.2Very low115 Ų115135.5 Ų135.580%0.80477%0.774SS**  trans-83137.7-164.6-38.60000114.2
2081S27Very low31.5Very low121 Ų121131.9 Ų131.985%0.84676%0.759SS**  trans-164.2129.7138-83.70000111.1
2082P37.9Very low32.6Very low112 Ų112126.5 Ų126.573%0.72773%0.733SS**  trans-101.4177.9-17640.9-36.8000113.5
2083Q28Very low33.8Very low176 Ų176120.2 Ų120.282%0.82272%0.715SS**  trans70.383.3162.5-63.2177.7-32.400118.9
2084L29.3Very low34.8Very low179 Ų179119.4 Ų119.494%0.93770%0.701SS**  trans-142.597.1134.6-80.9-174.5000109.7H2086L2084-H2086 PolarHBondContact O-N 3.1Å
2085S30.5Very low36.1Very low103 Ų103119.5 Ų119.572%0.7269%0.693SS**  trans-9464.8-171.160.60000113.3
2086H33Very low37.4Very low121 Ų121116.7 Ų116.756%0.5667%0.671SS**  trans-142.168.5173.7-80.8-59.5000113.3L2084 R2286L2084-H2086 PolarHBondContact O-N 3.1Å; H2086-R2286 PolarHBondContact CD2-NH1 3.27Å; H2086-R2286 PolarHBondContact CE1-NH1 3.21Å; H2086-R2286 PolarHBondContact CE1-NH2 2.94Å; H2086-R2286 PolarHBondContact ND1-NH1 3.35Å; H2086-R2286 PolarHBondContact NE2-NH1 3.46Å; H2086-R2286 PolarHBondContact NE2-NH2 3.49Å
2087D33.9Very low38.8Very low146 Ų146113.1 Ų113.178%0.78165%0.65SS**  trans-73.3126.2162.6-73.8-44.6000110.5
2088D43.7Very low40.2Very low95 Ų95111.5 Ų111.551%0.50863%0.633SS.*  trans-74.5158-171.2-167.111.3000112.1H2090 S2091 R2092D2088-H2090 PolarHBondContact O-N 2.98Å; D2088-H2090 VanDerWaalsContact O-N 3.13Å; D2088-H2090 IonicContact OD2-CD2 2.73Å; D2088-S2091 PolarHBondContact O-N 3.04Å; D2088-S2091 VanDerWaalsContact O-N 3.17Å; D2088-R2092 PolarHBondContact O-N 2.87Å
2089T39.1Very low41.2Very low94 Ų94112 Ų11258%0.57762%0.618SS**Hα-helixtrans-55.1-32179-48.20000111.6R2092 I2093T2089-R2092 PolarHBondContact O-N 2.98Å; T2089-I2093 HydrophobicContact CG2-CD1 4.22Å; T2089-I2093 WeakPolarHBondContact O-CG1 3.27Å; T2089-I2093 PolarHBondContact O-N 3Å
2090H39.4Very low42.1Very low133 Ų133112 Ų11262%0.61660%0.602SS**Hα-helixtrans-64.9-46.8177.9-74.6-77.2000113.3D2088 R2092 I2093 E2094D2088-H2090 PolarHBondContact O-N 2.98Å; D2088-H2090 VanDerWaalsContact O-N 3.13Å; D2088-H2090 IonicContact OD2-CD2 2.73Å; H2090-R2092 PolarHBondContact O-N 3.27Å; H2090-I2093 PolarHBondContact O-N 2.86Å; H2090-I2093 VanDerWaalsContact O-N 3.1Å; H2090-E2094 PolarHBondContact O-N 2.7Å
2091S51.1Low43.7Very low59 Ų59108.5 Ų108.541%0.41358%0.581SS.*Hα-helixtrans-60.6-31.7176.8-44.50000111.9D2088 H2095D2088-S2091 PolarHBondContact O-N 3.04Å; D2088-S2091 VanDerWaalsContact O-N 3.17Å; S2091-H2095 WeakPolarHBondContact O-CB 3.48Å; S2091-H2095 PolarHBondContact O-N 2.78Å
2092R46.3Very low44.5Very low109 Ų109109 Ų10941%0.41157%0.57SS.*Hα-helixtrans-73.9-38.8175.6-64.2-173.162.6154.43.3112.8D2088 T2089 H2090 E2094 H2095 Y2096D2088-R2092 PolarHBondContact O-N 2.87Å; T2089-R2092 PolarHBondContact O-N 2.98Å; H2090-R2092 PolarHBondContact O-N 3.27Å; R2092-E2094 VanDerWaalsContact C-N 3.32Å; R2092-H2095 PolarHBondContact O-N 2.81Å; R2092-Y2096 WeakPolarHBondContact O-CD2 3.3Å; R2092-Y2096 PolarHBondContact O-N 3.21Å
2093I50.6Low44.8Very low100 Ų100109 Ų10951%0.51356%0.561SS.*Hα-helixtrans-62.9-43.6173.3-69.7164.8000109.8T2089 H2090 Y2096 A2097T2089-I2093 HydrophobicContact CG2-CD1 4.22Å; T2089-I2093 WeakPolarHBondContact O-CG1 3.27Å; T2089-I2093 PolarHBondContact O-N 3Å; H2090-I2093 PolarHBondContact O-N 2.86Å; H2090-I2093 VanDerWaalsContact O-N 3.1Å; I2093-Y2096 PolarHBondContact O-N 2.96Å; I2093-A2097 WeakPolarHBondContact O-CB 3.32Å; I2093-A2097 PolarHBondContact O-N 3.43Å
2094E49.9Very low45.5Very low101 Ų101107.4 Ų107.447%0.47255%0.554SS.*Hα-helixtrans-60.4-46.6175.6-165.7169.4-141.400111H2090 R2092 Y2096 A2097 S2098H2090-E2094 PolarHBondContact O-N 2.7Å; R2092-E2094 VanDerWaalsContact C-N 3.32Å; E2094-Y2096 VanDerWaalsContact C-N 3.34Å; E2094-Y2096 PolarHBondContact O-N 3.43Å; E2094-A2097 PolarHBondContact O-N 2.96Å; E2094-A2097 VanDerWaalsContact O-N 3.13Å; E2094-S2098 PolarHBondContact O-N 3.13Å; E2094-S2098 PolarHBondContact O-OG 3.34Å
2095H56Low46.1Very low132 Ų132105.4 Ų105.461%0.61154%0.544SS*.Hα-helixtrans-64.4-33.1177-155.9-35000113.5S2091 R2092 R2099S2091-H2095 WeakPolarHBondContact O-CB 3.48Å; S2091-H2095 PolarHBondContact O-N 2.78Å; R2092-H2095 PolarHBondContact O-N 2.81Å; H2095-R2099 WeakPolarHBondContact O-CB 3.17Å; H2095-R2099 PolarHBondContact O-N 3.01Å; H2095-R2099 VanDerWaalsContact O-N 3.13Å
2096Y52.4Low46.4Very low93 Ų93104.9 Ų104.937%0.36554%0.54SS..Hα-helixtrans-73.3-36.2171.6-74.8-59.1000112.4R2092 I2093 E2094 R2099 L2100R2092-Y2096 WeakPolarHBondContact O-CD2 3.3Å; R2092-Y2096 PolarHBondContact O-N 3.21Å; I2093-Y2096 PolarHBondContact O-N 2.96Å; E2094-Y2096 VanDerWaalsContact C-N 3.34Å; E2094-Y2096 PolarHBondContact O-N 3.43Å; Y2096-R2099 PolarHBondContact O-N 3.38Å; Y2096-L2100 WeakPolarHBondContact O-CB 3.3Å; Y2096-L2100 PolarHBondContact O-N 2.61Å
2097A55.9Low46.3Very low55 Ų55105.3 Ų105.346%0.45555%0.547SS..Hα-helixtrans-66-43.7175.300000111.6I2093 E2094 R2099 L2100 A2101I2093-A2097 WeakPolarHBondContact O-CB 3.32Å; I2093-A2097 PolarHBondContact O-N 3.43Å; E2094-A2097 PolarHBondContact O-N 2.96Å; E2094-A2097 VanDerWaalsContact O-N 3.13Å; A2097-R2099 VanDerWaalsContact C-N 3.31Å; A2097-R2099 PolarHBondContact O-N 3.02Å; A2097-L2100 PolarHBondContact O-N 3.45Å; A2097-A2101 WeakPolarHBondContact O-CB 3.28Å; A2097-A2101 PolarHBondContact O-N 3.15Å
2098S56.5Low46Very low64 Ų64101.7 Ų101.745%0.44855%0.545SS..Hα-helixtrans-61-39.7171.8-58.40000111.8E2094 A2101 E2102E2094-S2098 PolarHBondContact O-N 3.13Å; E2094-S2098 PolarHBondContact O-OG 3.34Å; S2098-A2101 PolarHBondContact O-N 3.12Å; S2098-E2102 WeakPolarHBondContact O-CB 3.46Å; S2098-E2102 WeakPolarHBondContact O-CG 3.21Å; S2098-E2102 PolarHBondContact O-N 3.22Å
2099R52.7Low45.2Very low142 Ų142101.6 Ų101.654%0.53655%0.551SS.*Hα-helixtrans-71.4-31.8178.8-150.8177-156.3177.44.2112.9H2095 Y2096 A2097 M2103H2095-R2099 WeakPolarHBondContact O-CB 3.17Å; H2095-R2099 PolarHBondContact O-N 3.01Å; H2095-R2099 VanDerWaalsContact O-N 3.13Å; Y2096-R2099 PolarHBondContact O-N 3.38Å; A2097-R2099 VanDerWaalsContact C-N 3.31Å; A2097-R2099 PolarHBondContact O-N 3.02Å; R2099-M2103 WeakPolarHBondContact O-CB 3.46Å; R2099-M2103 PolarHBondContact O-N 2.92Å
2100L47.4Very low44.5Very low101 Ų101108.4 Ų108.453%0.52957%0.568SS.*Hα-helixtrans-66.7-47.3169.6-97.3151.7000111Y2096 A2097 E2102 M2103 E2104Y2096-L2100 WeakPolarHBondContact O-CB 3.3Å; Y2096-L2100 PolarHBondContact O-N 2.61Å; A2097-L2100 PolarHBondContact O-N 3.45Å; L2100-E2102 VanDerWaalsContact C-N 3.32Å; L2100-E2102 PolarHBondContact O-N 3.32Å; L2100-M2103 PolarHBondContact O-N 3.11Å; L2100-E2104 WeakPolarHBondContact O-CG 3.27Å; L2100-E2104 PolarHBondContact O-N 2.92Å
2101A56.1Low43.8Very low43 Ų43109.8 Ų109.836%0.35558%0.579SS.*Hα-helixtrans-63.5-34.3175.400000112.9A2097 S2098 N2105A2097-A2101 WeakPolarHBondContact O-CB 3.28Å; A2097-A2101 PolarHBondContact O-N 3.15Å; S2098-A2101 PolarHBondContact O-N 3.12Å; A2101-N2105 WeakPolarHBondContact O-CB 3.46Å; A2101-N2105 PolarHBondContact O-N 3.46Å; A2101-N2105 PolarHBondContact O-ND2 3.28Å
2102E44.8Very low42.6Very low132 Ų132114.4 Ų114.462%0.61760%0.599SS**Hα-helixtrans-67.8-36.3170.1-78.5-177.3163.500112.2S2098 L2100 N2105 S2106S2098-E2102 WeakPolarHBondContact O-CB 3.46Å; S2098-E2102 WeakPolarHBondContact O-CG 3.21Å; S2098-E2102 PolarHBondContact O-N 3.22Å; L2100-E2102 VanDerWaalsContact C-N 3.32Å; L2100-E2102 PolarHBondContact O-N 3.32Å; E2102-N2105 PolarHBondContact O-N 2.66Å; E2102-S2106 VanDerWaalsContact O-CB 3.27Å; E2102-S2106 WeakPolarHBondContact O-CB 3.41Å; E2102-S2106 PolarHBondContact O-N 3.46Å; E2102-S2106 PolarHBondContact O-OG 3.05Å
2103M43.2Very low41.8Very low110 Ų110116.6 Ų116.654%0.54262%0.619SS.*Hα-helixtrans-71.7-38.6177.5-158.8177.480.500112.1R2099 L2100 S2106 N2107R2099-M2103 WeakPolarHBondContact O-CB 3.46Å; R2099-M2103 PolarHBondContact O-N 2.92Å; L2100-M2103 PolarHBondContact O-N 3.11Å; M2103-S2106 WeakPolarHBondContact CA-OG 3.26Å; M2103-S2106 PolarHBondContact O-N 3.02Å; M2103-S2106 PolarHBondContact O-OG 3.02Å; M2103-N2107 PolarHBondContact O-N 3.48Å
2104E42.7Very low40.7Very low144 Ų144117.2 Ų117.267%0.67363%0.632SS**Hα-helixtrans-63.6-42.1171.6-72.4177.6154.600111.3L2100L2100-E2104 WeakPolarHBondContact O-CG 3.27Å; L2100-E2104 PolarHBondContact O-N 2.92Å
2105N43.8Very low39.7Very low137 Ų137120.3 Ų120.373%0.73365%0.65SS**Hα-helixtrans-73.2-27.9177.1-78.5-41.7000114.3A2101 E2102A2101-N2105 WeakPolarHBondContact O-CB 3.46Å; A2101-N2105 PolarHBondContact O-N 3.46Å; A2101-N2105 PolarHBondContact O-ND2 3.28Å; E2102-N2105 PolarHBondContact O-N 2.66Å
2106S36.6Very low38.4Very low91 Ų91118.7 Ų118.764%0.63665%0.654SS**Hα-helixtrans-87.4-15.4-177.251.70000114.6E2102 M2103 G2108E2102-S2106 VanDerWaalsContact O-CB 3.27Å; E2102-S2106 WeakPolarHBondContact O-CB 3.41Å; E2102-S2106 PolarHBondContact O-N 3.46Å; E2102-S2106 PolarHBondContact O-OG 3.05Å; M2103-S2106 WeakPolarHBondContact CA-OG 3.26Å; M2103-S2106 PolarHBondContact O-N 3.02Å; M2103-S2106 PolarHBondContact O-OG 3.02Å; S2106-G2108 PolarHBondContact O-N 3.23Å
2107N30.2Very low37.5Very low130 Ų130120.1 Ų120.170%0.69568%0.675SS**THydrogen-bonded Turntrans-83.512.1170.1-79-19.8000113.8M2103 S2109M2103-N2107 PolarHBondContact O-N 3.48Å; N2107-S2109 VanDerWaalsContact C-N 3.28Å; N2107-S2109 PolarHBondContact O-N 2.96Å
2108G27.2Very low36.5Very low71 Ų71121.9 Ų121.973%0.73268%0.676SS**  trans-68.269.6177.500000114.7S2106S2106-G2108 PolarHBondContact O-N 3.23Å
2109S26.3Very low35.4Very low93 Ų93125.7 Ų125.765%0.6569%0.687SS**  trans-154.550.6170.7-175.90000114.8N2107N2107-S2109 VanDerWaalsContact C-N 3.28Å; N2107-S2109 PolarHBondContact O-N 2.96Å
2110Y24.7Very low34.7Very low237 Ų237124 Ų12493%0.92970%0.697SS**SBendtrans-143.8127.9145.8-85.2-66.6000111.1N2112Y2110-N2112 PolarHBondContact O-N 3.29Å
2111L25.2Very low34.5Very low161 Ų161123.2 Ų123.284%0.84369%0.692SS**  trans-73.3119.4-174.4-72.1160.4000111.7
2112N26.9Very low33.8Very low156 Ų156125.2 Ų125.283%0.83470%0.697SS**  trans-161.592.6141.4-115.10.9000111.1Y2110 S2114Y2110-N2112 PolarHBondContact O-N 3.29Å; N2112-S2114 PolarHBondContact O-N 3.07Å
2113D28.2Very low33.8Very low155 Ų155124.2 Ų124.283%0.82970%0.696SS**  trans-68.693172.5-73.3-47.2000110.8
2114S27.9Very low34Very low113 Ų113125.3 Ų125.379%0.7970%0.7SS**  trans-160.837.2165.5-76.40000113.9N2112N2112-S2114 PolarHBondContact O-N 3.07Å
2115I28.5Very low34.3Very low166 Ų166123.4 Ų123.485%0.85169%0.691SS**  trans-113.985.6169.2-54.4179.5000108.6
2116S28.4Very low34.6Very low98 Ų98121.8 Ų121.869%0.68568%0.681SS**  trans-107.5127.8165.5-168.10000107.3N2118S2116-N2118 PolarHBondContact O-N 3.35Å
2117P34.6Very low35.3Very low124 Ų124121.6 Ų121.681%0.80567%0.673SS**SBendtrans-76.385.9-163.630.1-36.3000111.8
2118N34.6Very low36.5Very low92 Ų92119.8 Ų119.849%0.49266%0.662SS.*  trans-144.613.6-176.5-141.279.8000114.5S2116 S2120 I2121S2116-N2118 PolarHBondContact O-N 3.35Å; N2118-S2120 VanDerWaalsContact C-N 3.25Å; N2118-S2120 PolarHBondContact O-N 3.49Å; N2118-S2120 VanDerWaalsContact O-N 3.13Å; N2118-I2121 PolarHBondContact O-N 3.44Å
2119E33.3Very low38Very low143 Ų143121.4 Ų121.467%0.66865%0.651SS**Hα-helixtrans-57.7-28.3-172.5-68.2176.1148.800114.5I2121 D2122 D2123E2119-I2121 PolarHBondContact O-N 3.25Å; E2119-D2122 PolarHBondContact O-N 2.99Å; E2119-D2123 PolarHBondContact O-N 3.36Å
2120S37.9Very low39.4Very low107 Ų107121.3 Ų121.375%0.74864%0.64SS**Hα-helixtrans-58.7-14174.3176.70000114.8N2118N2118-S2120 VanDerWaalsContact C-N 3.25Å; N2118-S2120 PolarHBondContact O-N 3.49Å; N2118-S2120 VanDerWaalsContact O-N 3.13Å
2121I42.9Very low40.6Very low84 Ų84116.1 Ų116.143%0.43162%0.62SS.*Hα-helixtrans-105.1-31173.2-80.5174.6000111.6N2118 E2119 E2124 H2125N2118-I2121 PolarHBondContact O-N 3.44Å; E2119-I2121 PolarHBondContact O-N 3.25Å; I2121-E2124 PolarHBondContact O-N 3.02Å; I2121-H2125 VanDerWaalsContact CG2-CD2 3.47Å; I2121-H2125 WeakPolarHBondContact CG2-CD2 3.47Å; I2121-H2125 PolarHBondContact O-CD2 3.02Å; I2121-H2125 PolarHBondContact O-N 2.77Å
2122D41.9Very low42Very low86 Ų86111.3 Ų111.346%0.4660%0.599SS.*Hα-helixtrans-73.6-27.7-179.7-71.6-41.1000112.2E2119 H2125 L2126E2119-D2122 PolarHBondContact O-N 2.99Å; D2122-H2125 CarbonylContact O-C 3.57Å; D2122-H2125 PolarHBondContact O-N 3.5Å; D2122-L2126 WeakPolarHBondContact O-CB 3.48Å; D2122-L2126 PolarHBondContact O-N 2.8Å
2123D43.7Very low43.4Very low111 Ų111108.3 Ų108.359%0.59458%0.58SS**Hα-helixtrans-65.6-43.2170.4-70.3-23.9000112.8E2119 H2125 L2126 L2127E2119-D2123 PolarHBondContact O-N 3.36Å; D2123-H2125 VanDerWaalsContact C-N 3.27Å; D2123-H2125 PolarHBondContact O-N 2.68Å; D2123-L2126 PolarHBondContact O-N 3.03Å; D2123-L2127 VanDerWaalsContact O-CB 3.3Å; D2123-L2127 WeakPolarHBondContact O-CB 3.44Å; D2123-L2127 PolarHBondContact O-N 2.98Å
2124E47.7Very low44.4Very low133 Ų133104.5 Ų104.562%0.62157%0.565SS**Hα-helixtrans-62.3-38.9171.6-79.2-158.7148.700110.5I2121 I2128I2121-E2124 PolarHBondContact O-N 3.02Å; E2124-I2128 VanDerWaalsContact O-CB 3.27Å; E2124-I2128 WeakPolarHBondContact O-CB 3.49Å; E2124-I2128 WeakPolarHBondContact O-CD1 3.34Å; E2124-I2128 WeakPolarHBondContact O-CG1 3.47Å; E2124-I2128 PolarHBondContact O-N 3.1Å
2125H49.4Very low45.4Very low104 Ų104105.1 Ų105.148%0.48156%0.559SS.*Hα-helixtrans-71.2-36.3177.7-74.2-33.8000113.7I2121 D2122 D2123 Q2129I2121-H2125 VanDerWaalsContact CG2-CD2 3.47Å; I2121-H2125 WeakPolarHBondContact CG2-CD2 3.47Å; I2121-H2125 PolarHBondContact O-CD2 3.02Å; I2121-H2125 PolarHBondContact O-N 2.77Å; D2122-H2125 CarbonylContact O-C 3.57Å; D2122-H2125 PolarHBondContact O-N 3.5Å; D2123-H2125 VanDerWaalsContact C-N 3.27Å; D2123-H2125 PolarHBondContact O-N 2.68Å; H2125-Q2129 WeakPolarHBondContact O-CB 3.22Å; H2125-Q2129 PolarHBondContact O-N 3.09Å
2126L50.1Low46.3Very low102 Ų102103.6 Ų103.653%0.53455%0.553SS.*Hα-helixtrans-67.5-44174.2-125.188.1000110.4D2122 D2123 I2128 Q2129 H2130D2122-L2126 WeakPolarHBondContact O-CB 3.48Å; D2122-L2126 PolarHBondContact O-N 2.8Å; D2123-L2126 PolarHBondContact O-N 3.03Å; L2126-I2128 PolarHBondContact O-N 3.05Å; L2126-Q2129 PolarHBondContact O-N 3.31Å; L2126-Q2129 VanDerWaalsContact O-N 3.16Å; L2126-H2130 WeakPolarHBondContact O-CB 3.48Å; L2126-H2130 PolarHBondContact O-N 3.17Å
2127L51.4Low46.7Very low87 Ų87106.3 Ų106.346%0.45556%0.555SS.*Hα-helixtrans-62.8-44176.6-171.565000111.1D2123 Y2131 I2150 L2154D2123-L2127 VanDerWaalsContact O-CB 3.3Å; D2123-L2127 WeakPolarHBondContact O-CB 3.44Å; D2123-L2127 PolarHBondContact O-N 2.98Å; L2127-Y2131 WeakPolarHBondContact O-CB 3.3Å; L2127-Y2131 PolarHBondContact O-N 2.85Å; L2127-I2150 HydrophobicContact CD1-CG2 4.43Å; L2127-L2154 HydrophobicContact CD1-CD1 4.29Å
2128I56.2Low46.8Very low92 Ų92108.4 Ų108.447%0.47256%0.559SS.*Hα-helixtrans-63.5-40.5172.7-70.9165.5000110.9E2124 L2126 Y2131 C2132E2124-I2128 VanDerWaalsContact O-CB 3.27Å; E2124-I2128 WeakPolarHBondContact O-CB 3.49Å; E2124-I2128 WeakPolarHBondContact O-CD1 3.34Å; E2124-I2128 WeakPolarHBondContact O-CG1 3.47Å; E2124-I2128 PolarHBondContact O-N 3.1Å; L2126-I2128 PolarHBondContact O-N 3.05Å; I2128-Y2131 PolarHBondContact O-N 3.2Å; I2128-C2132 VanDerWaalsContact O-CB 3.3Å; I2128-C2132 WeakPolarHBondContact O-CB 3.36Å; I2128-C2132 PolarHBondContact O-N 3.09Å; I2128-C2132 PolarHBondContact O-SG 3.29Å
2129Q58.2Low46.6Very low105 Ų105109.3 Ų109.349%0.49157%0.572SS.*Hα-helixtrans-66-43.8179.3-174.5176.71800111.5H2125 L2126 Y2131 C2132 Q2133H2125-Q2129 WeakPolarHBondContact O-CB 3.22Å; H2125-Q2129 PolarHBondContact O-N 3.09Å; L2126-Q2129 PolarHBondContact O-N 3.31Å; L2126-Q2129 VanDerWaalsContact O-N 3.16Å; Q2129-Y2131 VanDerWaalsContact C-N 3.34Å; Q2129-C2132 PolarHBondContact O-N 3.31Å; Q2129-Q2133 WeakPolarHBondContact O-CB 3.21Å; Q2129-Q2133 WeakPolarHBondContact O-CG 3.41Å; Q2129-Q2133 PolarHBondContact O-N 2.93Å
2130H55.2Low46.9Very low92 Ų92108.1 Ų108.143%0.42658%0.577SS.*Hα-helixtrans-66.8-36.9177.2-151.8-89.3000111.3L2126 S2134L2126-H2130 WeakPolarHBondContact O-CB 3.48Å; L2126-H2130 PolarHBondContact O-N 3.17Å; H2130-S2134 WeakPolarHBondContact O-CB 3.49Å; H2130-S2134 PolarHBondContact O-N 2.86Å; H2130-S2134 PolarHBondContact O-OG 3.29Å
2131Y49.7Very low46.8Very low127 Ų127111 Ų11150%0.49858%0.583SS.*Hα-helixtrans-67.6-39.7172.5-150.5-92.9000112.4L2127 I2128 Q2129 S2134 L2135 P2147 I2150L2127-Y2131 WeakPolarHBondContact O-CB 3.3Å; L2127-Y2131 PolarHBondContact O-N 2.85Å; I2128-Y2131 PolarHBondContact O-N 3.2Å; Q2129-Y2131 VanDerWaalsContact C-N 3.34Å; Y2131-S2134 PolarHBondContact O-N 2.7Å; Y2131-L2135 HydrophobicContact CD1-CD1 3.95Å; Y2131-L2135 HydrophobicContact CE1-CD1 4.12Å; Y2131-L2135 WeakPolarHBondContact O-CG 3.42Å; Y2131-L2135 PolarHBondContact O-N 3.49Å; Y2131-P2147 HydrophobicContact CE2-CG 4.49Å; Y2131-I2150 HydrophobicContact CD2-CD1 4.24Å
2132C55Low46.5Very low60 Ų60112.9 Ų112.941%0.40560%0.604SS.*Hα-helixtrans-71.8-37.4176.9-69.60000112.8I2128 Q2129 S2134 L2135 N2136I2128-C2132 VanDerWaalsContact O-CB 3.3Å; I2128-C2132 WeakPolarHBondContact O-CB 3.36Å; I2128-C2132 PolarHBondContact O-N 3.09Å; I2128-C2132 PolarHBondContact O-SG 3.29Å; Q2129-C2132 PolarHBondContact O-N 3.31Å; C2132-S2134 VanDerWaalsContact C-N 3.33Å; C2132-L2135 PolarHBondContact O-N 3.46Å; C2132-N2136 PolarHBondContact O-N 3.5Å
2133Q56.3Low46.3Very low94 Ų94117.6 Ų117.644%0.43962%0.623SS.*Hα-helixtrans-65-39.6172.9-75.7-178.66.600111Q2129 L2135 N2136Q2129-Q2133 WeakPolarHBondContact O-CB 3.21Å; Q2129-Q2133 WeakPolarHBondContact O-CG 3.41Å; Q2129-Q2133 PolarHBondContact O-N 2.93Å; Q2133-L2135 PolarHBondContact O-N 2.98Å; Q2133-N2136 PolarHBondContact O-N 3.14Å
2134S50Low46.3Very low74 Ų74117.9 Ų117.952%0.51763%0.631SS.*Hα-helixtrans-63.6-18.6174.3-59.80000114H2130 Y2131 C2132H2130-S2134 WeakPolarHBondContact O-CB 3.49Å; H2130-S2134 PolarHBondContact O-N 2.86Å; H2130-S2134 PolarHBondContact O-OG 3.29Å; Y2131-S2134 PolarHBondContact O-N 2.7Å; C2132-S2134 VanDerWaalsContact C-N 3.33Å
2135L47.9Very low46.2Very low126 Ų126119.8 Ų119.866%0.6663%0.633SS**Hα-helixtrans-96.3-18.4178.1-77.5166.2000114.4Y2131 C2132 Q2133Y2131-L2135 HydrophobicContact CD1-CD1 3.95Å; Y2131-L2135 HydrophobicContact CE1-CD1 4.12Å; Y2131-L2135 WeakPolarHBondContact O-CG 3.42Å; Y2131-L2135 PolarHBondContact O-N 3.49Å; C2132-L2135 PolarHBondContact O-N 3.46Å; Q2133-L2135 PolarHBondContact O-N 2.98Å
2136N47.3Very low46.3Very low135 Ų135117.4 Ų117.472%0.72263%0.628SS**Hα-helixtrans-115.84.6-168.3-84.6-15.7000115.4C2132 Q2133 D2138C2132-N2136 PolarHBondContact O-N 3.5Å; Q2133-N2136 PolarHBondContact O-N 3.14Å; N2136-D2138 PolarHBondContact O-N 3.11Å
2137Q38.3Very low46Very low155 Ų155116.3 Ų116.372%0.72463%0.626SS**  trans-92.1100.3176.1-69.4-168.218.700111.9S2139Q2137-S2139 PolarHBondContact O-N 3.09Å
2138D35Very low46.1Very low168 Ų168114.8 Ų114.890%0.89863%0.626SS**  trans-6096.5169.5-79.9-49.2000111.2N2136N2136-D2138 PolarHBondContact O-N 3.11Å
2139S31.2Very low46.2Very low111 Ų111115 Ų11578%0.77663%0.625SS**  trans-152.5145.2161.2-88.40000112.4Q2137Q2137-S2139 PolarHBondContact O-N 3.09Å
2140P40.4Very low46Very low118 Ų118110.4 Ų110.477%0.76660%0.604SS**  trans-83.3130.7-155.530.2-35.4000114.3
2141L35.5Very low46.1Very low167 Ų167111 Ų11187%0.87461%0.61SS**SBendtrans59.869.5153.3-60173.6000117
2142S35.5Very low46.9Very low123 Ų123109.9 Ų109.986%0.8661%0.611SS**  trans-151.8155139.7-83.30000111.1
2143Q38.6Very low47.2Very low186 Ų186109.1 Ų109.187%0.86961%0.607SS**PPolyproline II helixtrans-65.1140.8-160.8-156.9166.8-3.600113.3
2144P42.8Very low47.4Very low117 Ų117107.7 Ų107.776%0.7660%0.602SS**PPolyproline II helixtrans-65138.4-176.825.7-34.7000112.2
2145R47.1Very low48.1Very low173 Ų173109.4 Ų109.465%0.65360%0.602SS**PPolyproline II helixtrans-64.1133.8179.3-70.5-174.2178.4-168.11.3110.7Q2149R2145-Q2149 HydrophobicContact CB-CB 4.41Å
2146S50.2Low48.9Very low54 Ų54107 Ų10738%0.37860%0.595SS.*PPolyproline II helixtrans-74.4155.4178.3680000111.5A2148 Q2149 I2150S2146-A2148 PolarHBondContact O-N 2.87Å; S2146-A2148 VanDerWaalsContact O-N 3.11Å; S2146-Q2149 WeakPolarHBondContact O-CB 3.48Å; S2146-Q2149 PolarHBondContact O-N 3.03Å; S2146-I2150 PolarHBondContact O-N 2.94Å
2147P45.4Very low49.8Very low78 Ų78107.4 Ų107.451%0.50659%0.593SS.*Hα-helixtrans-53.1-34.2179.2-28.835.7000114.3Y2131 Q2149 I2150 L2151Y2131-P2147 HydrophobicContact CE2-CG 4.49Å; P2147-Q2149 VanDerWaalsContact C-N 3.3Å; P2147-Q2149 PolarHBondContact O-N 3.28Å; P2147-I2150 PolarHBondContact O-N 3.19Å; P2147-L2151 PolarHBondContact O-N 2.88Å; P2147-L2151 VanDerWaalsContact O-N 3.11Å
2148A53Low50.9Low55 Ų55105.8 Ų105.846%0.45559%0.585SS.*Hα-helixtrans-61.3-35.5175.100000113S2146 I2150 I2152S2146-A2148 PolarHBondContact O-N 2.87Å; S2146-A2148 VanDerWaalsContact O-N 3.11Å; A2148-I2150 VanDerWaalsContact C-N 3.33Å; A2148-I2152 WeakPolarHBondContact O-CD1 3.41Å; A2148-I2152 WeakPolarHBondContact O-CG1 3.13Å; A2148-I2152 PolarHBondContact O-N 3.47Å
2149Q57.8Low52.2Low96 Ų96105.8 Ų105.845%0.44957%0.573SS.*Hα-helixtrans-74.5-23.6177.7-69.8170.5-47.200112.9R2145 S2146 P2147 S2153R2145-Q2149 HydrophobicContact CB-CB 4.41Å; S2146-Q2149 WeakPolarHBondContact O-CB 3.48Å; S2146-Q2149 PolarHBondContact O-N 3.03Å; P2147-Q2149 VanDerWaalsContact C-N 3.3Å; P2147-Q2149 PolarHBondContact O-N 3.28Å; Q2149-S2153 PolarHBondContact O-N 3.37Å; Q2149-S2153 PolarHBondContact O-OG 2.98Å; Q2149-S2153 VanDerWaalsContact O-OG 3.08Å
2150I53.7Low54.1Low9 Ų9101.9 Ų101.95%0.04655%0.549CS..Hα-helixtrans-76.1-44174.5-60.3175.8000109.4L2127 Y2131 S2146 P2147 A2148 S2153 L2154L2127-I2150 HydrophobicContact CD1-CG2 4.43Å; Y2131-I2150 HydrophobicContact CD2-CD1 4.24Å; S2146-I2150 PolarHBondContact O-N 2.94Å; P2147-I2150 PolarHBondContact O-N 3.19Å; A2148-I2150 VanDerWaalsContact C-N 3.33Å; I2150-S2153 WeakPolarHBondContact O-CB 3.44Å; I2150-S2153 PolarHBondContact O-N 3.34Å; I2150-L2154 HydrophobicContact CG2-CD1 4.43Å; I2150-L2154 PolarHBondContact O-N 3.27Å; I2150-L2154 VanDerWaalsContact O-N 3.13Å
2151L57.4Low55.2Low104 Ų104101.6 Ų101.655%0.54554%0.538SS..Hα-helixtrans-58.3-47.6173.3-82.6158.2000112.5P2147 S2153 L2154 E2155P2147-L2151 PolarHBondContact O-N 2.88Å; P2147-L2151 VanDerWaalsContact O-N 3.11Å; L2151-S2153 PolarHBondContact O-N 3.26Å; L2151-L2154 PolarHBondContact O-N 3.17Å; L2151-E2155 PolarHBondContact O-N 3.42Å
2152I66.3Low56.5Low104 Ų10498.6 Ų98.653%0.53352%0.522SS..Hα-helixtrans-61.5-30.6177.2-69.2163.1000112.1A2148 S2156A2148-I2152 WeakPolarHBondContact O-CD1 3.41Å; A2148-I2152 WeakPolarHBondContact O-CG1 3.13Å; A2148-I2152 PolarHBondContact O-N 3.47Å; I2152-S2156 WeakPolarHBondContact O-CB 3.42Å; I2152-S2156 PolarHBondContact O-N 3.07Å; I2152-S2156 PolarHBondContact O-OG 3.25Å
2153S62Low58.1Low44 Ų4499.1 Ų99.131%0.30851%0.511SS..Hα-helixtrans-70.4-45.2175.2-67.30000111.8Q2149 I2150 L2151 S2156 E2157Q2149-S2153 PolarHBondContact O-N 3.37Å; Q2149-S2153 PolarHBondContact O-OG 2.98Å; Q2149-S2153 VanDerWaalsContact O-OG 3.08Å; I2150-S2153 WeakPolarHBondContact O-CB 3.44Å; I2150-S2153 PolarHBondContact O-N 3.34Å; L2151-S2153 PolarHBondContact O-N 3.26Å; S2153-S2156 PolarHBondContact O-N 3.37Å; S2153-S2156 PolarHBondContact O-OG 3.36Å; S2153-E2157 PolarHBondContact O-N 3.06Å
2154L60.4Low60Low65 Ų6597.3 Ų97.334%0.3450%0.496SS..Hα-helixtrans-61.9-49176-74.2160.8000111.6L2127 I2150 L2151 S2156 E2157 E2158L2127-L2154 HydrophobicContact CD1-CD1 4.29Å; I2150-L2154 HydrophobicContact CG2-CD1 4.43Å; I2150-L2154 PolarHBondContact O-N 3.27Å; I2150-L2154 VanDerWaalsContact O-N 3.13Å; L2151-L2154 PolarHBondContact O-N 3.17Å; L2154-S2156 PolarHBondContact O-N 3.39Å; L2154-E2157 PolarHBondContact O-N 2.98Å; L2154-E2158 PolarHBondContact O-N 3.09Å
2155E64.4Low61.5Low110 Ų11096.4 Ų96.451%0.51448%0.484SS..Hα-helixtrans-56.7-26.9175.1-75.6-174.2150.100112.9L2151 R2159L2151-E2155 PolarHBondContact O-N 3.42Å; E2155-R2159 WeakPolarHBondContact O-CB 3.34Å; E2155-R2159 PolarHBondContact O-N 3.05Å
2156S64.8Low62.6Low74 Ų7492.8 Ų92.852%0.51748%0.477SS..Hα-helixtrans-81.6-29.4178.8740000113.9I2152 S2153 L2154 G2160I2152-S2156 WeakPolarHBondContact O-CB 3.42Å; I2152-S2156 PolarHBondContact O-N 3.07Å; I2152-S2156 PolarHBondContact O-OG 3.25Å; S2153-S2156 PolarHBondContact O-N 3.37Å; S2153-S2156 PolarHBondContact O-OG 3.36Å; L2154-S2156 PolarHBondContact O-N 3.39Å; S2156-G2160 PolarHBondContact O-N 3.16Å
2157E65.2Low63.8Low144 Ų14492.5 Ų92.567%0.67348%0.478SS*.Hα-helixtrans-76.8-44.9172.9-76.5-17713800110.8S2153 L2154 R2159 G2160 E2161S2153-E2157 PolarHBondContact O-N 3.06Å; L2154-E2157 PolarHBondContact O-N 2.98Å; E2157-R2159 VanDerWaalsContact C-N 3.31Å; E2157-R2159 PolarHBondContact O-N 3.02Å; E2157-G2160 WeakPolarHBondContact O-CA 3.08Å; E2157-G2160 PolarHBondContact O-N 3.36Å; E2157-E2161 PolarHBondContact O-N 3.03Å; E2157-E2161 VanDerWaalsContact O-N 3.16Å
2158E61.5Low65.2Low122 Ų12294.1 Ų94.157%0.5748%0.483SS*.Hα-helixtrans-56.7-42.4174.9-70.3177.7168.500112L2154 G2160 E2161 L2162L2154-E2158 PolarHBondContact O-N 3.09Å; E2158-G2160 VanDerWaalsContact C-N 3.33Å; E2158-G2160 PolarHBondContact O-N 2.94Å; E2158-E2161 PolarHBondContact O-N 3.28Å; E2158-L2162 PolarHBondContact O-N 3.13Å
2159R63.1Low65.7Low168 Ų16896.3 Ų96.363%0.63449%0.486SS*.Hα-helixtrans-58.9-41.4172.8-101.5-174.8165.6129.1-0.9112.9E2155 E2157 E2161 L2162 E2163E2155-R2159 WeakPolarHBondContact O-CB 3.34Å; E2155-R2159 PolarHBondContact O-N 3.05Å; E2157-R2159 VanDerWaalsContact C-N 3.31Å; E2157-R2159 PolarHBondContact O-N 3.02Å; R2159-E2161 VanDerWaalsContact C-N 3.26Å; R2159-E2161 PolarHBondContact O-N 3.46Å; R2159-L2162 PolarHBondContact O-N 2.89Å; R2159-E2163 WeakPolarHBondContact O-CB 3.39Å; R2159-E2163 WeakPolarHBondContact O-CG 3.49Å; R2159-E2163 PolarHBondContact O-N 3.4Å
2160G70.6Confident66.4Low28 Ų2897 Ų9729%0.28949%0.489SS..Hα-helixtrans-72.6-14.9-179.300000114.5S2156 E2157 E2158 R2164S2156-G2160 PolarHBondContact O-N 3.16Å; E2157-G2160 WeakPolarHBondContact O-CA 3.08Å; E2157-G2160 PolarHBondContact O-N 3.36Å; E2158-G2160 VanDerWaalsContact C-N 3.33Å; E2158-G2160 PolarHBondContact O-N 2.94Å; G2160-R2164 PolarHBondContact O-NE 3.15Å; G2160-R2164 PolarHBondContact O-NH2 3.33Å
2161E63.7Low67.7Low112 Ų112102 Ų10252%0.52351%0.512SS..Hα-helixtrans-88-44.1167-76.1-169.4153.900111.9E2157 E2158 R2159 E2163 R2164 I2165E2157-E2161 PolarHBondContact O-N 3.03Å; E2157-E2161 VanDerWaalsContact O-N 3.16Å; E2158-E2161 PolarHBondContact O-N 3.28Å; R2159-E2161 VanDerWaalsContact C-N 3.26Å; R2159-E2161 PolarHBondContact O-N 3.46Å; E2161-E2163 VanDerWaalsContact C-N 3.33Å; E2161-E2163 PolarHBondContact O-N 3.43Å; E2161-R2164 WeakPolarHBondContact O-CB 3.48Å; E2161-R2164 PolarHBondContact O-N 2.78Å; E2161-R2164 VanDerWaalsContact O-N 3.09Å; E2161-R2164 IonicContact OE1-NH2 2.8Å; E2161-I2165 WeakPolarHBondContact O-CG1 3.25Å; E2161-I2165 PolarHBondContact O-N 3.23Å
2162L62.3Low68.5Low105 Ų105102.7 Ų102.755%0.5551%0.513SS..Hα-helixtrans-57-43.7173.5-85.3159.5000112.6E2158 R2159 R2164 I2165 L2166E2158-L2162 PolarHBondContact O-N 3.13Å; R2159-L2162 PolarHBondContact O-N 2.89Å; L2162-R2164 VanDerWaalsContact C-N 3.31Å; L2162-R2164 PolarHBondContact O-N 3.41Å; L2162-I2165 PolarHBondContact O-N 3.31Å; L2162-L2166 WeakPolarHBondContact O-CB 3.41Å; L2162-L2166 PolarHBondContact O-N 2.8Å
2163E70.8Confident68.6Low134 Ų134102.7 Ų102.763%0.62651%0.514SS*.Hα-helixtrans-64.9-31.3176.5-75.5178.2-174.900112.8R2159 E2161 A2167R2159-E2163 WeakPolarHBondContact O-CB 3.39Å; R2159-E2163 WeakPolarHBondContact O-CG 3.49Å; R2159-E2163 PolarHBondContact O-N 3.4Å; E2161-E2163 VanDerWaalsContact C-N 3.33Å; E2161-E2163 PolarHBondContact O-N 3.43Å; E2163-A2167 WeakPolarHBondContact O-CB 3.43Å; E2163-A2167 PolarHBondContact O-N 2.78Å; E2163-A2167 VanDerWaalsContact O-N 3.1Å
2164R77.2Confident69.5Low147 Ų147107.9 Ų107.956%0.55553%0.527SS*.Hα-helixtrans-71.5-47.7173.4-99.2-179.6-69.3153.30.5112G2160 E2161 L2162 L2166 A2167 D2168G2160-R2164 PolarHBondContact O-NE 3.15Å; G2160-R2164 PolarHBondContact O-NH2 3.33Å; E2161-R2164 WeakPolarHBondContact O-CB 3.48Å; E2161-R2164 PolarHBondContact O-N 2.78Å; E2161-R2164 VanDerWaalsContact O-N 3.09Å; E2161-R2164 IonicContact OE1-NH2 2.8Å; L2162-R2164 VanDerWaalsContact C-N 3.31Å; L2162-R2164 PolarHBondContact O-N 3.41Å; R2164-L2166 VanDerWaalsContact C-N 3.27Å; R2164-L2166 PolarHBondContact O-N 3.44Å; R2164-A2167 PolarHBondContact O-N 2.9Å; R2164-A2167 VanDerWaalsContact O-N 3.09Å; R2164-D2168 PolarHBondContact O-N 2.95Å
2165I74.2Confident70.4Confident98 Ų98109.4 Ų109.450%0.50354%0.535SS..Hα-helixtrans-60.8-39.5178.5-66166.2000110.5E2161 L2162 L2169E2161-I2165 WeakPolarHBondContact O-CG1 3.25Å; E2161-I2165 PolarHBondContact O-N 3.23Å; L2162-I2165 PolarHBondContact O-N 3.31Å; I2165-L2169 HydrophobicContact CG2-CD1 3.96Å; I2165-L2169 WeakPolarHBondContact O-CB 3.26Å; I2165-L2169 VanDerWaalsContact O-CG 3.25Å; I2165-L2169 WeakPolarHBondContact O-CG 3.5Å; I2165-L2169 PolarHBondContact O-N 3.14Å
2166L69.8Low70.3Confident98 Ų98109.2 Ų109.251%0.51354%0.537SS..Hα-helixtrans-62.3-45.8172.1-103.4130.9000112.5L2162 R2164 D2168 L2169 E2170L2162-L2166 WeakPolarHBondContact O-CB 3.41Å; L2162-L2166 PolarHBondContact O-N 2.8Å; R2164-L2166 VanDerWaalsContact C-N 3.27Å; R2164-L2166 PolarHBondContact O-N 3.44Å; L2166-D2168 PolarHBondContact O-N 2.83Å; L2166-L2169 PolarHBondContact O-N 2.94Å; L2166-E2170 WeakPolarHBondContact O-CB 3.41Å; L2166-E2170 WeakPolarHBondContact O-CG 3.46Å; L2166-E2170 PolarHBondContact O-N 2.9Å
2167A76.9Confident70.4Confident47 Ų47110.6 Ų110.639%0.38854%0.535SS..Hα-helixtrans-62.5-42.117900000112.6E2163 R2164 E2170 E2171E2163-A2167 WeakPolarHBondContact O-CB 3.43Å; E2163-A2167 PolarHBondContact O-N 2.78Å; E2163-A2167 VanDerWaalsContact O-N 3.1Å; R2164-A2167 PolarHBondContact O-N 2.9Å; R2164-A2167 VanDerWaalsContact O-N 3.09Å; A2167-E2170 PolarHBondContact O-N 3.28Å; A2167-E2171 PolarHBondContact O-N 3.34Å
2168D74.5Confident70.8Confident113 Ų113106.5 Ų106.560%0.60453%0.527SS*.Hα-helixtrans-64.9-44177.6-68.8-20000111.1R2164 L2166 E2170 E2171 E2172R2164-D2168 PolarHBondContact O-N 2.95Å; L2166-D2168 PolarHBondContact O-N 2.83Å; D2168-E2170 PolarHBondContact O-N 2.82Å; D2168-E2171 PolarHBondContact O-N 3.13Å; D2168-E2172 PolarHBondContact O-N 3.38Å
2169L62.5Low71Confident100 Ų100105.1 Ų105.152%0.52452%0.52SS..Hα-helixtrans-64.8-36.7174.6-72.3169.6000112.6I2165 L2166 E2171 N2173I2165-L2169 HydrophobicContact CG2-CD1 3.96Å; I2165-L2169 WeakPolarHBondContact O-CB 3.26Å; I2165-L2169 VanDerWaalsContact O-CG 3.25Å; I2165-L2169 WeakPolarHBondContact O-CG 3.5Å; I2165-L2169 PolarHBondContact O-N 3.14Å; L2166-L2169 PolarHBondContact O-N 2.94Å; L2169-E2171 VanDerWaalsContact C-N 3.33Å; L2169-N2173 WeakPolarHBondContact O-CB 3.39Å; L2169-N2173 PolarHBondContact O-N 2.8Å
2170E72.7Confident71.2Confident112 Ų112103.9 Ų103.952%0.52352%0.516SS..Hα-helixtrans-68.7-29.5173.8-77.8-174.9178.700112.8L2166 A2167 D2168 R2174L2166-E2170 WeakPolarHBondContact O-CB 3.41Å; L2166-E2170 WeakPolarHBondContact O-CG 3.46Å; L2166-E2170 PolarHBondContact O-N 2.9Å; A2167-E2170 PolarHBondContact O-N 3.28Å; D2168-E2170 PolarHBondContact O-N 2.82Å; E2170-R2174 WeakPolarHBondContact O-CG 3.4Å; E2170-R2174 PolarHBondContact O-N 2.77Å; E2170-R2174 PolarHBondContact O-NE 3.27Å
2171E81.4Confident71.1Confident113 Ų113105.9 Ų105.953%0.52852%0.521SS..Hα-helixtrans-77-42.2172.9-172153.9166.700112A2167 D2168 L2169 N2173 R2174 N2175A2167-E2171 PolarHBondContact O-N 3.34Å; D2168-E2171 PolarHBondContact O-N 3.13Å; L2169-E2171 VanDerWaalsContact C-N 3.33Å; E2171-N2173 VanDerWaalsContact C-N 3.35Å; E2171-N2173 PolarHBondContact O-N 2.92Å; E2171-R2174 PolarHBondContact O-N 2.76Å; E2171-N2175 PolarHBondContact O-N 2.83Å; E2171-N2175 PolarHBondContact O-ND2 3.39Å
2172E73.9Confident71.5Confident119 Ų119107.2 Ų107.256%0.55652%0.521SS*.Hα-helixtrans-61.8-42.1174.7-167.9171.8-137.900111.7D2168 R2174 N2175 L2176D2168-E2172 PolarHBondContact O-N 3.38Å; E2172-R2174 PolarHBondContact O-N 3.05Å; E2172-N2175 PolarHBondContact O-N 3.25Å; E2172-L2176 HydrophobicContact CG-CD1 4.41Å; E2172-L2176 WeakPolarHBondContact O-CG 3.24Å; E2172-L2176 PolarHBondContact O-N 3.26Å
2173N69.2Low71Confident104 Ų104106.7 Ų106.756%0.55652%0.518SS*.Hα-helixtrans-64-38.5174.9-163.12.2000112L2169 E2171 L2176 Q2177L2169-N2173 WeakPolarHBondContact O-CB 3.39Å; L2169-N2173 PolarHBondContact O-N 2.8Å; E2171-N2173 VanDerWaalsContact C-N 3.35Å; E2171-N2173 PolarHBondContact O-N 2.92Å; N2173-L2176 PolarHBondContact O-N 2.94Å; N2173-Q2177 WeakPolarHBondContact O-CB 3.44Å; N2173-Q2177 PolarHBondContact O-N 3.12Å
2174R80.5Confident70.2Confident152 Ų152105.2 Ų105.257%0.57451%0.509SS*.Hα-helixtrans-64.3-39.7172.3-82.9177.5-74.4177.40.4112.5E2170 E2171 E2172 Q2177 A2178E2170-R2174 WeakPolarHBondContact O-CG 3.4Å; E2170-R2174 PolarHBondContact O-N 2.77Å; E2170-R2174 PolarHBondContact O-NE 3.27Å; E2171-R2174 PolarHBondContact O-N 2.76Å; E2172-R2174 PolarHBondContact O-N 3.05Å; R2174-Q2177 PolarHBondContact O-N 3.45Å; R2174-A2178 WeakPolarHBondContact O-CB 3.36Å; R2174-A2178 PolarHBondContact O-N 3.43Å
2175N79.8Confident69.1Low98 Ų98103.8 Ų103.852%0.52451%0.509SS..Hα-helixtrans-66.7-43.9176.6-74.5-36.1000111.9E2171 E2172 Q2177 A2178 E2179E2171-N2175 PolarHBondContact O-N 2.83Å; E2171-N2175 PolarHBondContact O-ND2 3.39Å; E2172-N2175 PolarHBondContact O-N 3.25Å; N2175-Q2177 VanDerWaalsContact C-N 3.33Å; N2175-Q2177 PolarHBondContact O-N 3.04Å; N2175-A2178 PolarHBondContact O-N 3.03Å; N2175-E2179 PolarHBondContact O-N 3.25Å
2176L61.9Low68Low106 Ų106104.7 Ų104.756%0.55551%0.511SS*.Hα-helixtrans-61.1-39.9174.3-73.9168.3000112.2E2172 N2173 E2179 Y2180E2172-L2176 HydrophobicContact CG-CD1 4.41Å; E2172-L2176 WeakPolarHBondContact O-CG 3.24Å; E2172-L2176 PolarHBondContact O-N 3.26Å; N2173-L2176 PolarHBondContact O-N 2.94Å; L2176-E2179 PolarHBondContact O-N 2.95Å; L2176-Y2180 WeakPolarHBondContact O-CB 3.14Å; L2176-Y2180 PolarHBondContact O-N 3.28Å
2177Q66.1Low66.9Low102 Ų102107.4 Ų107.448%0.47752%0.521SS..Hα-helixtrans-66-42.9176.4-16564.841.600111.6N2173 R2174 N2175 Y2180 D2181N2173-Q2177 WeakPolarHBondContact O-CB 3.44Å; N2173-Q2177 PolarHBondContact O-N 3.12Å; R2174-Q2177 PolarHBondContact O-N 3.45Å; N2175-Q2177 VanDerWaalsContact C-N 3.33Å; N2175-Q2177 PolarHBondContact O-N 3.04Å; Q2177-Y2180 PolarHBondContact O-N 3.28Å; Q2177-D2181 PolarHBondContact O-N 2.83Å
2178A74.5Confident65Low59 Ų59111.4 Ų111.449%0.48853%0.532SS..Hα-helixtrans-65.6-37.1175.600000112.7R2174 N2175 R2182R2174-A2178 WeakPolarHBondContact O-CB 3.36Å; R2174-A2178 PolarHBondContact O-N 3.43Å; N2175-A2178 PolarHBondContact O-N 3.03Å; A2178-R2182 WeakPolarHBondContact O-CB 3.41Å; A2178-R2182 PolarHBondContact O-N 2.97Å
2179E65.4Low63.4Low93 Ų93114 Ų11444%0.43554%0.54SS..Hα-helixtrans-71.1-37.6175.3-176.5152.2-128.500112.3N2175 L2176 R2182 L2183N2175-E2179 PolarHBondContact O-N 3.25Å; L2176-E2179 PolarHBondContact O-N 2.95Å; E2179-R2182 PolarHBondContact O-N 3.39Å; E2179-R2182 IonicContact OE1-CZ 3.36Å; E2179-R2182 IonicContact OE1-NH2 2.68Å; E2179-R2182 PolarHBondContact OE1-NH2 3.17Å; E2179-L2183 HydrophobicContact CG-CD1 4.08Å; E2179-L2183 HydrophobicContact CG-CG 4.48Å; E2179-L2183 WeakPolarHBondContact O-CB 3.45Å; E2179-L2183 WeakPolarHBondContact O-CG 3.47Å; E2179-L2183 PolarHBondContact O-N 2.89Å
2180Y67.5Low62Low141 Ų141117.6 Ų117.655%0.55355%0.551SS**Hα-helixtrans-58.5-47.5170.9176-94.4000111.7L2176 Q2177 R2182 L2183 K2184L2176-Y2180 WeakPolarHBondContact O-CB 3.14Å; L2176-Y2180 PolarHBondContact O-N 3.28Å; Q2177-Y2180 PolarHBondContact O-N 3.28Å; Y2180-R2182 VanDerWaalsContact C-N 3.35Å; Y2180-R2182 PolarHBondContact O-N 3.13Å; Y2180-L2183 PolarHBondContact O-N 2.7Å; Y2180-K2184 WeakPolarHBondContact O-CB 3.3Å; Y2180-K2184 PolarHBondContact O-N 3.21Å
2181D68.1Low60Low71 Ų71115.2 Ų115.238%0.3856%0.557SS.*Hα-helixtrans-66.2-36.4177.9-73.4-27.1000111.9Q2177 K2184 Q2185Q2177-D2181 PolarHBondContact O-N 2.83Å; D2181-K2184 PolarHBondContact O-N 2.99Å; D2181-Q2185 WeakPolarHBondContact O-CG 3.47Å; D2181-Q2185 PolarHBondContact O-N 3.4Å
2182R72.1Confident57.6Low140 Ų140118 Ų11853%0.52857%0.574SS.*Hα-helixtrans-64.1-43.6173.1-167.7-175.973.3171.4-4.3112.2A2178 E2179 Y2180 Q2185 Q2186A2178-R2182 WeakPolarHBondContact O-CB 3.41Å; A2178-R2182 PolarHBondContact O-N 2.97Å; E2179-R2182 PolarHBondContact O-N 3.39Å; E2179-R2182 IonicContact OE1-CZ 3.36Å; E2179-R2182 IonicContact OE1-NH2 2.68Å; E2179-R2182 PolarHBondContact OE1-NH2 3.17Å; Y2180-R2182 VanDerWaalsContact C-N 3.35Å; Y2180-R2182 PolarHBondContact O-N 3.13Å; R2182-Q2185 PolarHBondContact O-N 2.89Å; R2182-Q2186 WeakPolarHBondContact O-CG 3.42Å; R2182-Q2186 PolarHBondContact O-N 3.03Å
2183L52.7Low55.4Low94 Ų94117.2 Ų117.249%0.49258%0.582SS.*Hα-helixtrans-65-40.2176.2-78.7165.7000111.3E2179 Y2180 Q2186 H2187E2179-L2183 HydrophobicContact CG-CD1 4.08Å; E2179-L2183 HydrophobicContact CG-CG 4.48Å; E2179-L2183 WeakPolarHBondContact O-CB 3.45Å; E2179-L2183 WeakPolarHBondContact O-CG 3.47Å; E2179-L2183 PolarHBondContact O-N 2.89Å; Y2180-L2183 PolarHBondContact O-N 2.7Å; L2183-Q2186 PolarHBondContact O-N 3.33Å; L2183-H2187 PolarHBondContact O-N 2.67Å
2184K53.1Low53.7Low102 Ų102118.5 Ų118.544%0.44360%0.596SS.*Hα-helixtrans-61.7-47.8175.1-171.8-177.9173.8-165.60111.6Y2180 D2181 Q2186 H2187 E2188Y2180-K2184 WeakPolarHBondContact O-CB 3.3Å; Y2180-K2184 PolarHBondContact O-N 3.21Å; D2181-K2184 PolarHBondContact O-N 2.99Å; K2184-Q2186 PolarHBondContact O-N 3.18Å; K2184-H2187 PolarHBondContact O-N 3.45Å; K2184-H2187 VanDerWaalsContact O-N 3.1Å; K2184-E2188 WeakPolarHBondContact CE-OE1 3.37Å; K2184-E2188 PolarHBondContact O-N 3.38Å
2185Q54.9Low51.1Low117 Ų117119 Ų11955%0.54761%0.609SS.*Hα-helixtrans-62-39.3174.9-72.6178.211.700112.7D2181 R2182 H2187 E2188 H2189D2181-Q2185 WeakPolarHBondContact O-CG 3.47Å; D2181-Q2185 PolarHBondContact O-N 3.4Å; R2182-Q2185 PolarHBondContact O-N 2.89Å; Q2185-H2187 VanDerWaalsContact C-N 3.26Å; Q2185-H2187 PolarHBondContact O-N 3.03Å; Q2185-E2188 PolarHBondContact O-N 3.11Å; Q2185-H2189 WeakPolarHBondContact O-CB 3.45Å; Q2185-H2189 PolarHBondContact O-CD2 3.11Å; Q2185-H2189 PolarHBondContact O-N 3.44Å
2186Q49.8Very low48.9Very low117 Ų117119.4 Ų119.455%0.54762%0.617SS.*Hα-helixtrans-63.5-31.8173.6-80.5-169.3-22.300113R2182 L2183 K2184 K2190R2182-Q2186 WeakPolarHBondContact O-CG 3.42Å; R2182-Q2186 PolarHBondContact O-N 3.03Å; L2183-Q2186 PolarHBondContact O-N 3.33Å; K2184-Q2186 PolarHBondContact O-N 3.18Å; Q2186-K2190 PolarHBondContact O-N 3.25Å
2187H47Very low47.1Very low156 Ų156119.9 Ų119.972%0.72263%0.629SS**Hα-helixtrans-76.9-39.8176.7-129.4-71.9000112.4L2183 K2184 Q2185 H2189 K2190L2183-H2187 PolarHBondContact O-N 2.67Å; K2184-H2187 PolarHBondContact O-N 3.45Å; K2184-H2187 VanDerWaalsContact O-N 3.1Å; Q2185-H2187 VanDerWaalsContact C-N 3.26Å; Q2185-H2187 PolarHBondContact O-N 3.03Å; H2187-H2189 VanDerWaalsContact C-N 3.35Å; H2187-K2190 PolarHBondContact O-N 3.34Å
2188E37.7Very low45.2Very low131 Ų131120.8 Ų120.861%0.61264%0.644SS**Hα-helixtrans-67.2-33.6175.5-72.5175.7-176.300112.1K2184 Q2185 K2190K2184-E2188 WeakPolarHBondContact CE-OE1 3.37Å; K2184-E2188 PolarHBondContact O-N 3.38Å; Q2185-E2188 PolarHBondContact O-N 3.11Å; E2188-K2190 VanDerWaalsContact C-N 3.33Å; E2188-K2190 PolarHBondContact O-N 3.08Å
2189H40.5Very low43.2Very low168 Ų168124.1 Ų124.178%0.77866%0.661SS**THydrogen-bonded Turntrans-75.1-14.5174.8-80.2-47.7000115.1Q2185 H2187 G2191Q2185-H2189 WeakPolarHBondContact O-CB 3.45Å; Q2185-H2189 PolarHBondContact O-CD2 3.11Å; Q2185-H2189 PolarHBondContact O-N 3.44Å; H2187-H2189 VanDerWaalsContact C-N 3.35Å; H2189-G2191 VanDerWaalsContact C-N 3.27Å; H2189-G2191 PolarHBondContact O-N 3.18Å
2190K33.7Very low41.3Very low175 Ų175128.7 Ų128.776%0.76168%0.682SS**SBendtrans-9359171-75.4-175.9176.6177.30111Q2186 H2187 E2188 L2192Q2186-K2190 PolarHBondContact O-N 3.25Å; H2187-K2190 PolarHBondContact O-N 3.34Å; E2188-K2190 VanDerWaalsContact C-N 3.33Å; E2188-K2190 PolarHBondContact O-N 3.08Å; K2190-L2192 PolarHBondContact O-N 3.13Å
2191G31.3Very low39.2Very low62 Ų62129.4 Ų129.464%0.63969%0.692SS**  trans-63.3101.8175.400000112.3H2189H2189-G2191 VanDerWaalsContact C-N 3.27Å; H2189-G2191 PolarHBondContact O-N 3.18Å
2192L30.1Very low37.2Very low171 Ų171133.7 Ų133.790%0.89571%0.712SS**  trans-9995.2162.9-69177.1000108.2K2190K2190-L2192 PolarHBondContact O-N 3.13Å
2193S28.3Very low36.1Very low102 Ų102132 Ų13271%0.71372%0.719SS**  trans-65.1145.8173.8-66.80000110.8L2195S2193-L2195 PolarHBondContact O-N 3.22Å
2194P31.8Very low34.7Very low131 Ų131134.5 Ų134.585%0.85174%0.738SS**  trans-69.3123.5-175.328.3-34.5000111.2
2195L25.9Very low33.5Very low162 Ų162134.8 Ų134.885%0.84875%0.753SS**  trans-112.3156.2173.1-81.3167000110.4S2193S2193-L2195 PolarHBondContact O-N 3.22Å
2196P34.2Very low32.4Very low108 Ų108134.9 Ų134.970%0.70176%0.764SS**  trans-93.1168.4-146.5-6.226.3000114.9
2197S23.5Very low31.6Very low115 Ų115138.2 Ų138.280%0.80478%0.78SS**  trans-26.9112.7173.9-48.70000115.3
2198P26.8Very low31.1Very low122 Ų122133.7 Ų133.779%0.79277%0.766SS**PPolyproline II helixtrans-79.4133.8179-10.226.7000111.9
2199P31.9Very low31.4Very low128 Ų128131.9 Ų131.983%0.83177%0.766SS**PPolyproline II helixtrans-79.3172169.434.1-34.8000112.3
2200E26.7Very low31.6Very low189 Ų189132.1 Ų132.188%0.88376%0.759SS**SBendtrans-66.8168.2-166.9-61.8166.5127.600116.2
2201M24.3Very low31.7Very low156 Ų156128.4 Ų128.477%0.76875%0.748SS**  trans86103.2165.9-65.6-95.490.200119.2
2202M25.7Very low32.4Very low162 Ų162128.7 Ų128.780%0.79875%0.745SS**  trans87.8146.5142.9-66.2-67.6-179.500119.7
2203P47.4Very low33.5Very low105 Ų105126.4 Ų126.468%0.68273%0.729SS**  trans-106.9154.6-15139.3-34.1000114.5
2204T25Very low34.8Very low145 Ų145126.1 Ų126.189%0.8972%0.719SS**  trans-165.1143.4144.72.40000113.1
2205S27.5Very low36.1Very low108 Ų108125.8 Ų125.876%0.75571%0.709SS**  trans74.4107.6170.3-151.20000117.5Q2207S2205-Q2207 PolarHBondContact O-N 3.07Å
2206P31.7Very low37.8Very low120 Ų120120.7 Ų120.778%0.77969%0.69SS**PPolyproline II helixtrans-72.7128.1175.330.4-32.6000111S2208P2206-S2208 PolarHBondContact O-N 2.68Å
2207Q31.9Very low38.7Very low186 Ų186119.1 Ų119.187%0.86967%0.673SS**PPolyproline II helixtrans-60.7135.6166.2-70.1178-14.200109.1S2205S2205-Q2207 PolarHBondContact O-N 3.07Å
2208S37.5Very low40.2Very low62 Ų62115.6 Ų115.643%0.43465%0.651SS.*PPolyproline II helixtrans-61.7127.6-168.8-175.70000111.7P2206 R2210 D2211P2206-S2208 PolarHBondContact O-N 2.68Å; S2208-R2210 PolarHBondContact O-N 3.4Å; S2208-R2210 VanDerWaalsContact OG-CB 3.28Å; S2208-R2210 WeakPolarHBondContact OG-CB 3.03Å; S2208-R2210 PolarHBondContact OG-N 3.44Å; S2208-D2211 PolarHBondContact O-N 3.42Å; S2208-D2211 VanDerWaalsContact O-N 3.13Å
2209P43.8Very low41.8Very low93 Ų93117.6 Ų117.660%0.60465%0.648SS**Hα-helixtrans-52.7-27.8173.4-27.735.3000113.4D2211 A2212 E2213P2209-D2211 VanDerWaalsContact C-N 3.25Å; P2209-D2211 PolarHBondContact O-N 3.44Å; P2209-A2212 PolarHBondContact O-N 3.04Å; P2209-E2213 WeakPolarHBondContact O-CG 3.26Å; P2209-E2213 PolarHBondContact O-N 2.72Å
2210R43.7Very low43.1Very low172 Ų172114.6 Ų114.665%0.64962%0.624SS**Hα-helixtrans-52.7-38.6178.2-149.985.3178.2-156.64.3113.4S2208 L2214S2208-R2210 PolarHBondContact O-N 3.4Å; S2208-R2210 VanDerWaalsContact OG-CB 3.28Å; S2208-R2210 WeakPolarHBondContact OG-CB 3.03Å; S2208-R2210 PolarHBondContact OG-N 3.44Å; R2210-L2214 HydrophobicContact CG-CD1 4.47Å; R2210-L2214 WeakPolarHBondContact O-CB 3.48Å; R2210-L2214 WeakPolarHBondContact O-CD1 3.35Å; R2210-L2214 VanDerWaalsContact O-CG 3.25Å; R2210-L2214 WeakPolarHBondContact O-CG 3.36Å; R2210-L2214 PolarHBondContact O-N 3.22Å
2211D37.1Very low44.4Very low97 Ų97110.2 Ų110.252%0.51961%0.606SS.*Hα-helixtrans-78.1-33.5-174.5-62.9-27.1000111.3S2208 P2209 I2215S2208-D2211 PolarHBondContact O-N 3.42Å; S2208-D2211 VanDerWaalsContact O-N 3.13Å; P2209-D2211 VanDerWaalsContact C-N 3.25Å; P2209-D2211 PolarHBondContact O-N 3.44Å; D2211-I2215 WeakPolarHBondContact O-CG1 3.46Å; D2211-I2215 PolarHBondContact O-N 3.37Å; D2211-I2215 VanDerWaalsContact O-N 3.17Å
2212A46.6Very low46.4Very low69 Ų69112.1 Ų112.157%0.5761%0.605SS**Hα-helixtrans-69.8-40.217200000111.7P2209 A2216P2209-A2212 PolarHBondContact O-N 3.04Å; A2212-A2216 WeakPolarHBondContact O-CB 3.23Å; A2212-A2216 PolarHBondContact O-N 2.95Å
2213E51.6Low48.3Very low123 Ų123110 Ų11058%0.57559%0.593SS**Hα-helixtrans-60.7-47.4173.2-73.4173.9165.400111.7P2209 I2215 A2216 E2217P2209-E2213 WeakPolarHBondContact O-CG 3.26Å; P2209-E2213 PolarHBondContact O-N 2.72Å; E2213-I2215 PolarHBondContact O-N 3.07Å; E2213-A2216 PolarHBondContact O-N 3.02Å; E2213-E2217 WeakPolarHBondContact O-CB 3.41Å; E2213-E2217 PolarHBondContact O-N 3.41Å
2214L55.8Low48.7Very low95 Ų95109.5 Ų109.550%0.49758%0.581SS.*Hα-helixtrans-60.3-42.6178.4-79.4165.5000112.8R2210 A2218R2210-L2214 HydrophobicContact CG-CD1 4.47Å; R2210-L2214 WeakPolarHBondContact O-CB 3.48Å; R2210-L2214 WeakPolarHBondContact O-CD1 3.35Å; R2210-L2214 VanDerWaalsContact O-CG 3.25Å; R2210-L2214 WeakPolarHBondContact O-CG 3.36Å; R2210-L2214 PolarHBondContact O-N 3.22Å; L2214-A2218 VanDerWaalsContact O-CB 3.31Å; L2214-A2218 WeakPolarHBondContact O-CB 3.3Å; L2214-A2218 PolarHBondContact O-N 3.42Å
2215I59.1Low50.8Low124 Ų124108.9 Ų108.964%0.63657%0.566SS**Hα-helixtrans-68.2-38.4177.5-67.8168.6000110.9D2211 E2213 K2219D2211-I2215 WeakPolarHBondContact O-CG1 3.46Å; D2211-I2215 PolarHBondContact O-N 3.37Å; D2211-I2215 VanDerWaalsContact O-N 3.17Å; E2213-I2215 PolarHBondContact O-N 3.07Å; I2215-K2219 WeakPolarHBondContact O-CB 3.5Å; I2215-K2219 PolarHBondContact O-N 3.06Å; I2215-K2219 VanDerWaalsContact O-N 3.11Å
2216A62.5Low52.3Low55 Ų55105.6 Ų105.646%0.45555%0.549SS..Hα-helixtrans-65.9-45175.600000111.9A2212 E2213 K2219 L2220A2212-A2216 WeakPolarHBondContact O-CB 3.23Å; A2212-A2216 PolarHBondContact O-N 2.95Å; E2213-A2216 PolarHBondContact O-N 3.02Å; A2216-K2219 PolarHBondContact O-N 2.76Å; A2216-L2220 PolarHBondContact O-N 2.82Å
2217E53.6Low53.9Low75 Ų75106.7 Ų106.735%0.3554%0.538SS..Hα-helixtrans-61.6-47.4177.1-172.1168.8-144.600111.1E2213 K2219 L2220 L2221E2213-E2217 WeakPolarHBondContact O-CB 3.41Å; E2213-E2217 PolarHBondContact O-N 3.41Å; E2217-K2219 VanDerWaalsContact C-N 3.3Å; E2217-K2219 PolarHBondContact O-N 2.85Å; E2217-L2220 PolarHBondContact O-N 3.46Å; E2217-L2220 VanDerWaalsContact O-N 3.12Å; E2217-L2221 HydrophobicContact CG-CD1 4.16Å; E2217-L2221 HydrophobicContact CG-CG 4.48Å; E2217-L2221 WeakPolarHBondContact O-CG 3.45Å; E2217-L2221 PolarHBondContact O-N 2.98Å
2218A54.1Low54.8Low41 Ų41102.6 Ų102.634%0.33952%0.522SS..Hα-helixtrans-60.2-36176.400000113.2L2214 R2222L2214-A2218 VanDerWaalsContact O-CB 3.31Å; L2214-A2218 WeakPolarHBondContact O-CB 3.3Å; L2214-A2218 PolarHBondContact O-N 3.42Å; A2218-R2222 WeakPolarHBondContact O-CG 3.47Å; A2218-R2222 PolarHBondContact O-N 2.73Å
2219K60.6Low56.3Low165 Ų165104.4 Ų104.472%0.71752%0.523SS*.Hα-helixtrans-71.2-35.7176.6-159.2173.7-174178.20111.7I2215 A2216 E2217 Q2223I2215-K2219 WeakPolarHBondContact O-CB 3.5Å; I2215-K2219 PolarHBondContact O-N 3.06Å; I2215-K2219 VanDerWaalsContact O-N 3.11Å; A2216-K2219 PolarHBondContact O-N 2.76Å; E2217-K2219 VanDerWaalsContact C-N 3.3Å; E2217-K2219 PolarHBondContact O-N 2.85Å; K2219-Q2223 PolarHBondContact O-N 3.36Å
2220L59.2Low57.5Low65 Ų65102.6 Ų102.634%0.3452%0.516SS..Hα-helixtrans-71.7-41.5176.6-119.7144.3000112.4A2216 E2217 R2222 Q2223 H2224A2216-L2220 PolarHBondContact O-N 2.82Å; E2217-L2220 PolarHBondContact O-N 3.46Å; E2217-L2220 VanDerWaalsContact O-N 3.12Å; L2220-R2222 PolarHBondContact O-N 3.48Å; L2220-Q2223 CarbonylContact O-C 3.59Å; L2220-Q2223 WeakPolarHBondContact O-CB 3.17Å; L2220-Q2223 PolarHBondContact O-N 2.89Å; L2220-Q2223 VanDerWaalsContact O-N 3.08Å; L2220-H2224 PolarHBondContact O-N 3.17Å
2221L54.3Low58.7Low96 Ų96103.1 Ų103.150%0.50352%0.518SS..Hα-helixtrans-59.5-42.8176.8-74.6169.6000112.2E2217 Q2223 H2224 K2225E2217-L2221 HydrophobicContact CG-CD1 4.16Å; E2217-L2221 HydrophobicContact CG-CG 4.48Å; E2217-L2221 WeakPolarHBondContact O-CG 3.45Å; E2217-L2221 PolarHBondContact O-N 2.98Å; L2221-Q2223 VanDerWaalsContact C-N 3.29Å; L2221-Q2223 PolarHBondContact O-N 2.9Å; L2221-H2224 PolarHBondContact O-N 2.69Å; L2221-H2224 VanDerWaalsContact O-N 3.12Å; L2221-K2225 PolarHBondContact O-N 3.21Å
2222R65.9Low59.4Low197 Ų197103.9 Ų103.974%0.74352%0.52SS*.Hα-helixtrans-58.8-40.7173.1-67178.9-153.3-173.95.2112.1A2218 L2220 H2224 G2226A2218-R2222 WeakPolarHBondContact O-CG 3.47Å; A2218-R2222 PolarHBondContact O-N 2.73Å; L2220-R2222 PolarHBondContact O-N 3.48Å; R2222-H2224 VanDerWaalsContact C-N 3.3Å; R2222-H2224 PolarHBondContact O-N 3.23Å; R2222-G2226 PolarHBondContact O-N 3.4Å
2223Q65.2Low60.7Low116 Ų116105.1 Ų105.154%0.54251%0.514SS..Hα-helixtrans-72-25178.6-149.2-166.645.700112.6K2219 L2220 L2221 R2227K2219-Q2223 PolarHBondContact O-N 3.36Å; L2220-Q2223 CarbonylContact O-C 3.59Å; L2220-Q2223 WeakPolarHBondContact O-CB 3.17Å; L2220-Q2223 PolarHBondContact O-N 2.89Å; L2220-Q2223 VanDerWaalsContact O-N 3.08Å; L2221-Q2223 VanDerWaalsContact C-N 3.29Å; L2221-Q2223 PolarHBondContact O-N 2.9Å; Q2223-R2227 WeakPolarHBondContact O-CG 3.39Å
2224H55.7Low61.6Low96 Ų96104.9 Ų104.944%0.44452%0.516SS..Hα-helixtrans-79.8-40.2175.8-144.5-87.9000112L2220 L2221 R2222 G2226 R2227 L2228L2220-H2224 PolarHBondContact O-N 3.17Å; L2221-H2224 PolarHBondContact O-N 2.69Å; L2221-H2224 VanDerWaalsContact O-N 3.12Å; R2222-H2224 VanDerWaalsContact C-N 3.3Å; R2222-H2224 PolarHBondContact O-N 3.23Å; H2224-G2226 PolarHBondContact O-N 2.87Å; H2224-R2227 PolarHBondContact O-N 2.78Å; H2224-R2227 VanDerWaalsContact O-N 3.14Å; H2224-L2228 PolarHBondContact O-N 3.25Å; H2224-L2228 VanDerWaalsContact O-N 3.08Å
2225K70.4Confident61.9Low131 Ų131105.9 Ų105.957%0.5752%0.521SS*.Hα-helixtrans-53.1-52.2173.3176.1170.4172.9170.10111.5L2221 R2227 L2228 E2229L2221-K2225 PolarHBondContact O-N 3.21Å; K2225-R2227 PolarHBondContact O-N 3.28Å; K2225-L2228 PolarHBondContact O-N 3.1Å; K2225-E2229 WeakPolarHBondContact CE-OE1 3.49Å; K2225-E2229 HydrophobicContact CG-CG 4.33Å; K2225-E2229 IonicContact NZ-OE1 3.75Å; K2225-E2229 WeakPolarHBondContact O-CG 3.48Å; K2225-E2229 PolarHBondContact O-N 3.39Å
2226G58.2Low62.4Low39 Ų39103.7 Ų103.740%0.40251%0.508SS..Hα-helixtrans-61.6-26.7179.100000114.8R2222 H2224 A2230R2222-G2226 PolarHBondContact O-N 3.4Å; H2224-G2226 PolarHBondContact O-N 2.87Å; G2226-A2230 WeakPolarHBondContact O-CB 3.36Å; G2226-A2230 PolarHBondContact O-N 2.86Å
2227R64.9Low63Low143 Ų143105 Ų10554%0.5451%0.507SS..Hα-helixtrans-76.7-35.5173.3-65.4-179.3-147.4-166.75.8112.4Q2223 H2224 K2225 R2231Q2223-R2227 WeakPolarHBondContact O-CG 3.39Å; H2224-R2227 PolarHBondContact O-N 2.78Å; H2224-R2227 VanDerWaalsContact O-N 3.14Å; K2225-R2227 PolarHBondContact O-N 3.28Å; R2227-R2231 PolarHBondContact O-N 3.06Å; R2227-R2231 VanDerWaalsContact O-N 3.13Å
2228L51.6Low63.9Low101 Ų101106.8 Ų106.853%0.52952%0.515SS..Hα-helixtrans-70.4-44.3176.9-76167.2000111H2224 K2225 A2230 R2231 M2232H2224-L2228 PolarHBondContact O-N 3.25Å; H2224-L2228 VanDerWaalsContact O-N 3.08Å; K2225-L2228 PolarHBondContact O-N 3.1Å; L2228-A2230 VanDerWaalsContact C-N 3.33Å; L2228-A2230 PolarHBondContact O-N 3.5Å; L2228-R2231 PolarHBondContact O-N 3.18Å; L2228-R2231 VanDerWaalsContact O-N 3.12Å; L2228-M2232 WeakPolarHBondContact O-CB 3.11Å; L2228-M2232 PolarHBondContact O-N 2.89Å
2229E67.9Low64.8Low99 Ų99109.7 Ų109.746%0.46353%0.525SS..Hα-helixtrans-56.9-45.5173.9-69.9169.7152.200111.3K2225 R2231 M2232 Q2233K2225-E2229 WeakPolarHBondContact CE-OE1 3.49Å; K2225-E2229 HydrophobicContact CG-CG 4.33Å; K2225-E2229 IonicContact NZ-OE1 3.75Å; K2225-E2229 WeakPolarHBondContact O-CG 3.48Å; K2225-E2229 PolarHBondContact O-N 3.39Å; E2229-R2231 PolarHBondContact O-N 3.3Å; E2229-M2232 PolarHBondContact O-N 2.72Å; E2229-Q2233 PolarHBondContact O-N 3.31Å
2230A69.8Low65.5Low55 Ų55106.9 Ų106.946%0.45551%0.513SS..Hα-helixtrans-62.3-37.4175.500000113.5G2226 L2228 I2234G2226-A2230 WeakPolarHBondContact O-CB 3.36Å; G2226-A2230 PolarHBondContact O-N 2.86Å; L2228-A2230 VanDerWaalsContact C-N 3.33Å; L2228-A2230 PolarHBondContact O-N 3.5Å; A2230-I2234 WeakPolarHBondContact O-CD1 3.34Å; A2230-I2234 WeakPolarHBondContact O-CG1 3.23Å; A2230-I2234 PolarHBondContact O-N 3.37Å
2231R68.1Low66.2Low183 Ų183109.4 Ų109.469%0.69152%0.523SS*.Hα-helixtrans-71.3-39.4174.7-94.3-175.8169.7174.4-3.2112.7R2227 L2228 E2229 Q2233 I2234 L2235R2227-R2231 PolarHBondContact O-N 3.06Å; R2227-R2231 VanDerWaalsContact O-N 3.13Å; L2228-R2231 PolarHBondContact O-N 3.18Å; L2228-R2231 VanDerWaalsContact O-N 3.12Å; E2229-R2231 PolarHBondContact O-N 3.3Å; R2231-Q2233 VanDerWaalsContact C-N 3.34Å; R2231-I2234 PolarHBondContact O-N 3.01Å; R2231-L2235 WeakPolarHBondContact O-CG 3.37Å; R2231-L2235 PolarHBondContact O-N 2.99Å
2232M52.9Low66.7Low113 Ų113108.4 Ų108.456%0.55752%0.517SS*.Hα-helixtrans-62.1-43.6178.1-164.8177.682.800110.5L2228 E2229 I2234 L2235 E2236L2228-M2232 WeakPolarHBondContact O-CB 3.11Å; L2228-M2232 PolarHBondContact O-N 2.89Å; E2229-M2232 PolarHBondContact O-N 2.72Å; M2232-I2234 VanDerWaalsContact C-N 3.35Å; M2232-I2234 PolarHBondContact O-N 3.5Å; M2232-L2235 PolarHBondContact O-N 3.35Å; M2232-L2235 VanDerWaalsContact O-N 3.16Å; M2232-E2236 PolarHBondContact O-N 3.5Å
2233Q72.8Confident66.6Low96 Ų96105.2 Ų105.245%0.44951%0.511SS..Hα-helixtrans-59.2-42.4175.7-166.764.47000112.9E2229 R2231 E2236 D2237E2229-Q2233 PolarHBondContact O-N 3.31Å; R2231-Q2233 VanDerWaalsContact C-N 3.34Å; Q2233-E2236 PolarHBondContact O-N 3.24Å; Q2233-D2237 PolarHBondContact O-N 3.39Å
2234I71.9Confident66.9Low118 Ų118103.2 Ų103.261%0.60551%0.51SS*.Hα-helixtrans-65-40.1177-67165.8000111A2230 R2231 M2232 D2237 H2238A2230-I2234 WeakPolarHBondContact O-CD1 3.34Å; A2230-I2234 WeakPolarHBondContact O-CG1 3.23Å; A2230-I2234 PolarHBondContact O-N 3.37Å; R2231-I2234 PolarHBondContact O-N 3.01Å; M2232-I2234 VanDerWaalsContact C-N 3.35Å; M2232-I2234 PolarHBondContact O-N 3.5Å; I2234-D2237 PolarHBondContact O-N 3.13Å; I2234-H2238 WeakPolarHBondContact O-CB 3.32Å; I2234-H2238 PolarHBondContact O-N 3.5Å
2235L61.5Low67.7Low116 Ų116104.2 Ų104.261%0.60752%0.515SS*.Hα-helixtrans-68.7-39.4177.6-72.7169.2000112.2R2231 M2232 H2238 N2239R2231-L2235 WeakPolarHBondContact O-CG 3.37Å; R2231-L2235 PolarHBondContact O-N 2.99Å; M2232-L2235 PolarHBondContact O-N 3.35Å; M2232-L2235 VanDerWaalsContact O-N 3.16Å; L2235-H2238 PolarHBondContact O-N 3.48Å; L2235-N2239 WeakPolarHBondContact O-CB 3.48Å; L2235-N2239 PolarHBondContact O-N 3.23Å
2236E70.3Confident67.4Low77 Ų77102.4 Ų102.436%0.3651%0.511SS..Hα-helixtrans-60.9-45.3172.6-77.9-174.5-163.100112.4M2232 Q2233 H2238 N2239 K2240M2232-E2236 PolarHBondContact O-N 3.5Å; Q2233-E2236 PolarHBondContact O-N 3.24Å; E2236-H2238 VanDerWaalsContact C-N 3.29Å; E2236-H2238 PolarHBondContact O-N 2.83Å; E2236-N2239 PolarHBondContact O-N 2.8Å; E2236-K2240 VanDerWaalsContact O-CG 3.31Å; E2236-K2240 WeakPolarHBondContact O-CG 3.32Å; E2236-K2240 PolarHBondContact O-N 3Å; E2236-K2240 IonicContact OE2-NZ 3.32Å; E2236-K2240 PolarHBondContact OE2-NZ 3.4Å
2237D73.1Confident67.8Low83 Ų83106 Ų10644%0.44452%0.517SS..Hα-helixtrans-65.9-35.1179.4-76-4.7000111.5Q2233 I2234 K2240 Q2241Q2233-D2237 PolarHBondContact O-N 3.39Å; I2234-D2237 PolarHBondContact O-N 3.13Å; D2237-K2240 PolarHBondContact O-N 3.31Å; D2237-K2240 IonicContact OD1-NZ 2.7Å; D2237-Q2241 PolarHBondContact O-N 2.76Å
2238H74.2Confident67.9Low113 Ų113107.7 Ų107.752%0.52352%0.523SS..Hα-helixtrans-71.8-38174.9-156.3-134.6000112.2I2234 L2235 E2236 Q2241 L2242I2234-H2238 WeakPolarHBondContact O-CB 3.32Å; I2234-H2238 PolarHBondContact O-N 3.5Å; L2235-H2238 PolarHBondContact O-N 3.48Å; E2236-H2238 VanDerWaalsContact C-N 3.29Å; E2236-H2238 PolarHBondContact O-N 2.83Å; H2238-Q2241 WeakPolarHBondContact O-CB 3.12Å; H2238-Q2241 PolarHBondContact O-N 3.16Å; H2238-L2242 PolarHBondContact O-N 3.5Å
2239N71.7Confident68.2Low101 Ų101107.6 Ų107.654%0.5452%0.523SS..Hα-helixtrans-63.8-43.1170.9-98.4-6000111.8L2235 E2236 Q2241 L2242 E2243L2235-N2239 WeakPolarHBondContact O-CB 3.48Å; L2235-N2239 PolarHBondContact O-N 3.23Å; E2236-N2239 PolarHBondContact O-N 2.8Å; N2239-Q2241 VanDerWaalsContact C-N 3.26Å; N2239-Q2241 PolarHBondContact O-N 2.92Å; N2239-L2242 PolarHBondContact O-N 2.95Å; N2239-L2242 VanDerWaalsContact O-N 3.08Å; N2239-E2243 WeakPolarHBondContact O-CG 3.37Å; N2239-E2243 PolarHBondContact O-N 2.79Å
2240K75.7Confident68.1Low106 Ų106110.8 Ų110.846%0.46153%0.531SS..Hα-helixtrans-59.3-36.5173.6-72.2164.2-167.1150.60112E2236 D2237 S2244E2236-K2240 VanDerWaalsContact O-CG 3.31Å; E2236-K2240 WeakPolarHBondContact O-CG 3.32Å; E2236-K2240 PolarHBondContact O-N 3Å; E2236-K2240 IonicContact OE2-NZ 3.32Å; E2236-K2240 PolarHBondContact OE2-NZ 3.4Å; D2237-K2240 PolarHBondContact O-N 3.31Å; D2237-K2240 IonicContact OD1-NZ 2.7Å; K2240-S2244 WeakPolarHBondContact O-CB 3.34Å; K2240-S2244 PolarHBondContact O-N 3.02Å
2241Q74Confident67.7Low119 Ų119113.9 Ų113.956%0.55654%0.535SS*.Hα-helixtrans-66.1-43.5171.9-80.4-173-25.300112.6D2237 H2238 N2239 S2244 Q2245D2237-Q2241 PolarHBondContact O-N 2.76Å; H2238-Q2241 WeakPolarHBondContact O-CB 3.12Å; H2238-Q2241 PolarHBondContact O-N 3.16Å; N2239-Q2241 VanDerWaalsContact C-N 3.26Å; N2239-Q2241 PolarHBondContact O-N 2.92Å; Q2241-S2244 WeakPolarHBondContact O-CB 3.27Å; Q2241-S2244 PolarHBondContact O-N 3.09Å; Q2241-Q2245 WeakPolarHBondContact O-CG 3.15Å; Q2241-Q2245 PolarHBondContact O-N 3.25Å
2242L65.5Low66.7Low74 Ų74110.8 Ų110.839%0.38753%0.532SS..Hα-helixtrans-65-42.2176.9-75.2165.6000112.1H2238 N2239 Q2245 L2246H2238-L2242 PolarHBondContact O-N 3.5Å; N2239-L2242 PolarHBondContact O-N 2.95Å; N2239-L2242 VanDerWaalsContact O-N 3.08Å; L2242-Q2245 PolarHBondContact O-N 3.36Å; L2242-L2246 WeakPolarHBondContact O-CB 3.47Å; L2242-L2246 WeakPolarHBondContact O-CG 3.4Å; L2242-L2246 PolarHBondContact O-N 3.01Å
2243E62.3Low66.3Low131 Ų131112.2 Ų112.261%0.61254%0.541SS*.Hα-helixtrans-60.3-44.4172.1-74-175.516400111.6N2239 Q2245 L2246 H2247N2239-E2243 WeakPolarHBondContact O-CG 3.37Å; N2239-E2243 PolarHBondContact O-N 2.79Å; E2243-Q2245 VanDerWaalsContact C-N 3.32Å; E2243-Q2245 PolarHBondContact O-N 2.9Å; E2243-L2246 PolarHBondContact O-N 3.46Å; E2243-H2247 WeakPolarHBondContact O-CB 3.34Å; E2243-H2247 PolarHBondContact O-N 3.03Å
2244S71.5Confident65Low74 Ų74115.4 Ų115.452%0.51756%0.556SS.*Hα-helixtrans-59.4-41.8174.3177.60000112K2240 Q2241 R2248K2240-S2244 WeakPolarHBondContact O-CB 3.34Å; K2240-S2244 PolarHBondContact O-N 3.02Å; Q2241-S2244 WeakPolarHBondContact O-CB 3.27Å; Q2241-S2244 PolarHBondContact O-N 3.09Å; S2244-R2248 WeakPolarHBondContact O-CB 3.43Å; S2244-R2248 PolarHBondContact O-N 3.28Å; S2244-R2248 VanDerWaalsContact O-N 3.12Å
2245Q73.5Confident63.3Low117 Ų117116.8 Ų116.855%0.54756%0.56SS.*Hα-helixtrans-67.7-43.4177-73.1178.83.200111.6Q2241 L2242 E2243 R2248 L2249Q2241-Q2245 WeakPolarHBondContact O-CG 3.15Å; Q2241-Q2245 PolarHBondContact O-N 3.25Å; L2242-Q2245 PolarHBondContact O-N 3.36Å; E2243-Q2245 VanDerWaalsContact C-N 3.32Å; E2243-Q2245 PolarHBondContact O-N 2.9Å; Q2245-R2248 PolarHBondContact O-N 3.13Å; Q2245-L2249 WeakPolarHBondContact O-CB 3.3Å; Q2245-L2249 WeakPolarHBondContact O-CG 3.23Å; Q2245-L2249 PolarHBondContact O-N 3.29Å
2246L63.9Low62.3Low92 Ų92117.1 Ų117.148%0.48257%0.569SS.*Hα-helixtrans-63.1-40175.9-77167.5000112.2L2242 E2243 R2248 L2249 R2250L2242-L2246 WeakPolarHBondContact O-CB 3.47Å; L2242-L2246 WeakPolarHBondContact O-CG 3.4Å; L2242-L2246 PolarHBondContact O-N 3.01Å; E2243-L2246 PolarHBondContact O-N 3.46Å; L2246-R2248 VanDerWaalsContact C-N 3.35Å; L2246-L2249 PolarHBondContact O-N 3.2Å; L2246-R2250 WeakPolarHBondContact O-CG 3.46Å; L2246-R2250 PolarHBondContact O-N 2.81Å
2247H67.7Low60.5Low114 Ų114123 Ų12353%0.52860%0.596SS.*Hα-helixtrans-64.7-40.8175.9-160.587.6000111.4E2243 R2250 Q2251E2243-H2247 WeakPolarHBondContact O-CB 3.34Å; E2243-H2247 PolarHBondContact O-N 3.03Å; H2247-R2250 PolarHBondContact O-N 3.5Å; H2247-Q2251 PolarHBondContact O-N 3.27Å
2248R65.8Low58.7Low179 Ų179123.7 Ų123.768%0.67561%0.614SS**Hα-helixtrans-66-39.1175.5-142.3172-166.4177.22.8112.2S2244 Q2245 L2246 Q2251 L2252S2244-R2248 WeakPolarHBondContact O-CB 3.43Å; S2244-R2248 PolarHBondContact O-N 3.28Å; S2244-R2248 VanDerWaalsContact O-N 3.12Å; Q2245-R2248 PolarHBondContact O-N 3.13Å; L2246-R2248 VanDerWaalsContact C-N 3.35Å; R2248-Q2251 PolarHBondContact O-N 2.84Å; R2248-L2252 WeakPolarHBondContact O-CG 3.48Å; R2248-L2252 PolarHBondContact O-N 2.94Å; R2248-L2252 VanDerWaalsContact O-N 3.09Å
2249L58.7Low56.6Low99 Ų99127.5 Ų127.552%0.51863%0.632SS.*Hα-helixtrans-66.1-39.4173.6-80.7163.2000112.4Q2245 L2246 L2252 L2253Q2245-L2249 WeakPolarHBondContact O-CB 3.3Å; Q2245-L2249 WeakPolarHBondContact O-CG 3.23Å; Q2245-L2249 PolarHBondContact O-N 3.29Å; L2246-L2249 PolarHBondContact O-N 3.2Å; L2249-L2252 PolarHBondContact O-N 3.42Å; L2249-L2253 WeakPolarHBondContact O-CB 3.38Å; L2249-L2253 WeakPolarHBondContact O-CG 3.47Å; L2249-L2253 PolarHBondContact O-N 3.34Å
2250R66.2Low54.7Low167 Ų167126.9 Ų126.963%0.6364%0.641SS**Hα-helixtrans-62.3-46.6173.9-74.2175.3-175.4169.42.9111.6L2246 H2247 L2252 L2253 E2254L2246-R2250 WeakPolarHBondContact O-CG 3.46Å; L2246-R2250 PolarHBondContact O-N 2.81Å; H2247-R2250 PolarHBondContact O-N 3.5Å; R2250-L2252 VanDerWaalsContact C-N 3.29Å; R2250-L2252 PolarHBondContact O-N 3.46Å; R2250-L2253 PolarHBondContact O-N 3.01Å; R2250-L2253 VanDerWaalsContact O-N 3.11Å; R2250-E2254 PolarHBondContact O-N 3.44Å
2251Q59.6Low52.5Low119 Ų119131.6 Ų131.656%0.55666%0.661SS**Hα-helixtrans-59.4-37.5174.6-76.6-174.2-1300113.2H2247 R2248H2247-Q2251 PolarHBondContact O-N 3.27Å; R2248-Q2251 PolarHBondContact O-N 2.84Å
2252L48.9Very low50.4Low119 Ų119131.5 Ų131.562%0.62367%0.669SS**Hα-helixtrans-72-28.9176.1-73.3166.9000113.1R2248 L2249 R2250R2248-L2252 WeakPolarHBondContact O-CG 3.48Å; R2248-L2252 PolarHBondContact O-N 2.94Å; R2248-L2252 VanDerWaalsContact O-N 3.09Å; L2249-L2252 PolarHBondContact O-N 3.42Å; R2250-L2252 VanDerWaalsContact C-N 3.29Å; R2250-L2252 PolarHBondContact O-N 3.46Å
2253L44.2Very low48.7Very low143 Ų143135.5 Ų135.575%0.74969%0.69SS**Hα-helixtrans-79.7-28.3177.1-81.8162.9000113.5L2249 R2250 Q2255L2249-L2253 WeakPolarHBondContact O-CB 3.38Å; L2249-L2253 WeakPolarHBondContact O-CG 3.47Å; L2249-L2253 PolarHBondContact O-N 3.34Å; R2250-L2253 PolarHBondContact O-N 3.01Å; R2250-L2253 VanDerWaalsContact O-N 3.11Å; L2253-Q2255 VanDerWaalsContact C-N 3.32Å
2254E45.9Very low47Very low162 Ų162132.3 Ų132.376%0.75769%0.693SS**SBendtrans-79.2-9.3177.7-73.5-173.415100114R2250 P2256R2250-E2254 PolarHBondContact O-N 3.44Å; E2254-P2256 WeakPolarHBondContact O-CD 3.35Å
2255Q36.1Very low44.8Very low148 Ų148134.8 Ų134.869%0.69271%0.705SS**SBendtrans-76.4119.4177.5-109.617914.700111.8L2253 Q2257L2253-Q2255 VanDerWaalsContact C-N 3.32Å; Q2255-Q2257 PolarHBondContact O-N 3.41Å
2256P39.1Very low42.5Very low122 Ų122135.2 Ų135.279%0.79272%0.716SS**PPolyproline II helixtrans-64.2133-171.3-24.635.1000114E2254 A2258E2254-P2256 WeakPolarHBondContact O-CD 3.35Å; P2256-A2258 PolarHBondContact O-N 3.21Å
2257Q34Very low40.8Very low200 Ų200135.3 Ų135.394%0.93572%0.72SS**PPolyproline II helixtrans-62.9117.6-179.8-66.2-179.7-25.700112.3Q2255Q2255-Q2257 PolarHBondContact O-N 3.41Å
2258A33.5Very low38.9Very low98 Ų98132.1 Ų132.181%0.8171%0.71SS**  trans-109139.3162.900000110.1P2256 A2260P2256-A2258 PolarHBondContact O-N 3.21Å; A2258-A2260 PolarHBondContact O-N 2.97Å
2259E30.7Very low37Very low194 Ų194128.8 Ų128.891%0.90772%0.715SS**  trans-73.3123.5-153.5-61.8175.4145.900116.6
2260A32.2Very low36.1Very low88 Ų88126.5 Ų126.573%0.72771%0.706SS**  trans4.7126.9145.700000120.8A2258A2258-A2260 PolarHBondContact O-N 2.97Å
2261K28.8Very low34.3Very low204 Ų204121.5 Ų121.589%0.88770%0.696SS**  trans-158.591137.1-113.9163.8-171.2170.70115.1
2262V31.3Very low32.6Very low117 Ų117121.8 Ų121.871%0.70971%0.706SS**  47.7116126.5-1790000119.8
2263N28.4Very low31.5Very low158 Ų158121.4 Ų121.485%0.84571%0.714SS**  trans75.1122.9150.2-64.7-4.9000121.6
2264G26.2Very low30.6Very low64 Ų64121.1 Ų121.166%0.6671%0.712SS**  133.876120.900000118.6
2265T25.9Very low29.7Very low126 Ų126121 Ų12177%0.77371%0.711SS**  trans42.2104.714154.50000119.4
2266T25.2Very low29.2Very low127 Ų127124.1 Ų124.178%0.77972%0.717SS**  168.1125.395.237.80000115.2
2267V28.1Very low28.5Very low93 Ų93122.9 Ų122.956%0.56471%0.711SS**  trans72.8124.6131.7179.90000121.8T1107 K1108T1107-V2267 HydrophobicContact CG2-CG1 3.91Å; K1108-V2267 PolarHBondContact NZ-O 3.3Å
2268S29.3Very low28.2Very low47 Ų47118.2 Ų118.233%0.32969%0.693SS.*  trans73.7107.4156.1-68.40000120.7K1108K1108-S2268 VanDerWaalsContact O-CB 3.23Å; K1108-S2268 WeakPolarHBondContact O-CB 3.45Å; K1108-S2268 PolarHBondContact O-OG 2.88Å; K1108-S2268 VanDerWaalsContact O-OG 3.12Å
2269S24.8Very low27.8Very low110 Ų110118.6 Ų118.677%0.76969%0.689SS**  trans-158.5154.5152.2-96.80000107.8
2270P39.5Very low27.5Very low51 Ų51114.2 Ų114.233%0.33168%0.68SS.*  -143170-112.138.3-19.9000118.6E1109 T1110E1109-P2270 HydrophobicContact CB-CB 3.54Å; E1109-P2270 HydrophobicContact CG-CB 3.5Å; E1109-P2270 WeakPolarHBondContact OE1-CA 3.3Å; E1109-P2270 WeakPolarHBondContact OE1-CB 3.33Å; E1109-P2270 WeakPolarHBondContact OE2-CB 3.4Å; T1110-P2270 VanDerWaalsContact CA-CG 3.42Å; T1110-P2270 VanDerWaalsContact N-CB 3.35Å; T1110-P2270 WeakPolarHBondContact OG1-CB 3.38Å; T1110-P2270 WeakPolarHBondContact OG1-CG 3.49Å
2271S27.9Very low27Very low61 Ų61118.9 Ų118.943%0.42769%0.687SS.*  trans55.9111.6155.7-74.40000119.6E1109 T1110E1109-S2271 VanDerWaalsContact CD-N 3.3Å; E1109-S2271 PolarHBondContact OE1-N 3.22Å; E1109-S2271 WeakPolarHBondContact OE2-CA 3.38Å; E1109-S2271 WeakPolarHBondContact OE2-CB 3.2Å; E1109-S2271 PolarHBondContact OE2-N 3.2Å; E1109-S2271 PolarHBondContact OE2-OG 3.46Å; T1110-S2271 PolarHBondContact OG1-OG 3.45Å
2272T24.4Very low26.9Very low125 Ų125114.8 Ų114.877%0.76768%0.681SS**  trans179.992.9134.820.50000108.1
2273S27Very low26.7Very low112 Ų112118.6 Ų118.678%0.78369%0.694SS**  39.782.683.279.10000114.3
2274L25.2Very low26.5Very low137 Ų137118.4 Ų118.472%0.71769%0.692SS**  trans-153.361.2165-123.4159000112.6R2276L2274-R2276 VanDerWaalsContact C-N 3.3Å; L2274-R2276 HydrophobicContact CD2-CB 4.43Å; L2274-R2276 HydrophobicContact CD2-CG 3.96Å; L2274-R2276 PolarHBondContact O-N 2.73Å
2275Q27Very low26.5Very low158 Ų158122.5 Ų122.574%0.73870%0.698SS**  trans-66.993.6158.1-84.5-175.8-12.100109.5
2276R25.3Very low26.6Very low214 Ų214123.8 Ų123.881%0.80869%0.689SS**  trans-103.4138.6149.3-92-176.9171.6178.8-2.6106.1L2274L2274-R2276 VanDerWaalsContact C-N 3.3Å; L2274-R2276 HydrophobicContact CD2-CB 4.43Å; L2274-R2276 HydrophobicContact CD2-CG 3.96Å; L2274-R2276 PolarHBondContact O-N 2.73Å
2277S24.7Very low26.8Very low96 Ų96122.6 Ų122.667%0.67168%0.681SS**  cis-157.7166.5-1.1-69.40000108.8S2279S2277-S2279 PolarHBondContact O-N 3.03Å
2278D27Very low26.8Very low103 Ų103125.1 Ų125.155%0.55170%0.696SS**  trans-46.3134.7147.7-70.2-64.1000111.1
2279S24.4Very low26.8Very low105 Ų105125.9 Ų125.973%0.73471%0.711SS**  trans-150.994.8145.6-176.30000109.9S2277 Q2281S2277-S2279 PolarHBondContact O-N 3.03Å; S2279-Q2281 PolarHBondContact O-N 2.8Å; S2279-Q2281 VanDerWaalsContact O-N 3.16Å
2280S24.4Very low26.9Very low103 Ų103126.5 Ų126.572%0.7272%0.716SS**  trans-22.2112.3152.649.90000113.6
2281Q23.1Very low26.2Very low185 Ų185132.6 Ų132.686%0.86474%0.74SS**  trans-68.5127.7153.2-85.9-164.4-10.900107.9S2279 M2283S2279-Q2281 PolarHBondContact O-N 2.8Å; S2279-Q2281 VanDerWaalsContact O-N 3.16Å; Q2281-M2283 PolarHBondContact O-N 3.09Å
2282P27Very low26.2Very low118 Ų118135.2 Ų135.277%0.76675%0.753SS**  trans-74.1112.3-178.528.8-32.9000109.9L2284P2282-L2284 PolarHBondContact O-N 2.81Å
2283M25.3Very low26.3Very low198 Ų198133.9 Ų133.998%0.97575%0.749SS**  trans-69.197.6171.8-122.3-162.1161.400109.8Q2281Q2281-M2283 PolarHBondContact O-N 3.09Å
2284L24.9Very low26.2Very low154 Ų154136.3 Ų136.381%0.80675%0.753SS**  trans-147.376.5173-131.4-176.7000110.6P2282P2282-L2284 PolarHBondContact O-N 2.81Å
2285L26.7Very low26.3Very low149 Ų149134.4 Ų134.478%0.7875%0.751SS**  trans175.4108.6149-101162.9000112.7
2286R28.5Very low26.3Very low154 Ų154136 Ų13658%0.58176%0.761SS**  150.4120.3109.3-75.6-144.377121.312.8115.2H2086H2086-R2286 PolarHBondContact CD2-NH1 3.27Å; H2086-R2286 PolarHBondContact CE1-NH1 3.21Å; H2086-R2286 PolarHBondContact CE1-NH2 2.94Å; H2086-R2286 PolarHBondContact ND1-NH1 3.35Å; H2086-R2286 PolarHBondContact NE2-NH1 3.46Å; H2086-R2286 PolarHBondContact NE2-NH2 3.49Å
2287V27.6Very low26.6Very low101 Ų101129.5 Ų129.561%0.61276%0.761SS**  72.1103.7128.5-1800000118.8
2288V29.2Very low26.7Very low146 Ų146134.3 Ų134.389%0.88577%0.773SS**PPolyproline II helixtrans-57.9124.1143.4174.10000109
2289G28.4Very low26.8Very low63 Ų63138 Ų13865%0.64979%0.787SS**PPolyproline II helixtrans-77.9157.2-178.700000114.1
2290S27.5Very low27Very low124 Ų124139.4 Ų139.487%0.86779%0.786SS**PPolyproline II helixtrans-73.7137.3178.1-470000112.9
2291Q25.9Very low27.2Very low178 Ų178140.8 Ų140.883%0.83279%0.785SS**  trans-139.8122.5149-72.2-162.90.100110.7
2292T26.1Very low27.4Very low116 Ų116139.2 Ų139.271%0.71278%0.782SS**  trans51.4118.513661.70000121.4
2293S26.3Very low27.6Very low97 Ų97139.2 Ų139.268%0.67878%0.784SS**  trans23.7122.3136.155.90000119.4
2294D26.9Very low27.8Very low163 Ų163135.3 Ų135.387%0.87277%0.774SS**  -163.1171.288.1-104.9-30.6000113.9
2295S27.3Very low28.1Very low97 Ų97134 Ų13468%0.67878%0.775SS**  trans-92.1151.8-164.463.80000115.3
2296M26.6Very low28.5Very low192 Ų192135.6 Ų135.695%0.94678%0.778SS**  trans56.7122.5143.3-65.2-69.5-134.200119.1
2297G30.1Very low28.8Very low78 Ų78135.4 Ų135.480%0.80479%0.788SS**  trans173.765.617000000113.2
2298E27.6Very low29.1Very low197 Ų197137.1 Ų137.192%0.92180%0.8SS**  trans-69.3125.4153.8-69179.2145.400107.8
2299E30Very low29.6Very low181 Ų181134.7 Ų134.785%0.84679%0.789SS**  trans-171.9115.7137.1-109174.5-169.400111.4
2300D27.3Very low30.4Very low133 Ų133136.2 Ų136.271%0.71179%0.786SS**  70.7120.4129.1-87.78.5000124.7
2301L28.6Very low31.3Very low133 Ų133132.3 Ų132.370%0.69677%0.765SS**  trans8997133.1-61.2166.7000121.4
2302L28.1Very low32.1Very low152 Ų152130 Ų13080%0.79676%0.757SS**  55102.7125.5-60.7175.6000119.7
2303S30.2Very low33.1Very low118 Ų118131.3 Ų131.383%0.82576%0.756SS**  trans-153.4144.2133.6-81.30000110.8
2304P31Very low34.4Very low116 Ų116132.6 Ų132.675%0.75375%0.751SS**PPolyproline II helixtrans-78.1150-169.5-10.728.2000112.8Q2306P2304-Q2306 PolarHBondContact O-N 2.95Å
2305P31.5Very low35.9Very low127 Ų127128.4 Ų128.483%0.82573%0.731SS**PPolyproline II helixtrans-71.5128.7-178.529.7-34.1000111.3
2306Q33.6Very low37.3Very low182 Ų182129.3 Ų129.385%0.8573%0.726SS**PPolyproline II helixtrans-80.7131.9165.8-74.5-175.3-39.400109.9P2304 T2308P2304-Q2306 PolarHBondContact O-N 2.95Å; Q2306-T2308 PolarHBondContact O-N 3.42Å
2307D34.5Very low38.8Very low149 Ų149126.2 Ų126.280%0.79771%0.709SS**PPolyproline II helixtrans-56.3121.4-179.2-75.1-61.2000112S2309D2307-S2309 PolarHBondContact O-N 2.94Å
2308T35.4Very low40Very low138 Ų138128.4 Ų128.485%0.84770%0.698SS**  trans-87.323.2-173.4-23.70000113Q2306Q2306-T2308 PolarHBondContact O-N 3.42Å
2309S38.7Very low40.9Very low94 Ų94123.9 Ų123.966%0.65768%0.68SS**  trans-84.6-13.3-169.165.10000115.5D2307D2307-S2309 PolarHBondContact O-N 2.94Å
2310T45.2Very low41.8Very low96 Ų96121.5 Ų121.559%0.58967%0.673SS**SBendtrans-80.7-22-175.649.50000114.5L2312 E2313 E2314T2310-L2312 VanDerWaalsContact C-N 3.29Å; T2310-L2312 PolarHBondContact O-N 2.81Å; T2310-E2313 PolarHBondContact O-N 3.29Å; T2310-E2314 PolarHBondContact O-N 2.95Å
2311G46Very low42.7Very low42 Ų42121 Ų12143%0.43367%0.671SS.*Hα-helixtrans-65.7-24.2-172.300000115.4V2315G2311-V2315 VanDerWaalsContact O-CG2 3.25Å; G2311-V2315 WeakPolarHBondContact O-CG2 3.35Å
2312L42.6Very low43.3Very low128 Ų128118.7 Ų118.767%0.6767%0.666SS**Hα-helixtrans-83.8-31.4176.7-166.866.9000112.2T2310 V2315 M2316T2310-L2312 VanDerWaalsContact C-N 3.29Å; T2310-L2312 PolarHBondContact O-N 2.81Å; L2312-V2315 PolarHBondContact O-N 3.21Å; L2312-M2316 WeakPolarHBondContact O-CG 3.18Å; L2312-M2316 PolarHBondContact O-N 3.02Å
2313E48.8Very low43.4Very low145 Ų145118.9 Ų118.968%0.67866%0.66SS**Hα-helixtrans-72.3-41.9-179.6-159.9160-146.700110.5T2310 V2315 M2316 E2317T2310-E2313 PolarHBondContact O-N 3.29Å; E2313-V2315 VanDerWaalsContact C-N 3.35Å; E2313-V2315 PolarHBondContact O-N 3.33Å; E2313-M2316 PolarHBondContact O-N 3.18Å; E2313-E2317 WeakPolarHBondContact O-CB 3.3Å; E2313-E2317 PolarHBondContact O-N 3.25Å
2314E52.8Low43.6Very low123 Ų123119.2 Ų119.258%0.57566%0.659SS**Hα-helixtrans-62.1-38.7173.1-126.5179.9178.900112.4T2310 E2317 Q2318T2310-E2314 PolarHBondContact O-N 2.95Å; E2314-E2317 PolarHBondContact O-N 3.28Å; E2314-Q2318 WeakPolarHBondContact O-CB 3.44Å; E2314-Q2318 WeakPolarHBondContact O-CG 3.2Å; E2314-Q2318 PolarHBondContact O-N 3.44Å
2315V58.5Low43.6Very low75 Ų75119.1 Ų119.146%0.45566%0.662SS.*Hα-helixtrans-68.9-37.2175.4169.30000111.7G2311 L2312 E2313 L2319G2311-V2315 VanDerWaalsContact O-CG2 3.25Å; G2311-V2315 WeakPolarHBondContact O-CG2 3.35Å; L2312-V2315 PolarHBondContact O-N 3.21Å; E2313-V2315 VanDerWaalsContact C-N 3.35Å; E2313-V2315 PolarHBondContact O-N 3.33Å; V2315-L2319 HydrophobicContact CG1-CD1 4.21Å; V2315-L2319 WeakPolarHBondContact O-CB 3.47Å; V2315-L2319 PolarHBondContact O-N 3.35Å
2316M56Low43.5Very low117 Ų117119.1 Ų119.158%0.57667%0.665SS**Hα-helixtrans-69.4-37.1174-78.9-174.264.300112.5L2312 E2313 L2319 N2320L2312-M2316 WeakPolarHBondContact O-CG 3.18Å; L2312-M2316 PolarHBondContact O-N 3.02Å; E2313-M2316 PolarHBondContact O-N 3.18Å; M2316-L2319 PolarHBondContact O-N 3.07Å; M2316-N2320 PolarHBondContact O-N 3.39Å
2317E59.7Low43.4Very low127 Ų127121.7 Ų121.759%0.59367%0.667SS**Hα-helixtrans-70.1-39.4176.1-166.6168.4-154.900111.6E2313 E2314 N2320 N2321E2313-E2317 WeakPolarHBondContact O-CB 3.3Å; E2313-E2317 PolarHBondContact O-N 3.25Å; E2314-E2317 PolarHBondContact O-N 3.28Å; E2317-N2320 PolarHBondContact O-N 3.19Å; E2317-N2321 WeakPolarHBondContact O-CB 3.3Å; E2317-N2321 PolarHBondContact O-N 3.19Å; E2317-N2321 PolarHBondContact O-ND2 3.4Å
2318Q54.1Low43.2Very low123 Ų123118.3 Ų118.358%0.57567%0.667SS**Hα-helixtrans-63.2-39.6171.1-74.3-178.714.800112.6E2314 N2321 S2322E2314-Q2318 WeakPolarHBondContact O-CB 3.44Å; E2314-Q2318 WeakPolarHBondContact O-CG 3.2Å; E2314-Q2318 PolarHBondContact O-N 3.44Å; Q2318-N2321 PolarHBondContact O-N 3.34Å; Q2318-S2322 WeakPolarHBondContact O-CB 3.25Å; Q2318-S2322 PolarHBondContact O-N 2.9Å; Q2318-S2322 PolarHBondContact O-OG 3Å
2319L47.3Very low42.9Very low102 Ų102123.1 Ų123.153%0.53467%0.669SS.*Hα-helixtrans-66.3-38.8175.6-86.9164.2000112.8V2315 M2316 S2322V2315-L2319 HydrophobicContact CG1-CD1 4.21Å; V2315-L2319 WeakPolarHBondContact O-CB 3.47Å; V2315-L2319 PolarHBondContact O-N 3.35Å; M2316-L2319 PolarHBondContact O-N 3.07Å; L2319-S2322 PolarHBondContact O-N 3.21Å
2320N48Very low42.4Very low131 Ų131126.2 Ų126.270%0.70168%0.678SS**Hα-helixtrans-67.4-36.5174.1-91-23.3000112.5M2316 E2317 S2322M2316-N2320 PolarHBondContact O-N 3.39Å; E2317-N2320 PolarHBondContact O-N 3.19Å; N2320-S2322 VanDerWaalsContact C-N 3.32Å; N2320-S2322 PolarHBondContact O-N 3.08Å
2321N45.7Very low41.6Very low124 Ų124127.8 Ų127.866%0.66369%0.688SS**Hα-helixtrans-77.1-14.5178.1-73.5-42000114E2317 Q2318E2317-N2321 WeakPolarHBondContact O-CB 3.3Å; E2317-N2321 PolarHBondContact O-N 3.19Å; E2317-N2321 PolarHBondContact O-ND2 3.4Å; Q2318-N2321 PolarHBondContact O-N 3.34Å
2322S42.2Very low41.2Very low84 Ų84132.4 Ų132.459%0.58771%0.71SS**THydrogen-bonded Turntrans-83.6-5.1-177.9-64.20000115Q2318 L2319 N2320 P2324Q2318-S2322 WeakPolarHBondContact O-CB 3.25Å; Q2318-S2322 PolarHBondContact O-N 2.9Å; Q2318-S2322 PolarHBondContact O-OG 3Å; L2319-S2322 PolarHBondContact O-N 3.21Å; N2320-S2322 VanDerWaalsContact C-N 3.32Å; N2320-S2322 PolarHBondContact O-N 3.08Å; S2322-P2324 WeakPolarHBondContact O-CD 3.31Å
2323F29.8Very low40.5Very low155 Ų155129.7 Ų129.768%0.6871%0.713SS**SBendtrans-102.9109.2174.2-76.3-78.5000111.1S2325F2323-S2325 PolarHBondContact O-N 3.35Å
2324P33.4Very low39.4Very low125 Ų125132.5 Ų132.581%0.81272%0.723SS**  trans-66.798.7-175.8-19.232.1000111.7S2322 S2326S2322-P2324 WeakPolarHBondContact O-CD 3.31Å; P2324-S2326 PolarHBondContact O-N 3.24Å
2325S31.4Very low38.4Very low115 Ų115133.2 Ų133.280%0.80474%0.738SS**  trans-69.2103.6170.6-76.90000109.7F2323 R2327F2323-S2325 PolarHBondContact O-N 3.35Å; S2325-R2327 PolarHBondContact O-N 3.13Å
2326S29.5Very low37.2Very low126 Ų126138.4 Ų138.488%0.88176%0.76SS**  trans-60.391.8178.855.60000111.9P2324P2324-S2326 PolarHBondContact O-N 3.24Å
2327R32.7Very low36.1Very low237 Ų237143.4 Ų143.489%0.89477%0.773SS**  trans-122.188.6174.3-151.6176.9-166.8-167.84.2109.8S2325 R2329S2325-R2327 PolarHBondContact O-N 3.13Å; R2327-R2329 PolarHBondContact O-N 2.97Å
2328G29.3Very low35.1Very low77 Ų77145.6 Ų145.679%0.79478%0.783SS**  trans-58.6131-178.500000112.4
2329R29.5Very low34.1Very low239 Ų239146.5 Ų146.590%0.90279%0.792SS**  trans-101.2109.2173-166.6-178.7-132.4-145.24.8108.8R2327 T2331R2327-R2329 PolarHBondContact O-N 2.97Å; R2329-T2331 PolarHBondContact O-N 3.46Å
2330N28.9Very low33.5Very low159 Ų159148.4 Ų148.485%0.8581%0.808SS**  trans-60.6127.2176-66.3-22.4000111
2331T28.3Very low32.7Very low129 Ų129154.8 Ų154.879%0.79184%0.837SS**  trans-120134.1153.440.50000108.1R2329R2329-T2331 PolarHBondContact O-N 3.46Å
2332P36.7Very low32Very low139 Ų139156.4 Ų156.490%0.90385%0.845SS**  trans-86.5130.1-165.132.4-34.4000112.7
2333G27.9Very low31.5Very low71 Ų71160.2 Ų160.273%0.73286%0.859SS**  trans-175.696.7174.200000114.7
2334K26.1Very low31.6Very low205 Ų205160.4 Ų160.489%0.89187%0.869SS**  trans51.494.3163.8-66.8-179.7176.41770117.6
2335P32Very low31.5Very low137 Ų137162.5 Ų162.589%0.8987%0.872SS**PPolyproline II helixtrans-79.3119.9165.632-30.3000111
2336M32.2Very low31.5Very low185 Ų185165.5 Ų165.591%0.91188%0.876SS**PPolyproline II helixtrans-98.8152.2161-122.6-173.976.700109.9
2337R34.4Very low31.6Very low222 Ų222168.1 Ų168.184%0.83888%0.876SS**PPolyproline II helixtrans-66.9148.8-174.6-64.5171171.9156.8-5.6113.1
2338E38Very low31.5Very low173 Ų173163.2 Ų163.281%0.80888%0.875SS**  trans167.5112.5130.3-91.8163.1-166.100106
2339D32.7Very low31.7Very low142 Ų142169.8 Ų169.876%0.75988%0.881SS**  92.9143.165.2-86.4-32000113.4
2340T34.9Very low31.9Very low142 Ų142164.1 Ų164.187%0.87188%0.879SS**  trans64.9100.4-177.252.50000118.1
2341M30.6Very low32.1Very low265 Ų265164.5 Ų164.5100%1.30588%0.882SS**  trans-106.80132.5-150.7179.9-171.500107.6

Retrieved 2,341 of 2,341 residues in 2295.9 ms (Link to these results)

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