A0A3Q0KKH1_SCHMA Loading...

non-specific serine/threonine protein kinase AlphaSync Fragmented

AlphaFold DB , UniProt , Accession A0A3Q0KKH1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 3,438 aa.

>A0A3Q0KKH1_SCHMA|A0A3Q0KKH1
MNTNPNSLISQFVQGIKSRSEDDRFKTVAELCKVVSSELKEVSNQNYVICLDLLCNELINIVSNGDVHEKKGAIVAMGCLAEVDFMSVHNHCQRFVKQLLTQSVTTDLQLTALEARLIGQLGLVFPYDFIEEQTKNACSILSKDISDAQKHFAILTLREFILHTPTSFCQHMGSFITAILSALRDKNSITRELAGVALRCAFILTAKREQRRYRTYLSVDHSRMGEGPGSFSNLEGGASSVSNRMFFSATGNSRHKTNPNSMSTVNFPGLGYSVSDTNSTSSPFIWYRDCLIESIRTQSEPAPLILQEQSSHTSSSRKLNRDDWIHGNILILQELLFCVQPQFSKLLMELDQMCGLPLFEFLTVSHSEGSLAVRTVLSTRWPIVNASCISVAIGVLPGNPFCSSDSEQLPNLALEVLGLRDGIKQESNGYQQHHEQQQYGRQNFSNLSSEICLCLLLENIDKIWASVLMWINSRNHQIMFLLYKLIPRLVALKPSEFQDTERQRTVMEWMLQCLRKEKEKPMILLNLSLICYFMGPEFATSNYLTQIFQSIRSYLPTQKDVSNKKRSPALETSAILSVSLFTKSLGPAINESVNQILDAMVASGLNQPLIASFKVIAMHIPRLRKEIQDCLLNNISLVLMNNSGGSFSHLHSHITNTTSGDSTVSTLSFFPNLINLVGGTIHSGSSGTNVPTLSSNNTYSSALAVGANTVNSSTSAFPFSSATRFVFGPSTKGHSSKQTSSTGLNATGTEFAHVAIPGGFSASGELSTDVAVVALALKTLGSFNFDGHTLAHFVRHICDNFISISTCEVKEIRLEAVKTCAHLMIPWLKSTETQQWYARPALNTVADVLNKLLTVGISDPDPDVRRCVFLSFDQRFDLHLAQSDHLNYLFLALYDEVFDIRCLVMQRLGRLSDINPACVQPNLRKVLLHTLNDLSHSGSTRNKEQSALLLACLIATAPRFLIPYSEPLIHILLPRIRQALPASLRASLIVTSFSRLQNSTFTNNKEIDCSSSLLPAERLPASIQLIQNVILTTQIAANAASASANAIASAVAASAGLGGGLHFPLTANTSQRLTRRAPTGHIGANQIGPALAAANAVAMATGAATAAAAAAGAVMAATGQNTTTNTSGGGFGIFNTDAKNLFGTGLVPNYGFKSDVPMHDLAAIVERFGNLNFDYNSDTYFNFEFPPGAYPPSAYLLNSTPLIDSYMLGDQYSSRNQSWSEYSMSRMSENSSTAQWTEPTPVIVALFTTLGRLAAVAPRSIYHYMDEFIPILAYMMQDTSCFLKRSIAVWTLTRLVSHTGYVVIPYKRYPQLLNILLGMLKREEIKCIRQEVLRALGVLGALDPFKFKLYSGQVDTYGDTGIAVSHHEVVERKDVDITQSELVINLSWESRDVFFSVCALSALIHSLRDPALHSQYGSIVHTIVYVLKLLGPRSVIYLRQLIPDYFRCLENTRDARLQEFLIRQLGNVMTIVQLNTKEFAHEVIDLLITHWWIAPNVQRACIGLLSPMSSVLGAEFRTYLTRLIPTILRMFHHESNESNLIALLEVLPEFGYTLKDYAHIIVPAISSLIDITSEASLFVLLNSVSEISSSNYITTTTTTATTTTTSTSTSHSAMPNSKSQLDTDTIDLSNILSSVPENNCTSTNDTNVGVIQTSNTSTVPNGLNQQILPDKVGSVHLRKACLECLARFTDCVDLDDFAGQIIHPICRLLLTLESCHQSYQQLLHQQHHLSSTKSASLGSQACLNAINELRVPAMDVLTGLLYRMGQKFKFFLPLVQKMLSRLQLHTPRFNTVLGQVEKGAYLPTTSDRAHVKFTSISTRNRAQKLNVDDSETPGTVKLLKINNTNLERAWHSSRMVSHDDWSQWLKTLNMALLRESPSPAIRACSQLTAITPGIGRTLFNAAFLSCWPELNYHQQDDLINTLERVLRVPDQSPEVSQTILNLEEFMAHMDKYSSSSHRVHLPLPLGVLADRALKNRAYAKALYYKEQEFLMESEKRSCPSPATLSSLLTIYSKLNLEEAANGVLLYATRSTQDKLANEEVWREKLHDWKSALNLYERKLEDDRIKDKSSLILGRMRCLRALGQWAPLNNMAWERWNDVNDQVRALMAPLACSAAWALNSWDRVERYTEALSADNSFDGAFYRAVLNIHSEQYAKACDFIMKARDVLDSNLTAMAEESYNRAYADLVGTQLLSEAEEVIQYKLIPERRSILREAWQSRLLGCNSVIEDWSQIIQLRSLVLEPYEDRRSWLRFAGLCRRSGRFILSRQVLENLLGLDPAGIPPCDPIPSSDPAIVFGYTKLLWAVGAHEEAVSRLCVLKTHVLEPLLRAETGINSAQQSSVFQLLSPNLLNANETLDGLDSRQIEIQIINERKELRRLLAKCCLKLGSWYSELYTRSPPGGHQIDNHSLAYTPNSVFTAASGNGLQFSVAAAARTLSKVNSNSDVIDNIHPSQMSRGAGMRLSNNYSGIVVGGRESSNRNGSRIRRTASAAGGTSVVNENLATSNITQTWEESQAFVIQCYQTATLHAPDCRNTWQSWAMANYAVFNHLDTLKACLERAELELNKVGGIDNHSLWTSRRNFSSSTGIHGSGVNHMQSSNLPVGNISSNFSPLPPPIAELVRAKTDLQRCMELHAAPSVKGFVNSISLSPTANLQDSLRLINLLFKFGHLTEIREVIREGLTKIRLDNWLLVIQQLLARIDTPREYVATIIIDLLISVGQRYPQSMVYPLVLAFKSGGSDRRRYNANRILYSMEEQNSRLISEAFLLNEELIRLSITWVEMWSEALEDASRVYFGEKDIAKMFRLLHPLHQMMDRGHETIHEATFLQENGNDLAESRLCCERYELTQVRIDLQKAWEGYYTLYRRFAKQVNNMTTLELTVSSPRLHEYGQDWQLAVPGSYEPHRPLVRIASIKNCLTFITSKQRPRKLTITGSNGHQYVFLLKGHEDTRQDERIMQFFGLVNTLLINNPETLRRNLTIQRMSVIPLSTYTGLIGWVPNSDTFHNLIRDYREKADVVLNKENREMLRLAPDFDRLNVIQKTEIFEAGLRESSGRDLANILWLKSHSSEAWFERRTNFTRSMATMSMVGYILGLGDRHPSNIMLSRVTGKVVHIDFGDCFEVATMREKFPEKVPFRLTRMIISAMEVTGIDGVYRHTCEMVMSLLRSNRESLLAVLEAFIHDPLLQWVLHENRKEFNHLENKLDDGGGGGGGIAPAIGTNCLANGTGGGVHGVTTANNQSVQLKPGARNSDYPHRQVYAHQQHHAVQNTLRRPTDKSNNLTSGQQNSQGHFQQQNLNRRANSPNRVFTNPNHPDSASLRDPQKVNQWRHHLCNGPWFGCYETAKRLRKQMESGHIVVERHGLQGFIFSAKPPSTEDSCIDSESQPVTLGNVRARSVMERIRQKLTGTERDQVMSVSAQVDFLIREATSNQNLCQMYIGWCAFW

Structure and PAE viewers are unavailable as this is a multi-fragment structure.

 

Download 12 Fragment Structures   AlphaSync Parameters   PDBs   Table  
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
1M31.4Very low63.3Low207 Ų20796.4 Ų96.4100%1.0253%0.53SS*.  0150.90-64.5-175.9-177.400108.7T3M1-T3 HydrophobicContact CB-CG2 4.5Å; M1-T3 PolarHBondContact O-N 2.86Å
2N35.7Very low64.7Low181 Ų18189.6 Ų89.697%0.96849%0.491SS*.  trans-86.241.1176.3-78.25.1000112.5
3T50.7Low66Low78 Ų7883.8 Ų83.848%0.47946%0.461SS..  trans-77.1123.8174.735.30000109.2M1M1-T3 HydrophobicContact CB-CG2 4.5Å; M1-T3 PolarHBondContact O-N 2.86Å
4N61.3Low67.3Low123 Ų12388.7 Ų88.766%0.65848%0.478SS*.  trans-56.5132.1173.4-92.1-30.1000109N6 S7N4-N6 PolarHBondContact O-N 3.1Å; N4-N6 VanDerWaalsContact O-N 3.1Å; N4-S7 PolarHBondContact O-N 2.69Å; N4-S7 PolarHBondContact O-OG 3.23Å
5P64.2Low68.2Low58 Ų5883.8 Ų83.838%0.37746%0.457SS..Hα-helixtrans-55.6-37-177.220.7-32.1000111.4S7 L8 I9 C50P5-S7 VanDerWaalsContact C-N 3.32Å; P5-S7 PolarHBondContact O-N 2.79Å; P5-L8 PolarHBondContact O-N 3.02Å; P5-I9 VanDerWaalsContact O-CG1 3.3Å; P5-I9 WeakPolarHBondContact O-CG1 3.23Å; P5-I9 PolarHBondContact O-N 3.39Å; P5-C50 HydrophobicContact CB-CB 4.47Å
6N70.6Confident69Low98 Ų9878.6 Ų78.652%0.52443%0.428SS..Hα-helixtrans-59.8-33.5177.6-61.5-3.7000114.1N4 S10N4-N6 PolarHBondContact O-N 3.1Å; N4-N6 VanDerWaalsContact O-N 3.1Å; N6-S10 VanDerWaalsContact O-CB 3.3Å; N6-S10 WeakPolarHBondContact O-CB 3.3Å; N6-S10 PolarHBondContact O-N 2.88Å; N6-S10 PolarHBondContact O-OG 2.8Å
7S73Confident69.9Low63 Ų6378.6 Ų78.644%0.44142%0.423SS..Hα-helixtrans-75.4-37.3178.661.50000111.8N4 P5 S10 Q11N4-S7 PolarHBondContact O-N 2.69Å; N4-S7 PolarHBondContact O-OG 3.23Å; P5-S7 VanDerWaalsContact C-N 3.32Å; P5-S7 PolarHBondContact O-N 2.79Å; S7-S10 PolarHBondContact O-N 3.26Å; S7-Q11 PolarHBondContact O-N 3.31Å
8L72.9Confident70.6Confident37 Ų3775.7 Ų75.719%0.19441%0.41CS..Hα-helixtrans-66.9-45.6175.4-177.8139.6000110.7P5 S10 Q11 F12 V34P5-L8 PolarHBondContact O-N 3.02Å; L8-S10 VanDerWaalsContact C-N 3.34Å; L8-S10 PolarHBondContact O-N 2.85Å; L8-Q11 PolarHBondContact O-N 2.89Å; L8-F12 HydrophobicContact CD1-CE2 4.45Å; L8-F12 HydrophobicContact CD2-CD2 3.83Å; L8-F12 HydrophobicContact CD2-CE2 3.71Å; L8-F12 HydrophobicContact CG-CD2 4.09Å; L8-F12 HydrophobicContact CG-CE2 3.79Å; L8-F12 WeakPolarHBondContact O-CD2 3.36Å; L8-F12 PolarHBondContact O-N 2.94Å; L8-F12 VanDerWaalsContact O-N 3.14Å; L8-V34 HydrophobicContact CD1-CG1 4.28Å; L8-V34 HydrophobicContact CD2-CG1 4.46Å
9I76.8Confident71Confident11 Ų1182.4 Ų82.46%0.05643%0.429CS..Hα-helixtrans-57.7-46171.9-66.3165.3000110.6P5 Q11 F12 V13 L53 L54P5-I9 VanDerWaalsContact O-CG1 3.3Å; P5-I9 WeakPolarHBondContact O-CG1 3.23Å; P5-I9 PolarHBondContact O-N 3.39Å; I9-Q11 VanDerWaalsContact C-N 3.32Å; I9-Q11 PolarHBondContact O-N 3.32Å; I9-F12 PolarHBondContact O-N 2.66Å; I9-V13 HydrophobicContact CG2-CG2 4.01Å; I9-V13 WeakPolarHBondContact O-CB 3.36Å; I9-V13 VanDerWaalsContact O-CG2 3.31Å; I9-V13 WeakPolarHBondContact O-CG2 3.26Å; I9-V13 PolarHBondContact O-N 3.34Å; I9-L53 HydrophobicContact CD1-CB 3.77Å; I9-L53 HydrophobicContact CD1-CD1 4.42Å; I9-L54 HydrophobicContact CG2-CD1 4.2Å
10S78.9Confident71.4Confident70 Ų7080.7 Ų80.749%0.4942%0.424SS..Hα-helixtrans-60.3-39.6180-62.30000112.8N6 S7 L8 Q14N6-S10 VanDerWaalsContact O-CB 3.3Å; N6-S10 WeakPolarHBondContact O-CB 3.3Å; N6-S10 PolarHBondContact O-N 2.88Å; N6-S10 PolarHBondContact O-OG 2.8Å; S7-S10 PolarHBondContact O-N 3.26Å; L8-S10 VanDerWaalsContact C-N 3.34Å; L8-S10 PolarHBondContact O-N 2.85Å; S10-Q14 WeakPolarHBondContact O-CB 3.38Å; S10-Q14 PolarHBondContact O-N 3.07Å
11Q81.1Confident71.6Confident134 Ų13479 Ų7963%0.62641%0.414SS*.Hα-helixtrans-64.3-46.8176.3-178.3178.2-12.800111.6S7 L8 I9 Q14 G15S7-Q11 PolarHBondContact O-N 3.31Å; L8-Q11 PolarHBondContact O-N 2.89Å; I9-Q11 VanDerWaalsContact C-N 3.32Å; I9-Q11 PolarHBondContact O-N 3.32Å; Q11-Q14 PolarHBondContact O-N 2.76Å; Q11-G15 PolarHBondContact O-N 3.47Å
12F80Confident73.7Confident15 Ų1573.5 Ų73.57%0.06639%0.389CS..Hα-helixtrans-66.4-41.7177.1-74.2-61.8000112.4L8 I9 Q14 G15 I16 E30 L31 V34L8-F12 HydrophobicContact CD1-CE2 4.45Å; L8-F12 HydrophobicContact CD2-CD2 3.83Å; L8-F12 HydrophobicContact CD2-CE2 3.71Å; L8-F12 HydrophobicContact CG-CD2 4.09Å; L8-F12 HydrophobicContact CG-CE2 3.79Å; L8-F12 WeakPolarHBondContact O-CD2 3.36Å; L8-F12 PolarHBondContact O-N 2.94Å; L8-F12 VanDerWaalsContact O-N 3.14Å; I9-F12 PolarHBondContact O-N 2.66Å; F12-Q14 VanDerWaalsContact C-N 3.3Å; F12-Q14 PolarHBondContact O-N 3.31Å; F12-G15 PolarHBondContact O-N 2.73Å; F12-G15 VanDerWaalsContact O-N 3.14Å; F12-I16 WeakPolarHBondContact O-CB 3.42Å; F12-I16 WeakPolarHBondContact O-CD1 3.2Å; F12-I16 VanDerWaalsContact O-CG1 3.24Å; F12-I16 WeakPolarHBondContact O-CG1 3.45Å; F12-I16 PolarHBondContact O-N 2.87Å; F12-E30 HydrophobicContact CE1-CB 4.1Å; F12-L31 HydrophobicContact CB-CD1 4.31Å; F12-L31 HydrophobicContact CD1-CB 3.81Å; F12-L31 HydrophobicContact CD1-CD1 4.2Å; F12-L31 HydrophobicContact CD2-CD1 3.82Å; F12-L31 HydrophobicContact CE1-CB 3.95Å; F12-L31 HydrophobicContact CE2-CD1 4.18Å; F12-L31 HydrophobicContact CG-CB 4.31Å; F12-L31 HydrophobicContact CG-CD1 3.85Å; F12-V34 HydrophobicContact CE2-CB 4.4Å; F12-V34 HydrophobicContact CE2-CG1 4.21Å; F12-V34 HydrophobicContact CE2-CG2 4.48Å; F12-V34 HydrophobicContact CZ-CB 4.15Å; F12-V34 HydrophobicContact CZ-CG1 4.43Å; F12-V34 HydrophobicContact CZ-CG2 3.92Å
13V81.7Confident75.8Confident15 Ų1568.2 Ų68.29%0.09136%0.361CS..Hα-helixtrans-60-40.1174.3166.70000111.2I9 I16 K17 E57 I61I9-V13 HydrophobicContact CG2-CG2 4.01Å; I9-V13 WeakPolarHBondContact O-CB 3.36Å; I9-V13 VanDerWaalsContact O-CG2 3.31Å; I9-V13 WeakPolarHBondContact O-CG2 3.26Å; I9-V13 PolarHBondContact O-N 3.34Å; V13-I16 PolarHBondContact O-N 2.96Å; V13-K17 HydrophobicContact CG1-CD 4Å; V13-K17 WeakPolarHBondContact O-CB 3.42Å; V13-K17 VanDerWaalsContact O-CG 3.22Å; V13-K17 WeakPolarHBondContact O-CG 3.46Å; V13-K17 PolarHBondContact O-N 3.44Å; V13-E57 HydrophobicContact CG2-CB 4.43Å; V13-I61 HydrophobicContact CG1-CD1 3.84Å; V13-I61 HydrophobicContact CG2-CD1 4.3Å
14Q83.6Confident77.2Confident152 Ų15265.1 Ų65.171%0.7134%0.34SS*.Hα-helixtrans-65.8-38.4174.9-172.3175.36.100112.4S10 Q11 F12 K17S10-Q14 WeakPolarHBondContact O-CB 3.38Å; S10-Q14 PolarHBondContact O-N 3.07Å; Q11-Q14 PolarHBondContact O-N 2.76Å; F12-Q14 VanDerWaalsContact C-N 3.3Å; F12-Q14 PolarHBondContact O-N 3.31Å; Q14-K17 PolarHBondContact O-N 3.08Å
15G80.4Confident78Confident15 Ų1560.9 Ų60.916%0.15532%0.316CS..Hα-helixtrans-64.2-45.7173.800000113.2Q11 F12 K17 S18Q11-G15 PolarHBondContact O-N 3.47Å; F12-G15 PolarHBondContact O-N 2.73Å; F12-G15 VanDerWaalsContact O-N 3.14Å; G15-K17 VanDerWaalsContact C-N 3.26Å; G15-K17 PolarHBondContact O-N 3.14Å; G15-S18 WeakPolarHBondContact O-CB 3.38Å; G15-S18 PolarHBondContact O-N 3.41Å; G15-S18 PolarHBondContact O-OG 2.86Å
16I81.6Confident78.8Confident0 Ų062 Ų620%032%0.315CS..Hα-helixtrans-63.2-31.4177.6-70.2165.7000112F12 V13 S18 R24 V28 L31 L58 G72 A73 A76F12-I16 WeakPolarHBondContact O-CB 3.42Å; F12-I16 WeakPolarHBondContact O-CD1 3.2Å; F12-I16 VanDerWaalsContact O-CG1 3.24Å; F12-I16 WeakPolarHBondContact O-CG1 3.45Å; F12-I16 PolarHBondContact O-N 2.87Å; V13-I16 PolarHBondContact O-N 2.96Å; I16-S18 VanDerWaalsContact C-N 3.27Å; I16-S18 PolarHBondContact O-N 3.45Å; I16-R24 VanDerWaalsContact O-CD 3.24Å; I16-R24 WeakPolarHBondContact O-CD 3.49Å; I16-R24 WeakPolarHBondContact O-CG 3.34Å; I16-V28 HydrophobicContact CG1-CG2 4.22Å; I16-L31 HydrophobicContact CD1-CD2 4.26Å; I16-L58 HydrophobicContact CD1-CD2 4.19Å; I16-G72 VanDerWaalsContact CG2-C 3.48Å; I16-A73 HydrophobicContact CG2-CB 4.37Å; I16-A76 HydrophobicContact CD1-CB 3.92Å
17K84.8Confident79.4Confident79 Ų7958.5 Ų58.534%0.34330%0.297SS..THydrogen-bonded Turntrans-80.62.5175.3-70.3178.3171-175.40114.5V13 Q14 G15 E69V13-K17 HydrophobicContact CG1-CD 4Å; V13-K17 WeakPolarHBondContact O-CB 3.42Å; V13-K17 VanDerWaalsContact O-CG 3.22Å; V13-K17 WeakPolarHBondContact O-CG 3.46Å; V13-K17 PolarHBondContact O-N 3.44Å; Q14-K17 PolarHBondContact O-N 3.08Å; G15-K17 VanDerWaalsContact C-N 3.26Å; G15-K17 PolarHBondContact O-N 3.14Å; K17-E69 HydrophobicContact CB-CG 4.06Å; K17-E69 VanDerWaalsContact CD-OE1 3.27Å; K17-E69 WeakPolarHBondContact CD-OE1 3.18Å; K17-E69 HydrophobicContact CG-CB 4.21Å; K17-E69 HydrophobicContact CG-CG 3.83Å; K17-E69 WeakPolarHBondContact CG-OE1 3.47Å
18S81.8Confident79.7Confident26 Ų2655.5 Ų55.518%0.18228%0.276CS..  trans-6614717863.30000112.3G15 I16 R24G15-S18 WeakPolarHBondContact O-CB 3.38Å; G15-S18 PolarHBondContact O-N 3.41Å; G15-S18 PolarHBondContact O-OG 2.86Å; I16-S18 VanDerWaalsContact C-N 3.27Å; I16-S18 PolarHBondContact O-N 3.45Å; S18-R24 WeakPolarHBondContact O-CD 3.33Å; S18-R24 WeakPolarHBondContact O-CG 3.42Å; S18-R24 PolarHBondContact O-NH1 3.26Å; S18-R24 VanDerWaalsContact OG-CG 3.28Å; S18-R24 WeakPolarHBondContact OG-CG 3.47Å; S18-R24 PolarHBondContact OG-N 3.04Å
19R79Confident79.8Confident203 Ų20356.1 Ų56.177%0.76629%0.286SS*.SBendtrans-74.7-33.8179.4-72.2-176.6173.7-178.3-3.5113.1R24R19-R24 PolarHBondContact O-NH1 3.49Å
20S77.7Confident79.9Confident48 Ų4859.5 Ų59.534%0.33630%0.302SS..SBendtrans-64.1134.6175.91700000111.5D23 R24S20-D23 WeakPolarHBondContact CB-OD2 3.31Å; S20-D23 PolarHBondContact OG-N 3.1Å; S20-D23 PolarHBondContact OG-OD2 3.4Å; S20-R24 WeakPolarHBondContact O-CG 3.42Å; S20-R24 PolarHBondContact O-N 3.28Å; S20-R24 PolarHBondContact O-NH1 3.05Å
21E76.4Confident80Confident47 Ų4756.3 Ų56.322%0.2228%0.279CS..Hα-helixtrans-71-41.5178.1-179.8171.1147.300112R24 F25 R380E21-R24 PolarHBondContact O-N 3.07Å; E21-F25 HydrophobicContact CG-CD2 3.78Å; E21-F25 HydrophobicContact CG-CE2 3.28Å; E21-F25 HydrophobicContact CG-CZ 4.18Å; E21-F25 WeakPolarHBondContact O-CD2 3.27Å; E21-F25 PolarHBondContact O-N 3.18Å; E21-F25 VanDerWaalsContact O-N 3.11Å; E21-F25 WeakPolarHBondContact OE1-CE2 3.49Å; E21-R380 WeakPolarHBondContact OE1-CD 3.42Å; E21-R380 IonicContact OE1-NE 2.82Å
22D75.2Confident79.7Confident91 Ų9150 Ų5049%0.48725%0.25SS..Hα-helixtrans-69.3-35.8-179.3-66.1-48.4000112.1F25 K26 R380D22-F25 PolarHBondContact O-N 3.03Å; D22-K26 WeakPolarHBondContact O-CB 3.04Å; D22-K26 PolarHBondContact O-N 2.95Å; D22-R380 IonicContact OD1-CZ 2.64Å; D22-R380 IonicContact OD1-NH1 2.65Å; D22-R380 PolarHBondContact OD1-NH1 3.48Å; D22-R380 IonicContact OD1-NH2 2.64Å
23D80.6Confident79.2Confident70 Ų7056.5 Ų56.537%0.37428%0.279SS..Hα-helixtrans-67.4-39175.6-67-45.3000111.9S20 K26 T27S20-D23 WeakPolarHBondContact CB-OD2 3.31Å; S20-D23 PolarHBondContact OG-N 3.1Å; S20-D23 PolarHBondContact OG-OD2 3.4Å; D23-K26 PolarHBondContact O-N 3.2Å; D23-T27 WeakPolarHBondContact O-CB 3.32Å; D23-T27 VanDerWaalsContact O-CG2 3.29Å; D23-T27 WeakPolarHBondContact O-CG2 3.45Å; D23-T27 PolarHBondContact O-N 3.49Å; D23-T27 PolarHBondContact O-OG1 3.36Å
24R80.1Confident78.9Confident13 Ų1356.6 Ų56.65%0.04928%0.279CS..Hα-helixtrans-61.1-44.8172.2-72.1-167.5-57.6-86.9-4.5111.4I16 S18 R19 S20 E21 T27 V28 H68I16-R24 VanDerWaalsContact O-CD 3.24Å; I16-R24 WeakPolarHBondContact O-CD 3.49Å; I16-R24 WeakPolarHBondContact O-CG 3.34Å; S18-R24 WeakPolarHBondContact O-CD 3.33Å; S18-R24 WeakPolarHBondContact O-CG 3.42Å; S18-R24 PolarHBondContact O-NH1 3.26Å; S18-R24 VanDerWaalsContact OG-CG 3.28Å; S18-R24 WeakPolarHBondContact OG-CG 3.47Å; S18-R24 PolarHBondContact OG-N 3.04Å; R19-R24 PolarHBondContact O-NH1 3.49Å; S20-R24 WeakPolarHBondContact O-CG 3.42Å; S20-R24 PolarHBondContact O-N 3.28Å; S20-R24 PolarHBondContact O-NH1 3.05Å; E21-R24 PolarHBondContact O-N 3.07Å; R24-T27 WeakPolarHBondContact CA-OG1 3.38Å; R24-T27 PolarHBondContact O-OG1 3.31Å; R24-T27 VanDerWaalsContact O-OG1 3.06Å; R24-V28 VanDerWaalsContact O-CG2 3.31Å; R24-V28 WeakPolarHBondContact O-CG2 3.35Å; R24-V28 PolarHBondContact O-N 3.22Å; R24-H68 WeakPolarHBondContact CD-O 3.36Å
25F78.4Confident78.3Confident34 Ų3449.5 Ų49.515%0.14925%0.246CC..Hα-helixtrans-69.9-38.5179.2-69-47.9000113.2E21 D22 V28 A29 V75 R380 P382E21-F25 HydrophobicContact CG-CD2 3.78Å; E21-F25 HydrophobicContact CG-CE2 3.28Å; E21-F25 HydrophobicContact CG-CZ 4.18Å; E21-F25 WeakPolarHBondContact O-CD2 3.27Å; E21-F25 PolarHBondContact O-N 3.18Å; E21-F25 VanDerWaalsContact O-N 3.11Å; E21-F25 WeakPolarHBondContact OE1-CE2 3.49Å; D22-F25 PolarHBondContact O-N 3.03Å; F25-V28 PolarHBondContact O-N 3.12Å; F25-A29 WeakPolarHBondContact O-CB 3.32Å; F25-A29 PolarHBondContact O-N 2.86Å; F25-V75 HydrophobicContact CD1-CG1 3.96Å; F25-V75 HydrophobicContact CE1-CB 4.43Å; F25-V75 HydrophobicContact CE1-CG1 3.78Å; F25-V75 HydrophobicContact CE1-CG2 3.9Å; F25-R380 HydrophobicContact CE2-CB 3.57Å; F25-R380 HydrophobicContact CE2-CG 4.21Å; F25-R380 HydrophobicContact CZ-CB 3.62Å; F25-P382 HydrophobicContact CD1-CB 4.31Å; F25-P382 HydrophobicContact CD1-CG 3.74Å; F25-P382 HydrophobicContact CE1-CG 3.92Å
26K80.4Confident77.7Confident81 Ų8151 Ų5135%0.35226%0.255SS..Hα-helixtrans-61.2-46.8174.3-176.1179.7174-174.40111.2D22 D23 V28 A29 E30D22-K26 WeakPolarHBondContact O-CB 3.04Å; D22-K26 PolarHBondContact O-N 2.95Å; D23-K26 PolarHBondContact O-N 3.2Å; K26-V28 VanDerWaalsContact C-N 3.34Å; K26-V28 PolarHBondContact O-N 2.67Å; K26-A29 PolarHBondContact O-N 3.36Å; K26-E30 WeakPolarHBondContact CE-OE1 3.49Å; K26-E30 WeakPolarHBondContact O-CG 3.03Å; K26-E30 PolarHBondContact O-N 3.47Å
27T82.3Confident77Confident24 Ų2453.2 Ų53.215%0.14727%0.27CS..Hα-helixtrans-68.2-31.3179.7520000112.9D23 R24 L31D23-T27 WeakPolarHBondContact O-CB 3.32Å; D23-T27 VanDerWaalsContact O-CG2 3.29Å; D23-T27 WeakPolarHBondContact O-CG2 3.45Å; D23-T27 PolarHBondContact O-N 3.49Å; D23-T27 PolarHBondContact O-OG1 3.36Å; R24-T27 WeakPolarHBondContact CA-OG1 3.38Å; R24-T27 PolarHBondContact O-OG1 3.31Å; R24-T27 VanDerWaalsContact O-OG1 3.06Å; T27-L31 VanDerWaalsContact O-CB 3.31Å; T27-L31 WeakPolarHBondContact O-CB 3.35Å; T27-L31 PolarHBondContact O-N 3.23Å
28V81.1Confident75.9Confident0 Ų053.8 Ų53.80%027%0.274CS..Hα-helixtrans-70.3-40169.91720000112.1I16 R24 F25 K26 L31 C32 V75 A76 C79I16-V28 HydrophobicContact CG1-CG2 4.22Å; R24-V28 VanDerWaalsContact O-CG2 3.31Å; R24-V28 WeakPolarHBondContact O-CG2 3.35Å; R24-V28 PolarHBondContact O-N 3.22Å; F25-V28 PolarHBondContact O-N 3.12Å; K26-V28 VanDerWaalsContact C-N 3.34Å; K26-V28 PolarHBondContact O-N 2.67Å; V28-L31 WeakPolarHBondContact O-CB 3.47Å; V28-L31 PolarHBondContact O-N 3.35Å; V28-C32 PolarHBondContact O-N 3.3Å; V28-C32 PolarHBondContact O-SG 3.29Å; V28-V75 HydrophobicContact CB-CG1 4.43Å; V28-V75 HydrophobicContact CG1-CG1 4.12Å; V28-V75 HydrophobicContact CG2-CG1 4.17Å; V28-A76 HydrophobicContact CG2-CB 4.01Å; V28-C79 HydrophobicContact CG1-CB 3.91Å; V28-C79 VanDerWaalsContact CG1-SG 3.54Å
29A74.6Confident75.1Confident50 Ų5053.3 Ų53.341%0.41327%0.269SS..Hα-helixtrans-64.5-40.5175.100000112F25 K26 C32 K33F25-A29 WeakPolarHBondContact O-CB 3.32Å; F25-A29 PolarHBondContact O-N 2.86Å; K26-A29 PolarHBondContact O-N 3.36Å; A29-C32 PolarHBondContact O-N 2.97Å; A29-K33 PolarHBondContact O-N 3.12Å
30E78.4Confident74.4Confident82 Ų8248.3 Ų48.338%0.38325%0.253SS..Hα-helixtrans-62.4-45.1171.5-73.4172.6-176.300111.5F12 K26 C32 K33 V34F12-E30 HydrophobicContact CE1-CB 4.1Å; K26-E30 WeakPolarHBondContact CE-OE1 3.49Å; K26-E30 WeakPolarHBondContact O-CG 3.03Å; K26-E30 PolarHBondContact O-N 3.47Å; E30-C32 PolarHBondContact O-N 3.49Å; E30-K33 WeakPolarHBondContact O-CB 3.4Å; E30-K33 PolarHBondContact O-N 3.1Å; E30-V34 WeakPolarHBondContact O-CG2 3.26Å; E30-V34 PolarHBondContact O-N 3.48Å
31L81.1Confident73.5Confident3 Ų351.9 Ų51.92%0.01626%0.264CS..Hα-helixtrans-55.7-48.6174.617564.8000111.2F12 I16 T27 V28 K33 V34 V35 L54 A76F12-L31 HydrophobicContact CB-CD1 4.31Å; F12-L31 HydrophobicContact CD1-CB 3.81Å; F12-L31 HydrophobicContact CD1-CD1 4.2Å; F12-L31 HydrophobicContact CD2-CD1 3.82Å; F12-L31 HydrophobicContact CE1-CB 3.95Å; F12-L31 HydrophobicContact CE2-CD1 4.18Å; F12-L31 HydrophobicContact CG-CB 4.31Å; F12-L31 HydrophobicContact CG-CD1 3.85Å; I16-L31 HydrophobicContact CD1-CD2 4.26Å; T27-L31 VanDerWaalsContact O-CB 3.31Å; T27-L31 WeakPolarHBondContact O-CB 3.35Å; T27-L31 PolarHBondContact O-N 3.23Å; V28-L31 WeakPolarHBondContact O-CB 3.47Å; V28-L31 PolarHBondContact O-N 3.35Å; L31-K33 VanDerWaalsContact C-N 3.34Å; L31-K33 PolarHBondContact O-N 3.31Å; L31-V34 PolarHBondContact O-N 3.35Å; L31-V35 HydrophobicContact CD1-CG2 3.97Å; L31-V35 HydrophobicContact CG-CG2 4.28Å; L31-V35 WeakPolarHBondContact O-CB 3.47Å; L31-V35 VanDerWaalsContact O-CG2 3.26Å; L31-V35 WeakPolarHBondContact O-CG2 3.42Å; L31-V35 PolarHBondContact O-N 2.94Å; L31-L54 HydrophobicContact CD1-CD2 3.98Å; L31-L54 HydrophobicContact CD2-CD2 4.3Å; L31-A76 HydrophobicContact CD2-CB 4.47Å
32C73.9Confident72.8Confident3 Ų352.5 Ų52.52%0.0227%0.271CS..Hα-helixtrans-64.1-36.3178.7-68.70000113.1V28 A29 E30 S36 C79 V83 V384V28-C32 PolarHBondContact O-N 3.3Å; V28-C32 PolarHBondContact O-SG 3.29Å; A29-C32 PolarHBondContact O-N 2.97Å; E30-C32 PolarHBondContact O-N 3.49Å; C32-S36 VanDerWaalsContact O-CB 3.26Å; C32-S36 WeakPolarHBondContact O-CB 3.34Å; C32-S36 PolarHBondContact O-N 2.72Å; C32-S36 PolarHBondContact O-OG 2.61Å; C32-C79 WeakPolarHBondContact SG-CB 3.37Å; C32-V83 HydrophobicContact CB-CG2 4.14Å; C32-V384 HydrophobicContact CB-CB 4.41Å; C32-V384 HydrophobicContact CB-CG1 3.44Å; C32-V384 VanDerWaalsContact CB-CG1 3.44Å
33K70.9Confident72.3Confident151 Ų15151.4 Ų51.466%0.65727%0.271SS*.Hα-helixtrans-64-42.8173.2-172.9177.1-179.3177.90111.3A29 E30 L31 S36 S37A29-K33 PolarHBondContact O-N 3.12Å; E30-K33 WeakPolarHBondContact O-CB 3.4Å; E30-K33 PolarHBondContact O-N 3.1Å; L31-K33 VanDerWaalsContact C-N 3.34Å; L31-K33 PolarHBondContact O-N 3.31Å; K33-S36 PolarHBondContact O-OG 3.49Å; K33-S37 WeakPolarHBondContact O-CB 3.44Å; K33-S37 PolarHBondContact O-N 2.84Å; K33-S37 PolarHBondContact O-OG 3.06Å
34V73.8Confident71.6Confident17 Ų1754.2 Ų54.210%0.10329%0.285CS..Hα-helixtrans-68-41.5176.9171.40000111.5L8 F12 E30 L31 E38 L39L8-V34 HydrophobicContact CD1-CG1 4.28Å; L8-V34 HydrophobicContact CD2-CG1 4.46Å; F12-V34 HydrophobicContact CE2-CB 4.4Å; F12-V34 HydrophobicContact CE2-CG1 4.21Å; F12-V34 HydrophobicContact CE2-CG2 4.48Å; F12-V34 HydrophobicContact CZ-CB 4.15Å; F12-V34 HydrophobicContact CZ-CG1 4.43Å; F12-V34 HydrophobicContact CZ-CG2 3.92Å; E30-V34 WeakPolarHBondContact O-CG2 3.26Å; E30-V34 PolarHBondContact O-N 3.48Å; L31-V34 PolarHBondContact O-N 3.35Å; V34-E38 HydrophobicContact CG1-CB 4.22Å; V34-E38 PolarHBondContact O-N 2.9Å; V34-E38 VanDerWaalsContact O-N 3.11Å; V34-L39 HydrophobicContact CG1-CD1 4.15Å; V34-L39 HydrophobicContact CG1-CG 4.37Å; V34-L39 WeakPolarHBondContact O-CB 3.41Å; V34-L39 PolarHBondContact O-N 3.26Å
35V73Confident71.1Confident2 Ų261 Ų611%0.01232%0.318CS..Hα-helixtrans-63.7-43.1175.5172.90000112L31 L39 L51 L80 V83L31-V35 HydrophobicContact CD1-CG2 3.97Å; L31-V35 HydrophobicContact CG-CG2 4.28Å; L31-V35 WeakPolarHBondContact O-CB 3.47Å; L31-V35 VanDerWaalsContact O-CG2 3.26Å; L31-V35 WeakPolarHBondContact O-CG2 3.42Å; L31-V35 PolarHBondContact O-N 2.94Å; V35-L39 HydrophobicContact CB-CD1 4.36Å; V35-L39 HydrophobicContact CG2-CD1 3.75Å; V35-L51 HydrophobicContact CG1-CD2 4.42Å; V35-L80 HydrophobicContact CG1-CD2 4.32Å; V35-L80 HydrophobicContact CG2-CD2 3.95Å; V35-V83 HydrophobicContact CG1-CG1 3.94Å
36S67.6Low70.8Confident48 Ų4863.4 Ų63.434%0.33633%0.332SS..Hα-helixtrans-77-26.6-177.655.90000114.5C32 K33 K40C32-S36 VanDerWaalsContact O-CB 3.26Å; C32-S36 WeakPolarHBondContact O-CB 3.34Å; C32-S36 PolarHBondContact O-N 2.72Å; C32-S36 PolarHBondContact O-OG 2.61Å; K33-S36 PolarHBondContact O-OG 3.49Å; S36-K40 WeakPolarHBondContact O-CD 3.2Å
37S66.5Low70.5Confident46 Ų4660.6 Ų60.632%0.32232%0.32SS..THydrogen-bonded Turntrans-113.2-77.2-179.362.50000113K33 L39 K40 E41K33-S37 WeakPolarHBondContact O-CB 3.44Å; K33-S37 PolarHBondContact O-N 2.84Å; K33-S37 PolarHBondContact O-OG 3.06Å; S37-L39 PolarHBondContact O-N 2.91Å; S37-K40 PolarHBondContact O-N 3.42Å; S37-K40 VanDerWaalsContact O-N 3.12Å; S37-E41 PolarHBondContact O-N 3.43Å
38E61.2Low70.3Confident90 Ų9062.8 Ų62.842%0.42133%0.333SS..Hα-helixtrans-60.5-41.8-169.9-55.3-174173.700113.6V34 K40 E41V34-E38 HydrophobicContact CG1-CB 4.22Å; V34-E38 PolarHBondContact O-N 2.9Å; V34-E38 VanDerWaalsContact O-N 3.11Å; E38-K40 VanDerWaalsContact C-N 3.27Å; E38-K40 PolarHBondContact O-N 3.19Å; E38-E41 WeakPolarHBondContact O-CB 3.22Å; E38-E41 PolarHBondContact O-N 3Å; E38-E41 VanDerWaalsContact O-N 3.12Å
39L64.9Low70.3Confident16 Ų1667 Ų678%0.08435%0.354CS..Hα-helixtrans-68.5-26.3-179.9-92162.8000112.4V34 V35 S37 E41 V42 Y47 C50V34-L39 HydrophobicContact CG1-CD1 4.15Å; V34-L39 HydrophobicContact CG1-CG 4.37Å; V34-L39 WeakPolarHBondContact O-CB 3.41Å; V34-L39 PolarHBondContact O-N 3.26Å; V35-L39 HydrophobicContact CB-CD1 4.36Å; V35-L39 HydrophobicContact CG2-CD1 3.75Å; S37-L39 PolarHBondContact O-N 2.91Å; L39-E41 VanDerWaalsContact C-N 3.33Å; L39-V42 WeakPolarHBondContact O-CB 3.24Å; L39-V42 PolarHBondContact O-N 3.36Å; L39-Y47 HydrophobicContact CB-CD2 3.92Å; L39-Y47 HydrophobicContact CB-CE2 4.23Å; L39-Y47 WeakPolarHBondContact O-CD2 3.28Å; L39-C50 HydrophobicContact CD2-CB 4.06Å
40K63.6Low70.5Confident99 Ų9964.9 Ų64.943%0.4334%0.337SS..Hα-helixtrans-79-13.7173.4-62.8-171.8-176179.20113.4S36 S37 E38 V42 Y47 D84S36-K40 WeakPolarHBondContact O-CD 3.2Å; S37-K40 PolarHBondContact O-N 3.42Å; S37-K40 VanDerWaalsContact O-N 3.12Å; E38-K40 VanDerWaalsContact C-N 3.27Å; E38-K40 PolarHBondContact O-N 3.19Å; K40-V42 VanDerWaalsContact C-N 3.32Å; K40-Y47 HydrophobicContact CG-CD2 4.48Å; K40-Y47 HydrophobicContact CG-CE2 4.06Å; K40-D84 WeakPolarHBondContact CE-OD1 3.39Å; K40-D84 WeakPolarHBondContact CE-OD2 3.5Å; K40-D84 IonicContact NZ-OD1 3.56Å; K40-D84 PolarHBondContact NZ-OD1 3.25Å; K40-D84 IonicContact NZ-OD2 3.7Å; K40-D84 PolarHBondContact NZ-OD2 3.45Å
41E58.8Low70.7Confident122 Ų12261.2 Ų61.257%0.5732%0.319SS*.Hα-helixtrans-78.4-18.7167.3-60.3-173.216700112S37 E38 L39S37-E41 PolarHBondContact O-N 3.43Å; E38-E41 WeakPolarHBondContact O-CB 3.22Å; E38-E41 PolarHBondContact O-N 3Å; E38-E41 VanDerWaalsContact O-N 3.12Å; L39-E41 VanDerWaalsContact C-N 3.33Å
42V62.4Low70.8Confident61 Ų6163.9 Ų63.937%0.3733%0.334SS..SBendtrans-79.5143.7173.2-161.40000109.4L39 K40 N44 N46L39-V42 WeakPolarHBondContact O-CB 3.24Å; L39-V42 PolarHBondContact O-N 3.36Å; K40-V42 VanDerWaalsContact C-N 3.32Å; V42-N44 PolarHBondContact O-N 3.14Å; V42-N46 HydrophobicContact CG1-CB 3.61Å
43S64.2Low71.4Confident68 Ų6867.1 Ų67.148%0.47635%0.351SS..  trans-47.8132.2175.757.20000112.4Q45 N46 Y47S43-Q45 PolarHBondContact O-N 3.06Å; S43-N46 PolarHBondContact O-N 3.37Å; S43-N46 PolarHBondContact OG-ND2 3.17Å; S43-Y47 PolarHBondContact O-N 2.97Å
44N67.4Low72.1Confident128 Ų12860.1 Ų60.168%0.68432%0.32SS*.Hα-helixtrans-43.9-35.3-174.8-69.4-9.9000115.3V42 Y47 V48V42-N44 PolarHBondContact O-N 3.14Å; N44-Y47 PolarHBondContact O-N 3.12Å; N44-V48 WeakPolarHBondContact O-CG2 3.48Å; N44-V48 PolarHBondContact O-N 2.65Å; N44-V48 VanDerWaalsContact O-N 3.11Å
45Q68.9Low72.6Confident155 Ų15559.3 Ų59.372%0.72432%0.315SS*.Hα-helixtrans-63-49.4176.8-67.3176.9-10.800112.4S43 Y47 V48 I49S43-Q45 PolarHBondContact O-N 3.06Å; Q45-Y47 VanDerWaalsContact C-N 3.31Å; Q45-Y47 PolarHBondContact O-N 3.4Å; Q45-V48 PolarHBondContact O-N 3.03Å; Q45-I49 WeakPolarHBondContact O-CD1 3.32Å; Q45-I49 VanDerWaalsContact O-CG1 3.29Å; Q45-I49 WeakPolarHBondContact O-CG1 3.38Å; Q45-I49 PolarHBondContact O-N 3.37Å
46N72.1Confident73.3Confident86 Ų8662.1 Ų62.146%0.4633%0.33SS..Hα-helixtrans-67.4-32.2177.7-70.5-13.4000112V42 S43 C50V42-N46 HydrophobicContact CG1-CB 3.61Å; S43-N46 PolarHBondContact O-N 3.37Å; S43-N46 PolarHBondContact OG-ND2 3.17Å; N46-C50 WeakPolarHBondContact O-CB 3.38Å; N46-C50 PolarHBondContact O-N 3.4Å
47Y74.7Confident74.2Confident22 Ų2263.5 Ų63.59%0.08633%0.332CS..Hα-helixtrans-59.6-52172.5170.7-89.5000111.1L39 K40 S43 N44 Q45 I49 C50 L51 D84L39-Y47 HydrophobicContact CB-CD2 3.92Å; L39-Y47 HydrophobicContact CB-CE2 4.23Å; L39-Y47 WeakPolarHBondContact O-CD2 3.28Å; K40-Y47 HydrophobicContact CG-CD2 4.48Å; K40-Y47 HydrophobicContact CG-CE2 4.06Å; S43-Y47 PolarHBondContact O-N 2.97Å; N44-Y47 PolarHBondContact O-N 3.12Å; Q45-Y47 VanDerWaalsContact C-N 3.31Å; Q45-Y47 PolarHBondContact O-N 3.4Å; Y47-I49 PolarHBondContact O-N 2.84Å; Y47-C50 PolarHBondContact O-N 2.92Å; Y47-L51 HydrophobicContact CD1-CD1 4.16Å; Y47-L51 HydrophobicContact CE1-CD1 3.45Å; Y47-L51 VanDerWaalsContact CE1-CD1 3.45Å; Y47-L51 HydrophobicContact CE1-CG 4.37Å; Y47-L51 HydrophobicContact CE2-CD1 4.21Å; Y47-L51 VanDerWaalsContact CZ-CD1 3.49Å; Y47-L51 PolarHBondContact O-N 2.95Å; Y47-D84 WeakPolarHBondContact OH-CB 3.29Å; Y47-D84 PolarHBondContact OH-OD2 3.22Å
48V78Confident75.2Confident69 Ų6961.3 Ų61.342%0.41832%0.316SS..Hα-helixtrans-61.9-45.7178.2175.40000111.2N44 Q45 C50 L51 D52N44-V48 WeakPolarHBondContact O-CG2 3.48Å; N44-V48 PolarHBondContact O-N 2.65Å; N44-V48 VanDerWaalsContact O-N 3.11Å; Q45-V48 PolarHBondContact O-N 3.03Å; V48-C50 VanDerWaalsContact C-N 3.32Å; V48-C50 PolarHBondContact O-N 3.27Å; V48-L51 PolarHBondContact O-N 3.25Å; V48-D52 WeakPolarHBondContact O-CB 3.21Å; V48-D52 PolarHBondContact O-N 2.99Å
49I81.3Confident76.5Confident89 Ų8958.2 Ų58.246%0.45630%0.302SS..Hα-helixtrans-60.9-40.6177.8-65.7163.3000111.5Q45 Y47 D52 L53Q45-I49 WeakPolarHBondContact O-CD1 3.32Å; Q45-I49 VanDerWaalsContact O-CG1 3.29Å; Q45-I49 WeakPolarHBondContact O-CG1 3.38Å; Q45-I49 PolarHBondContact O-N 3.37Å; Y47-I49 PolarHBondContact O-N 2.84Å; I49-D52 PolarHBondContact O-N 3.49Å; I49-L53 HydrophobicContact CG2-CD1 4.13Å; I49-L53 VanDerWaalsContact O-CG 3.31Å; I49-L53 WeakPolarHBondContact O-CG 3.35Å; I49-L53 PolarHBondContact O-N 3.11Å
50C78.9Confident77.6Confident6 Ų661 Ų614%0.04132%0.317CS..Hα-helixtrans-66-40.8178.1-168.60000111.8P5 L39 N46 Y47 V48 L54P5-C50 HydrophobicContact CB-CB 4.47Å; L39-C50 HydrophobicContact CD2-CB 4.06Å; N46-C50 WeakPolarHBondContact O-CB 3.38Å; N46-C50 PolarHBondContact O-N 3.4Å; Y47-C50 PolarHBondContact O-N 2.92Å; V48-C50 VanDerWaalsContact C-N 3.32Å; V48-C50 PolarHBondContact O-N 3.27Å; C50-L54 WeakPolarHBondContact O-CB 3.33Å; C50-L54 PolarHBondContact O-N 2.84Å
51L81.5Confident78.7Confident4 Ų456.7 Ų56.72%0.02130%0.299CS..Hα-helixtrans-66.5-43.8173.8-72.7-175.3000112V35 Y47 V48 L53 L54 C55 L80 S87V35-L51 HydrophobicContact CG1-CD2 4.42Å; Y47-L51 HydrophobicContact CD1-CD1 4.16Å; Y47-L51 HydrophobicContact CE1-CD1 3.45Å; Y47-L51 VanDerWaalsContact CE1-CD1 3.45Å; Y47-L51 HydrophobicContact CE1-CG 4.37Å; Y47-L51 HydrophobicContact CE2-CD1 4.21Å; Y47-L51 VanDerWaalsContact CZ-CD1 3.49Å; Y47-L51 PolarHBondContact O-N 2.95Å; V48-L51 PolarHBondContact O-N 3.25Å; L51-L53 VanDerWaalsContact C-N 3.32Å; L51-L53 PolarHBondContact O-N 3.5Å; L51-L54 PolarHBondContact O-N 3.41Å; L51-C55 WeakPolarHBondContact O-CB 3.37Å; L51-C55 PolarHBondContact O-N 3.02Å; L51-C55 PolarHBondContact O-SG 2.72Å; L51-L80 HydrophobicContact CD2-CD2 4.3Å; L51-S87 VanDerWaalsContact CD1-OG 3.23Å; L51-S87 WeakPolarHBondContact CD1-OG 3.47Å
52D84Confident80Confident59 Ų5950.9 Ų50.932%0.31627%0.272SS..Hα-helixtrans-57.3-45.7176.9-75.2-12.8000111.3V48 I49 N56 H91V48-D52 WeakPolarHBondContact O-CB 3.21Å; V48-D52 PolarHBondContact O-N 2.99Å; I49-D52 PolarHBondContact O-N 3.49Å; D52-N56 WeakPolarHBondContact O-CB 3.44Å; D52-N56 VanDerWaalsContact O-CG 3.25Å; D52-N56 PolarHBondContact O-N 2.9Å; D52-N56 PolarHBondContact O-ND2 2.91Å; D52-H91 IonicContact OD1-CD2 2.83Å; D52-H91 IonicContact OD1-CE1 2.61Å; D52-H91 PolarHBondContact OD1-CE1 3.42Å; D52-H91 IonicContact OD1-NE2 3.96Å; D52-H91 PolarHBondContact OD1-NE2 3.46Å
53L85.1Confident81.2Confident72 Ų7249.5 Ų49.538%0.37726%0.264SS..Hα-helixtrans-63.7-45.8176.1-70.1171.3000111.9I9 I49 L51 N56 E57I9-L53 HydrophobicContact CD1-CB 3.77Å; I9-L53 HydrophobicContact CD1-CD1 4.42Å; I49-L53 HydrophobicContact CG2-CD1 4.13Å; I49-L53 VanDerWaalsContact O-CG 3.31Å; I49-L53 WeakPolarHBondContact O-CG 3.35Å; I49-L53 PolarHBondContact O-N 3.11Å; L51-L53 VanDerWaalsContact C-N 3.32Å; L51-L53 PolarHBondContact O-N 3.5Å; L53-N56 PolarHBondContact O-N 2.95Å; L53-E57 PolarHBondContact O-N 3.34Å
54L85.4Confident82.2Confident4 Ų453.1 Ų53.12%0.02128%0.278CS..Hα-helixtrans-62.5-45.7178.2-178.466000112I9 L31 C50 L51 N56 E57 L58 L80I9-L54 HydrophobicContact CG2-CD1 4.2Å; L31-L54 HydrophobicContact CD1-CD2 3.98Å; L31-L54 HydrophobicContact CD2-CD2 4.3Å; C50-L54 WeakPolarHBondContact O-CB 3.33Å; C50-L54 PolarHBondContact O-N 2.84Å; L51-L54 PolarHBondContact O-N 3.41Å; L54-N56 PolarHBondContact O-N 3.32Å; L54-E57 PolarHBondContact O-N 3.13Å; L54-L58 HydrophobicContact CG-CD1 4.26Å; L54-L58 VanDerWaalsContact O-CG 3.29Å; L54-L58 WeakPolarHBondContact O-CG 3.46Å; L54-L58 PolarHBondContact O-N 2.92Å; L54-L80 HydrophobicContact CD2-CD1 3.94Å; L54-L80 HydrophobicContact CD2-CD2 4.22Å; L54-L80 HydrophobicContact CG-CD1 4.4Å
55C86Confident82.9Confident0 Ų047.7 Ų47.70%025%0.253CS..Hα-helixtrans-64.6-38.9179-68.70000112.1L51 L58 I59 H91 F95L51-C55 WeakPolarHBondContact O-CB 3.37Å; L51-C55 PolarHBondContact O-N 3.02Å; L51-C55 PolarHBondContact O-SG 2.72Å; C55-L58 PolarHBondContact O-N 2.77Å; C55-I59 VanDerWaalsContact O-CG1 3.29Å; C55-I59 WeakPolarHBondContact O-CG1 3.37Å; C55-I59 PolarHBondContact O-N 3.34Å; C55-H91 HydrophobicContact CB-CB 4.14Å; C55-F95 HydrophobicContact CB-CE1 4.09Å; C55-F95 HydrophobicContact CB-CZ 3.93Å
56N87.7Confident83.7Confident60 Ų6044.3 Ų44.332%0.32124%0.24SC..Hα-helixtrans-66.9-41.7174.5-71.7-47.6000111.9D52 L53 L54 I59 N60D52-N56 WeakPolarHBondContact O-CB 3.44Å; D52-N56 VanDerWaalsContact O-CG 3.25Å; D52-N56 PolarHBondContact O-N 2.9Å; D52-N56 PolarHBondContact O-ND2 2.91Å; L53-N56 PolarHBondContact O-N 2.95Å; L54-N56 PolarHBondContact O-N 3.32Å; N56-I59 PolarHBondContact O-N 2.9Å; N56-N60 VanDerWaalsContact O-CG 3.25Å; N56-N60 PolarHBondContact O-N 3.36Å; N56-N60 PolarHBondContact O-ND2 2.92Å
57E86.4Confident84.3Confident78 Ų7842.5 Ų42.536%0.36423%0.232SC..Hα-helixtrans-62.8-41.1173.3-80.5-59.1118.800112.3V13 L53 L54 I59 N60 I61V13-E57 HydrophobicContact CG2-CB 4.43Å; L53-E57 PolarHBondContact O-N 3.34Å; L54-E57 PolarHBondContact O-N 3.13Å; E57-I59 PolarHBondContact O-N 3.47Å; E57-N60 WeakPolarHBondContact O-CB 3.42Å; E57-N60 PolarHBondContact O-N 2.92Å; E57-N60 PolarHBondContact OE1-ND2 3.19Å; E57-I61 WeakPolarHBondContact O-CD1 3.45Å; E57-I61 VanDerWaalsContact O-CG1 3.22Å; E57-I61 WeakPolarHBondContact O-CG1 3.41Å; E57-I61 PolarHBondContact O-N 2.98Å
58L87.6Confident84.8Confident0 Ų044.8 Ų44.80%024%0.243CC..Hα-helixtrans-61.8-41.8174-69.7173.4000111.8I16 L54 C55 N60 I61 V62 A73 A76 M77 L80I16-L58 HydrophobicContact CD1-CD2 4.19Å; L54-L58 HydrophobicContact CG-CD1 4.26Å; L54-L58 VanDerWaalsContact O-CG 3.29Å; L54-L58 WeakPolarHBondContact O-CG 3.46Å; L54-L58 PolarHBondContact O-N 2.92Å; C55-L58 PolarHBondContact O-N 2.77Å; L58-N60 VanDerWaalsContact C-N 3.34Å; L58-N60 PolarHBondContact O-N 3.43Å; L58-I61 PolarHBondContact O-N 3.35Å; L58-V62 WeakPolarHBondContact O-CB 3.44Å; L58-V62 VanDerWaalsContact O-CG2 3.29Å; L58-V62 WeakPolarHBondContact O-CG2 3.29Å; L58-V62 PolarHBondContact O-N 2.92Å; L58-A73 HydrophobicContact CD2-CB 3.82Å; L58-A76 HydrophobicContact CD1-CB 4.12Å; L58-A76 HydrophobicContact CD2-CB 3.91Å; L58-M77 VanDerWaalsContact C-CE 3.45Å; L58-M77 HydrophobicContact CB-CE 3.74Å; L58-M77 HydrophobicContact CB-CG 4.19Å; L58-M77 HydrophobicContact CD1-CG 4.22Å; L58-L80 HydrophobicContact CD1-CD1 3.55Å
59I87.7Confident85.2Confident24 Ų2443.7 Ų43.712%0.12323%0.234CC..Hα-helixtrans-60.1-44.7173.7-70.9163.9000110.8C55 N56 E57 I61 V62 S63 M77 R94 F95 Q98C55-I59 VanDerWaalsContact O-CG1 3.29Å; C55-I59 WeakPolarHBondContact O-CG1 3.37Å; C55-I59 PolarHBondContact O-N 3.34Å; N56-I59 PolarHBondContact O-N 2.9Å; E57-I59 PolarHBondContact O-N 3.47Å; I59-I61 PolarHBondContact O-N 2.96Å; I59-V62 PolarHBondContact O-N 3.41Å; I59-S63 PolarHBondContact O-N 3.05Å; I59-S63 PolarHBondContact O-OG 3.3Å; I59-M77 HydrophobicContact CB-CE 4.44Å; I59-M77 HydrophobicContact CG1-CE 3.81Å; I59-R94 HydrophobicContact CD1-CB 3.92Å; I59-F95 HydrophobicContact CD1-CD1 3.82Å; I59-F95 HydrophobicContact CD1-CE1 3.79Å; I59-F95 HydrophobicContact CG1-CD1 3.62Å; I59-F95 HydrophobicContact CG1-CE1 3.73Å; I59-Q98 HydrophobicContact CG2-CG 4.29Å
60N87.9Confident85.5Confident76 Ų7640.5 Ų40.541%0.40622%0.216SC..Hα-helixtrans-59.5-45.8177-69.3-21.9000111.3N56 E57 L58 S63 N64N56-N60 VanDerWaalsContact O-CG 3.25Å; N56-N60 PolarHBondContact O-N 3.36Å; N56-N60 PolarHBondContact O-ND2 2.92Å; E57-N60 WeakPolarHBondContact O-CB 3.42Å; E57-N60 PolarHBondContact O-N 2.92Å; E57-N60 PolarHBondContact OE1-ND2 3.19Å; L58-N60 VanDerWaalsContact C-N 3.34Å; L58-N60 PolarHBondContact O-N 3.43Å; N60-S63 PolarHBondContact O-N 2.89Å; N60-S63 PolarHBondContact O-OG 3.39Å; N60-N64 PolarHBondContact O-N 3.41Å
61I87.2Confident85.9Confident7 Ų740.9 Ų40.94%0.03622%0.217CC..Hα-helixtrans-65-44.3177.9-63.8161.5000111.3V13 E57 L58 I59 S63 G65 E69 A73V13-I61 HydrophobicContact CG1-CD1 3.84Å; V13-I61 HydrophobicContact CG2-CD1 4.3Å; E57-I61 WeakPolarHBondContact O-CD1 3.45Å; E57-I61 VanDerWaalsContact O-CG1 3.22Å; E57-I61 WeakPolarHBondContact O-CG1 3.41Å; E57-I61 PolarHBondContact O-N 2.98Å; L58-I61 PolarHBondContact O-N 3.35Å; I59-I61 PolarHBondContact O-N 2.96Å; I61-S63 PolarHBondContact O-N 3.46Å; I61-G65 VanDerWaalsContact O-CA 3.27Å; I61-G65 WeakPolarHBondContact O-CA 3.33Å; I61-G65 PolarHBondContact O-N 3.23Å; I61-E69 HydrophobicContact CG2-CB 3.74Å; I61-A73 HydrophobicContact CB-CB 4.09Å; I61-A73 HydrophobicContact CG2-CB 3.73Å
62V86.3Confident86Confident1 Ų140.7 Ų40.71%0.00622%0.217CC..Hα-helixtrans-63.9-32.8177.8175.20000110.9L58 I59 K70 A73 I74 M77 L99 Q102L58-V62 WeakPolarHBondContact O-CB 3.44Å; L58-V62 VanDerWaalsContact O-CG2 3.29Å; L58-V62 WeakPolarHBondContact O-CG2 3.29Å; L58-V62 PolarHBondContact O-N 2.92Å; I59-V62 PolarHBondContact O-N 3.41Å; V62-K70 WeakPolarHBondContact O-CD 3.36Å; V62-K70 WeakPolarHBondContact O-CE 3.2Å; V62-K70 PolarHBondContact O-NZ 3.44Å; V62-A73 HydrophobicContact CG2-CB 3.48Å; V62-A73 VanDerWaalsContact CG2-CB 3.48Å; V62-I74 HydrophobicContact CG1-CG1 4.37Å; V62-I74 HydrophobicContact CG2-CG1 4.1Å; V62-M77 HydrophobicContact CB-CE 4.3Å; V62-M77 HydrophobicContact CG2-CE 3.79Å; V62-M77 HydrophobicContact CG2-SD 4.18Å; V62-L99 HydrophobicContact CG1-CD2 4.01Å; V62-Q102 VanDerWaalsContact O-CD 3.32Å; V62-Q102 PolarHBondContact O-NE2 3.24Å; V62-Q102 PolarHBondContact O-OE1 2.77Å
63S86.1Confident86.2Confident31 Ų3137.9 Ų37.922%0.21720%0.202CC..Hα-helixtrans-72.5-54.2175.671.10000113.7I59 N60 I61 K70I59-S63 PolarHBondContact O-N 3.05Å; I59-S63 PolarHBondContact O-OG 3.3Å; N60-S63 PolarHBondContact O-N 2.89Å; N60-S63 PolarHBondContact O-OG 3.39Å; I61-S63 PolarHBondContact O-N 3.46Å; S63-K70 PolarHBondContact O-NZ 3.2Å
64N85.4Confident86.3Confident144 Ų14434.5 Ų34.577%0.7718%0.184SC*.Hα-helixtrans-110.3-7.6-164.6-64.5-40.6000114.9N60N60-N64 PolarHBondContact O-N 3.41Å
65G82.6Confident86.3Confident14 Ų1434.4 Ų34.414%0.14418%0.184CC..SBendtrans-78165-17400000114.7I61 E69 K70I61-G65 VanDerWaalsContact O-CA 3.27Å; I61-G65 WeakPolarHBondContact O-CA 3.33Å; I61-G65 PolarHBondContact O-N 3.23Å; G65-E69 WeakPolarHBondContact CA-OE2 3.46Å; G65-K70 WeakPolarHBondContact O-CE 3.27Å
66D85.2Confident86.2Confident84 Ų8434.4 Ų34.445%0.44918%0.184SC..  trans-67.2160.7171.7-176.826.7000111.2H68 E69 K70D66-H68 PolarHBondContact O-N 3.29Å; D66-H68 VanDerWaalsContact O-N 3.11Å; D66-H68 IonicContact OD2-CD2 2.68Å; D66-E69 HydrophobicContact CB-CG 4.2Å; D66-E69 PolarHBondContact N-OE2 2.71Å; D66-E69 WeakPolarHBondContact O-CA 3.12Å; D66-E69 WeakPolarHBondContact O-CB 3.42Å; D66-E69 PolarHBondContact O-N 2.71Å; D66-K70 WeakPolarHBondContact O-CG 3.41Å; D66-K70 PolarHBondContact O-N 2.98Å
67V85.5Confident86.2Confident49 Ų4931.6 Ų31.630%0.29717%0.168SC..Hα-helixtrans-51.5-40.7-177177.90000111.8K71 D107 L110V67-K71 HydrophobicContact CG1-CD 4.41Å; V67-K71 VanDerWaalsContact O-CG 3.24Å; V67-K71 WeakPolarHBondContact O-CG 3.4Å; V67-K71 PolarHBondContact O-N 3.32Å; V67-D107 HydrophobicContact CG1-CB 4.25Å; V67-D107 WeakPolarHBondContact CG1-OD2 3.34Å; V67-L110 HydrophobicContact CG1-CD2 4.25Å
68H84.5Confident85.9Confident69 Ų6927.9 Ų27.932%0.31915%0.151SC..Hα-helixtrans-67.5-38.7176.6-62.1-76.6000113.2R24 D66 G72R24-H68 WeakPolarHBondContact CD-O 3.36Å; D66-H68 PolarHBondContact O-N 3.29Å; D66-H68 VanDerWaalsContact O-N 3.11Å; D66-H68 IonicContact OD2-CD2 2.68Å; H68-G72 PolarHBondContact O-N 2.99Å; H68-G72 VanDerWaalsContact O-N 3.11Å
69E87.5Confident85.5Confident47 Ų4727.9 Ų27.922%0.2215%0.151CC..Hα-helixtrans-69.6-40.7177.4-53.4-172143.100110.9K17 I61 G65 D66 G72 A73K17-E69 HydrophobicContact CB-CG 4.06Å; K17-E69 VanDerWaalsContact CD-OE1 3.27Å; K17-E69 WeakPolarHBondContact CD-OE1 3.18Å; K17-E69 HydrophobicContact CG-CB 4.21Å; K17-E69 HydrophobicContact CG-CG 3.83Å; K17-E69 WeakPolarHBondContact CG-OE1 3.47Å; I61-E69 HydrophobicContact CG2-CB 3.74Å; G65-E69 WeakPolarHBondContact CA-OE2 3.46Å; D66-E69 HydrophobicContact CB-CG 4.2Å; D66-E69 PolarHBondContact N-OE2 2.71Å; D66-E69 WeakPolarHBondContact O-CA 3.12Å; D66-E69 WeakPolarHBondContact O-CB 3.42Å; D66-E69 PolarHBondContact O-N 2.71Å; E69-G72 PolarHBondContact O-N 3.28Å; E69-A73 WeakPolarHBondContact O-CB 3.22Å; E69-A73 PolarHBondContact O-N 3.38Å
70K87.9Confident85.1Confident21 Ų2126.9 Ų26.99%0.09115%0.146CC..Hα-helixtrans-59.9-47173.9-64.7-166.8178.9-146.90111.5V62 S63 G65 D66 G72 A73 I74 L110V62-K70 WeakPolarHBondContact O-CD 3.36Å; V62-K70 WeakPolarHBondContact O-CE 3.2Å; V62-K70 PolarHBondContact O-NZ 3.44Å; S63-K70 PolarHBondContact O-NZ 3.2Å; G65-K70 WeakPolarHBondContact O-CE 3.27Å; D66-K70 WeakPolarHBondContact O-CG 3.41Å; D66-K70 PolarHBondContact O-N 2.98Å; K70-G72 VanDerWaalsContact C-N 3.33Å; K70-G72 PolarHBondContact O-N 3.48Å; K70-A73 PolarHBondContact O-N 3.22Å; K70-I74 WeakPolarHBondContact O-CB 3.05Å; K70-I74 WeakPolarHBondContact O-CD1 3.09Å; K70-I74 WeakPolarHBondContact O-CG1 3.36Å; K70-I74 PolarHBondContact O-N 3.49Å; K70-L110 HydrophobicContact CB-CD1 3.82Å; K70-L110 HydrophobicContact CB-CD2 4.1Å; K70-L110 HydrophobicContact CD-CD2 4.06Å
71K86.3Confident84.6Confident14 Ų1424.1 Ų24.16%0.06113%0.133CC..Hα-helixtrans-55-47.3174.3-72.2173179.7174.40111.5V67 V75 D107 L110 L113V67-K71 HydrophobicContact CG1-CD 4.41Å; V67-K71 VanDerWaalsContact O-CG 3.24Å; V67-K71 WeakPolarHBondContact O-CG 3.4Å; V67-K71 PolarHBondContact O-N 3.32Å; K71-V75 WeakPolarHBondContact O-CB 3.42Å; K71-V75 VanDerWaalsContact O-CG2 3.23Å; K71-V75 WeakPolarHBondContact O-CG2 3.49Å; K71-V75 PolarHBondContact O-N 2.91Å; K71-D107 WeakPolarHBondContact CE-OD2 3.3Å; K71-D107 IonicContact NZ-OD2 2.79Å; K71-D107 PolarHBondContact NZ-OD2 3.03Å; K71-L110 HydrophobicContact CG-CB 4.44Å; K71-L110 HydrophobicContact CG-CD1 4.15Å; K71-L113 HydrophobicContact CB-CD1 3.91Å; K71-L113 HydrophobicContact CG-CD1 3.84Å
72G84.3Confident83.8Confident1 Ų125.9 Ų25.91%0.0114%0.142CC..Hα-helixtrans-61.8-45.9176.600000113.3I16 H68 E69 K70 V75 A76I16-G72 VanDerWaalsContact CG2-C 3.48Å; H68-G72 PolarHBondContact O-N 2.99Å; H68-G72 VanDerWaalsContact O-N 3.11Å; E69-G72 PolarHBondContact O-N 3.28Å; K70-G72 VanDerWaalsContact C-N 3.33Å; K70-G72 PolarHBondContact O-N 3.48Å; G72-V75 PolarHBondContact O-N 2.95Å; G72-A76 WeakPolarHBondContact O-CB 3.32Å; G72-A76 PolarHBondContact O-N 2.98Å
73A88.1Confident82.9Confident0 Ų026.5 Ų26.50%015%0.145CC..Hα-helixtrans-71.9-36.8-175.500000113.2I16 L58 I61 V62 E69 K70 A76 M77I16-A73 HydrophobicContact CG2-CB 4.37Å; L58-A73 HydrophobicContact CD2-CB 3.82Å; I61-A73 HydrophobicContact CB-CB 4.09Å; I61-A73 HydrophobicContact CG2-CB 3.73Å; V62-A73 HydrophobicContact CG2-CB 3.48Å; V62-A73 VanDerWaalsContact CG2-CB 3.48Å; E69-A73 WeakPolarHBondContact O-CB 3.22Å; E69-A73 PolarHBondContact O-N 3.38Å; K70-A73 PolarHBondContact O-N 3.22Å; A73-A76 PolarHBondContact O-N 3.28Å; A73-M77 WeakPolarHBondContact O-CG 3.35Å; A73-M77 PolarHBondContact O-N 3.18Å
74I87.6Confident82.1Confident0 Ų026.7 Ų26.70%014%0.144CC..Hα-helixtrans-61.9-44.2172.6-73.2160.2000111V62 K70 M77 G78 L99 L110 L113 E114 L117 W381V62-I74 HydrophobicContact CG1-CG1 4.37Å; V62-I74 HydrophobicContact CG2-CG1 4.1Å; K70-I74 WeakPolarHBondContact O-CB 3.05Å; K70-I74 WeakPolarHBondContact O-CD1 3.09Å; K70-I74 WeakPolarHBondContact O-CG1 3.36Å; K70-I74 PolarHBondContact O-N 3.49Å; I74-M77 PolarHBondContact O-N 2.86Å; I74-G78 PolarHBondContact O-N 3.19Å; I74-L99 HydrophobicContact CD1-CD2 4.37Å; I74-L99 HydrophobicContact CG1-CD2 4.22Å; I74-L110 HydrophobicContact CD1-CD1 3.35Å; I74-L113 HydrophobicContact CG2-CB 3.85Å; I74-E114 HydrophobicContact CD1-CG 3.5Å; I74-L117 HydrophobicContact CB-CD2 4.42Å; I74-L117 HydrophobicContact CG2-CB 4.11Å; I74-L117 HydrophobicContact CG2-CD2 3.85Å; I74-W381 HydrophobicContact CG2-CH2 3.98Å; I74-W381 HydrophobicContact CG2-CZ3 3.97Å
75V84.1Confident81.3Confident3 Ų322.3 Ų22.32%0.01812%0.118CC..Hα-helixtrans-61.4-47.2175.4165.60000110.6F25 V28 K71 G72 M77 G78 C79 L113 P382F25-V75 HydrophobicContact CD1-CG1 3.96Å; F25-V75 HydrophobicContact CE1-CB 4.43Å; F25-V75 HydrophobicContact CE1-CG1 3.78Å; F25-V75 HydrophobicContact CE1-CG2 3.9Å; V28-V75 HydrophobicContact CB-CG1 4.43Å; V28-V75 HydrophobicContact CG1-CG1 4.12Å; V28-V75 HydrophobicContact CG2-CG1 4.17Å; K71-V75 WeakPolarHBondContact O-CB 3.42Å; K71-V75 VanDerWaalsContact O-CG2 3.23Å; K71-V75 WeakPolarHBondContact O-CG2 3.49Å; K71-V75 PolarHBondContact O-N 2.91Å; G72-V75 PolarHBondContact O-N 2.95Å; V75-M77 PolarHBondContact O-N 3.24Å; V75-G78 PolarHBondContact O-N 2.95Å; V75-C79 PolarHBondContact O-N 2.84Å; V75-C79 PolarHBondContact O-SG 3.12Å; V75-L113 HydrophobicContact CG2-CD1 4.23Å; V75-L113 HydrophobicContact CG2-CD2 4.34Å; V75-P382 HydrophobicContact CG1-CG 3.38Å
76A85.2Confident80.8Confident0 Ų030.4 Ų30.40%015%0.154CC..Hα-helixtrans-60.6-42.1176.800000112.8I16 V28 L31 L58 G72 A73 G78 C79 L80I16-A76 HydrophobicContact CD1-CB 3.92Å; V28-A76 HydrophobicContact CG2-CB 4.01Å; L31-A76 HydrophobicContact CD2-CB 4.47Å; L58-A76 HydrophobicContact CD1-CB 4.12Å; L58-A76 HydrophobicContact CD2-CB 3.91Å; G72-A76 WeakPolarHBondContact O-CB 3.32Å; G72-A76 PolarHBondContact O-N 2.98Å; A73-A76 PolarHBondContact O-N 3.28Å; A76-G78 VanDerWaalsContact C-N 3.32Å; A76-G78 PolarHBondContact O-N 3.3Å; A76-C79 PolarHBondContact O-N 3.38Å; A76-L80 WeakPolarHBondContact O-CB 3.2Å; A76-L80 VanDerWaalsContact O-CG 3.28Å; A76-L80 WeakPolarHBondContact O-CG 3.41Å; A76-L80 PolarHBondContact O-N 2.99Å
77M87Confident80.1Confident1 Ų128.1 Ų28.11%0.00515%0.145CC..Hα-helixtrans-58.2-43.4174.1-75.9-179.5176.500112L58 I59 V62 A73 I74 V75 A81 F95 L117L58-M77 VanDerWaalsContact C-CE 3.45Å; L58-M77 HydrophobicContact CB-CE 3.74Å; L58-M77 HydrophobicContact CB-CG 4.19Å; L58-M77 HydrophobicContact CD1-CG 4.22Å; I59-M77 HydrophobicContact CB-CE 4.44Å; I59-M77 HydrophobicContact CG1-CE 3.81Å; V62-M77 HydrophobicContact CB-CE 4.3Å; V62-M77 HydrophobicContact CG2-CE 3.79Å; V62-M77 HydrophobicContact CG2-SD 4.18Å; A73-M77 WeakPolarHBondContact O-CG 3.35Å; A73-M77 PolarHBondContact O-N 3.18Å; I74-M77 PolarHBondContact O-N 2.86Å; V75-M77 PolarHBondContact O-N 3.24Å; M77-A81 PolarHBondContact O-N 3.5Å; M77-A81 VanDerWaalsContact O-N 3.12Å; M77-F95 HydrophobicContact CB-CD2 4.12Å; M77-F95 HydrophobicContact CB-CE2 4.08Å; M77-F95 HydrophobicContact CE-CD1 3.51Å; M77-F95 HydrophobicContact CE-CE1 3.72Å; M77-F95 HydrophobicContact CE-CG 4.11Å; M77-F95 HydrophobicContact CE-CZ 4.46Å; M77-F95 HydrophobicContact CG-CD1 4.3Å; M77-F95 HydrophobicContact CG-CD2 4.06Å; M77-F95 HydrophobicContact CG-CE1 4.18Å; M77-F95 HydrophobicContact CG-CE2 3.94Å; M77-F95 HydrophobicContact CG-CG 4.25Å; M77-F95 HydrophobicContact CG-CZ 4Å; M77-F95 HydrophobicContact SD-CB 4.01Å; M77-F95 HydrophobicContact SD-CD1 3.71Å; M77-F95 HydrophobicContact SD-CD2 4.02Å; M77-F95 HydrophobicContact SD-CE1 4.14Å; M77-F95 HydrophobicContact SD-CE2 4.43Å; M77-F95 HydrophobicContact SD-CG 3.65Å; M77-F95 HydrophobicContact SD-CZ 4.48Å; M77-L117 HydrophobicContact CB-CD1 4.46Å; M77-L117 HydrophobicContact CB-CD2 3.89Å; M77-L117 HydrophobicContact SD-CD2 4.18Å
78G80.1Confident79.7Confident0 Ų025.8 Ų25.80%013%0.131CC..Hα-helixtrans-59.2-51.817600000112.9I74 V75 A76 L80 A81 E82I74-G78 PolarHBondContact O-N 3.19Å; V75-G78 PolarHBondContact O-N 2.95Å; A76-G78 VanDerWaalsContact C-N 3.32Å; A76-G78 PolarHBondContact O-N 3.3Å; G78-L80 VanDerWaalsContact C-N 3.34Å; G78-L80 PolarHBondContact O-N 3.26Å; G78-A81 WeakPolarHBondContact O-CB 3.28Å; G78-A81 PolarHBondContact O-N 3.17Å; G78-A81 VanDerWaalsContact O-N 3.16Å; G78-E82 PolarHBondContact O-N 3.04Å
79C78.5Confident79.5Confident0 Ų026.3 Ų26.30%013%0.133CC..Hα-helixtrans-67.7-33-178.3-51.20000112.7V28 C32 V75 A76 A81 E82 V83 P382 V384V28-C79 HydrophobicContact CG1-CB 3.91Å; V28-C79 VanDerWaalsContact CG1-SG 3.54Å; C32-C79 WeakPolarHBondContact SG-CB 3.37Å; V75-C79 PolarHBondContact O-N 2.84Å; V75-C79 PolarHBondContact O-SG 3.12Å; A76-C79 PolarHBondContact O-N 3.38Å; C79-A81 VanDerWaalsContact C-N 3.34Å; C79-E82 PolarHBondContact O-N 3.48Å; C79-V83 VanDerWaalsContact O-CG2 3.26Å; C79-V83 WeakPolarHBondContact O-CG2 3.46Å; C79-V83 PolarHBondContact O-N 3.48Å; C79-V83 VanDerWaalsContact O-N 3.11Å; C79-P382 PolarHBondContact SG-O 3.5Å; C79-V384 HydrophobicContact CB-CB 4.28Å; C79-V384 HydrophobicContact CB-CG2 3.87Å; C79-V384 WeakPolarHBondContact SG-CG2 3.4Å
80L80.2Confident79.1Confident3 Ų329.7 Ų29.72%0.01615%0.153CC..Hα-helixtrans-63.4-39.6171.9-72.8171.6000112V35 L51 L54 L58 A76 G78 E82 V83 D84V35-L80 HydrophobicContact CG1-CD2 4.32Å; V35-L80 HydrophobicContact CG2-CD2 3.95Å; L51-L80 HydrophobicContact CD2-CD2 4.3Å; L54-L80 HydrophobicContact CD2-CD1 3.94Å; L54-L80 HydrophobicContact CD2-CD2 4.22Å; L54-L80 HydrophobicContact CG-CD1 4.4Å; L58-L80 HydrophobicContact CD1-CD1 3.55Å; A76-L80 WeakPolarHBondContact O-CB 3.2Å; A76-L80 VanDerWaalsContact O-CG 3.28Å; A76-L80 WeakPolarHBondContact O-CG 3.41Å; A76-L80 PolarHBondContact O-N 2.99Å; G78-L80 VanDerWaalsContact C-N 3.34Å; G78-L80 PolarHBondContact O-N 3.26Å; L80-E82 VanDerWaalsContact C-N 3.34Å; L80-V83 PolarHBondContact O-N 2.99Å; L80-D84 PolarHBondContact O-N 2.79Å
81A77.8Confident78.7Confident17 Ų1729.2 Ų29.214%0.1415%0.151CC..Hα-helixtrans-67-32.1174.900000112.9M77 G78 C79 L121M77-A81 PolarHBondContact O-N 3.5Å; M77-A81 VanDerWaalsContact O-N 3.12Å; G78-A81 WeakPolarHBondContact O-CB 3.28Å; G78-A81 PolarHBondContact O-N 3.17Å; G78-A81 VanDerWaalsContact O-N 3.16Å; C79-A81 VanDerWaalsContact C-N 3.34Å; A81-L121 HydrophobicContact CB-CD2 3.94Å
82E69.5Low78.5Confident45 Ų4528.5 Ų28.521%0.2115%0.148CC..Hα-helixtrans-73.1-25.3173.3-73.9-173.3-179.600114.1G78 C79 L80 V384 N385G78-E82 PolarHBondContact O-N 3.04Å; C79-E82 PolarHBondContact O-N 3.48Å; L80-E82 VanDerWaalsContact C-N 3.34Å; E82-V384 PolarHBondContact OE2-N 2.85Å; E82-N385 HydrophobicContact CB-CB 4.41Å; E82-N385 PolarHBondContact O-ND2 2.95Å; E82-N385 VanDerWaalsContact O-ND2 3.14Å; E82-N385 PolarHBondContact OE2-N 2.74Å; E82-N385 VanDerWaalsContact OE2-N 3.14Å
83V67.7Low78.5Confident14 Ų1434.9 Ų34.99%0.08518%0.177CC..Hα-helixtrans-89.8-49.1-174.3173.70000112.6C32 V35 C79 L80 N385C32-V83 HydrophobicContact CB-CG2 4.14Å; V35-V83 HydrophobicContact CG1-CG1 3.94Å; C79-V83 VanDerWaalsContact O-CG2 3.26Å; C79-V83 WeakPolarHBondContact O-CG2 3.46Å; C79-V83 PolarHBondContact O-N 3.48Å; C79-V83 VanDerWaalsContact O-N 3.11Å; L80-V83 PolarHBondContact O-N 2.99Å; V83-N385 WeakPolarHBondContact CG2-ND2 3.41Å
84D68.6Low78.3Confident35 Ų3541.2 Ų41.219%0.18720%0.201CC..  trans-144.261.7-174-79.4-55.3000112.6K40 Y47 L80 M86 S87 V88K40-D84 WeakPolarHBondContact CE-OD1 3.39Å; K40-D84 WeakPolarHBondContact CE-OD2 3.5Å; K40-D84 IonicContact NZ-OD1 3.56Å; K40-D84 PolarHBondContact NZ-OD1 3.25Å; K40-D84 IonicContact NZ-OD2 3.7Å; K40-D84 PolarHBondContact NZ-OD2 3.45Å; Y47-D84 WeakPolarHBondContact OH-CB 3.29Å; Y47-D84 PolarHBondContact OH-OD2 3.22Å; L80-D84 PolarHBondContact O-N 2.79Å; D84-M86 VanDerWaalsContact C-N 3.25Å; D84-M86 PolarHBondContact O-N 2.9Å; D84-S87 PolarHBondContact O-N 3.47Å; D84-S87 VanDerWaalsContact O-N 3.08Å; D84-S87 PolarHBondContact O-OG 3.47Å; D84-V88 PolarHBondContact O-N 3.16Å
85F69.1Low78.1Confident51 Ų5141.2 Ų41.222%0.22420%0.201CC..Hα-helixtrans-47.9-41.5-175.6-176.4-94.5000114.8S87 V88 H89 V124F85-S87 PolarHBondContact O-N 2.82Å; F85-V88 PolarHBondContact O-N 2.8Å; F85-V88 VanDerWaalsContact O-N 3.11Å; F85-H89 HydrophobicContact CD1-CB 4.48Å; F85-H89 HydrophobicContact CE1-CB 3.85Å; F85-H89 AromaticContact CE1-CG 3.89Å; F85-H89 AromaticContact CE1-ND1 3.19Å; F85-H89 WeakPolarHBondContact CE1-ND1 3.3Å; F85-H89 HydrophobicContact CZ-CB 4.02Å; F85-H89 AromaticContact CZ-CG 3.97Å; F85-H89 AromaticContact CZ-ND1 3.15Å; F85-H89 WeakPolarHBondContact CZ-ND1 3.33Å; F85-H89 PolarHBondContact O-N 2.69Å; F85-V124 HydrophobicContact CD1-CG1 3.85Å; F85-V124 HydrophobicContact CD2-CB 4.34Å; F85-V124 HydrophobicContact CD2-CG1 4.21Å; F85-V124 HydrophobicContact CD2-CG2 4.03Å; F85-V124 HydrophobicContact CE1-CB 4.09Å; F85-V124 HydrophobicContact CE1-CG1 3.28Å; F85-V124 HydrophobicContact CE2-CB 3.58Å; F85-V124 HydrophobicContact CE2-CG1 3.69Å; F85-V124 HydrophobicContact CE2-CG2 3.65Å; F85-V124 HydrophobicContact CG-CG1 4.28Å; F85-V124 HydrophobicContact CZ-CB 3.43Å; F85-V124 VanDerWaalsContact CZ-CB 3.43Å; F85-V124 HydrophobicContact CZ-CG1 3.19Å; F85-V124 HydrophobicContact CZ-CG2 4.03Å
86M71.4Confident78.1Confident184 Ų18441.4 Ų41.491%0.90620%0.203SC*.Hα-helixtrans-60.7-31.5-176.1-67.9-166.27500113.7D84D84-M86 VanDerWaalsContact C-N 3.25Å; D84-M86 PolarHBondContact O-N 2.9Å
87S72.2Confident78.1Confident36 Ų3648.7 Ų48.725%0.25223%0.234SC..Hα-helixtrans-81.2-33.3176.765.10000112.3L51 D84 F85L51-S87 VanDerWaalsContact CD1-OG 3.23Å; L51-S87 WeakPolarHBondContact CD1-OG 3.47Å; D84-S87 PolarHBondContact O-N 3.47Å; D84-S87 VanDerWaalsContact O-N 3.08Å; D84-S87 PolarHBondContact O-OG 3.47Å; F85-S87 PolarHBondContact O-N 2.82Å
88V75.8Confident77.9Confident1 Ų151.2 Ų51.21%0.00625%0.246CC..Hα-helixtrans-90.5-13.6-174.5-168.70000112.6D84 F85 N90 H91 C92 F95D84-V88 PolarHBondContact O-N 3.16Å; F85-V88 PolarHBondContact O-N 2.8Å; F85-V88 VanDerWaalsContact O-N 3.11Å; V88-N90 VanDerWaalsContact C-N 3.31Å; V88-N90 PolarHBondContact O-N 2.99Å; V88-N90 VanDerWaalsContact O-N 3.1Å; V88-H91 HydrophobicContact CG1-CB 4.17Å; V88-H91 CarbonylContact O-C 3.52Å; V88-H91 WeakPolarHBondContact O-CA 3.21Å; V88-H91 WeakPolarHBondContact O-CB 3.44Å; V88-H91 PolarHBondContact O-N 3.33Å; V88-C92 PolarHBondContact O-N 3.39Å; V88-C92 PolarHBondContact O-SG 3.15Å; V88-C92 VanDerWaalsContact O-SG 3.37Å; V88-F95 HydrophobicContact CG1-CE2 3.74Å; V88-F95 HydrophobicContact CG1-CZ 4.1Å
89H79.6Confident78.1Confident80 Ų8051.6 Ų51.637%0.3725%0.248SC..Hα-helixtrans-43.7-49-176.4-179.882.4000114.5F85 H91 C92F85-H89 HydrophobicContact CD1-CB 4.48Å; F85-H89 HydrophobicContact CE1-CB 3.85Å; F85-H89 AromaticContact CE1-CG 3.89Å; F85-H89 AromaticContact CE1-ND1 3.19Å; F85-H89 WeakPolarHBondContact CE1-ND1 3.3Å; F85-H89 HydrophobicContact CZ-CB 4.02Å; F85-H89 AromaticContact CZ-CG 3.97Å; F85-H89 AromaticContact CZ-ND1 3.15Å; F85-H89 WeakPolarHBondContact CZ-ND1 3.33Å; F85-H89 PolarHBondContact O-N 2.69Å; H89-H91 VanDerWaalsContact C-N 3.27Å; H89-H91 PolarHBondContact O-N 3.11Å; H89-C92 WeakPolarHBondContact O-CB 3.4Å; H89-C92 PolarHBondContact O-N 3.43Å
90N79.1Confident78.3Confident117 Ų11754.6 Ų54.663%0.62626%0.264SS*.Hα-helixtrans-66.4-28179.5-67.9-30.5000113.2V88V88-N90 VanDerWaalsContact C-N 3.31Å; V88-N90 PolarHBondContact O-N 2.99Å; V88-N90 VanDerWaalsContact O-N 3.1Å
91H81.5Confident78.3Confident11 Ų1159.2 Ų59.25%0.05129%0.292CS..Hα-helixtrans-83.1-31.1174.5-60-59.2000112.2D52 C55 V88 H89 Q93 R94 F95D52-H91 IonicContact OD1-CD2 2.83Å; D52-H91 IonicContact OD1-CE1 2.61Å; D52-H91 PolarHBondContact OD1-CE1 3.42Å; D52-H91 IonicContact OD1-NE2 3.96Å; D52-H91 PolarHBondContact OD1-NE2 3.46Å; C55-H91 HydrophobicContact CB-CB 4.14Å; V88-H91 HydrophobicContact CG1-CB 4.17Å; V88-H91 CarbonylContact O-C 3.52Å; V88-H91 WeakPolarHBondContact O-CA 3.21Å; V88-H91 WeakPolarHBondContact O-CB 3.44Å; V88-H91 PolarHBondContact O-N 3.33Å; H89-H91 VanDerWaalsContact C-N 3.27Å; H89-H91 PolarHBondContact O-N 3.11Å; H91-Q93 PolarHBondContact O-N 2.87Å; H91-R94 CarbonylContact O-C 3.52Å; H91-R94 WeakPolarHBondContact O-CA 3.46Å; H91-R94 VanDerWaalsContact O-CB 3.32Å; H91-R94 WeakPolarHBondContact O-CB 3.44Å; H91-R94 PolarHBondContact O-N 3.25Å; H91-F95 HydrophobicContact CB-CE1 3.89Å; H91-F95 HydrophobicContact CB-CE2 4.3Å; H91-F95 HydrophobicContact CB-CZ 3.76Å; H91-F95 VanDerWaalsContact O-CD1 3.32Å; H91-F95 WeakPolarHBondContact O-CD1 3.27Å; H91-F95 VanDerWaalsContact O-CG 3.29Å; H91-F95 WeakPolarHBondContact O-CG 3.48Å; H91-F95 PolarHBondContact O-N 2.95Å
92C81.1Confident78Confident0 Ų059.5 Ų59.50%029%0.291CS..Hα-helixtrans-53.5-40.7175.1-660000112V88 H89 R94 F95 V96 L121 F125V88-C92 PolarHBondContact O-N 3.39Å; V88-C92 PolarHBondContact O-SG 3.15Å; V88-C92 VanDerWaalsContact O-SG 3.37Å; H89-C92 WeakPolarHBondContact O-CB 3.4Å; H89-C92 PolarHBondContact O-N 3.43Å; C92-R94 VanDerWaalsContact C-N 3.31Å; C92-R94 PolarHBondContact O-N 3.43Å; C92-F95 WeakPolarHBondContact O-CB 3.36Å; C92-F95 PolarHBondContact O-N 2.85Å; C92-V96 PolarHBondContact O-N 3.2Å; C92-L121 HydrophobicContact CB-CD2 4.02Å; C92-F125 HydrophobicContact CB-CE2 4.42Å; C92-F125 HydrophobicContact CB-CZ 3.93Å
93Q83.9Confident77.6Confident135 Ų13562 Ų6263%0.63131%0.313SS*.Hα-helixtrans-67.1-34.1177.2-165.8-177.68.900111.7H91 K97 F125H91-Q93 PolarHBondContact O-N 2.87Å; Q93-K97 WeakPolarHBondContact O-CB 3.46Å; Q93-K97 PolarHBondContact O-N 3.4Å; Q93-F125 HydrophobicContact CB-CE1 4.15Å; Q93-F125 HydrophobicContact CB-CZ 4.19Å; Q93-F125 HydrophobicContact CG-CE1 4.45Å
94R83.7Confident77.6Confident132 Ų13263.1 Ų63.150%0.49832%0.32SS..Hα-helixtrans-69.5-40.8173.2-58.4179179.6-174.2-0.4111.4I59 H91 C92 K97 Q98I59-R94 HydrophobicContact CD1-CB 3.92Å; H91-R94 CarbonylContact O-C 3.52Å; H91-R94 WeakPolarHBondContact O-CA 3.46Å; H91-R94 VanDerWaalsContact O-CB 3.32Å; H91-R94 WeakPolarHBondContact O-CB 3.44Å; H91-R94 PolarHBondContact O-N 3.25Å; C92-R94 VanDerWaalsContact C-N 3.31Å; C92-R94 PolarHBondContact O-N 3.43Å; R94-K97 PolarHBondContact O-N 2.89Å; R94-Q98 VanDerWaalsContact O-CB 3.3Å; R94-Q98 WeakPolarHBondContact O-CB 3.2Å; R94-Q98 PolarHBondContact O-N 3.44Å
95F84.2Confident77.7Confident1 Ų162.9 Ų62.90%0.00432%0.32CS..Hα-helixtrans-58.4-53.5175.4-58-18.9000110.3C55 I59 M77 V88 H91 C92 K97 Q98 L99 L121C55-F95 HydrophobicContact CB-CE1 4.09Å; C55-F95 HydrophobicContact CB-CZ 3.93Å; I59-F95 HydrophobicContact CD1-CD1 3.82Å; I59-F95 HydrophobicContact CD1-CE1 3.79Å; I59-F95 HydrophobicContact CG1-CD1 3.62Å; I59-F95 HydrophobicContact CG1-CE1 3.73Å; M77-F95 HydrophobicContact CB-CD2 4.12Å; M77-F95 HydrophobicContact CB-CE2 4.08Å; M77-F95 HydrophobicContact CE-CD1 3.51Å; M77-F95 HydrophobicContact CE-CE1 3.72Å; M77-F95 HydrophobicContact CE-CG 4.11Å; M77-F95 HydrophobicContact CE-CZ 4.46Å; M77-F95 HydrophobicContact CG-CD1 4.3Å; M77-F95 HydrophobicContact CG-CD2 4.06Å; M77-F95 HydrophobicContact CG-CE1 4.18Å; M77-F95 HydrophobicContact CG-CE2 3.94Å; M77-F95 HydrophobicContact CG-CG 4.25Å; M77-F95 HydrophobicContact CG-CZ 4Å; M77-F95 HydrophobicContact SD-CB 4.01Å; M77-F95 HydrophobicContact SD-CD1 3.71Å; M77-F95 HydrophobicContact SD-CD2 4.02Å; M77-F95 HydrophobicContact SD-CE1 4.14Å; M77-F95 HydrophobicContact SD-CE2 4.43Å; M77-F95 HydrophobicContact SD-CG 3.65Å; M77-F95 HydrophobicContact SD-CZ 4.48Å; V88-F95 HydrophobicContact CG1-CE2 3.74Å; V88-F95 HydrophobicContact CG1-CZ 4.1Å; H91-F95 HydrophobicContact CB-CE1 3.89Å; H91-F95 HydrophobicContact CB-CE2 4.3Å; H91-F95 HydrophobicContact CB-CZ 3.76Å; H91-F95 VanDerWaalsContact O-CD1 3.32Å; H91-F95 WeakPolarHBondContact O-CD1 3.27Å; H91-F95 VanDerWaalsContact O-CG 3.29Å; H91-F95 WeakPolarHBondContact O-CG 3.48Å; H91-F95 PolarHBondContact O-N 2.95Å; C92-F95 WeakPolarHBondContact O-CB 3.36Å; C92-F95 PolarHBondContact O-N 2.85Å; F95-K97 PolarHBondContact O-N 2.84Å; F95-Q98 PolarHBondContact O-N 2.98Å; F95-L99 WeakPolarHBondContact O-CD1 3.33Å; F95-L99 VanDerWaalsContact O-CG 3.22Å; F95-L99 WeakPolarHBondContact O-CG 3.18Å; F95-L99 PolarHBondContact O-N 3.01Å; F95-L121 HydrophobicContact CB-CD1 4.43Å
96V84.5Confident77.9Confident7 Ų767.2 Ų67.24%0.04235%0.35CS..Hα-helixtrans-57.4-49177.1167.90000111.8C92 Q98 L99 L100 L121 F125 F129C92-V96 PolarHBondContact O-N 3.2Å; V96-Q98 VanDerWaalsContact C-N 3.28Å; V96-Q98 PolarHBondContact O-N 3.06Å; V96-L99 PolarHBondContact O-N 3.47Å; V96-L100 HydrophobicContact CG1-CD1 3.72Å; V96-L100 HydrophobicContact CG1-CG 4.31Å; V96-L100 WeakPolarHBondContact O-CG 3.32Å; V96-L100 PolarHBondContact O-N 3.4Å; V96-L121 HydrophobicContact CG2-CB 4.28Å; V96-L121 HydrophobicContact CG2-CD1 3.72Å; V96-F125 HydrophobicContact CB-CE2 4.47Å; V96-F125 HydrophobicContact CG2-CD2 4.38Å; V96-F125 HydrophobicContact CG2-CE2 3.59Å; V96-F125 HydrophobicContact CG2-CZ 4.28Å; V96-F129 HydrophobicContact CG1-CE1 4.47Å; V96-F129 HydrophobicContact CG1-CE2 3.62Å; V96-F129 HydrophobicContact CG1-CZ 3.42Å; V96-F129 VanDerWaalsContact CG1-CZ 3.42Å
97K85.5Confident78.5Confident153 Ų15360.4 Ų60.467%0.66532%0.318SS*.Hα-helixtrans-57.8-42.9178.1-176.1177179.6178.70111.5Q93 R94 F95 T101Q93-K97 WeakPolarHBondContact O-CB 3.46Å; Q93-K97 PolarHBondContact O-N 3.4Å; R94-K97 PolarHBondContact O-N 2.89Å; F95-K97 PolarHBondContact O-N 2.84Å; K97-T101 VanDerWaalsContact O-CB 3.32Å; K97-T101 WeakPolarHBondContact O-CB 3.41Å; K97-T101 PolarHBondContact O-N 2.95Å; K97-T101 PolarHBondContact O-OG1 2.91Å
98Q82.6Confident79.1Confident53 Ų5359.8 Ų59.825%0.24831%0.311CS..Hα-helixtrans-69.3-37-179.7-17458.428.500112.6I59 R94 F95 V96 Q102I59-Q98 HydrophobicContact CG2-CG 4.29Å; R94-Q98 VanDerWaalsContact O-CB 3.3Å; R94-Q98 WeakPolarHBondContact O-CB 3.2Å; R94-Q98 PolarHBondContact O-N 3.44Å; F95-Q98 PolarHBondContact O-N 2.98Å; V96-Q98 VanDerWaalsContact C-N 3.28Å; V96-Q98 PolarHBondContact O-N 3.06Å; Q98-Q102 WeakPolarHBondContact O-CG 3.42Å; Q98-Q102 PolarHBondContact O-N 3.39Å; Q98-Q102 PolarHBondContact O-NE2 2.9Å
99L83.3Confident79.4Confident8 Ų861.9 Ų61.94%0.04232%0.321CS..Hα-helixtrans-67.4-45.3176.2-67.2162000111.3V62 I74 F95 V96 T101 Q102 E114 L117 I118V62-L99 HydrophobicContact CG1-CD2 4.01Å; I74-L99 HydrophobicContact CD1-CD2 4.37Å; I74-L99 HydrophobicContact CG1-CD2 4.22Å; F95-L99 WeakPolarHBondContact O-CD1 3.33Å; F95-L99 VanDerWaalsContact O-CG 3.22Å; F95-L99 WeakPolarHBondContact O-CG 3.18Å; F95-L99 PolarHBondContact O-N 3.01Å; V96-L99 PolarHBondContact O-N 3.47Å; L99-T101 VanDerWaalsContact C-N 3.3Å; L99-T101 PolarHBondContact O-N 2.89Å; L99-Q102 PolarHBondContact O-N 3.42Å; L99-E114 HydrophobicContact CD2-CB 4.45Å; L99-E114 HydrophobicContact CD2-CG 4.06Å; L99-L117 HydrophobicContact CD1-CB 4.45Å; L99-L117 HydrophobicContact CD1-CD2 3.68Å; L99-L117 HydrophobicContact CD1-CG 4.08Å; L99-I118 HydrophobicContact CB-CD1 4.28Å; L99-I118 HydrophobicContact CD1-CG1 4.24Å
100L83.5Confident79.8Confident64 Ų6458 Ų5834%0.33530%0.303SS..Hα-helixtrans-69.3-24.2178.3-66.5174.9000113.6V96 I118 F129 F152V96-L100 HydrophobicContact CG1-CD1 3.72Å; V96-L100 HydrophobicContact CG1-CG 4.31Å; V96-L100 WeakPolarHBondContact O-CG 3.32Å; V96-L100 PolarHBondContact O-N 3.4Å; L100-I118 HydrophobicContact CD2-CD1 4.17Å; L100-F129 HydrophobicContact CD1-CE2 4.32Å; L100-F152 HydrophobicContact CD2-CE1 4.29Å; L100-F152 HydrophobicContact CD2-CZ 4.34Å
101T79.6Confident80.1Confident100 Ų10052.6 Ų52.661%0.61327%0.274SS*.Hα-helixtrans-84.1-17.2178.9-54.70000112.6K97 L99K97-T101 VanDerWaalsContact O-CB 3.32Å; K97-T101 WeakPolarHBondContact O-CB 3.41Å; K97-T101 PolarHBondContact O-N 2.95Å; K97-T101 PolarHBondContact O-OG1 2.91Å; L99-T101 VanDerWaalsContact C-N 3.3Å; L99-T101 PolarHBondContact O-N 2.89Å
102Q72.4Confident80.3Confident23 Ų2352.1 Ų52.111%0.10727%0.272CS..SBendtrans-75.1150-173.8-88-177.760.400114V62 Q98 L99 V104V62-Q102 VanDerWaalsContact O-CD 3.32Å; V62-Q102 PolarHBondContact O-NE2 3.24Å; V62-Q102 PolarHBondContact O-OE1 2.77Å; Q98-Q102 WeakPolarHBondContact O-CG 3.42Å; Q98-Q102 PolarHBondContact O-N 3.39Å; Q98-Q102 PolarHBondContact O-NE2 2.9Å; L99-Q102 PolarHBondContact O-N 3.42Å; Q102-V104 PolarHBondContact O-N 2.89Å
103S61Low80.5Confident97 Ų9752.6 Ų52.668%0.67828%0.275SS*.  trans-62.7107169.955.90000109.4T105S103-T105 PolarHBondContact O-N 3.34Å; S103-T105 VanDerWaalsContact O-N 3.12Å
104V67.8Low80.7Confident38 Ų3846.5 Ų46.523%0.2325%0.246CC..  trans-52.5119.5179.8-177.10000109.9Q102 A148 Q149 F152Q102-V104 PolarHBondContact O-N 2.89Å; V104-A148 HydrophobicContact CG1-CB 4.04Å; V104-A148 WeakPolarHBondContact CG1-O 3.46Å; V104-Q149 HydrophobicContact CB-CG 3.97Å; V104-Q149 HydrophobicContact CG2-CG 3.82Å; V104-F152 HydrophobicContact CG1-CB 3.88Å; V104-F152 HydrophobicContact CG1-CG 4.45Å
105T70.8Confident80.9Confident30 Ų3040.2 Ų40.218%0.18422%0.222CC..  trans-79.8159.6-172.365.60000111.5S103 D107 L110S103-T105 PolarHBondContact O-N 3.34Å; S103-T105 VanDerWaalsContact O-N 3.12Å; T105-D107 VanDerWaalsContact C-N 3.27Å; T105-L110 HydrophobicContact CG2-CD2 3.88Å; T105-L110 WeakPolarHBondContact OG1-CD2 3.2Å
106T73.4Confident80.9Confident141 Ų14140.7 Ų40.787%0.86522%0.224SC*.SBendtrans-79.7-8.7175.653.20000113.3L108T106-L108 PolarHBondContact O-N 3.18Å
107D83.6Confident81Confident42 Ų4240.4 Ų40.423%0.22522%0.222CC..  trans-84.1109.3177.1-179.611000110.6V67 K71 T105 Q109 L110 T111V67-D107 HydrophobicContact CG1-CB 4.25Å; V67-D107 WeakPolarHBondContact CG1-OD2 3.34Å; K71-D107 WeakPolarHBondContact CE-OD2 3.3Å; K71-D107 IonicContact NZ-OD2 2.79Å; K71-D107 PolarHBondContact NZ-OD2 3.03Å; T105-D107 VanDerWaalsContact C-N 3.27Å; D107-Q109 PolarHBondContact O-N 2.86Å; D107-Q109 WeakPolarHBondContact OD1-CB 3.43Å; D107-Q109 PolarHBondContact OD1-N 3.19Å; D107-L110 HydrophobicContact CB-CB 4.25Å; D107-L110 PolarHBondContact O-N 3.29Å; D107-T111 PolarHBondContact O-N 3Å; D107-T111 PolarHBondContact O-OG1 3.39Å
108L83.5Confident81.1Confident22 Ų2233.1 Ų33.112%0.11519%0.191CC..Hα-helixtrans-62.3-28178.9-173.765000113.5T106 A112 H151 L155 L193 A372 V376T106-L108 PolarHBondContact O-N 3.18Å; L108-A112 WeakPolarHBondContact O-CB 3.41Å; L108-A112 PolarHBondContact O-N 3.44Å; L108-H151 HydrophobicContact CD1-CB 4.38Å; L108-L155 HydrophobicContact CD1-CD1 3.91Å; L108-L193 HydrophobicContact CD1-CD1 4Å; L108-A372 HydrophobicContact CD2-CB 3.3Å; L108-A372 VanDerWaalsContact CD2-O 3.28Å; L108-A372 WeakPolarHBondContact CD2-O 3.4Å; L108-V376 HydrophobicContact CD1-CG2 3.7Å; L108-V376 HydrophobicContact CD2-CG2 3.73Å; L108-V376 HydrophobicContact CG-CG2 3.54Å
109Q82.4Confident81.1Confident45 Ų4530.6 Ų30.621%0.2118%0.179CC..Hα-helixtrans-65.4-46.7174.4-71.2-171.4-15.200111.1D107 A112 L113 T375 T379D107-Q109 PolarHBondContact O-N 2.86Å; D107-Q109 WeakPolarHBondContact OD1-CB 3.43Å; D107-Q109 PolarHBondContact OD1-N 3.19Å; Q109-A112 PolarHBondContact O-N 3.46Å; Q109-L113 WeakPolarHBondContact O-CG 3.45Å; Q109-L113 PolarHBondContact O-N 2.91Å; Q109-L113 VanDerWaalsContact O-N 3.15Å; Q109-T375 HydrophobicContact CB-CG2 4.43Å; Q109-T375 HydrophobicContact CG-CG2 3.25Å; Q109-T379 HydrophobicContact CB-CG2 3.78Å; Q109-T379 HydrophobicContact CG-CG2 3.78Å
110L87.5Confident80.9Confident0 Ų031.2 Ų31.20%018%0.182CC..Hα-helixtrans-62.4-48.7177178.554.7000110.2V67 K70 K71 I74 T105 D107 A112 L113 E114V67-L110 HydrophobicContact CG1-CD2 4.25Å; K70-L110 HydrophobicContact CB-CD1 3.82Å; K70-L110 HydrophobicContact CB-CD2 4.1Å; K70-L110 HydrophobicContact CD-CD2 4.06Å; K71-L110 HydrophobicContact CG-CB 4.44Å; K71-L110 HydrophobicContact CG-CD1 4.15Å; I74-L110 HydrophobicContact CD1-CD1 3.35Å; T105-L110 HydrophobicContact CG2-CD2 3.88Å; T105-L110 WeakPolarHBondContact OG1-CD2 3.2Å; D107-L110 HydrophobicContact CB-CB 4.25Å; D107-L110 PolarHBondContact O-N 3.29Å; L110-A112 VanDerWaalsContact C-N 3.25Å; L110-A112 PolarHBondContact O-N 2.95Å; L110-L113 PolarHBondContact O-N 3Å; L110-E114 HydrophobicContact CD1-CG 4.18Å; L110-E114 HydrophobicContact CG-CG 4.43Å; L110-E114 WeakPolarHBondContact O-CG 3.42Å; L110-E114 PolarHBondContact O-N 2.98Å
111T86.3Confident80.8Confident3 Ų328.3 Ų28.32%0.01817%0.167CC..Hα-helixtrans-54.5-39176.5-48.10000112.7D107 A115 F152 L155D107-T111 PolarHBondContact O-N 3Å; D107-T111 PolarHBondContact O-OG1 3.39Å; T111-A115 WeakPolarHBondContact O-CB 3.45Å; T111-A115 PolarHBondContact O-N 3.32Å; T111-F152 HydrophobicContact CG2-CB 3.75Å; T111-F152 HydrophobicContact CG2-CD2 3.87Å; T111-F152 HydrophobicContact CG2-CG 4.32Å; T111-L155 HydrophobicContact CG2-CD1 4.02Å
112A85.5Confident80.7Confident1 Ų123.6 Ų23.61%0.00814%0.138CC..Hα-helixtrans-69.6-38.1176.600000113.2L108 Q109 L110 R116 L155 V376 T379L108-A112 WeakPolarHBondContact O-CB 3.41Å; L108-A112 PolarHBondContact O-N 3.44Å; Q109-A112 PolarHBondContact O-N 3.46Å; L110-A112 VanDerWaalsContact C-N 3.25Å; L110-A112 PolarHBondContact O-N 2.95Å; A112-R116 WeakPolarHBondContact O-CB 3.46Å; A112-R116 VanDerWaalsContact O-CG 3.23Å; A112-R116 WeakPolarHBondContact O-CG 3.34Å; A112-R116 PolarHBondContact O-N 3.48Å; A112-L155 HydrophobicContact CB-CD1 4.37Å; A112-V376 HydrophobicContact CB-CB 4.42Å; A112-V376 HydrophobicContact CB-CG1 4.19Å; A112-V376 HydrophobicContact CB-CG2 4.2Å; A112-T379 HydrophobicContact CB-CG2 4.37Å
113L84.7Confident80.9Confident9 Ų927.6 Ų27.65%0.04716%0.16CC..Hα-helixtrans-68.9-40.8174.6-63.7176.9000111.4K71 I74 V75 Q109 L110 R116 L117 W381K71-L113 HydrophobicContact CB-CD1 3.91Å; K71-L113 HydrophobicContact CG-CD1 3.84Å; I74-L113 HydrophobicContact CG2-CB 3.85Å; V75-L113 HydrophobicContact CG2-CD1 4.23Å; V75-L113 HydrophobicContact CG2-CD2 4.34Å; Q109-L113 WeakPolarHBondContact O-CG 3.45Å; Q109-L113 PolarHBondContact O-N 2.91Å; Q109-L113 VanDerWaalsContact O-N 3.15Å; L110-L113 PolarHBondContact O-N 3Å; L113-R116 PolarHBondContact O-N 2.94Å; L113-L117 PolarHBondContact O-N 2.98Å; L113-W381 HydrophobicContact CB-CZ3 4.05Å; L113-W381 HydrophobicContact CD2-CE3 3.56Å; L113-W381 HydrophobicContact CD2-CZ3 3.88Å; L113-W381 WeakPolarHBondContact O-CZ3 3.29Å
114E88.2Confident81.7Confident7 Ų726.1 Ų26.13%0.03315%0.146CC..Hα-helixtrans-59.6-47.9175.2-66.8171.2159.300111.1I74 L99 L110 R116 L117 I118 F152I74-E114 HydrophobicContact CD1-CG 3.5Å; L99-E114 HydrophobicContact CD2-CB 4.45Å; L99-E114 HydrophobicContact CD2-CG 4.06Å; L110-E114 HydrophobicContact CD1-CG 4.18Å; L110-E114 HydrophobicContact CG-CG 4.43Å; L110-E114 WeakPolarHBondContact O-CG 3.42Å; L110-E114 PolarHBondContact O-N 2.98Å; E114-R116 PolarHBondContact O-N 3.32Å; E114-L117 PolarHBondContact O-N 3.03Å; E114-I118 WeakPolarHBondContact O-CG1 3.43Å; E114-I118 PolarHBondContact O-N 3.14Å; E114-I118 VanDerWaalsContact O-N 3.09Å; E114-F152 HydrophobicContact CB-CE2 4.02Å
115A87.6Confident82.2Confident0 Ų025.9 Ų25.90%014%0.142CC..Hα-helixtrans-63.9-3817700000113.2T111 I118 G119 L155 T156 E159T111-A115 WeakPolarHBondContact O-CB 3.45Å; T111-A115 PolarHBondContact O-N 3.32Å; A115-I118 PolarHBondContact O-N 2.99Å; A115-G119 PolarHBondContact O-N 2.83Å; A115-L155 HydrophobicContact CB-CB 3.63Å; A115-T156 HydrophobicContact CB-CG2 4.01Å; A115-E159 HydrophobicContact CB-CG 4.37Å
116R85.3Confident82.8Confident11 Ų1128.3 Ų28.34%0.04216%0.159CC..Hα-helixtrans-65.6-42.4175.3-77.7172.6-174.6-169.27.8112.3A112 L113 E114 I118 G119 Q120 E159 V376 L377 T379 W381A112-R116 WeakPolarHBondContact O-CB 3.46Å; A112-R116 VanDerWaalsContact O-CG 3.23Å; A112-R116 WeakPolarHBondContact O-CG 3.34Å; A112-R116 PolarHBondContact O-N 3.48Å; L113-R116 PolarHBondContact O-N 2.94Å; E114-R116 PolarHBondContact O-N 3.32Å; R116-I118 VanDerWaalsContact C-N 3.32Å; R116-I118 PolarHBondContact O-N 3.23Å; R116-G119 PolarHBondContact O-N 3.07Å; R116-Q120 WeakPolarHBondContact O-CG 3.44Å; R116-Q120 PolarHBondContact O-N 3.1Å; R116-E159 HydrophobicContact CG-CG 4.03Å; R116-E159 WeakPolarHBondContact CG-OE1 3.24Å; R116-E159 IonicContact NE-OE1 2.9Å; R116-V376 PolarHBondContact NH2-O 2.84Å; R116-L377 PolarHBondContact NH2-O 3.34Å; R116-T379 VanDerWaalsContact CZ-OG1 3.27Å; R116-T379 PolarHBondContact NH1-O 3Å; R116-T379 PolarHBondContact NH2-O 2.58Å; R116-T379 VanDerWaalsContact NH2-O 3.13Å; R116-T379 PolarHBondContact NH2-OG1 3.36Å; R116-W381 HydrophobicContact CB-CD2 4.46Å; R116-W381 HydrophobicContact CB-CE3 3.87Å; R116-W381 HydrophobicContact CB-CH2 4.49Å; R116-W381 HydrophobicContact CB-CZ3 3.91Å
117L85.7Confident83.4Confident1 Ų124.8 Ų24.81%0.00513%0.13CC..Hα-helixtrans-60.1-45.1175.3-172.750.7000110.9I74 M77 L99 L113 E114 Q120 L121 W381I74-L117 HydrophobicContact CB-CD2 4.42Å; I74-L117 HydrophobicContact CG2-CB 4.11Å; I74-L117 HydrophobicContact CG2-CD2 3.85Å; M77-L117 HydrophobicContact CB-CD1 4.46Å; M77-L117 HydrophobicContact CB-CD2 3.89Å; M77-L117 HydrophobicContact SD-CD2 4.18Å; L99-L117 HydrophobicContact CD1-CB 4.45Å; L99-L117 HydrophobicContact CD1-CD2 3.68Å; L99-L117 HydrophobicContact CD1-CG 4.08Å; L113-L117 PolarHBondContact O-N 2.98Å; E114-L117 PolarHBondContact O-N 3.03Å; L117-Q120 PolarHBondContact O-N 3.22Å; L117-L121 HydrophobicContact CD1-CD1 3.95Å; L117-L121 HydrophobicContact CD1-CG 4.05Å; L117-L121 HydrophobicContact CG-CD1 3.94Å; L117-L121 HydrophobicContact CG-CG 4.44Å; L117-L121 WeakPolarHBondContact O-CB 3.45Å; L117-L121 VanDerWaalsContact O-CG 3.24Å; L117-L121 WeakPolarHBondContact O-CG 3.31Å; L117-L121 PolarHBondContact O-N 3Å; L117-W381 HydrophobicContact CB-CH2 3.82Å; L117-W381 HydrophobicContact CD1-CH2 4.19Å; L117-W381 HydrophobicContact CD1-CZ2 4.33Å; L117-W381 HydrophobicContact CG-CH2 4.49Å
118I87.6Confident83.6Confident1 Ų128.1 Ų28.11%0.00515%0.148CC..Hα-helixtrans-63.3-41.5176.7-69166.5000111.4L99 L100 E114 A115 R116 G122 F152 T156 F160L99-I118 HydrophobicContact CB-CD1 4.28Å; L99-I118 HydrophobicContact CD1-CG1 4.24Å; L100-I118 HydrophobicContact CD2-CD1 4.17Å; E114-I118 WeakPolarHBondContact O-CG1 3.43Å; E114-I118 PolarHBondContact O-N 3.14Å; E114-I118 VanDerWaalsContact O-N 3.09Å; A115-I118 PolarHBondContact O-N 2.99Å; R116-I118 VanDerWaalsContact C-N 3.32Å; R116-I118 PolarHBondContact O-N 3.23Å; I118-G122 PolarHBondContact O-N 3.38Å; I118-F152 HydrophobicContact CD1-CE2 4.08Å; I118-F152 HydrophobicContact CD1-CZ 3.57Å; I118-T156 HydrophobicContact CD1-CG2 4.42Å; I118-F160 HydrophobicContact CG2-CE1 3.89Å; I118-F160 HydrophobicContact CG2-CZ 3.62Å
119G82.8Confident83.7Confident0 Ų028.5 Ų28.50%015%0.149CC..Hα-helixtrans-62.7-43.317600000113.4A115 R116 G122 H163A115-G119 PolarHBondContact O-N 2.83Å; R116-G119 PolarHBondContact O-N 3.07Å; G119-G122 PolarHBondContact O-N 3.07Å; G119-H163 VanDerWaalsContact O-CB 3.25Å; G119-H163 WeakPolarHBondContact O-CB 3.5Å
120Q79.8Confident83.9Confident21 Ų2126.6 Ų26.610%0.09814%0.14CC..Hα-helixtrans-67.1-47.2176.5-73.316919.100112.1R116 L117 G122 L123 H163 W381 Q436R116-Q120 WeakPolarHBondContact O-CG 3.44Å; R116-Q120 PolarHBondContact O-N 3.1Å; L117-Q120 PolarHBondContact O-N 3.22Å; Q120-G122 PolarHBondContact O-N 3.14Å; Q120-L123 VanDerWaalsContact O-CB 3.3Å; Q120-L123 WeakPolarHBondContact O-CB 3.29Å; Q120-L123 PolarHBondContact O-N 3.4Å; Q120-H163 WeakPolarHBondContact CG-CE1 3.08Å; Q120-W381 VanDerWaalsContact OE1-CE2 3.31Å; Q120-Q436 VanDerWaalsContact NE2-OE1 3.09Å
121L82Confident84Confident3 Ų329 Ų292%0.01615%0.151CC..Hα-helixtrans-63.9-28.5176-67.5177.1000111.8A81 C92 F95 V96 L117 L123 V124 F125A81-L121 HydrophobicContact CB-CD2 3.94Å; C92-L121 HydrophobicContact CB-CD2 4.02Å; F95-L121 HydrophobicContact CB-CD1 4.43Å; V96-L121 HydrophobicContact CG2-CB 4.28Å; V96-L121 HydrophobicContact CG2-CD1 3.72Å; L117-L121 HydrophobicContact CD1-CD1 3.95Å; L117-L121 HydrophobicContact CD1-CG 4.05Å; L117-L121 HydrophobicContact CG-CD1 3.94Å; L117-L121 HydrophobicContact CG-CG 4.44Å; L117-L121 WeakPolarHBondContact O-CB 3.45Å; L117-L121 VanDerWaalsContact O-CG 3.24Å; L117-L121 WeakPolarHBondContact O-CG 3.31Å; L117-L121 PolarHBondContact O-N 3Å; L121-L123 PolarHBondContact O-N 2.95Å; L121-L123 VanDerWaalsContact O-N 3.16Å; L121-V124 PolarHBondContact O-N 2.94Å; L121-F125 HydrophobicContact CB-CD2 4.21Å; L121-F125 HydrophobicContact CB-CE2 3.93Å; L121-F125 VanDerWaalsContact O-CD2 3.25Å; L121-F125 WeakPolarHBondContact O-CD2 3.23Å; L121-F125 PolarHBondContact O-N 3.48Å
122G77.3Confident84.1Confident1 Ų134.7 Ų34.71%0.0118%0.177CC..THydrogen-bonded Turntrans-59.4-17.1171.100000115I118 G119 Q120 V124 T164I118-G122 PolarHBondContact O-N 3.38Å; G119-G122 PolarHBondContact O-N 3.07Å; Q120-G122 PolarHBondContact O-N 3.14Å; G122-V124 PolarHBondContact O-N 3.44Å; G122-T164 WeakPolarHBondContact O-CG2 3.07Å
123L75.9Confident84.2Confident107 Ų10735.6 Ų35.656%0.5618%0.181SC*.THydrogen-bonded Turntrans-69.7-19.4170.6-72.1170.7000113.6Q120 L121 H163 T164Q120-L123 VanDerWaalsContact O-CB 3.3Å; Q120-L123 WeakPolarHBondContact O-CB 3.29Å; Q120-L123 PolarHBondContact O-N 3.4Å; L121-L123 PolarHBondContact O-N 2.95Å; L121-L123 VanDerWaalsContact O-N 3.16Å; L123-H163 HydrophobicContact CD2-CB 4.29Å; L123-H163 WeakPolarHBondContact CD2-O 3.4Å; L123-H163 HydrophobicContact CG-CB 4.18Å; L123-T164 HydrophobicContact CD2-CG2 4.3Å
124V77Confident84.5Confident66 Ų6635.1 Ų35.140%0.418%0.179SC..THydrogen-bonded Turntrans-124.2-5.4-169.5-138.10000113.9F85 L121 G122F85-V124 HydrophobicContact CD1-CG1 3.85Å; F85-V124 HydrophobicContact CD2-CB 4.34Å; F85-V124 HydrophobicContact CD2-CG1 4.21Å; F85-V124 HydrophobicContact CD2-CG2 4.03Å; F85-V124 HydrophobicContact CE1-CB 4.09Å; F85-V124 HydrophobicContact CE1-CG1 3.28Å; F85-V124 HydrophobicContact CE2-CB 3.58Å; F85-V124 HydrophobicContact CE2-CG1 3.69Å; F85-V124 HydrophobicContact CE2-CG2 3.65Å; F85-V124 HydrophobicContact CG-CG1 4.28Å; F85-V124 HydrophobicContact CZ-CB 3.43Å; F85-V124 VanDerWaalsContact CZ-CB 3.43Å; F85-V124 HydrophobicContact CZ-CG1 3.19Å; F85-V124 HydrophobicContact CZ-CG2 4.03Å; L121-V124 PolarHBondContact O-N 2.94Å; G122-V124 PolarHBondContact O-N 3.44Å
125F79.9Confident84.6Confident32 Ų3240 Ų4014%0.1420%0.2CC..SBendtrans-86.2154.9166.1-75.2-60.5000111.7C92 Q93 V96 L121 F129C92-F125 HydrophobicContact CB-CE2 4.42Å; C92-F125 HydrophobicContact CB-CZ 3.93Å; Q93-F125 HydrophobicContact CB-CE1 4.15Å; Q93-F125 HydrophobicContact CB-CZ 4.19Å; Q93-F125 HydrophobicContact CG-CE1 4.45Å; V96-F125 HydrophobicContact CB-CE2 4.47Å; V96-F125 HydrophobicContact CG2-CD2 4.38Å; V96-F125 HydrophobicContact CG2-CE2 3.59Å; V96-F125 HydrophobicContact CG2-CZ 4.28Å; L121-F125 HydrophobicContact CB-CD2 4.21Å; L121-F125 HydrophobicContact CB-CE2 3.93Å; L121-F125 VanDerWaalsContact O-CD2 3.25Å; L121-F125 WeakPolarHBondContact O-CD2 3.23Å; L121-F125 PolarHBondContact O-N 3.48Å; F125-F129 HydrophobicContact CB-CB 4.19Å; F125-F129 HydrophobicContact CB-CD1 3.77Å; F125-F129 HydrophobicContact CB-CG 4.17Å; F125-F129 HydrophobicContact CD2-CD1 4.2Å; F125-F129 HydrophobicContact CD2-CE1 4.22Å; F125-F129 HydrophobicContact CG-CD1 4.18Å
126P82.9Confident84.7Confident82 Ų8243.4 Ų43.453%0.53222%0.218SC..  trans-63.7160.1176.727.7-35.8000112.1D128 F129P126-D128 VanDerWaalsContact C-N 3.25Å; P126-D128 PolarHBondContact O-N 3.17Å; P126-F129 PolarHBondContact O-N 2.88Å
127Y84.9Confident84.9Confident66 Ų6643 Ų4326%0.25922%0.218SC..Hα-helixtrans-52.6-41.1-178.2172.9-102.6000113.3F129 I130 E131 Q170 H171Y127-F129 PolarHBondContact O-N 3.12Å; Y127-I130 WeakPolarHBondContact O-CA 3.26Å; Y127-I130 WeakPolarHBondContact O-CB 3.23Å; Y127-I130 PolarHBondContact O-N 3.39Å; Y127-E131 HydrophobicContact CE1-CB 4.12Å; Y127-E131 PolarHBondContact O-N 2.75Å; Y127-Q170 PolarHBondContact OH-OE1 3.05Å; Y127-H171 AromaticContact CZ-NE2 3.94Å; Y127-H171 PolarHBondContact OH-CE1 3.27Å; Y127-H171 PolarHBondContact OH-NE2 2.89Å
128D88.4Confident85.1Confident113 Ų11343.5 Ų43.560%0.60422%0.221SC*.Hα-helixtrans-55.5-37.1-177.2-48.2-17.6000112.6P126 E131 E132P126-D128 VanDerWaalsContact C-N 3.25Å; P126-D128 PolarHBondContact O-N 3.17Å; D128-E131 PolarHBondContact O-N 3.34Å; D128-E132 WeakPolarHBondContact O-CB 3.5Å; D128-E132 PolarHBondContact O-N 2.92Å
129F86.8Confident85.2Confident30 Ų3045.3 Ų45.313%0.13223%0.233CC..Hα-helixtrans-65-42.6175.7172.7-102.1000111.5V96 L100 F125 P126 Y127 E132 Q133V96-F129 HydrophobicContact CG1-CE1 4.47Å; V96-F129 HydrophobicContact CG1-CE2 3.62Å; V96-F129 HydrophobicContact CG1-CZ 3.42Å; V96-F129 VanDerWaalsContact CG1-CZ 3.42Å; L100-F129 HydrophobicContact CD1-CE2 4.32Å; F125-F129 HydrophobicContact CB-CB 4.19Å; F125-F129 HydrophobicContact CB-CD1 3.77Å; F125-F129 HydrophobicContact CB-CG 4.17Å; F125-F129 HydrophobicContact CD2-CD1 4.2Å; F125-F129 HydrophobicContact CD2-CE1 4.22Å; F125-F129 HydrophobicContact CG-CD1 4.18Å; P126-F129 PolarHBondContact O-N 2.88Å; Y127-F129 PolarHBondContact O-N 3.12Å; F129-E132 PolarHBondContact O-N 3.34Å; F129-Q133 HydrophobicContact CD2-CG 4.1Å; F129-Q133 HydrophobicContact CE1-CG 4.07Å; F129-Q133 HydrophobicContact CE2-CG 3.56Å; F129-Q133 HydrophobicContact CZ-CG 3.53Å; F129-Q133 WeakPolarHBondContact O-CG 3.49Å; F129-Q133 PolarHBondContact O-N 2.92Å
130I86.3Confident85.5Confident5 Ų546.6 Ų46.63%0.02624%0.24CC..Hα-helixtrans-66.2-41.1178.1-53.6164.5000109.9Y127 T134 F160 T164Y127-I130 WeakPolarHBondContact O-CA 3.26Å; Y127-I130 WeakPolarHBondContact O-CB 3.23Å; Y127-I130 PolarHBondContact O-N 3.39Å; I130-T134 WeakPolarHBondContact O-CB 3.25Å; I130-T134 PolarHBondContact O-N 3.19Å; I130-T134 PolarHBondContact O-OG1 3.33Å; I130-F160 HydrophobicContact CG2-CD1 4.42Å; I130-F160 HydrophobicContact CG2-CG 4.44Å; I130-T164 HydrophobicContact CD1-CG2 3.78Å
131E89Confident85.8Confident50 Ų5046.2 Ų46.223%0.23424%0.239CC..Hα-helixtrans-63.3-46.9176.4176.2166.1-153.400111.7Y127 D128 T134 K135 H171Y127-E131 HydrophobicContact CE1-CB 4.12Å; Y127-E131 PolarHBondContact O-N 2.75Å; D128-E131 PolarHBondContact O-N 3.34Å; E131-T134 PolarHBondContact O-N 2.69Å; E131-K135 HydrophobicContact CG-CD 3.99Å; E131-K135 VanDerWaalsContact CG-CE 3.48Å; E131-K135 HydrophobicContact CG-CG 4.5Å; E131-K135 WeakPolarHBondContact O-CB 3.11Å; E131-K135 WeakPolarHBondContact O-CG 3.37Å; E131-K135 PolarHBondContact O-N 3.49Å; E131-K135 WeakPolarHBondContact OE1-CE 3.44Å; E131-K135 IonicContact OE1-NZ 2.97Å; E131-K135 PolarHBondContact OE1-NZ 3.31Å; E131-H171 IonicContact OE1-CE1 3.54Å; E131-H171 PolarHBondContact OE1-CE1 3.49Å; E131-H171 VanDerWaalsContact OE1-CE1 3.3Å
132E89Confident85.9Confident122 Ų12250.1 Ų50.157%0.5727%0.266SS*.Hα-helixtrans-58.9-51.5176.2-172.4-171.4-174.500111.3D128 F129 T134 K135 N136D128-E132 WeakPolarHBondContact O-CB 3.5Å; D128-E132 PolarHBondContact O-N 2.92Å; F129-E132 PolarHBondContact O-N 3.34Å; E132-T134 VanDerWaalsContact C-N 3.34Å; E132-T134 PolarHBondContact O-N 2.92Å; E132-K135 PolarHBondContact O-N 2.91Å; E132-N136 VanDerWaalsContact O-CB 3.26Å; E132-N136 WeakPolarHBondContact O-CB 3.22Å; E132-N136 PolarHBondContact O-N 3.47Å
133Q87.9Confident86.1Confident20 Ų2055.4 Ų55.49%0.09329%0.289CS..Hα-helixtrans-66.7-34.4-179.5-62.6-44.5-51.900112.5F129 A137 F160F129-Q133 HydrophobicContact CD2-CG 4.1Å; F129-Q133 HydrophobicContact CE1-CG 4.07Å; F129-Q133 HydrophobicContact CE2-CG 3.56Å; F129-Q133 HydrophobicContact CZ-CG 3.53Å; F129-Q133 WeakPolarHBondContact O-CG 3.49Å; F129-Q133 PolarHBondContact O-N 2.92Å; Q133-A137 VanDerWaalsContact O-CB 3.24Å; Q133-A137 WeakPolarHBondContact O-CB 3.36Å; Q133-A137 PolarHBondContact O-N 3.18Å; Q133-F160 HydrophobicContact CB-CE2 3.69Å; Q133-F160 HydrophobicContact CB-CZ 3.83Å; Q133-F160 HydrophobicContact CG-CZ 4.4Å
134T89.9Confident85.9Confident0 Ų055.9 Ų55.90%029%0.292CS..Hα-helixtrans-66.1-47.2175.1-59.90000111.1I130 E131 E132 A137 C138 L157 F168 H171I130-T134 WeakPolarHBondContact O-CB 3.25Å; I130-T134 PolarHBondContact O-N 3.19Å; I130-T134 PolarHBondContact O-OG1 3.33Å; E131-T134 PolarHBondContact O-N 2.69Å; E132-T134 VanDerWaalsContact C-N 3.34Å; E132-T134 PolarHBondContact O-N 2.92Å; T134-A137 PolarHBondContact O-N 3.44Å; T134-C138 WeakPolarHBondContact O-CB 3.44Å; T134-C138 PolarHBondContact O-N 3.11Å; T134-C138 PolarHBondContact O-SG 3.35Å; T134-C138 VanDerWaalsContact O-SG 3.35Å; T134-L157 HydrophobicContact CG2-CD2 3.89Å; T134-F168 HydrophobicContact CG2-CD2 4.36Å; T134-F168 HydrophobicContact CG2-CE2 4.2Å; T134-H171 HydrophobicContact CG2-CB 3.89Å
135K91.1Very high86.1Confident109 Ų10955 Ų5547%0.47428%0.284SS..Hα-helixtrans-62.2-43.7175.7-73.7174-177.71690111.7E131 E132 C138 S139E131-K135 HydrophobicContact CG-CD 3.99Å; E131-K135 VanDerWaalsContact CG-CE 3.48Å; E131-K135 HydrophobicContact CG-CG 4.5Å; E131-K135 WeakPolarHBondContact O-CB 3.11Å; E131-K135 WeakPolarHBondContact O-CG 3.37Å; E131-K135 PolarHBondContact O-N 3.49Å; E131-K135 WeakPolarHBondContact OE1-CE 3.44Å; E131-K135 IonicContact OE1-NZ 2.97Å; E131-K135 PolarHBondContact OE1-NZ 3.31Å; E132-K135 PolarHBondContact O-N 2.91Å; K135-C138 PolarHBondContact O-N 3.37Å; K135-S139 WeakPolarHBondContact O-CB 3.45Å; K135-S139 PolarHBondContact O-N 3.18Å
136N89.7Confident86.4Confident71 Ų7156.7 Ų56.738%0.3830%0.3SS..Hα-helixtrans-59.6-52.5177.3-17518000110.9E132 C138 S139 I140E132-N136 VanDerWaalsContact O-CB 3.26Å; E132-N136 WeakPolarHBondContact O-CB 3.22Å; E132-N136 PolarHBondContact O-N 3.47Å; N136-C138 PolarHBondContact O-N 3.17Å; N136-S139 WeakPolarHBondContact O-CA 3.27Å; N136-S139 WeakPolarHBondContact O-CB 3.17Å; N136-S139 PolarHBondContact O-N 3.37Å; N136-S139 PolarHBondContact O-OG 3.25Å; N136-I140 WeakPolarHBondContact O-CG1 3.42Å; N136-I140 PolarHBondContact O-N 3.43Å
137A90.1Very high86.5Confident4 Ų455.7 Ų55.73%0.03329%0.291CS..Hα-helixtrans-58.2-46.617800000112.3Q133 T134 S139 I140 L141 A153 L157Q133-A137 VanDerWaalsContact O-CB 3.24Å; Q133-A137 WeakPolarHBondContact O-CB 3.36Å; Q133-A137 PolarHBondContact O-N 3.18Å; T134-A137 PolarHBondContact O-N 3.44Å; A137-S139 VanDerWaalsContact C-N 3.3Å; A137-S139 PolarHBondContact O-N 2.84Å; A137-I140 WeakPolarHBondContact O-CB 3.49Å; A137-I140 PolarHBondContact O-N 3.46Å; A137-I140 VanDerWaalsContact O-N 3.14Å; A137-L141 WeakPolarHBondContact O-CG 3.29Å; A137-L141 PolarHBondContact O-N 3.08Å; A137-A153 HydrophobicContact CB-CB 4.05Å; A137-L157 HydrophobicContact CB-CD1 3.98Å; A137-L157 HydrophobicContact CB-CD2 4Å; A137-L157 HydrophobicContact CB-CG 3.77Å
138C89.9Confident86.5Confident11 Ų1153.6 Ų53.67%0.07429%0.287CS..Hα-helixtrans-57.9-41.3173.2-71.50000112T134 K135 N136 I140 L141 S142 A178T134-C138 WeakPolarHBondContact O-CB 3.44Å; T134-C138 PolarHBondContact O-N 3.11Å; T134-C138 PolarHBondContact O-SG 3.35Å; T134-C138 VanDerWaalsContact O-SG 3.35Å; K135-C138 PolarHBondContact O-N 3.37Å; N136-C138 PolarHBondContact O-N 3.17Å; C138-I140 VanDerWaalsContact C-N 3.31Å; C138-I140 PolarHBondContact O-N 3.5Å; C138-L141 PolarHBondContact O-N 2.99Å; C138-S142 PolarHBondContact O-N 2.93Å; C138-S142 PolarHBondContact O-OG 3.2Å; C138-A178 HydrophobicContact CB-CB 4.06Å
139S89Confident86.5Confident38 Ų3852 Ų5227%0.26628%0.276SS..Hα-helixtrans-65.7-31.4177.194.60000113.4K135 N136 A137 K143K135-S139 WeakPolarHBondContact O-CB 3.45Å; K135-S139 PolarHBondContact O-N 3.18Å; N136-S139 WeakPolarHBondContact O-CA 3.27Å; N136-S139 WeakPolarHBondContact O-CB 3.17Å; N136-S139 PolarHBondContact O-N 3.37Å; N136-S139 PolarHBondContact O-OG 3.25Å; A137-S139 VanDerWaalsContact C-N 3.3Å; A137-S139 PolarHBondContact O-N 2.84Å; S139-K143 VanDerWaalsContact O-CD 3.3Å; S139-K143 WeakPolarHBondContact O-CD 3.48Å; S139-K143 VanDerWaalsContact O-CG 3.23Å; S139-K143 WeakPolarHBondContact O-CG 3.29Å; S139-K143 PolarHBondContact O-N 2.97Å; S139-K143 PolarHBondContact OG-NZ 3.22Å
140I88.5Confident86.6Confident28 Ų2851.1 Ų51.114%0.14427%0.272CS..Hα-helixtrans-68.7-38.6176.7-70.2165000110.3N136 A137 C138 S142 K143 I145 Q149 A153N136-I140 WeakPolarHBondContact O-CG1 3.42Å; N136-I140 PolarHBondContact O-N 3.43Å; A137-I140 WeakPolarHBondContact O-CB 3.49Å; A137-I140 PolarHBondContact O-N 3.46Å; A137-I140 VanDerWaalsContact O-N 3.14Å; C138-I140 VanDerWaalsContact C-N 3.31Å; C138-I140 PolarHBondContact O-N 3.5Å; I140-S142 VanDerWaalsContact C-N 3.34Å; I140-S142 PolarHBondContact O-N 3.13Å; I140-K143 PolarHBondContact O-N 3Å; I140-I145 HydrophobicContact CB-CD1 4.43Å; I140-I145 HydrophobicContact CG1-CD1 4.32Å; I140-I145 HydrophobicContact CG2-CD1 4.15Å; I140-I145 HydrophobicContact CG2-CG2 4.39Å; I140-Q149 HydrophobicContact CG2-CB 4.48Å; I140-A153 HydrophobicContact CB-CB 4.24Å; I140-A153 HydrophobicContact CG2-CB 4Å
141L86.9Confident86.8Confident12 Ų1251.9 Ų51.96%0.06328%0.275CS..Hα-helixtrans-68.4-30.6178.3-59.6-177.6000113.4A137 C138 K143 K150 A153 I154 L157 A178 I179A137-L141 WeakPolarHBondContact O-CG 3.29Å; A137-L141 PolarHBondContact O-N 3.08Å; C138-L141 PolarHBondContact O-N 2.99Å; L141-K143 VanDerWaalsContact C-N 3.33Å; L141-K150 HydrophobicContact CD2-CB 4.2Å; L141-A153 HydrophobicContact CD2-CB 4.04Å; L141-A153 HydrophobicContact CG-CB 4.45Å; L141-I154 HydrophobicContact CD1-CG1 4.21Å; L141-I154 HydrophobicContact CD2-CD1 4.23Å; L141-I154 HydrophobicContact CD2-CG1 3.69Å; L141-L157 HydrophobicContact CD1-CD1 3.76Å; L141-A178 HydrophobicContact CB-CB 4.32Å; L141-A178 HydrophobicContact CD1-CB 4.33Å; L141-I179 HydrophobicContact CD1-CD1 4.29Å
142S82.8Confident86.8Confident85 Ų8550.6 Ų50.659%0.59427%0.269SS*.THydrogen-bonded Turntrans-78.5-14.1174.4-51.80000114C138 I140C138-S142 PolarHBondContact O-N 2.93Å; C138-S142 PolarHBondContact O-OG 3.2Å; I140-S142 VanDerWaalsContact C-N 3.34Å; I140-S142 PolarHBondContact O-N 3.13Å
143K81.8Confident86.9Confident112 Ų11244.8 Ų44.849%0.48724%0.242SC..SBendtrans-99.2152.5-177.1-72.8166.6-173.6160.70111.5S139 I140 L141 I145S139-K143 VanDerWaalsContact O-CD 3.3Å; S139-K143 WeakPolarHBondContact O-CD 3.48Å; S139-K143 VanDerWaalsContact O-CG 3.23Å; S139-K143 WeakPolarHBondContact O-CG 3.29Å; S139-K143 PolarHBondContact O-N 2.97Å; S139-K143 PolarHBondContact OG-NZ 3.22Å; I140-K143 PolarHBondContact O-N 3Å; L141-K143 VanDerWaalsContact C-N 3.33Å; K143-I145 HydrophobicContact CB-CD1 3.62Å; K143-I145 HydrophobicContact CB-CG1 3.81Å; K143-I145 HydrophobicContact CD-CD1 3.96Å; K143-I145 HydrophobicContact CG-CD1 4.46Å; K143-I145 PolarHBondContact O-N 3.42Å
144D73.3Confident87.2Confident118 Ų11843.9 Ų43.963%0.63124%0.238SC*.  trans-81.462.6178.9-77-31.4000112.9R317D144-R317 VanDerWaalsContact CG-CZ 3.48Å; D144-R317 IonicContact OD1-CZ 3Å; D144-R317 IonicContact OD1-NH1 2.66Å; D144-R317 PolarHBondContact OD1-NH1 2.64Å; D144-R317 IonicContact OD1-NH2 2.79Å; D144-R317 PolarHBondContact OD1-NH2 3.25Å; D144-R317 IonicContact OD2-CZ 3.31Å; D144-R317 VanDerWaalsContact OD2-CZ 3.31Å; D144-R317 IonicContact OD2-NH1 3.78Å; D144-R317 IonicContact OD2-NH2 2.69Å; D144-R317 PolarHBondContact OD2-NH2 3.4Å
145I80.9Confident87.2Confident46 Ų4644 Ų4424%0.23624%0.238CC..  trans-98.1160.8-175.7-71.6173.1000110.8I140 K143 Q149 K150I140-I145 HydrophobicContact CB-CD1 4.43Å; I140-I145 HydrophobicContact CG1-CD1 4.32Å; I140-I145 HydrophobicContact CG2-CD1 4.15Å; I140-I145 HydrophobicContact CG2-CG2 4.39Å; K143-I145 HydrophobicContact CB-CD1 3.62Å; K143-I145 HydrophobicContact CB-CG1 3.81Å; K143-I145 HydrophobicContact CD-CD1 3.96Å; K143-I145 HydrophobicContact CG-CD1 4.46Å; K143-I145 PolarHBondContact O-N 3.42Å; I145-Q149 HydrophobicContact CG2-CB 3.61Å; I145-Q149 HydrophobicContact CG2-CG 4.24Å; I145-K150 WeakPolarHBondContact O-CE 3.43Å; I145-K150 PolarHBondContact O-NZ 3.05Å
146S84.8Confident87.1Confident68 Ų6839.2 Ų39.248%0.47622%0.218SC..  trans-50.4138.7173.259.80000113.4A148 Q149 K150S146-A148 VanDerWaalsContact C-N 3.28Å; S146-A148 PolarHBondContact O-N 2.87Å; S146-Q149 PolarHBondContact O-N 3.4Å; S146-Q149 VanDerWaalsContact O-N 3.08Å; S146-Q149 WeakPolarHBondContact OG-CG 3.41Å; S146-K150 PolarHBondContact O-N 3.24Å
147D85Confident87.2Confident62 Ų6235.9 Ų35.933%0.33220%0.2SC..Hα-helixtrans-55.7-37-176.5-67.8-4.1000114Q149 K150 H151 N187D147-Q149 PolarHBondContact O-N 3.37Å; D147-K150 CarbonylContact O-C 3.6Å; D147-K150 WeakPolarHBondContact O-CB 2.96Å; D147-K150 PolarHBondContact O-N 3.37Å; D147-K150 VanDerWaalsContact O-N 3.11Å; D147-K150 IonicContact OD1-NZ 2.73Å; D147-H151 PolarHBondContact O-CD2 2.9Å; D147-H151 VanDerWaalsContact O-CD2 3.27Å; D147-H151 VanDerWaalsContact O-CG 3.23Å; D147-H151 PolarHBondContact O-N 3.09Å; D147-N187 PolarHBondContact OD2-ND2 3.24Å
148A85.8Confident87.2Confident21 Ų2136.6 Ų36.617%0.17420%0.202CC..Hα-helixtrans-59.8-42.7177.900000112.6V104 S146 K150 H151 F152V104-A148 HydrophobicContact CG1-CB 4.04Å; V104-A148 WeakPolarHBondContact CG1-O 3.46Å; S146-A148 VanDerWaalsContact C-N 3.28Å; S146-A148 PolarHBondContact O-N 2.87Å; A148-K150 VanDerWaalsContact C-N 3.34Å; A148-K150 PolarHBondContact O-N 3.36Å; A148-H151 PolarHBondContact O-N 3.17Å; A148-F152 PolarHBondContact O-N 3.48Å
149Q88Confident86.9Confident79 Ų7936.4 Ų36.437%0.36920%0.2SC..Hα-helixtrans-68-32.6175.6-68.3-175.92.400112.2V104 I140 I145 S146 D147 A153V104-Q149 HydrophobicContact CB-CG 3.97Å; V104-Q149 HydrophobicContact CG2-CG 3.82Å; I140-Q149 HydrophobicContact CG2-CB 4.48Å; I145-Q149 HydrophobicContact CG2-CB 3.61Å; I145-Q149 HydrophobicContact CG2-CG 4.24Å; S146-Q149 PolarHBondContact O-N 3.4Å; S146-Q149 VanDerWaalsContact O-N 3.08Å; S146-Q149 WeakPolarHBondContact OG-CG 3.41Å; D147-Q149 PolarHBondContact O-N 3.37Å; Q149-A153 WeakPolarHBondContact O-CB 3.32Å; Q149-A153 PolarHBondContact O-N 3.23Å
150K89Confident86.9Confident13 Ų1334.6 Ų34.66%0.05719%0.187CC..Hα-helixtrans-66.5-42.5170.6-63.6175.1-178.2159.20111.4L141 I145 S146 D147 A148 A153 I154 D185 T190L141-K150 HydrophobicContact CD2-CB 4.2Å; I145-K150 WeakPolarHBondContact O-CE 3.43Å; I145-K150 PolarHBondContact O-NZ 3.05Å; S146-K150 PolarHBondContact O-N 3.24Å; D147-K150 CarbonylContact O-C 3.6Å; D147-K150 WeakPolarHBondContact O-CB 2.96Å; D147-K150 PolarHBondContact O-N 3.37Å; D147-K150 VanDerWaalsContact O-N 3.11Å; D147-K150 IonicContact OD1-NZ 2.73Å; A148-K150 VanDerWaalsContact C-N 3.34Å; A148-K150 PolarHBondContact O-N 3.36Å; K150-A153 PolarHBondContact O-N 2.91Å; K150-I154 VanDerWaalsContact O-CG1 3.26Å; K150-I154 WeakPolarHBondContact O-CG1 3.28Å; K150-I154 PolarHBondContact O-N 2.95Å; K150-D185 WeakPolarHBondContact CD-OD2 3.39Å; K150-D185 IonicContact NZ-OD1 3.61Å; K150-D185 IonicContact NZ-OD2 3.56Å; K150-D185 PolarHBondContact NZ-OD2 2.67Å; K150-T190 HydrophobicContact CB-CG2 4.36Å; K150-T190 HydrophobicContact CD-CG2 4.41Å
151H90Very high86.9Confident20 Ų2033.5 Ų33.59%0.09318%0.182CC..Hα-helixtrans-60.8-46.6176.2-60.7163.6000110.6L108 D147 A148 I154 L155 I189 T190 L193L108-H151 HydrophobicContact CD1-CB 4.38Å; D147-H151 PolarHBondContact O-CD2 2.9Å; D147-H151 VanDerWaalsContact O-CD2 3.27Å; D147-H151 VanDerWaalsContact O-CG 3.23Å; D147-H151 PolarHBondContact O-N 3.09Å; A148-H151 PolarHBondContact O-N 3.17Å; H151-I154 PolarHBondContact O-N 3.37Å; H151-L155 WeakPolarHBondContact O-CB 3.2Å; H151-L155 WeakPolarHBondContact O-CG 3.39Å; H151-L155 PolarHBondContact O-N 3.16Å; H151-I189 VanDerWaalsContact CE1-CG2 3.49Å; H151-I189 WeakPolarHBondContact CE1-CG2 3.24Å; H151-T190 PolarHBondContact CD2-OG1 2.82Å; H151-T190 PolarHBondContact NE2-OG1 3.22Å; H151-L193 HydrophobicContact CB-CD1 3.97Å
152F90.1Very high86.7Confident23 Ų2336 Ų3610%0.10120%0.195CC..Hα-helixtrans-56.9-50.7173.4-178.1-105.2000111.8L100 V104 T111 E114 I118 A148 I154 L155 T156L100-F152 HydrophobicContact CD2-CE1 4.29Å; L100-F152 HydrophobicContact CD2-CZ 4.34Å; V104-F152 HydrophobicContact CG1-CB 3.88Å; V104-F152 HydrophobicContact CG1-CG 4.45Å; T111-F152 HydrophobicContact CG2-CB 3.75Å; T111-F152 HydrophobicContact CG2-CD2 3.87Å; T111-F152 HydrophobicContact CG2-CG 4.32Å; E114-F152 HydrophobicContact CB-CE2 4.02Å; I118-F152 HydrophobicContact CD1-CE2 4.08Å; I118-F152 HydrophobicContact CD1-CZ 3.57Å; A148-F152 PolarHBondContact O-N 3.48Å; F152-I154 PolarHBondContact O-N 3.06Å; F152-L155 PolarHBondContact O-N 3.45Å; F152-L155 VanDerWaalsContact O-N 3.1Å; F152-T156 HydrophobicContact CD1-CG2 4.26Å; F152-T156 HydrophobicContact CD2-CG2 4.37Å; F152-T156 HydrophobicContact CE1-CG2 3.92Å; F152-T156 HydrophobicContact CE2-CG2 4.04Å; F152-T156 HydrophobicContact CG-CG2 4.49Å; F152-T156 HydrophobicContact CZ-CG2 3.81Å; F152-T156 PolarHBondContact O-N 3.16Å; F152-T156 PolarHBondContact O-OG1 3.05Å
153A91.5Very high86.6Confident1 Ų134 Ų341%0.00818%0.176CC..Hα-helixtrans-60.1-41.517900000113.5A137 I140 L141 Q149 K150 L155 T156 L157A137-A153 HydrophobicContact CB-CB 4.05Å; I140-A153 HydrophobicContact CB-CB 4.24Å; I140-A153 HydrophobicContact CG2-CB 4Å; L141-A153 HydrophobicContact CD2-CB 4.04Å; L141-A153 HydrophobicContact CG-CB 4.45Å; Q149-A153 WeakPolarHBondContact O-CB 3.32Å; Q149-A153 PolarHBondContact O-N 3.23Å; K150-A153 PolarHBondContact O-N 2.91Å; A153-L155 VanDerWaalsContact C-N 3.33Å; A153-T156 WeakPolarHBondContact CA-OG1 3.43Å; A153-T156 PolarHBondContact O-OG1 3.01Å; A153-L157 WeakPolarHBondContact O-CB 3.32Å; A153-L157 WeakPolarHBondContact O-CD1 3.41Å; A153-L157 WeakPolarHBondContact O-CG 3.35Å; A153-L157 PolarHBondContact O-N 3.47Å
154I92.4Very high86.7Confident1 Ų129.1 Ų29.11%0.00516%0.156CC..Hα-helixtrans-63.4-41174.6-67.7164.9000110.7L141 K150 H151 F152 R158 I179 A182 T190 L193 A194 A197L141-I154 HydrophobicContact CD1-CG1 4.21Å; L141-I154 HydrophobicContact CD2-CD1 4.23Å; L141-I154 HydrophobicContact CD2-CG1 3.69Å; K150-I154 VanDerWaalsContact O-CG1 3.26Å; K150-I154 WeakPolarHBondContact O-CG1 3.28Å; K150-I154 PolarHBondContact O-N 2.95Å; H151-I154 PolarHBondContact O-N 3.37Å; F152-I154 PolarHBondContact O-N 3.06Å; I154-R158 WeakPolarHBondContact O-CB 3.32Å; I154-R158 PolarHBondContact O-N 2.87Å; I154-I179 HydrophobicContact CG1-CD1 4.36Å; I154-A182 HydrophobicContact CD1-CB 4.26Å; I154-T190 HydrophobicContact CD1-CG2 3.63Å; I154-L193 HydrophobicContact CG2-CB 3.93Å; I154-L193 WeakPolarHBondContact CG2-O 3.23Å; I154-A194 HydrophobicContact CD1-CB 4.2Å; I154-A197 HydrophobicContact CG2-CB 3.96Å
155L90Very high87.2Confident2 Ų225.7 Ų25.71%0.0114%0.14CC..Hα-helixtrans-71.1-41.8-179.5-68.8172.9000112.2L108 T111 A112 A115 H151 F152 A153 L157 R158 E159 L193 V376L108-L155 HydrophobicContact CD1-CD1 3.91Å; T111-L155 HydrophobicContact CG2-CD1 4.02Å; A112-L155 HydrophobicContact CB-CD1 4.37Å; A115-L155 HydrophobicContact CB-CB 3.63Å; H151-L155 WeakPolarHBondContact O-CB 3.2Å; H151-L155 WeakPolarHBondContact O-CG 3.39Å; H151-L155 PolarHBondContact O-N 3.16Å; F152-L155 PolarHBondContact O-N 3.45Å; F152-L155 VanDerWaalsContact O-N 3.1Å; A153-L155 VanDerWaalsContact C-N 3.33Å; L155-L157 VanDerWaalsContact C-N 3.34Å; L155-L157 PolarHBondContact O-N 3.26Å; L155-R158 WeakPolarHBondContact O-CB 3.2Å; L155-R158 PolarHBondContact O-N 3.05Å; L155-E159 WeakPolarHBondContact O-CG 3.39Å; L155-E159 PolarHBondContact O-N 2.98Å; L155-L193 HydrophobicContact CD2-CD2 4.29Å; L155-V376 HydrophobicContact CD1-CG2 4.11Å; L155-V376 HydrophobicContact CD2-CB 4.39Å; L155-V376 HydrophobicContact CD2-CG1 3.44Å; L155-V376 VanDerWaalsContact CD2-CG1 3.44Å; L155-V376 HydrophobicContact CD2-CG2 4.02Å
156T89.6Confident87.4Confident9 Ų928.7 Ų28.76%0.05516%0.161CC..Hα-helixtrans-62.2-41.817452.50000111.4A115 I118 F152 A153 R158 E159 F160A115-T156 HydrophobicContact CB-CG2 4.01Å; I118-T156 HydrophobicContact CD1-CG2 4.42Å; F152-T156 HydrophobicContact CD1-CG2 4.26Å; F152-T156 HydrophobicContact CD2-CG2 4.37Å; F152-T156 HydrophobicContact CE1-CG2 3.92Å; F152-T156 HydrophobicContact CE2-CG2 4.04Å; F152-T156 HydrophobicContact CG-CG2 4.49Å; F152-T156 HydrophobicContact CZ-CG2 3.81Å; F152-T156 PolarHBondContact O-N 3.16Å; F152-T156 PolarHBondContact O-OG1 3.05Å; A153-T156 WeakPolarHBondContact CA-OG1 3.43Å; A153-T156 PolarHBondContact O-OG1 3.01Å; T156-R158 PolarHBondContact O-N 3.07Å; T156-E159 PolarHBondContact O-N 2.94Å; T156-F160 WeakPolarHBondContact O-CD2 3.41Å; T156-F160 VanDerWaalsContact O-CG 3.32Å; T156-F160 WeakPolarHBondContact O-CG 3.42Å; T156-F160 PolarHBondContact O-N 2.93Å
157L92Very high87.3Confident0 Ų026.6 Ų26.60%015%0.146CC..Hα-helixtrans-61-44.4173.8-71.3165.8000111.6T134 A137 L141 A153 L155 E159 F160 I161 F168 F175T134-L157 HydrophobicContact CG2-CD2 3.89Å; A137-L157 HydrophobicContact CB-CD1 3.98Å; A137-L157 HydrophobicContact CB-CD2 4Å; A137-L157 HydrophobicContact CB-CG 3.77Å; L141-L157 HydrophobicContact CD1-CD1 3.76Å; A153-L157 WeakPolarHBondContact O-CB 3.32Å; A153-L157 WeakPolarHBondContact O-CD1 3.41Å; A153-L157 WeakPolarHBondContact O-CG 3.35Å; A153-L157 PolarHBondContact O-N 3.47Å; L155-L157 VanDerWaalsContact C-N 3.34Å; L155-L157 PolarHBondContact O-N 3.26Å; L157-E159 PolarHBondContact O-N 3.29Å; L157-F160 PolarHBondContact O-N 3.28Å; L157-I161 WeakPolarHBondContact O-CD1 3.29Å; L157-I161 VanDerWaalsContact O-CG1 3.25Å; L157-I161 WeakPolarHBondContact O-CG1 3.34Å; L157-I161 PolarHBondContact O-N 3.49Å; L157-F168 HydrophobicContact CD2-CE2 3.9Å; L157-F175 HydrophobicContact CB-CE2 4.31Å; L157-F175 HydrophobicContact CD1-CD2 4.21Å; L157-F175 HydrophobicContact CD1-CE2 4.38Å; L157-F175 HydrophobicContact CD2-CD2 4.47Å
158R89.2Confident87.4Confident20 Ų2023.6 Ų23.68%0.07513%0.13CC..Hα-helixtrans-58.5-46.3175.4176.2-177.6152.8-86.6-34.5112I154 L155 T156 I161 L162 A197I154-R158 WeakPolarHBondContact O-CB 3.32Å; I154-R158 PolarHBondContact O-N 2.87Å; L155-R158 WeakPolarHBondContact O-CB 3.2Å; L155-R158 PolarHBondContact O-N 3.05Å; T156-R158 PolarHBondContact O-N 3.07Å; R158-I161 WeakPolarHBondContact O-CB 3.5Å; R158-I161 PolarHBondContact O-N 2.81Å; R158-L162 HydrophobicContact CG-CD1 4.26Å; R158-L162 VanDerWaalsContact NH2-CD1 3.3Å; R158-L162 WeakPolarHBondContact O-CG 3.38Å; R158-L162 PolarHBondContact O-N 3.28Å; R158-A197 HydrophobicContact CB-CB 4.18Å
159E84.9Confident87.3Confident6 Ų623.2 Ų23.23%0.02813%0.126CC..Hα-helixtrans-73-33.1-178.1-59.3-61.6176.500111.9A115 R116 L155 T156 L157 I161 L162 H163A115-E159 HydrophobicContact CB-CG 4.37Å; R116-E159 HydrophobicContact CG-CG 4.03Å; R116-E159 WeakPolarHBondContact CG-OE1 3.24Å; R116-E159 IonicContact NE-OE1 2.9Å; L155-E159 WeakPolarHBondContact O-CG 3.39Å; L155-E159 PolarHBondContact O-N 2.98Å; T156-E159 PolarHBondContact O-N 2.94Å; L157-E159 PolarHBondContact O-N 3.29Å; E159-I161 VanDerWaalsContact C-N 3.34Å; E159-I161 PolarHBondContact O-N 3.21Å; E159-L162 PolarHBondContact O-N 3.3Å; E159-L162 WeakPolarHBondContact OE2-CD1 3.23Å; E159-H163 WeakPolarHBondContact O-CB 3.36Å; E159-H163 PolarHBondContact O-CD2 2.7Å; E159-H163 PolarHBondContact O-N 3.45Å
160F88.8Confident87.2Confident0 Ų026.2 Ų26.20%014%0.14CC..Hα-helixtrans-64.8-33.1169.6-67.7-39.8000113.4I118 I130 Q133 T156 L157 L162 T164 F168I118-F160 HydrophobicContact CG2-CE1 3.89Å; I118-F160 HydrophobicContact CG2-CZ 3.62Å; I130-F160 HydrophobicContact CG2-CD1 4.42Å; I130-F160 HydrophobicContact CG2-CG 4.44Å; Q133-F160 HydrophobicContact CB-CE2 3.69Å; Q133-F160 HydrophobicContact CB-CZ 3.83Å; Q133-F160 HydrophobicContact CG-CZ 4.4Å; T156-F160 WeakPolarHBondContact O-CD2 3.41Å; T156-F160 VanDerWaalsContact O-CG 3.32Å; T156-F160 WeakPolarHBondContact O-CG 3.42Å; T156-F160 PolarHBondContact O-N 2.93Å; L157-F160 PolarHBondContact O-N 3.28Å; F160-L162 VanDerWaalsContact C-N 3.31Å; F160-T164 WeakPolarHBondContact CA-OG1 3.43Å; F160-T164 CarbonylContact O-C 3.2Å; F160-T164 VanDerWaalsContact O-CA 3.29Å; F160-T164 WeakPolarHBondContact O-CA 3.22Å; F160-T164 PolarHBondContact O-N 2.88Å; F160-T164 PolarHBondContact O-OG1 3.4Å; F160-F168 HydrophobicContact CB-CD2 4.31Å
161I88.1Confident87.1Confident6 Ų626.6 Ų26.63%0.03114%0.142CC..Hα-helixtrans-64-38.4172-68.2158.7000111.2L157 R158 E159 F168 F175 C200 A201 L204L157-I161 WeakPolarHBondContact O-CD1 3.29Å; L157-I161 VanDerWaalsContact O-CG1 3.25Å; L157-I161 WeakPolarHBondContact O-CG1 3.34Å; L157-I161 PolarHBondContact O-N 3.49Å; R158-I161 WeakPolarHBondContact O-CB 3.5Å; R158-I161 PolarHBondContact O-N 2.81Å; E159-I161 VanDerWaalsContact C-N 3.34Å; E159-I161 PolarHBondContact O-N 3.21Å; I161-F168 HydrophobicContact CD1-CD1 4.47Å; I161-F168 HydrophobicContact CD1-CE1 3.81Å; I161-F168 HydrophobicContact CD1-CE2 4.14Å; I161-F168 HydrophobicContact CD1-CZ 3.61Å; I161-F168 HydrophobicContact CG1-CD1 3.54Å; I161-F168 HydrophobicContact CG1-CD2 3.84Å; I161-F168 HydrophobicContact CG1-CE1 3.38Å; I161-F168 HydrophobicContact CG1-CE2 3.66Å; I161-F168 HydrophobicContact CG1-CG 3.77Å; I161-F168 HydrophobicContact CG1-CZ 3.41Å; I161-F168 VanDerWaalsContact CG1-CZ 3.41Å; I161-F175 HydrophobicContact CD1-CE2 4.27Å; I161-F175 HydrophobicContact CD1-CZ 4.08Å; I161-C200 HydrophobicContact CB-CB 4.28Å; I161-C200 HydrophobicContact CD1-CB 4.4Å; I161-C200 HydrophobicContact CG2-CB 3.67Å; I161-C200 WeakPolarHBondContact CG2-O 3.45Å; I161-A201 HydrophobicContact CD1-CB 4.08Å; I161-L204 HydrophobicContact CG2-CB 4.42Å; I161-L204 HydrophobicContact CG2-CD2 3.95Å
162L83.1Confident87Confident65 Ų6525.7 Ų25.734%0.3414%0.138SC..Hα-helixtrans-79-47.5-176.2-69.6171.4000112.6R158 E159 F160R158-L162 HydrophobicContact CG-CD1 4.26Å; R158-L162 VanDerWaalsContact NH2-CD1 3.3Å; R158-L162 WeakPolarHBondContact O-CG 3.38Å; R158-L162 PolarHBondContact O-N 3.28Å; E159-L162 PolarHBondContact O-N 3.3Å; E159-L162 WeakPolarHBondContact OE2-CD1 3.23Å; F160-L162 VanDerWaalsContact C-N 3.31Å
163H80.5Confident86.8Confident42 Ų4226.1 Ų26.119%0.19415%0.148CC..Hα-helixtrans-83.3-42.4-178.2-71-76.8000112.8G119 Q120 L123 E159 P165G119-H163 VanDerWaalsContact O-CB 3.25Å; G119-H163 WeakPolarHBondContact O-CB 3.5Å; Q120-H163 WeakPolarHBondContact CG-CE1 3.08Å; L123-H163 HydrophobicContact CD2-CB 4.29Å; L123-H163 WeakPolarHBondContact CD2-O 3.4Å; L123-H163 HydrophobicContact CG-CB 4.18Å; E159-H163 WeakPolarHBondContact O-CB 3.36Å; E159-H163 PolarHBondContact O-CD2 2.7Å; E159-H163 PolarHBondContact O-N 3.45Å; H163-P165 WeakPolarHBondContact O-CD 3.49Å
164T82.8Confident86.6Confident10 Ų1028.5 Ų28.56%0.06117%0.165CC..  trans-117.953.8-172.655.20000113.8G122 L123 I130 F160 T166 S167 F168G122-T164 WeakPolarHBondContact O-CG2 3.07Å; L123-T164 HydrophobicContact CD2-CG2 4.3Å; I130-T164 HydrophobicContact CD1-CG2 3.78Å; F160-T164 WeakPolarHBondContact CA-OG1 3.43Å; F160-T164 CarbonylContact O-C 3.2Å; F160-T164 VanDerWaalsContact O-CA 3.29Å; F160-T164 WeakPolarHBondContact O-CA 3.22Å; F160-T164 PolarHBondContact O-N 2.88Å; F160-T164 PolarHBondContact O-OG1 3.4Å; T164-T166 PolarHBondContact O-N 2.93Å; T164-T166 VanDerWaalsContact O-N 3.14Å; T164-S167 PolarHBondContact O-N 3.22Å; T164-F168 PolarHBondContact O-N 3.4Å; T164-F168 VanDerWaalsContact O-N 3.14Å
165P84.9Confident86.5Confident45 Ų4528.4 Ų28.429%0.29216%0.164SC..Hα-helixtrans-65.9-19.5-172.527.3-36.3000114.4H163 C169 L204 R208H163-P165 WeakPolarHBondContact O-CD 3.49Å; P165-C169 PolarHBondContact O-SG 3.34Å; P165-L204 HydrophobicContact CB-CD1 3.56Å; P165-L204 HydrophobicContact CB-CD2 3.71Å; P165-L204 HydrophobicContact CB-CG 4.3Å; P165-R208 PolarHBondContact O-NH2 3.43Å
166T84.4Confident86.5Confident110 Ų11028.6 Ų28.668%0.67517%0.165SC*.Hα-helixtrans-71.1-54.9176.6-56.20000110.2T164 R208T164-T166 PolarHBondContact O-N 2.93Å; T164-T166 VanDerWaalsContact O-N 3.14Å; T166-R208 PolarHBondContact O-NH2 2.83Å
167S84.2Confident86.4Confident23 Ų2332.5 Ų32.516%0.16119%0.189CC..Hα-helixtrans-60.8-50.4-178.8-48.30000112T164 C169 Q170T164-S167 PolarHBondContact O-N 3.22Å; S167-C169 VanDerWaalsContact C-N 3.33Å; S167-C169 PolarHBondContact O-N 3.49Å; S167-Q170 PolarHBondContact O-N 3.35Å
168F86.2Confident86.2Confident0 Ų032.7 Ų32.70%019%0.191CC..Hα-helixtrans-57.6-39.7-171.8-177.9-90.4000114.1T134 L157 F160 I161 T164 Q170 H171 M172 F175T134-F168 HydrophobicContact CG2-CD2 4.36Å; T134-F168 HydrophobicContact CG2-CE2 4.2Å; L157-F168 HydrophobicContact CD2-CE2 3.9Å; F160-F168 HydrophobicContact CB-CD2 4.31Å; I161-F168 HydrophobicContact CD1-CD1 4.47Å; I161-F168 HydrophobicContact CD1-CE1 3.81Å; I161-F168 HydrophobicContact CD1-CE2 4.14Å; I161-F168 HydrophobicContact CD1-CZ 3.61Å; I161-F168 HydrophobicContact CG1-CD1 3.54Å; I161-F168 HydrophobicContact CG1-CD2 3.84Å; I161-F168 HydrophobicContact CG1-CE1 3.38Å; I161-F168 HydrophobicContact CG1-CE2 3.66Å; I161-F168 HydrophobicContact CG1-CG 3.77Å; I161-F168 HydrophobicContact CG1-CZ 3.41Å; I161-F168 VanDerWaalsContact CG1-CZ 3.41Å; T164-F168 PolarHBondContact O-N 3.4Å; T164-F168 VanDerWaalsContact O-N 3.14Å; F168-Q170 PolarHBondContact O-N 3.32Å; F168-Q170 VanDerWaalsContact O-N 3.09Å; F168-H171 PolarHBondContact O-N 3.47Å; F168-M172 HydrophobicContact CD1-CE 4.21Å; F168-M172 HydrophobicContact CE1-CE 3.98Å; F168-M172 HydrophobicContact CE1-SD 4.08Å; F168-F175 HydrophobicContact CE1-CB 4.3Å; F168-F175 HydrophobicContact CE1-CD1 4.24Å; F168-F175 HydrophobicContact CE1-CG 4.12Å; F168-F175 HydrophobicContact CE2-CD2 4.39Å; F168-F175 HydrophobicContact CZ-CB 3.76Å; F168-F175 HydrophobicContact CZ-CD1 4.03Å; F168-F175 AromaticContact CZ-CD2 3.64Å; F168-F175 HydrophobicContact CZ-CD2 3.64Å; F168-F175 HydrophobicContact CZ-CE2 4.22Å; F168-F175 AromaticContact CZ-CG 3.51Å; F168-F175 HydrophobicContact CZ-CG 3.51Å
169C83.7Confident86.4Confident13 Ų1331.7 Ų31.79%0.08819%0.187CC..G310 helixtrans-66.4-15.7-172.1-71.20000115.3P165 S167 H171 M172 L204 R208P165-C169 PolarHBondContact O-SG 3.34Å; S167-C169 VanDerWaalsContact C-N 3.33Å; S167-C169 PolarHBondContact O-N 3.49Å; C169-H171 PolarHBondContact O-N 2.9Å; C169-M172 WeakPolarHBondContact O-CB 3.04Å; C169-M172 PolarHBondContact O-N 2.88Å; C169-L204 WeakPolarHBondContact SG-CD2 3.29Å; C169-L204 VanDerWaalsContact SG-CG 3.52Å; C169-R208 VanDerWaalsContact CB-NH2 3.29Å; C169-R208 PolarHBondContact SG-NE 3.12Å; C169-R208 PolarHBondContact SG-NH2 3.46Å; C169-R208 VanDerWaalsContact SG-NH2 3.39Å
170Q86.2Confident86.5Confident142 Ų14232.7 Ų32.766%0.66419%0.192SC*.G310 helixtrans-63.5-28.3171.7-57.5-163.634.900111.1Y127 S167 F168Y127-Q170 PolarHBondContact OH-OE1 3.05Å; S167-Q170 PolarHBondContact O-N 3.35Å; F168-Q170 PolarHBondContact O-N 3.32Å; F168-Q170 VanDerWaalsContact O-N 3.09Å
171H87Confident86.4Confident20 Ų2035.1 Ų35.19%0.09321%0.209CC..G310 helixtrans-99.18.3-178.5-50.6-54.1000113.6Y127 E131 T134 F168 C169 G173 S174 F175Y127-H171 AromaticContact CZ-NE2 3.94Å; Y127-H171 PolarHBondContact OH-CE1 3.27Å; Y127-H171 PolarHBondContact OH-NE2 2.89Å; E131-H171 IonicContact OE1-CE1 3.54Å; E131-H171 PolarHBondContact OE1-CE1 3.49Å; E131-H171 VanDerWaalsContact OE1-CE1 3.3Å; T134-H171 HydrophobicContact CG2-CB 3.89Å; F168-H171 PolarHBondContact O-N 3.47Å; C169-H171 PolarHBondContact O-N 2.9Å; H171-G173 VanDerWaalsContact C-N 3.31Å; H171-G173 PolarHBondContact O-N 2.75Å; H171-S174 PolarHBondContact O-N 3.3Å; H171-S174 PolarHBondContact O-OG 3.11Å; H171-F175 PolarHBondContact O-N 2.79Å
172M86.8Confident86.4Confident2 Ų235 Ų351%0.0121%0.209CC..Hα-helixtrans-55.2-39.3-171.8-173.364.179.800113.7F168 C169 F175 I176 A201 W286F168-M172 HydrophobicContact CD1-CE 4.21Å; F168-M172 HydrophobicContact CE1-CE 3.98Å; F168-M172 HydrophobicContact CE1-SD 4.08Å; C169-M172 WeakPolarHBondContact O-CB 3.04Å; C169-M172 PolarHBondContact O-N 2.88Å; M172-F175 PolarHBondContact O-N 3.43Å; M172-F175 HydrophobicContact SD-CD1 3.9Å; M172-I176 HydrophobicContact CG-CD1 3.81Å; M172-I176 HydrophobicContact CG-CG1 4.45Å; M172-I176 WeakPolarHBondContact O-CG1 3.43Å; M172-I176 PolarHBondContact O-N 3.05Å; M172-I176 HydrophobicContact SD-CD1 4.21Å; M172-I176 HydrophobicContact SD-CG1 4.35Å; M172-A201 HydrophobicContact CE-CB 4.05Å; M172-A201 HydrophobicContact SD-CB 3.98Å; M172-W286 HydrophobicContact CB-CH2 3.77Å; M172-W286 HydrophobicContact CB-CZ2 3.8Å; M172-W286 HydrophobicContact CB-CZ3 4.2Å; M172-W286 HydrophobicContact CG-CD2 3.87Å; M172-W286 HydrophobicContact CG-CE3 3.69Å; M172-W286 HydrophobicContact CG-CH2 3.71Å; M172-W286 HydrophobicContact CG-CZ2 3.86Å; M172-W286 HydrophobicContact CG-CZ3 3.62Å
173G86Confident86.7Confident31 Ų3131.9 Ų31.932%0.3219%0.193SC..Hα-helixtrans-64.6-39.9176.200000113.5H171 I176 T177H171-G173 VanDerWaalsContact C-N 3.31Å; H171-G173 PolarHBondContact O-N 2.75Å; G173-I176 PolarHBondContact O-N 3.5Å; G173-T177 PolarHBondContact O-N 3.22Å; G173-T177 PolarHBondContact O-OG1 3.48Å
174S87.2Confident86.9Confident51 Ų5131.6 Ų31.636%0.35719%0.19SC..Hα-helixtrans-69.6-33.2174.172.20000112.4H171 T177 A178H171-S174 PolarHBondContact O-N 3.3Å; H171-S174 PolarHBondContact O-OG 3.11Å; S174-T177 WeakPolarHBondContact CA-OG1 3.25Å; S174-T177 PolarHBondContact O-OG1 3.35Å; S174-T177 VanDerWaalsContact O-OG1 3.06Å; S174-A178 VanDerWaalsContact O-CB 3.28Å; S174-A178 WeakPolarHBondContact O-CB 3.07Å; S174-A178 PolarHBondContact O-N 3.47Å; S174-A178 VanDerWaalsContact O-N 3.12Å
175F91Very high87.1Confident0 Ų032 Ų320%019%0.192CC..Hα-helixtrans-66.9-45.9173.6167.6-101.3000111.8L157 I161 F168 H171 M172 T177 A178 I179 A197 L198 A201L157-F175 HydrophobicContact CB-CE2 4.31Å; L157-F175 HydrophobicContact CD1-CD2 4.21Å; L157-F175 HydrophobicContact CD1-CE2 4.38Å; L157-F175 HydrophobicContact CD2-CD2 4.47Å; I161-F175 HydrophobicContact CD1-CE2 4.27Å; I161-F175 HydrophobicContact CD1-CZ 4.08Å; F168-F175 HydrophobicContact CE1-CB 4.3Å; F168-F175 HydrophobicContact CE1-CD1 4.24Å; F168-F175 HydrophobicContact CE1-CG 4.12Å; F168-F175 HydrophobicContact CE2-CD2 4.39Å; F168-F175 HydrophobicContact CZ-CB 3.76Å; F168-F175 HydrophobicContact CZ-CD1 4.03Å; F168-F175 AromaticContact CZ-CD2 3.64Å; F168-F175 HydrophobicContact CZ-CD2 3.64Å; F168-F175 HydrophobicContact CZ-CE2 4.22Å; F168-F175 AromaticContact CZ-CG 3.51Å; F168-F175 HydrophobicContact CZ-CG 3.51Å; H171-F175 PolarHBondContact O-N 2.79Å; M172-F175 PolarHBondContact O-N 3.43Å; M172-F175 HydrophobicContact SD-CD1 3.9Å; F175-T177 PolarHBondContact O-N 2.95Å; F175-A178 PolarHBondContact O-N 3.27Å; F175-I179 HydrophobicContact CD1-CG2 4.47Å; F175-I179 HydrophobicContact CD2-CB 4.45Å; F175-I179 HydrophobicContact CE1-CB 4.33Å; F175-I179 HydrophobicContact CE1-CG2 4.01Å; F175-I179 HydrophobicContact CE2-CB 4.02Å; F175-I179 HydrophobicContact CE2-CD1 3.95Å; F175-I179 HydrophobicContact CE2-CG1 4.02Å; F175-I179 HydrophobicContact CZ-CB 3.95Å; F175-I179 HydrophobicContact CZ-CD1 4.2Å; F175-I179 HydrophobicContact CZ-CG1 3.83Å; F175-I179 HydrophobicContact CZ-CG2 4.09Å; F175-I179 WeakPolarHBondContact O-CB 3.25Å; F175-I179 WeakPolarHBondContact O-CG2 3.44Å; F175-I179 PolarHBondContact O-N 3.32Å; F175-A197 HydrophobicContact CE2-CB 4.36Å; F175-A197 HydrophobicContact CZ-CB 4.15Å; F175-L198 HydrophobicContact CE1-CD1 4.5Å; F175-A201 HydrophobicContact CD1-CB 4.08Å; F175-A201 HydrophobicContact CE1-CB 3.39Å; F175-A201 HydrophobicContact CZ-CB 4.1Å
176I89.3Confident87.1Confident6 Ų636.5 Ų36.53%0.03121%0.207CC..Hα-helixtrans-63.8-44.1-178-70.3161.2000111M172 G173 A178 I179 L180 W286M172-I176 HydrophobicContact CG-CD1 3.81Å; M172-I176 HydrophobicContact CG-CG1 4.45Å; M172-I176 WeakPolarHBondContact O-CG1 3.43Å; M172-I176 PolarHBondContact O-N 3.05Å; M172-I176 HydrophobicContact SD-CD1 4.21Å; M172-I176 HydrophobicContact SD-CG1 4.35Å; G173-I176 PolarHBondContact O-N 3.5Å; I176-A178 PolarHBondContact O-N 2.98Å; I176-I179 PolarHBondContact O-N 2.99Å; I176-L180 HydrophobicContact CG2-CD1 3.85Å; I176-L180 HydrophobicContact CG2-CG 4.34Å; I176-L180 WeakPolarHBondContact O-CB 3.36Å; I176-L180 WeakPolarHBondContact O-CG 3.41Å; I176-L180 PolarHBondContact O-N 2.88Å; I176-W286 HydrophobicContact CD1-CB 3.41Å; I176-W286 VanDerWaalsContact CD1-CB 3.41Å; I176-W286 HydrophobicContact CD1-CD2 3.8Å; I176-W286 HydrophobicContact CD1-CE3 4.48Å; I176-W286 HydrophobicContact CD1-CG 3.26Å
177T87.8Confident87.2Confident91 Ų9132.9 Ų32.956%0.55818%0.183SC*.Hα-helixtrans-62.7-42.7176.1460000112G173 S174 F175 S181G173-T177 PolarHBondContact O-N 3.22Å; G173-T177 PolarHBondContact O-OG1 3.48Å; S174-T177 WeakPolarHBondContact CA-OG1 3.25Å; S174-T177 PolarHBondContact O-OG1 3.35Å; S174-T177 VanDerWaalsContact O-OG1 3.06Å; F175-T177 PolarHBondContact O-N 2.95Å; T177-S181 PolarHBondContact O-N 3.4Å
178A89.1Confident87.3Confident3 Ų332.4 Ų32.43%0.02518%0.18CC..Hα-helixtrans-68.2-41.117600000113.6C138 L141 S174 F175 I176 S181 A182C138-A178 HydrophobicContact CB-CB 4.06Å; L141-A178 HydrophobicContact CB-CB 4.32Å; L141-A178 HydrophobicContact CD1-CB 4.33Å; S174-A178 VanDerWaalsContact O-CB 3.28Å; S174-A178 WeakPolarHBondContact O-CB 3.07Å; S174-A178 PolarHBondContact O-N 3.47Å; S174-A178 VanDerWaalsContact O-N 3.12Å; F175-A178 PolarHBondContact O-N 3.27Å; I176-A178 PolarHBondContact O-N 2.98Å; A178-S181 PolarHBondContact O-N 2.92Å; A178-S181 PolarHBondContact O-OG 3.39Å; A178-A182 PolarHBondContact O-N 3.42Å; A178-A182 VanDerWaalsContact O-N 3.12Å
179I91.6Very high87.3Confident0 Ų034 Ų340%019%0.188CC..Hα-helixtrans-74.1-32-177.6-151.865.4000111.9L141 I154 F175 I176 S181 A182 L183 A194 A197 L198L141-I179 HydrophobicContact CD1-CD1 4.29Å; I154-I179 HydrophobicContact CG1-CD1 4.36Å; F175-I179 HydrophobicContact CD1-CG2 4.47Å; F175-I179 HydrophobicContact CD2-CB 4.45Å; F175-I179 HydrophobicContact CE1-CB 4.33Å; F175-I179 HydrophobicContact CE1-CG2 4.01Å; F175-I179 HydrophobicContact CE2-CB 4.02Å; F175-I179 HydrophobicContact CE2-CD1 3.95Å; F175-I179 HydrophobicContact CE2-CG1 4.02Å; F175-I179 HydrophobicContact CZ-CB 3.95Å; F175-I179 HydrophobicContact CZ-CD1 4.2Å; F175-I179 HydrophobicContact CZ-CG1 3.83Å; F175-I179 HydrophobicContact CZ-CG2 4.09Å; F175-I179 WeakPolarHBondContact O-CB 3.25Å; F175-I179 WeakPolarHBondContact O-CG2 3.44Å; F175-I179 PolarHBondContact O-N 3.32Å; I176-I179 PolarHBondContact O-N 2.99Å; I179-S181 VanDerWaalsContact C-N 3.3Å; I179-S181 PolarHBondContact O-N 3.05Å; I179-A182 HydrophobicContact CD1-CB 4.4Å; I179-A182 PolarHBondContact O-N 2.91Å; I179-L183 WeakPolarHBondContact O-CG 3.24Å; I179-L183 PolarHBondContact O-N 3.44Å; I179-A194 HydrophobicContact CD1-CB 3.72Å; I179-A194 HydrophobicContact CG1-CB 4.01Å; I179-A197 HydrophobicContact CD1-CB 4.18Å; I179-L198 HydrophobicContact CG2-CD1 3.99Å
180L88.6Confident87.6Confident27 Ų2733.4 Ų33.414%0.14118%0.184CC..Hα-helixtrans-62.9-37.5170-72.6172.4000111I176 L183 R184 E293 I331I176-L180 HydrophobicContact CG2-CD1 3.85Å; I176-L180 HydrophobicContact CG2-CG 4.34Å; I176-L180 WeakPolarHBondContact O-CB 3.36Å; I176-L180 WeakPolarHBondContact O-CG 3.41Å; I176-L180 PolarHBondContact O-N 2.88Å; L180-L183 HydrophobicContact CD2-CD1 4.39Å; L180-L183 PolarHBondContact O-N 3.23Å; L180-R184 WeakPolarHBondContact O-CG 3.34Å; L180-R184 PolarHBondContact O-N 3.21Å; L180-E293 HydrophobicContact CD2-CG 4.27Å; L180-I331 HydrophobicContact CD2-CD1 3.83Å; L180-I331 HydrophobicContact CD2-CG1 4.46Å
181S86.8Confident87.8Confident50 Ų5026.8 Ų26.835%0.3515%0.153SC..Hα-helixtrans-66.2-37.5172.976.30000112.9T177 A178 I179 L183 R184T177-S181 PolarHBondContact O-N 3.4Å; A178-S181 PolarHBondContact O-N 2.92Å; A178-S181 PolarHBondContact O-OG 3.39Å; I179-S181 VanDerWaalsContact C-N 3.3Å; I179-S181 PolarHBondContact O-N 3.05Å; S181-L183 PolarHBondContact O-N 2.64Å; S181-R184 CarbonylContact O-C 3.58Å; S181-R184 PolarHBondContact O-N 2.9Å; S181-R184 VanDerWaalsContact O-N 3.1Å
182A87.7Confident87.8Confident4 Ų426.7 Ų26.73%0.03315%0.152CC..Hα-helixtrans-67.5-32.6174.200000113.2I154 A178 I179 R184 D185 T190 A194I154-A182 HydrophobicContact CD1-CB 4.26Å; A178-A182 PolarHBondContact O-N 3.42Å; A178-A182 VanDerWaalsContact O-N 3.12Å; I179-A182 HydrophobicContact CD1-CB 4.4Å; I179-A182 PolarHBondContact O-N 2.91Å; A182-R184 PolarHBondContact O-N 3.02Å; A182-D185 WeakPolarHBondContact O-CB 3.31Å; A182-D185 PolarHBondContact O-N 3.27Å; A182-T190 HydrophobicContact CB-CG2 4.41Å; A182-A194 HydrophobicContact CB-CB 4.02Å
183L88.2Confident87.9Confident0 Ų026.8 Ų26.80%015%0.153CC..Hα-helixtrans-69.9-13.6172-73.4162.7000113.3I179 L180 S181 R191 A194 L198 L330 I331I179-L183 WeakPolarHBondContact O-CG 3.24Å; I179-L183 PolarHBondContact O-N 3.44Å; L180-L183 HydrophobicContact CD2-CD1 4.39Å; L180-L183 PolarHBondContact O-N 3.23Å; S181-L183 PolarHBondContact O-N 2.64Å; L183-R191 WeakPolarHBondContact CD2-O 3.48Å; L183-A194 HydrophobicContact CD2-CB 3.95Å; L183-A194 HydrophobicContact CG-CB 3.93Å; L183-L198 HydrophobicContact CD1-CD2 4.02Å; L183-L330 HydrophobicContact CD2-CB 4.39Å; L183-L330 HydrophobicContact CD2-CD1 4.32Å; L183-I331 HydrophobicContact CD1-CD1 4.14Å; L183-I331 HydrophobicContact CD1-CG1 3.64Å
184R86.6Confident88.1Confident36 Ų3625.3 Ų25.314%0.13614%0.138CC..THydrogen-bonded Turntrans-100.113.8172-60.5-56.4-173.6-157.60.9113.3L180 S181 A182 E293 L319 W324 N328L180-R184 WeakPolarHBondContact O-CG 3.34Å; L180-R184 PolarHBondContact O-N 3.21Å; S181-R184 CarbonylContact O-C 3.58Å; S181-R184 PolarHBondContact O-N 2.9Å; S181-R184 VanDerWaalsContact O-N 3.1Å; A182-R184 PolarHBondContact O-N 3.02Å; R184-E293 IonicContact CZ-OE1 3.73Å; R184-E293 VanDerWaalsContact CZ-OE1 3.26Å; R184-E293 IonicContact NE-OE1 3.26Å; R184-E293 PolarHBondContact NE-OE1 3.15Å; R184-E293 PolarHBondContact NH2-O 2.96Å; R184-E293 IonicContact NH2-OE1 3.7Å; R184-E293 PolarHBondContact NH2-OE1 3.22Å; R184-L319 HydrophobicContact CB-CD1 4.08Å; R184-L319 VanDerWaalsContact O-CD1 3.31Å; R184-L319 WeakPolarHBondContact O-CD1 3.48Å; R184-L319 WeakPolarHBondContact O-CD2 3.19Å; R184-W324 HydrophobicContact CG-CZ3 4.38Å; R184-W324 PolarHBondContact NH1-O 2.94Å; R184-N328 PolarHBondContact NH1-OD1 3.36Å; R184-N328 PolarHBondContact NH2-OD1 2.84Å
185D85.4Confident88.2Confident19 Ų1922.9 Ų22.910%0.10212%0.121CC..SBendtrans-77.6157.9175.4-153.1-12.2000112.4K150 A182 T190 R191K150-D185 WeakPolarHBondContact CD-OD2 3.39Å; K150-D185 IonicContact NZ-OD1 3.61Å; K150-D185 IonicContact NZ-OD2 3.56Å; K150-D185 PolarHBondContact NZ-OD2 2.67Å; A182-D185 WeakPolarHBondContact O-CB 3.31Å; A182-D185 PolarHBondContact O-N 3.27Å; D185-T190 HydrophobicContact CB-CG2 4.14Å; D185-R191 WeakPolarHBondContact O-CD 3.27Å; D185-R191 PolarHBondContact O-NE 3.42Å; D185-R191 VanDerWaalsContact O-NE 3.1Å
186K85.9Confident88Confident139 Ų13923.6 Ų23.660%0.60413%0.125SC*.SBendtrans-69.8-35.6177.3-64.7179.7-179.2177.90111.9S188 R191 L319K186-S188 PolarHBondContact O-N 3.28Å; K186-R191 PolarHBondContact O-NH2 2.78Å; K186-L319 HydrophobicContact CG-CD2 4.49Å
187N86.6Confident88Confident34 Ų3423.3 Ų23.318%0.18212%0.124CC..  trans-71131.5-176.5-169.8-26000111.1D147 I189 R191D147-N187 PolarHBondContact OD2-ND2 3.24Å; N187-I189 VanDerWaalsContact C-N 3.34Å; N187-I189 WeakPolarHBondContact OD1-CB 3.47Å; N187-I189 PolarHBondContact OD1-N 3.01Å; N187-R191 WeakPolarHBondContact O-CG 3.25Å; N187-R191 PolarHBondContact O-N 3.48Å; N187-R191 PolarHBondContact O-NE 2.91Å
188S85.9Confident88.2Confident12 Ų1219 Ų198%0.08410%0.097CC..Hα-helixtrans-65.2-37.3175.9168.20000111.6K186 R191 E192 G369K186-S188 PolarHBondContact O-N 3.28Å; S188-R191 PolarHBondContact O-N 2.89Å; S188-E192 PolarHBondContact O-N 2.79Å; S188-G369 PolarHBondContact OG-N 3.15Å
189I87Confident88.1Confident34 Ų3421.9 Ų21.917%0.17411%0.108CC..Hα-helixtrans-63.6-49.3179.8-60.7169.7000111H151 N187 R191 E192 L193 E368 A372H151-I189 VanDerWaalsContact CE1-CG2 3.49Å; H151-I189 WeakPolarHBondContact CE1-CG2 3.24Å; N187-I189 VanDerWaalsContact C-N 3.34Å; N187-I189 WeakPolarHBondContact OD1-CB 3.47Å; N187-I189 PolarHBondContact OD1-N 3.01Å; I189-R191 VanDerWaalsContact C-N 3.27Å; I189-R191 PolarHBondContact O-N 3.35Å; I189-E192 PolarHBondContact O-N 3.1Å; I189-L193 HydrophobicContact CG2-CD1 3.67Å; I189-L193 HydrophobicContact CG2-CG 4.14Å; I189-L193 WeakPolarHBondContact O-CB 3.49Å; I189-L193 VanDerWaalsContact O-CG 3.28Å; I189-L193 WeakPolarHBondContact O-CG 3.25Å; I189-L193 PolarHBondContact O-N 3.29Å; I189-E368 HydrophobicContact CD1-CB 4.45Å; I189-E368 HydrophobicContact CG1-CB 4.31Å; I189-A372 HydrophobicContact CB-CB 4.17Å; I189-A372 HydrophobicContact CD1-CB 4.35Å; I189-A372 HydrophobicContact CG1-CB 3.87Å; I189-A372 HydrophobicContact CG2-CB 3.47Å; I189-A372 VanDerWaalsContact CG2-CB 3.47Å
190T89.2Confident87.9Confident0 Ų022.6 Ų22.60%011%0.113CC..Hα-helixtrans-56.7-43.3177.7-48.80000111.2K150 H151 I154 A182 D185 A194K150-T190 HydrophobicContact CB-CG2 4.36Å; K150-T190 HydrophobicContact CD-CG2 4.41Å; H151-T190 PolarHBondContact CD2-OG1 2.82Å; H151-T190 PolarHBondContact NE2-OG1 3.22Å; I154-T190 HydrophobicContact CD1-CG2 3.63Å; A182-T190 HydrophobicContact CB-CG2 4.41Å; D185-T190 HydrophobicContact CB-CG2 4.14Å; T190-A194 WeakPolarHBondContact O-CB 3.44Å; T190-A194 PolarHBondContact O-N 3.33Å
191R89.9Confident87.9Confident4 Ų421.4 Ų21.42%0.01511%0.106CC..Hα-helixtrans-65.3-47.3179.2-72.7178.6-78.5167.1-8.7112.8L183 D185 K186 N187 S188 I189 A194 G195 D323 L330L183-R191 WeakPolarHBondContact CD2-O 3.48Å; D185-R191 WeakPolarHBondContact O-CD 3.27Å; D185-R191 PolarHBondContact O-NE 3.42Å; D185-R191 VanDerWaalsContact O-NE 3.1Å; K186-R191 PolarHBondContact O-NH2 2.78Å; N187-R191 WeakPolarHBondContact O-CG 3.25Å; N187-R191 PolarHBondContact O-N 3.48Å; N187-R191 PolarHBondContact O-NE 2.91Å; S188-R191 PolarHBondContact O-N 2.89Å; I189-R191 VanDerWaalsContact C-N 3.27Å; I189-R191 PolarHBondContact O-N 3.35Å; R191-A194 PolarHBondContact O-N 3.04Å; R191-G195 PolarHBondContact O-N 2.9Å; R191-D323 IonicContact CZ-OD1 3.74Å; R191-D323 VanDerWaalsContact CZ-OD1 3.24Å; R191-D323 PolarHBondContact NH1-O 3.04Å; R191-D323 VanDerWaalsContact NH1-O 3.13Å; R191-D323 IonicContact NH1-OD1 3.72Å; R191-D323 PolarHBondContact NH1-OD1 3.01Å; R191-D323 IonicContact NH2-OD1 2.76Å; R191-D323 PolarHBondContact NH2-OD1 3.21Å; R191-L330 HydrophobicContact CB-CD1 4.12Å
192E87.1Confident88Confident17 Ų1719.1 Ų19.18%0.0799%0.09CC..Hα-helixtrans-68.9-39.7179.7-69.2-163.3-125.700112.1S188 I189 A194 G195 V196 L330 S367 G369 S370 V373S188-E192 PolarHBondContact O-N 2.79Å; I189-E192 PolarHBondContact O-N 3.1Å; E192-A194 VanDerWaalsContact C-N 3.35Å; E192-A194 PolarHBondContact O-N 3.03Å; E192-G195 PolarHBondContact O-N 3.23Å; E192-V196 PolarHBondContact O-N 3.09Å; E192-L330 HydrophobicContact CG-CD1 4.2Å; E192-S367 WeakPolarHBondContact OE1-CB 3.43Å; E192-S367 PolarHBondContact OE1-OG 3.47Å; E192-G369 VanDerWaalsContact OE1-C 3.23Å; E192-G369 VanDerWaalsContact OE1-CA 3.29Å; E192-G369 WeakPolarHBondContact OE1-CA 3.17Å; E192-S370 PolarHBondContact OE1-N 3.42Å; E192-S370 WeakPolarHBondContact OE2-CA 3.41Å; E192-S370 WeakPolarHBondContact OE2-CB 3.39Å; E192-S370 PolarHBondContact OE2-N 3.34Å; E192-S370 VanDerWaalsContact OE2-N 3.14Å; E192-V373 HydrophobicContact CB-CG2 3.71Å
193L88.2Confident87.8Confident4 Ų419.7 Ų19.72%0.0219%0.092CC..Hα-helixtrans-61.8-41.6172.7-67.8176.4000111.9L108 H151 I154 L155 I189 G195 V196 A197 V373 V376L108-L193 HydrophobicContact CD1-CD1 4Å; H151-L193 HydrophobicContact CB-CD1 3.97Å; I154-L193 HydrophobicContact CG2-CB 3.93Å; I154-L193 WeakPolarHBondContact CG2-O 3.23Å; L155-L193 HydrophobicContact CD2-CD2 4.29Å; I189-L193 HydrophobicContact CG2-CD1 3.67Å; I189-L193 HydrophobicContact CG2-CG 4.14Å; I189-L193 WeakPolarHBondContact O-CB 3.49Å; I189-L193 VanDerWaalsContact O-CG 3.28Å; I189-L193 WeakPolarHBondContact O-CG 3.25Å; I189-L193 PolarHBondContact O-N 3.29Å; L193-G195 VanDerWaalsContact C-N 3.31Å; L193-G195 PolarHBondContact O-N 3.37Å; L193-V196 PolarHBondContact O-N 2.96Å; L193-V196 VanDerWaalsContact O-N 3.14Å; L193-A197 PolarHBondContact O-N 3.48Å; L193-A197 VanDerWaalsContact O-N 3.07Å; L193-V373 HydrophobicContact CD2-CG2 3.99Å; L193-V376 HydrophobicContact CD2-CB 4.36Å; L193-V376 HydrophobicContact CD2-CG2 3.74Å
194A92Very high87.6Confident0 Ų020.5 Ų20.50%010%0.097CC..Hα-helixtrans-62.1-38.3176.500000112I154 I179 A182 L183 T190 R191 E192 V196 A197 L198I154-A194 HydrophobicContact CD1-CB 4.2Å; I179-A194 HydrophobicContact CD1-CB 3.72Å; I179-A194 HydrophobicContact CG1-CB 4.01Å; A182-A194 HydrophobicContact CB-CB 4.02Å; L183-A194 HydrophobicContact CD2-CB 3.95Å; L183-A194 HydrophobicContact CG-CB 3.93Å; T190-A194 WeakPolarHBondContact O-CB 3.44Å; T190-A194 PolarHBondContact O-N 3.33Å; R191-A194 PolarHBondContact O-N 3.04Å; E192-A194 VanDerWaalsContact C-N 3.35Å; E192-A194 PolarHBondContact O-N 3.03Å; A194-V196 PolarHBondContact O-N 2.83Å; A194-A197 PolarHBondContact O-N 2.87Å; A194-L198 WeakPolarHBondContact O-CB 3.42Å; A194-L198 PolarHBondContact O-N 3.38Å
195G89.5Confident87.6Confident1 Ų119 Ų191%0.019%0.091CC..Hα-helixtrans-60.1-39.8171.800000113.2R191 E192 L193 L198 R199R191-G195 PolarHBondContact O-N 2.9Å; E192-G195 PolarHBondContact O-N 3.23Å; L193-G195 VanDerWaalsContact C-N 3.31Å; L193-G195 PolarHBondContact O-N 3.37Å; G195-L198 PolarHBondContact O-N 3.25Å; G195-R199 PolarHBondContact O-N 3.44Å
196V85.8Confident87.6Confident14 Ų1418.1 Ų18.19%0.0859%0.087CC..Hα-helixtrans-67.8-39.8176-1750000111.8E192 L193 A194 R199 C200 V373E192-V196 PolarHBondContact O-N 3.09Å; L193-V196 PolarHBondContact O-N 2.96Å; L193-V196 VanDerWaalsContact O-N 3.14Å; A194-V196 PolarHBondContact O-N 2.83Å; V196-R199 WeakPolarHBondContact O-CB 3.45Å; V196-R199 PolarHBondContact O-N 2.85Å; V196-C200 PolarHBondContact O-N 3.14Å; V196-C200 PolarHBondContact O-SG 3.15Å; V196-V373 HydrophobicContact CG2-CB 4.36Å; V196-V373 HydrophobicContact CG2-CG1 3.64Å; V196-V373 HydrophobicContact CG2-CG2 3.74Å
197A89.9Confident87.4Confident0 Ų014.5 Ų14.50%07%0.071CC..Hα-helixtrans-63.5-42.2173.900000111.6I154 R158 F175 I179 L193 A194 R199 C200 A201I154-A197 HydrophobicContact CG2-CB 3.96Å; R158-A197 HydrophobicContact CB-CB 4.18Å; F175-A197 HydrophobicContact CE2-CB 4.36Å; F175-A197 HydrophobicContact CZ-CB 4.15Å; I179-A197 HydrophobicContact CD1-CB 4.18Å; L193-A197 PolarHBondContact O-N 3.48Å; L193-A197 VanDerWaalsContact O-N 3.07Å; A194-A197 PolarHBondContact O-N 2.87Å; A197-R199 PolarHBondContact O-N 3.44Å; A197-C200 PolarHBondContact O-N 2.99Å; A197-A201 PolarHBondContact O-N 3.48Å
198L91.5Very high87Confident0 Ų017.4 Ų17.40%08%0.08CC..Hα-helixtrans-61.1-41.7175.3-173.765000112F175 I179 L183 A194 G195 C200 A201 F202 E334F175-L198 HydrophobicContact CE1-CD1 4.5Å; I179-L198 HydrophobicContact CG2-CD1 3.99Å; L183-L198 HydrophobicContact CD1-CD2 4.02Å; A194-L198 WeakPolarHBondContact O-CB 3.42Å; A194-L198 PolarHBondContact O-N 3.38Å; G195-L198 PolarHBondContact O-N 3.25Å; L198-C200 PolarHBondContact O-N 2.77Å; L198-A201 PolarHBondContact O-N 3.31Å; L198-F202 HydrophobicContact CD1-CD1 4.29Å; L198-F202 HydrophobicContact CD1-CD2 4.41Å; L198-F202 HydrophobicContact CD1-CE1 3.76Å; L198-F202 HydrophobicContact CD1-CE2 3.9Å; L198-F202 HydrophobicContact CD1-CZ 3.55Å; L198-F202 HydrophobicContact CD2-CE2 3.8Å; L198-F202 HydrophobicContact CD2-CZ 4.01Å; L198-F202 HydrophobicContact CG-CD2 4.02Å; L198-F202 HydrophobicContact CG-CE1 4.37Å; L198-F202 HydrophobicContact CG-CE2 3.59Å; L198-F202 HydrophobicContact CG-CZ 3.79Å; L198-F202 PolarHBondContact O-N 2.99Å; L198-E334 HydrophobicContact CD2-CB 4.49Å
199R87.7Confident86.6Confident65 Ų6517.8 Ų17.825%0.2458%0.08CC..Hα-helixtrans-55.1-49.8172.9-171.8-176.9-65.2155.59.1111.6G195 V196 A197 A201 F202 I203 E334 F337G195-R199 PolarHBondContact O-N 3.44Å; V196-R199 WeakPolarHBondContact O-CB 3.45Å; V196-R199 PolarHBondContact O-N 2.85Å; A197-R199 PolarHBondContact O-N 3.44Å; R199-A201 VanDerWaalsContact C-N 3.3Å; R199-A201 PolarHBondContact O-N 3.37Å; R199-F202 PolarHBondContact O-N 3.16Å; R199-I203 HydrophobicContact CG-CD1 3.91Å; R199-I203 WeakPolarHBondContact O-CD1 3.47Å; R199-I203 WeakPolarHBondContact O-CG1 3.28Å; R199-I203 PolarHBondContact O-N 2.8Å; R199-E334 HydrophobicContact CB-CG 4.38Å; R199-E334 VanDerWaalsContact CB-OE2 3.29Å; R199-E334 WeakPolarHBondContact CB-OE2 3.29Å; R199-E334 VanDerWaalsContact CG-OE2 3.28Å; R199-E334 WeakPolarHBondContact CG-OE2 3.33Å; R199-E334 IonicContact CZ-OE1 3.48Å; R199-E334 IonicContact CZ-OE2 3.71Å; R199-E334 IonicContact NE-OE1 2.78Å; R199-E334 PolarHBondContact NE-OE1 2.96Å; R199-E334 IonicContact NE-OE2 3.19Å; R199-E334 PolarHBondContact NE-OE2 3.13Å; R199-E334 IonicContact NH2-OE1 3.7Å; R199-E334 PolarHBondContact NH2-OE1 2.78Å; R199-E334 IonicContact NH2-OE2 3.99Å; R199-E334 PolarHBondContact NH2-OE2 3.46Å; R199-F337 HydrophobicContact CG-CD1 3.86Å; R199-F337 HydrophobicContact CG-CE1 3.97Å
200C86Confident85.9Confident15 Ų1519.9 Ų19.910%0.1019%0.089CC..Hα-helixtrans-59.6-42.2178.4-69.20000111.5I161 V196 A197 L198 L204I161-C200 HydrophobicContact CB-CB 4.28Å; I161-C200 HydrophobicContact CD1-CB 4.4Å; I161-C200 HydrophobicContact CG2-CB 3.67Å; I161-C200 WeakPolarHBondContact CG2-O 3.45Å; V196-C200 PolarHBondContact O-N 3.14Å; V196-C200 PolarHBondContact O-SG 3.15Å; A197-C200 PolarHBondContact O-N 2.99Å; L198-C200 PolarHBondContact O-N 2.77Å; C200-L204 PolarHBondContact O-N 2.91Å; C200-L204 VanDerWaalsContact O-N 3.16Å
201A88.9Confident84.8Confident1 Ų128.9 Ų28.91%0.00812%0.123CC..Hα-helixtrans-64.8-46.617800000112.9I161 M172 F175 A197 L198 R199 L204 T205I161-A201 HydrophobicContact CD1-CB 4.08Å; M172-A201 HydrophobicContact CE-CB 4.05Å; M172-A201 HydrophobicContact SD-CB 3.98Å; F175-A201 HydrophobicContact CD1-CB 4.08Å; F175-A201 HydrophobicContact CE1-CB 3.39Å; F175-A201 HydrophobicContact CZ-CB 4.1Å; A197-A201 PolarHBondContact O-N 3.48Å; L198-A201 PolarHBondContact O-N 3.31Å; R199-A201 VanDerWaalsContact C-N 3.3Å; R199-A201 PolarHBondContact O-N 3.37Å; A201-L204 WeakPolarHBondContact O-CB 3.41Å; A201-L204 PolarHBondContact O-N 2.88Å; A201-L204 VanDerWaalsContact O-N 3.16Å; A201-T205 PolarHBondContact O-N 3.4Å; A201-T205 PolarHBondContact O-OG1 3.47Å
202F88.3Confident83.5Confident3 Ų334.8 Ų34.81%0.01315%0.145CC..Hα-helixtrans-67.5-35.6178.4-67.6-28000113.1L198 R199 L204 T205 A206 Y287 C290 E334 L335 C338L198-F202 HydrophobicContact CD1-CD1 4.29Å; L198-F202 HydrophobicContact CD1-CD2 4.41Å; L198-F202 HydrophobicContact CD1-CE1 3.76Å; L198-F202 HydrophobicContact CD1-CE2 3.9Å; L198-F202 HydrophobicContact CD1-CZ 3.55Å; L198-F202 HydrophobicContact CD2-CE2 3.8Å; L198-F202 HydrophobicContact CD2-CZ 4.01Å; L198-F202 HydrophobicContact CG-CD2 4.02Å; L198-F202 HydrophobicContact CG-CE1 4.37Å; L198-F202 HydrophobicContact CG-CE2 3.59Å; L198-F202 HydrophobicContact CG-CZ 3.79Å; L198-F202 PolarHBondContact O-N 2.99Å; R199-F202 PolarHBondContact O-N 3.16Å; F202-L204 VanDerWaalsContact C-N 3.26Å; F202-L204 PolarHBondContact O-N 3.27Å; F202-T205 WeakPolarHBondContact O-CB 3.47Å; F202-T205 PolarHBondContact O-N 2.91Å; F202-A206 PolarHBondContact O-N 2.9Å; F202-Y287 HydrophobicContact CB-CE1 4.33Å; F202-Y287 HydrophobicContact CD1-CD1 4.1Å; F202-Y287 AromaticContact CD1-CE1 3.69Å; F202-Y287 HydrophobicContact CD1-CE1 3.69Å; F202-Y287 AromaticContact CE1-CD1 3.98Å; F202-Y287 HydrophobicContact CE1-CD1 3.98Å; F202-Y287 HydrophobicContact CE1-CE1 4.07Å; F202-Y287 HydrophobicContact CG-CE1 4.02Å; F202-Y287 HydrophobicContact CZ-CD1 4.4Å; F202-C290 HydrophobicContact CZ-CB 4.05Å; F202-E334 HydrophobicContact CD2-CB 4.14Å; F202-E334 HydrophobicContact CE2-CB 4.2Å; F202-L335 HydrophobicContact CD2-CD2 4.38Å; F202-L335 HydrophobicContact CE1-CD2 4.5Å; F202-L335 HydrophobicContact CE2-CD2 3.59Å; F202-L335 HydrophobicContact CE2-CG 4.03Å; F202-L335 HydrophobicContact CZ-CD2 3.66Å; F202-L335 HydrophobicContact CZ-CG 4.4Å; F202-C338 HydrophobicContact CB-CB 4.4Å; F202-C338 WeakPolarHBondContact CB-SG 3.4Å
203I83.3Confident82.2Confident15 Ų1538.8 Ų38.88%0.07716%0.16CC..Hα-helixtrans-59.2-41.2171.2-67.1163.1000110.6R199 K207 F337 F444R199-I203 HydrophobicContact CG-CD1 3.91Å; R199-I203 WeakPolarHBondContact O-CD1 3.47Å; R199-I203 WeakPolarHBondContact O-CG1 3.28Å; R199-I203 PolarHBondContact O-N 2.8Å; I203-K207 HydrophobicContact CG2-CD 4.45Å; I203-K207 WeakPolarHBondContact O-CB 3.49Å; I203-K207 WeakPolarHBondContact O-CG 3.37Å; I203-K207 PolarHBondContact O-N 3.19Å; I203-F337 HydrophobicContact CD1-CE1 3.83Å; I203-F337 HydrophobicContact CG1-CE1 4Å; I203-F444 HydrophobicContact CD1-CD2 4Å; I203-F444 HydrophobicContact CD1-CE2 3.89Å; I203-F444 HydrophobicContact CD1-CG 4.37Å; I203-F444 HydrophobicContact CD1-CZ 4.16Å; I203-F444 HydrophobicContact CG2-CD1 3.5Å; I203-F444 VanDerWaalsContact CG2-CD1 3.5Å; I203-F444 HydrophobicContact CG2-CE1 3.41Å; I203-F444 VanDerWaalsContact CG2-CE1 3.41Å; I203-F444 HydrophobicContact CG2-CG 4.19Å; I203-F444 HydrophobicContact CG2-CZ 4.02Å
204L85.7Confident80.7Confident17 Ų1748.2 Ų48.29%0.08920%0.196CC..Hα-helixtrans-67.1-38.2176.6177.253.3000111.9I161 P165 C169 C200 A201 F202 K207 R208I161-L204 HydrophobicContact CG2-CB 4.42Å; I161-L204 HydrophobicContact CG2-CD2 3.95Å; P165-L204 HydrophobicContact CB-CD1 3.56Å; P165-L204 HydrophobicContact CB-CD2 3.71Å; P165-L204 HydrophobicContact CB-CG 4.3Å; C169-L204 WeakPolarHBondContact SG-CD2 3.29Å; C169-L204 VanDerWaalsContact SG-CG 3.52Å; C200-L204 PolarHBondContact O-N 2.91Å; C200-L204 VanDerWaalsContact O-N 3.16Å; A201-L204 WeakPolarHBondContact O-CB 3.41Å; A201-L204 PolarHBondContact O-N 2.88Å; A201-L204 VanDerWaalsContact O-N 3.16Å; F202-L204 VanDerWaalsContact C-N 3.26Å; F202-L204 PolarHBondContact O-N 3.27Å; L204-K207 PolarHBondContact O-N 3.26Å; L204-R208 WeakPolarHBondContact O-CG 3.22Å; L204-R208 PolarHBondContact O-N 3.25Å; L204-R208 VanDerWaalsContact O-N 3.14Å
205T86.6Confident78.9Confident4 Ų452.1 Ų52.13%0.02522%0.22CC..Hα-helixtrans-61.2-52.6172-59.50000111.4A201 F202 K207 R208 E209 P283 W286 Y287A201-T205 PolarHBondContact O-N 3.4Å; A201-T205 PolarHBondContact O-OG1 3.47Å; F202-T205 WeakPolarHBondContact O-CB 3.47Å; F202-T205 PolarHBondContact O-N 2.91Å; T205-K207 VanDerWaalsContact C-N 3.29Å; T205-K207 PolarHBondContact O-N 3.5Å; T205-R208 WeakPolarHBondContact O-CA 3.42Å; T205-R208 PolarHBondContact O-N 2.92Å; T205-E209 HydrophobicContact CG2-CG 4.5Å; T205-E209 WeakPolarHBondContact O-CG 3.21Å; T205-E209 PolarHBondContact O-N 3.22Å; T205-P283 HydrophobicContact CG2-CB 3.69Å; T205-P283 HydrophobicContact CG2-CG 4.08Å; T205-W286 HydrophobicContact CG2-CE3 4.06Å; T205-W286 HydrophobicContact CG2-CZ3 4.24Å; T205-Y287 HydrophobicContact CG2-CE2 4.09Å; T205-Y287 WeakPolarHBondContact CG2-OH 3.42Å
206A83.9Confident76.9Confident2 Ų258 Ų582%0.01724%0.243CC..Hα-helixtrans-57.3-39.3176.700000112.5F202 R208 E209 Q210 L447F202-A206 PolarHBondContact O-N 2.9Å; A206-R208 VanDerWaalsContact C-N 3.28Å; A206-R208 PolarHBondContact O-N 2.99Å; A206-E209 PolarHBondContact O-N 3.33Å; A206-Q210 PolarHBondContact O-N 3.02Å; A206-Q210 VanDerWaalsContact O-N 3.15Å; A206-L447 HydrophobicContact CB-CD2 4.35Å
207K81.8Confident75Confident62 Ų6260.9 Ų60.927%0.2726%0.257SS..Hα-helixtrans-62.4-30.9173.6-79.2-175.3179.5-168.80113.5I203 L204 T205 R211 N443 L447I203-K207 HydrophobicContact CG2-CD 4.45Å; I203-K207 WeakPolarHBondContact O-CB 3.49Å; I203-K207 WeakPolarHBondContact O-CG 3.37Å; I203-K207 PolarHBondContact O-N 3.19Å; L204-K207 PolarHBondContact O-N 3.26Å; T205-K207 VanDerWaalsContact C-N 3.29Å; T205-K207 PolarHBondContact O-N 3.5Å; K207-R211 WeakPolarHBondContact O-CG 3.49Å; K207-N443 PolarHBondContact NZ-O 3.49Å; K207-L447 HydrophobicContact CB-CD2 4.19Å; K207-L447 HydrophobicContact CD-CD1 4.36Å; K207-L447 HydrophobicContact CG-CD1 3.71Å; K207-L447 HydrophobicContact CG-CD2 3.6Å; K207-L447 HydrophobicContact CG-CG 4.3Å
208R79.7Confident72.9Confident95 Ų9564.4 Ų64.436%0.35828%0.282SS..Hα-helixtrans-82.7-34.1176.5-72-179174.4-134.26.3112.3P165 T166 C169 L204 T205 A206 R211 R212P165-R208 PolarHBondContact O-NH2 3.43Å; T166-R208 PolarHBondContact O-NH2 2.83Å; C169-R208 VanDerWaalsContact CB-NH2 3.29Å; C169-R208 PolarHBondContact SG-NE 3.12Å; C169-R208 PolarHBondContact SG-NH2 3.46Å; C169-R208 VanDerWaalsContact SG-NH2 3.39Å; L204-R208 WeakPolarHBondContact O-CG 3.22Å; L204-R208 PolarHBondContact O-N 3.25Å; L204-R208 VanDerWaalsContact O-N 3.14Å; T205-R208 WeakPolarHBondContact O-CA 3.42Å; T205-R208 PolarHBondContact O-N 2.92Å; A206-R208 VanDerWaalsContact C-N 3.28Å; A206-R208 PolarHBondContact O-N 2.99Å; R208-R211 PolarHBondContact O-N 3.26Å; R208-R212 PolarHBondContact O-N 3.19Å; R208-R212 VanDerWaalsContact O-N 3.17Å
209E77.6Confident70.8Confident20 Ų2067.7 Ų67.79%0.09330%0.302CS..Hα-helixtrans-61.7-51.2175.2-70.7177.214700112.1T205 A206 R211 R212 Y213 P283 Y287 S449T205-E209 HydrophobicContact CG2-CG 4.5Å; T205-E209 WeakPolarHBondContact O-CG 3.21Å; T205-E209 PolarHBondContact O-N 3.22Å; A206-E209 PolarHBondContact O-N 3.33Å; E209-R211 PolarHBondContact O-N 2.86Å; E209-R212 WeakPolarHBondContact O-CB 3.36Å; E209-R212 PolarHBondContact O-N 3.48Å; E209-Y213 PolarHBondContact O-N 3.24Å; E209-P283 HydrophobicContact CG-CB 4.26Å; E209-P283 HydrophobicContact CG-CG 4.15Å; E209-P283 WeakPolarHBondContact OE1-CB 3.44Å; E209-Y287 WeakPolarHBondContact OE1-CE2 3.3Å; E209-Y287 PolarHBondContact OE2-OH 3.2Å; E209-S449 WeakPolarHBondContact OE2-CB 3.46Å; E209-S449 PolarHBondContact OE2-OG 2.98Å
210Q71.7Confident68.5Low78 Ų7869.1 Ų69.136%0.36431%0.314SS..Hα-helixtrans-60.6-32.5179.3-69-168.1-10.600112.9A206 R214 L447 S448A206-Q210 PolarHBondContact O-N 3.02Å; A206-Q210 VanDerWaalsContact O-N 3.15Å; Q210-R214 WeakPolarHBondContact O-CB 3.36Å; Q210-R214 PolarHBondContact O-N 3.41Å; Q210-L447 VanDerWaalsContact CD-CD2 3.44Å; Q210-L447 HydrophobicContact CG-CD2 4.06Å; Q210-S448 PolarHBondContact NE2-O 2.99Å
211R65Low66.3Low190 Ų19075.9 Ų75.972%0.71734%0.344SS*.Hα-helixtrans-67.1-42.1173.6-73.4179.2-178.9-174.50.9112.2K207 R208 E209 T215K207-R211 WeakPolarHBondContact O-CG 3.49Å; R208-R211 PolarHBondContact O-N 3.26Å; E209-R211 PolarHBondContact O-N 2.86Å; R211-T215 PolarHBondContact O-N 3.17Å; R211-T215 PolarHBondContact O-OG1 3.35Å
212R64.3Low63.8Low127 Ų12780.4 Ų80.448%0.47938%0.375SS..Hα-helixtrans-62-50.3174.7-73.9-179.7174.3165.1-3110.7R208 E209 R214 T215 Y216R208-R212 PolarHBondContact O-N 3.19Å; R208-R212 VanDerWaalsContact O-N 3.17Å; E209-R212 WeakPolarHBondContact O-CB 3.36Å; E209-R212 PolarHBondContact O-N 3.48Å; R212-R214 VanDerWaalsContact C-N 3.35Å; R212-R214 PolarHBondContact O-N 3.23Å; R212-T215 WeakPolarHBondContact O-CB 3.49Å; R212-T215 PolarHBondContact O-N 3.04Å; R212-Y216 HydrophobicContact CB-CE2 4.36Å; R212-Y216 WeakPolarHBondContact O-CD2 3.4Å; R212-Y216 PolarHBondContact O-N 2.69Å
213Y59.9Low61.5Low101 Ų10190.1 Ų90.140%0.39641%0.412SS..Hα-helixtrans-58.7-43.1-179.9-169.4-114.3000113E209 T215 Y216 L217E209-Y213 PolarHBondContact O-N 3.24Å; Y213-T215 PolarHBondContact O-N 3.38Å; Y213-Y216 PolarHBondContact O-N 2.68Å; Y213-L217 HydrophobicContact CD1-CD1 3.82Å; Y213-L217 HydrophobicContact CE1-CD1 3.43Å; Y213-L217 VanDerWaalsContact CE1-CD1 3.43Å; Y213-L217 PolarHBondContact O-N 3.48Å
214R55.2Low59.1Low202 Ų20297.7 Ų97.776%0.76245%0.449SS*.Hα-helixtrans-60.7-31.5175-164.4179.6-163.8118.92.1113.2Q210 R212 S218Q210-R214 WeakPolarHBondContact O-CB 3.36Å; Q210-R214 PolarHBondContact O-N 3.41Å; R212-R214 VanDerWaalsContact C-N 3.35Å; R212-R214 PolarHBondContact O-N 3.23Å; R214-S218 PolarHBondContact O-N 3.18Å
215T55.5Low56.5Low83 Ų83100.4 Ų100.451%0.50948%0.481SS..Hα-helixtrans-70.3-45.4178-52.10000110.8R211 R212 Y213 L217 S218 V219R211-T215 PolarHBondContact O-N 3.17Å; R211-T215 PolarHBondContact O-OG1 3.35Å; R212-T215 WeakPolarHBondContact O-CB 3.49Å; R212-T215 PolarHBondContact O-N 3.04Å; Y213-T215 PolarHBondContact O-N 3.38Å; T215-L217 PolarHBondContact O-N 3.48Å; T215-S218 PolarHBondContact O-N 2.92Å; T215-S218 PolarHBondContact O-OG 3.09Å; T215-V219 PolarHBondContact O-N 3.39Å
216Y47Very low53.8Low125 Ų125110 Ų11049%0.4953%0.526SS..Hα-helixtrans-59.5-47.8177.2-67.2-70.7000112.2R212 Y213 S218 V219 D220R212-Y216 HydrophobicContact CB-CE2 4.36Å; R212-Y216 WeakPolarHBondContact O-CD2 3.4Å; R212-Y216 PolarHBondContact O-N 2.69Å; Y213-Y216 PolarHBondContact O-N 2.68Å; Y216-S218 PolarHBondContact O-N 3.07Å; Y216-V219 PolarHBondContact O-N 3.29Å; Y216-D220 PolarHBondContact O-N 3.05Å; Y216-D220 VanDerWaalsContact O-N 3.1Å
217L46.2Very low51.4Low74 Ų74113.4 Ų113.439%0.38756%0.561SS.*Hα-helixtrans-56.8-34.9175.7-88154.9000113.6Y213 T215 V219 H221Y213-L217 HydrophobicContact CD1-CD1 3.82Å; Y213-L217 HydrophobicContact CE1-CD1 3.43Å; Y213-L217 VanDerWaalsContact CE1-CD1 3.43Å; Y213-L217 PolarHBondContact O-N 3.48Å; T215-L217 PolarHBondContact O-N 3.48Å; L217-V219 VanDerWaalsContact C-N 3.34Å; L217-H221 PolarHBondContact O-N 3.47Å; L217-H221 PolarHBondContact O-ND1 2.97Å
218S44.3Very low48.9Very low74 Ų74116.9 Ų116.952%0.51759%0.59SS.*Hα-helixtrans-72.5-24.3176.2670000114.2R214 T215 Y216 S222R214-S218 PolarHBondContact O-N 3.18Å; T215-S218 PolarHBondContact O-N 2.92Å; T215-S218 PolarHBondContact O-OG 3.09Å; Y216-S218 PolarHBondContact O-N 3.07Å; S218-S222 PolarHBondContact O-OG 3.42Å
219V48.3Very low46.7Very low69 Ų69116 Ų11642%0.41861%0.61SS.*Hα-helixtrans-82.1-37.9177.31750000111.1T215 Y216 L217 S222T215-V219 PolarHBondContact O-N 3.39Å; Y216-V219 PolarHBondContact O-N 3.29Å; L217-V219 VanDerWaalsContact C-N 3.34Å; V219-S222 PolarHBondContact O-N 2.98Å; V219-S222 PolarHBondContact O-OG 3.32Å; V219-S222 VanDerWaalsContact O-OG 3.05Å
220D39.4Very low44.3Very low95 Ų95119.5 Ų119.551%0.50864%0.637SS.*Hα-helixtrans-74.4-30.9-179.1-67.3-33.8000112.9Y216 S222 R223 M224Y216-D220 PolarHBondContact O-N 3.05Å; Y216-D220 VanDerWaalsContact O-N 3.1Å; D220-S222 PolarHBondContact O-N 3.14Å; D220-R223 PolarHBondContact O-N 3.14Å; D220-R223 VanDerWaalsContact O-N 3.15Å; D220-M224 PolarHBondContact O-N 2.74Å
221H39.2Very low42.2Very low156 Ų156125.7 Ų125.772%0.72266%0.663SS**THydrogen-bonded Turntrans-68.6-11.7172.9-76.228.5000114L217L217-H221 PolarHBondContact O-N 3.47Å; L217-H221 PolarHBondContact O-ND1 2.97Å
222S37.8Very low40.4Very low96 Ų96120.9 Ų120.967%0.67166%0.659SS**THydrogen-bonded Turntrans-103.78.5173.441.40000113.4S218 V219 D220S218-S222 PolarHBondContact O-OG 3.42Å; V219-S222 PolarHBondContact O-N 2.98Å; V219-S222 PolarHBondContact O-OG 3.32Å; V219-S222 VanDerWaalsContact O-OG 3.05Å; D220-S222 PolarHBondContact O-N 3.14Å
223R38.8Very low38.7Very low208 Ų208121.8 Ų121.879%0.78567%0.673SS**THydrogen-bonded Turntrans-125.7-0.1177.2-81.1-175.4166.4-172.7-4.3115.6D220D220-R223 PolarHBondContact O-N 3.14Å; D220-R223 VanDerWaalsContact O-N 3.15Å
224M33.1Very low37.2Very low173 Ų173125.4 Ų125.485%0.85270%0.698SS**  trans-117.980.8175.4-73-75-174.400109.6D220D220-M224 PolarHBondContact O-N 2.74Å
225G30.3Very low35.8Very low74 Ų74125 Ų12576%0.76371%0.705SS**  trans-153.357.7-169.700000114.7
226E30.5Very low34.5Very low205 Ų205125.2 Ų125.296%0.95872%0.724SS**  trans-151.2122.1165.7-109.1174.1-148.500109.5
227G33.1Very low33.3Very low74 Ų74122.6 Ų122.676%0.76374%0.735SS**  trans138.993179.800000114.3
228P30.8Very low32.3Very low136 Ų136123.6 Ų123.688%0.88375%0.753SS**  trans-90.1145.3-178.635-33.1000112.7
229G31.8Very low31.3Very low75 Ų75125.4 Ų125.477%0.77377%0.766SS**  trans164.696.2168.900000116.5
230S27.9Very low30.3Very low94 Ų94126.8 Ų126.866%0.65778%0.779SS**  trans27118.6144.5-175.40000119.4
231F27.7Very low29.7Very low208 Ų208129.9 Ų129.991%0.91280%0.801SS**  -170.5124.2103.7-101.6-69.8000110.9
232S26.4Very low29.1Very low89 Ų89126.7 Ų126.762%0.62280%0.796SS**  trans-93.3166.9-179.155.70000112.7
233N28.4Very low28.6Very low146 Ų146129.7 Ų129.778%0.78181%0.805SS**  trans76.9101.2162.1-49.8-21.7000117.8
234L29.3Very low28Very low178 Ų178130.2 Ų130.293%0.93281%0.807SS**  -162.1132.3123.3-109.1147.8000110.7
235E26.7Very low27.7Very low194 Ų194130.3 Ų130.391%0.90781%0.807SS**  trans-74.7142.8-168.7-65.7162.8117.700112.9G237E235-G237 PolarHBondContact O-N 2.91Å
236G26.5Very low27.5Very low87 Ų87135 Ų13590%0.89781%0.807SS**  trans-85102.9-173.700000114.1
237G23.1Very low27.3Very low70 Ų70134.3 Ų134.372%0.72280%0.801SS**  trans-90.7133.8158.400000112.1E235E235-G237 PolarHBondContact O-N 2.91Å
238A24.8Very low26.9Very low94 Ų94136.2 Ų136.278%0.77780%0.803SS**SBendtrans60.7121.7156.300000120.9
239S23.7Very low26.7Very low113 Ų113134.4 Ų134.479%0.7980%0.799SS**  trans36.5102.7137.362.60000120.4
240S27.4Very low26.5Very low98 Ų98137.4 Ų137.469%0.68580%0.803SS**  -172.3122.5120.947.90000111.8S242S240-S242 PolarHBondContact O-N 3.41Å
241V26.5Very low26.7Very low159 Ų159136.6 Ų136.696%0.96481%0.809SS**  trans-86.776.6162.6-178.40000106.9
242S27.1Very low26.7Very low90 Ų90134.7 Ų134.763%0.62981%0.809SS**  trans-99.3121.9178-76.90000111.3S240 R244S240-S242 PolarHBondContact O-N 3.41Å; S242-R244 PolarHBondContact O-N 3.18Å
243N26.6Very low27Very low159 Ų159136.3 Ų136.385%0.8582%0.82SS**  trans-6107.8158-61-22000116.3
244R26.9Very low27Very low218 Ų218140.1 Ų140.182%0.82382%0.823SS**  trans-9577.8155.2-70.3-166.7-169-172.64.9110.3S242 F246S242-R244 PolarHBondContact O-N 3.18Å; R244-F246 HydrophobicContact CB-CD2 4.36Å; R244-F246 HydrophobicContact CB-CE2 4.5Å; R244-F246 PolarHBondContact O-N 3.16Å
245M27.1Very low27.1Very low176 Ų176141 Ų14187%0.86782%0.822SS**  trans-71.6107.1154-88.4-175.5165.900107.9F247M245-F247 VanDerWaalsContact C-N 3.26Å; M245-F247 PolarHBondContact O-N 3.41Å
246F24.9Very low27.1Very low172 Ų172140.8 Ų140.875%0.75482%0.818SS**  trans-78.175.5171.7-99.1-85.8000110.5R244R244-F246 HydrophobicContact CB-CD2 4.36Å; R244-F246 HydrophobicContact CB-CE2 4.5Å; R244-F246 PolarHBondContact O-N 3.16Å
247F26.1Very low27.3Very low191 Ų191143.2 Ų143.284%0.83882%0.816SS**  trans-14194.2163.4-83.3-73.3000110.2M245M245-F247 VanDerWaalsContact C-N 3.26Å; M245-F247 PolarHBondContact O-N 3.41Å
248S25.4Very low27.6Very low113 Ų113147.3 Ų147.379%0.7982%0.821SS**  trans-121110.8163.1-179.70000107.5
249A27.1Very low27.8Very low98 Ų98148.1 Ų148.181%0.8182%0.819SS**  trans-121.7106.317700000108.9
250T27.7Very low27.9Very low138 Ų138150.8 Ų150.885%0.84782%0.824SS**  trans-134.3128.2172.848.60000109.1
251G31.2Very low28Very low77 Ų77151 Ų15179%0.79483%0.825SS**  trans140.683.5171.400000115.8
252N28.4Very low28Very low169 Ų169153.2 Ų153.290%0.90483%0.828SS**  trans-15.1129.6160.2-71-32.6000117.9
253S31.8Very low27.9Very low122 Ų122152.6 Ų152.685%0.85382%0.823SS**  -152152.8117.1-1620000112.1
254R27.8Very low28Very low227 Ų227150.2 Ų150.286%0.85782%0.815SS**  trans-87.7142.2-175.3-60.5162.6174.9161.8-3.3109.5
255H32.2Very low28.1Very low196 Ų196145.9 Ų145.991%0.90781%0.812SS**  -167.2141126.7-105.2-75.1000111.3
256K27.4Very low28.1Very low190 Ų190144.1 Ų144.183%0.82681%0.806SS**  trans-86144176-63.9172.9174.7178.50109.9
257T29.5Very low28.3Very low138 Ų138142.5 Ų142.585%0.84780%0.799SS**  173.8149118.730.30000113.6
258N29.7Very low28.4Very low155 Ų155139.2 Ų139.283%0.82980%0.797SS**  trans58.8113.4165.6-91.8-0.6000121.7
259P28.8Very low28.7Very low112 Ų112137.4 Ų137.473%0.72780%0.796SS**  trans-87.8120.9155.834-26.3000110.4
260N27Very low29Very low169 Ų169137.3 Ų137.390%0.90478%0.781SS**  trans166.567.2153.7-87.5-17.8000110.7
261S29.4Very low28.9Very low101 Ų101135 Ų13571%0.70679%0.785SS**  trans-157.2119.5158.643.40000109.7S263S261-S263 VanDerWaalsContact C-N 3.33Å; S261-S263 PolarHBondContact O-N 2.91Å; S261-S263 VanDerWaalsContact O-N 3.14Å
262M25Very low29Very low207 Ų207138 Ų138100%1.0277%0.773SS**  trans-86.179.1177.2-169.7167.369.800108.5
263S26.5Very low28.8Very low76 Ų76134.1 Ų134.153%0.53176%0.759SS.*  trans-127.6125.3-175.656.90000112.5S261S261-S263 VanDerWaalsContact C-N 3.33Å; S261-S263 PolarHBondContact O-N 2.91Å; S261-S263 VanDerWaalsContact O-N 3.14Å
264T28.1Very low28.9Very low110 Ų110133.8 Ų133.868%0.67575%0.752SS**  trans33.495.8151.438.60000117.6N266T264-N266 PolarHBondContact O-N 3.44Å
265V29.1Very low29Very low127 Ų127126.6 Ų126.677%0.7774%0.736SS**  trans-77.2110.5161.1-178.50000108.6F267V265-F267 PolarHBondContact O-N 3.02Å
266N27.2Very low28.8Very low138 Ų138122.9 Ų122.974%0.73872%0.723SS**  trans-74.7120.4171.2-81.5-17000110T264 P268T264-N266 PolarHBondContact O-N 3.44Å; N266-P268 WeakPolarHBondContact O-CD 3.27Å
267F28.4Very low29Very low138 Ų138119.8 Ų119.861%0.60572%0.72SS**  trans-77.9118.3168.3-84-91.3000110.3V265 G269V265-F267 PolarHBondContact O-N 3.02Å; F267-G269 PolarHBondContact O-N 3.42Å
268P28.4Very low29.2Very low122 Ų122120.6 Ų120.679%0.79272%0.719SS**THydrogen-bonded Turntrans-79.2111.7173.131.3-30.9000109.7N266N266-P268 WeakPolarHBondContact O-CD 3.27Å
269G32.2Very low29.6Very low75 Ų75115.8 Ų115.877%0.77370%0.698SS**THydrogen-bonded Turntrans140.7-25.616900000116.2F267F267-G269 PolarHBondContact O-N 3.42Å
270L33.4Very low30.6Very low96 Ų96116.3 Ų116.350%0.50370%0.699SS.*SBendtrans-121.3113.4166.9-8390.2000109.5Y272L270-Y272 HydrophobicContact CB-CD2 4.17Å; L270-Y272 HydrophobicContact CD2-CD2 4.34Å; L270-Y272 HydrophobicContact CD2-CE2 3.91Å; L270-Y272 PolarHBondContact O-N 3.28Å
271G24.8Very low32.1Very low89 Ų89111.6 Ų111.692%0.91868%0.68SS**  trans-71.964.6175.200000113.1S273G271-S273 PolarHBondContact O-N 3.32Å
272Y33.3Very low34Very low142 Ų142108.7 Ų108.756%0.55766%0.659SS**  trans-78.4105.7160.1-85-81.4000108.5L270 V274L270-Y272 HydrophobicContact CB-CD2 4.17Å; L270-Y272 HydrophobicContact CD2-CD2 4.34Å; L270-Y272 HydrophobicContact CD2-CE2 3.91Å; L270-Y272 PolarHBondContact O-N 3.28Å; Y272-V274 PolarHBondContact O-N 3.44Å
273S24.8Very low36.4Very low86 Ų8699.4 Ų99.460%0.60161%0.614SS**  trans-64115.1166.449.70000109.1G271 S275G271-S273 PolarHBondContact O-N 3.32Å; S273-S275 PolarHBondContact O-N 2.91Å
274V34.5Very low38.9Very low116 Ų116100.2 Ų100.270%0.70361%0.608SS**THydrogen-bonded Turntrans-73.426.1-178.9-172.10000111.8Y272Y272-V274 PolarHBondContact O-N 3.44Å
275S29Very low41.6Very low75 Ų7597.6 Ų97.652%0.52459%0.589SS.*THydrogen-bonded Turntrans-88.5-21.6-176.650.30000114.1S273 T277S273-S275 PolarHBondContact O-N 2.91Å; S275-T277 VanDerWaalsContact C-N 3.26Å; S275-T277 PolarHBondContact O-N 3.16Å
276D28.9Very low44.3Very low118 Ų11893 Ų9363%0.63156%0.558SS**  trans-87.559.8-172.5-69.84.6000112.5N278 S279D276-N278 PolarHBondContact O-N 3.02Å; D276-S279 PolarHBondContact O-N 3.12Å; D276-S279 PolarHBondContact O-OG 3.41Å
277T31.8Very low47.2Very low125 Ų12586.5 Ų86.577%0.76752%0.523SS*.THydrogen-bonded Turntrans-64.1-3.6-177.7470000115.3S275S275-T277 VanDerWaalsContact C-N 3.26Å; S275-T277 PolarHBondContact O-N 3.16Å
278N32.2Very low50Low156 Ų15686 Ų8683%0.83452%0.518SS*.THydrogen-bonded Turntrans-112.89-177.9-74.6-17.1000114.9D276D276-N278 PolarHBondContact O-N 3.02Å
279S38.7Very low52.7Low54 Ų5483.6 Ų83.638%0.37850%0.498SS..  trans-98.496.3176.666.90000112.9D276 S281D276-S279 PolarHBondContact O-N 3.12Å; D276-S279 PolarHBondContact O-OG 3.41Å; S279-S281 PolarHBondContact O-N 3.42Å
280T50.5Low55.4Low123 Ų12380 Ų8076%0.75546%0.461SS*.THydrogen-bonded Turntrans-68.31517749.20000114.7
281S58.3Low57.9Low70 Ų7075.9 Ų75.949%0.4944%0.439SS..THydrogen-bonded Turntrans-122.617.4-161.959.50000114.6S279S279-S281 PolarHBondContact O-N 3.42Å
282S68Low60.9Low39 Ų3975.6 Ų75.627%0.27342%0.416SS..  trans-91.6135.5175.877.90000111.8F284 I285S282-F284 PolarHBondContact O-N 2.73Å; S282-F284 VanDerWaalsContact O-N 3.16Å; S282-I285 PolarHBondContact O-N 2.97Å; S282-I285 VanDerWaalsContact O-N 3.16Å; S282-I285 WeakPolarHBondContact OG-CD1 3.33Å; S282-I285 WeakPolarHBondContact OG-CG1 3.46Å
283P76.1Confident63.3Low12 Ų1270.2 Ų70.28%0.07840%0.396CS..Hα-helixtrans-55.7-28.8175.2-3138.2000115T205 E209 I285 W286 Y287T205-P283 HydrophobicContact CG2-CB 3.69Å; T205-P283 HydrophobicContact CG2-CG 4.08Å; E209-P283 HydrophobicContact CG-CB 4.26Å; E209-P283 HydrophobicContact CG-CG 4.15Å; E209-P283 WeakPolarHBondContact OE1-CB 3.44Å; P283-I285 VanDerWaalsContact C-N 3.35Å; P283-I285 PolarHBondContact O-N 3.44Å; P283-W286 HydrophobicContact CB-CE3 4.32Å; P283-W286 HydrophobicContact CG-CE3 4.46Å; P283-W286 HydrophobicContact CG-CZ3 4.28Å; P283-W286 WeakPolarHBondContact O-CB 3.34Å; P283-W286 PolarHBondContact O-N 3.22Å; P283-Y287 HydrophobicContact CB-CE2 4.38Å; P283-Y287 VanDerWaalsContact O-CD2 3.31Å; P283-Y287 WeakPolarHBondContact O-CD2 3.48Å; P283-Y287 PolarHBondContact O-N 2.92Å; P283-Y287 VanDerWaalsContact O-N 3.07Å
284F80.3Confident66.1Low93 Ų9366.2 Ų66.241%0.40837%0.368SS..Hα-helixtrans-58.5-44.9176.8178.6-92.7000112.1S282 W286 R288 I451 L455S282-F284 PolarHBondContact O-N 2.73Å; S282-F284 VanDerWaalsContact O-N 3.16Å; F284-W286 VanDerWaalsContact C-N 3.33Å; F284-W286 PolarHBondContact O-N 3.45Å; F284-R288 WeakPolarHBondContact O-CB 3.43Å; F284-R288 PolarHBondContact O-N 3.44Å; F284-I451 HydrophobicContact CB-CG2 4.2Å; F284-I451 HydrophobicContact CD2-CG2 3.87Å; F284-L455 HydrophobicContact CD2-CD1 4.05Å; F284-L455 HydrophobicContact CD2-CD2 4.41Å; F284-L455 HydrophobicContact CD2-CG 4.4Å; F284-L455 HydrophobicContact CE2-CD1 4.1Å; F284-L455 HydrophobicContact CE2-CD2 3.63Å; F284-L455 HydrophobicContact CE2-CG 4.04Å; F284-L455 HydrophobicContact CZ-CD2 4.01Å
285I84.2Confident68.4Low55 Ų5562.6 Ų62.628%0.28234%0.344SS..Hα-helixtrans-59.5-47.8177.3-65.6163.7000109.4S282 P283 Y287 R288 D289S282-I285 PolarHBondContact O-N 2.97Å; S282-I285 VanDerWaalsContact O-N 3.16Å; S282-I285 WeakPolarHBondContact OG-CD1 3.33Å; S282-I285 WeakPolarHBondContact OG-CG1 3.46Å; P283-I285 VanDerWaalsContact C-N 3.35Å; P283-I285 PolarHBondContact O-N 3.44Å; I285-Y287 PolarHBondContact O-N 3.05Å; I285-R288 PolarHBondContact O-N 3.39Å; I285-D289 VanDerWaalsContact CG2-OD2 3.29Å; I285-D289 WeakPolarHBondContact CG2-OD2 3.19Å; I285-D289 WeakPolarHBondContact O-CB 3.46Å; I285-D289 PolarHBondContact O-N 2.78Å
286W85.2Confident70.6Confident30 Ų3061.1 Ų61.111%0.11433%0.327CS..Hα-helixtrans-59.4-47.9-178.1-59.2-16.6000113.7M172 I176 T205 P283 F284 C290M172-W286 HydrophobicContact CB-CH2 3.77Å; M172-W286 HydrophobicContact CB-CZ2 3.8Å; M172-W286 HydrophobicContact CB-CZ3 4.2Å; M172-W286 HydrophobicContact CG-CD2 3.87Å; M172-W286 HydrophobicContact CG-CE3 3.69Å; M172-W286 HydrophobicContact CG-CH2 3.71Å; M172-W286 HydrophobicContact CG-CZ2 3.86Å; M172-W286 HydrophobicContact CG-CZ3 3.62Å; I176-W286 HydrophobicContact CD1-CB 3.41Å; I176-W286 VanDerWaalsContact CD1-CB 3.41Å; I176-W286 HydrophobicContact CD1-CD2 3.8Å; I176-W286 HydrophobicContact CD1-CE3 4.48Å; I176-W286 HydrophobicContact CD1-CG 3.26Å; T205-W286 HydrophobicContact CG2-CE3 4.06Å; T205-W286 HydrophobicContact CG2-CZ3 4.24Å; P283-W286 HydrophobicContact CB-CE3 4.32Å; P283-W286 HydrophobicContact CG-CE3 4.46Å; P283-W286 HydrophobicContact CG-CZ3 4.28Å; P283-W286 WeakPolarHBondContact O-CB 3.34Å; P283-W286 PolarHBondContact O-N 3.22Å; F284-W286 VanDerWaalsContact C-N 3.33Å; F284-W286 PolarHBondContact O-N 3.45Å; W286-C290 PolarHBondContact O-N 2.87Å; W286-C290 PolarHBondContact O-SG 3.17Å
287Y88Confident72.3Confident2 Ų258.8 Ų58.81%0.00832%0.317CS..Hα-helixtrans-68.9-39.3175.9-65.5-52.4000112.1F202 T205 E209 P283 I285 C290 L291 L335 S449 I451 C452F202-Y287 HydrophobicContact CB-CE1 4.33Å; F202-Y287 HydrophobicContact CD1-CD1 4.1Å; F202-Y287 AromaticContact CD1-CE1 3.69Å; F202-Y287 HydrophobicContact CD1-CE1 3.69Å; F202-Y287 AromaticContact CE1-CD1 3.98Å; F202-Y287 HydrophobicContact CE1-CD1 3.98Å; F202-Y287 HydrophobicContact CE1-CE1 4.07Å; F202-Y287 HydrophobicContact CG-CE1 4.02Å; F202-Y287 HydrophobicContact CZ-CD1 4.4Å; T205-Y287 HydrophobicContact CG2-CE2 4.09Å; T205-Y287 WeakPolarHBondContact CG2-OH 3.42Å; E209-Y287 WeakPolarHBondContact OE1-CE2 3.3Å; E209-Y287 PolarHBondContact OE2-OH 3.2Å; P283-Y287 HydrophobicContact CB-CE2 4.38Å; P283-Y287 VanDerWaalsContact O-CD2 3.31Å; P283-Y287 WeakPolarHBondContact O-CD2 3.48Å; P283-Y287 PolarHBondContact O-N 2.92Å; P283-Y287 VanDerWaalsContact O-N 3.07Å; I285-Y287 PolarHBondContact O-N 3.05Å; Y287-C290 PolarHBondContact O-N 3.39Å; Y287-L291 VanDerWaalsContact O-CB 3.24Å; Y287-L291 WeakPolarHBondContact O-CB 3.21Å; Y287-L291 PolarHBondContact O-N 2.99Å; Y287-L335 HydrophobicContact CD1-CD2 3.77Å; Y287-S449 WeakPolarHBondContact CE2-OG 3.38Å; Y287-S449 PolarHBondContact OH-OG 3.39Å; Y287-I451 HydrophobicContact CD2-CG2 4.32Å; Y287-C452 HydrophobicContact CD1-CB 4.21Å; Y287-C452 HydrophobicContact CD2-CB 4.01Å; Y287-C452 HydrophobicContact CE1-CB 4.24Å; Y287-C452 HydrophobicContact CE2-CB 4.02Å; Y287-C452 HydrophobicContact CG-CB 4.1Å
288R86.8Confident73.6Confident129 Ų12957.7 Ų57.749%0.48730%0.304SS..Hα-helixtrans-61.5-47.4177.9177.9-177.5175.6-157-2.4111.5F284 I285 C290 L291 I292 L455F284-R288 WeakPolarHBondContact O-CB 3.43Å; F284-R288 PolarHBondContact O-N 3.44Å; I285-R288 PolarHBondContact O-N 3.39Å; R288-C290 PolarHBondContact O-N 3.29Å; R288-L291 PolarHBondContact O-N 2.94Å; R288-I292 HydrophobicContact CG-CD1 3.72Å; R288-I292 HydrophobicContact CG-CG1 4.36Å; R288-I292 WeakPolarHBondContact O-CB 3.07Å; R288-I292 VanDerWaalsContact O-CG1 3.27Å; R288-I292 WeakPolarHBondContact O-CG1 3.32Å; R288-I292 PolarHBondContact O-N 3.48Å; R288-L455 HydrophobicContact CB-CD1 4.49Å
289D86.2Confident74.4Confident71 Ų7155.3 Ų55.338%0.3830%0.299SS..Hα-helixtrans-63.1-43.9-179.1-66.1-14.3000110.7I285 E293I285-D289 VanDerWaalsContact CG2-OD2 3.29Å; I285-D289 WeakPolarHBondContact CG2-OD2 3.19Å; I285-D289 WeakPolarHBondContact O-CB 3.46Å; I285-D289 PolarHBondContact O-N 2.78Å; D289-E293 WeakPolarHBondContact O-CB 3.25Å; D289-E293 PolarHBondContact O-N 3.16Å
290C87.6Confident74.7Confident0 Ų058.5 Ų58.50%031%0.308CS..Hα-helixtrans-64.5-40.5174.9-64.60000112.2F202 W286 Y287 R288 E293 S294 I331 L335F202-C290 HydrophobicContact CZ-CB 4.05Å; W286-C290 PolarHBondContact O-N 2.87Å; W286-C290 PolarHBondContact O-SG 3.17Å; Y287-C290 PolarHBondContact O-N 3.39Å; R288-C290 PolarHBondContact O-N 3.29Å; C290-E293 PolarHBondContact O-N 2.9Å; C290-S294 WeakPolarHBondContact O-CB 3.26Å; C290-S294 PolarHBondContact O-N 3.41Å; C290-I331 HydrophobicContact CB-CG2 3.96Å; C290-I331 WeakPolarHBondContact O-CG2 3.39Å; C290-L335 HydrophobicContact CB-CD1 4.39Å; C290-L335 HydrophobicContact CB-CD2 4.36Å
291L87.9Confident74.2Confident8 Ų858.1 Ų58.14%0.04231%0.307CS..Hα-helixtrans-66.2-46.4178.2-178.160.9000111.5Y287 R288 E293 S294 I295 L335 L455 L456 N459 I463Y287-L291 VanDerWaalsContact O-CB 3.24Å; Y287-L291 WeakPolarHBondContact O-CB 3.21Å; Y287-L291 PolarHBondContact O-N 2.99Å; R288-L291 PolarHBondContact O-N 2.94Å; L291-E293 PolarHBondContact O-N 2.59Å; L291-S294 PolarHBondContact O-N 3.13Å; L291-S294 PolarHBondContact O-OG 2.94Å; L291-I295 HydrophobicContact CD1-CD1 3.8Å; L291-I295 HydrophobicContact CD1-CG1 4.31Å; L291-I295 HydrophobicContact CG-CD1 3.96Å; L291-I295 WeakPolarHBondContact O-CG1 3.49Å; L291-I295 PolarHBondContact O-N 3.5Å; L291-L335 HydrophobicContact CB-CD1 4.18Å; L291-L335 HydrophobicContact CD1-CD1 4.24Å; L291-L455 HydrophobicContact CD2-CB 4.1Å; L291-L455 WeakPolarHBondContact CD2-O 3.28Å; L291-L456 HydrophobicContact CD1-CD2 3.8Å; L291-N459 HydrophobicContact CD2-CB 4.36Å; L291-I463 HydrophobicContact CD1-CD1 4.25Å
292I86.8Confident73.2Confident83 Ų8357.6 Ų57.643%0.42631%0.307SS..Hα-helixtrans-56.7-51.1174.9-71.2169.4000109.8R288 S294 I295 R296R288-I292 HydrophobicContact CG-CD1 3.72Å; R288-I292 HydrophobicContact CG-CG1 4.36Å; R288-I292 WeakPolarHBondContact O-CB 3.07Å; R288-I292 VanDerWaalsContact O-CG1 3.27Å; R288-I292 WeakPolarHBondContact O-CG1 3.32Å; R288-I292 PolarHBondContact O-N 3.48Å; I292-S294 PolarHBondContact O-N 3.2Å; I292-I295 PolarHBondContact O-N 3.34Å; I292-R296 VanDerWaalsContact O-CB 3.32Å; I292-R296 WeakPolarHBondContact O-CB 3.31Å; I292-R296 PolarHBondContact O-N 3.04Å
293E83.1Confident71.5Confident30 Ų3060.7 Ų60.714%0.1433%0.327CS..Hα-helixtrans-66.3-25.6-178.8-169.656.3-153.700112.5L180 R184 D289 C290 L291 R296 N328L180-E293 HydrophobicContact CD2-CG 4.27Å; R184-E293 IonicContact CZ-OE1 3.73Å; R184-E293 VanDerWaalsContact CZ-OE1 3.26Å; R184-E293 IonicContact NE-OE1 3.26Å; R184-E293 PolarHBondContact NE-OE1 3.15Å; R184-E293 PolarHBondContact NH2-O 2.96Å; R184-E293 IonicContact NH2-OE1 3.7Å; R184-E293 PolarHBondContact NH2-OE1 3.22Å; D289-E293 WeakPolarHBondContact O-CB 3.25Å; D289-E293 PolarHBondContact O-N 3.16Å; C290-E293 PolarHBondContact O-N 2.9Å; L291-E293 PolarHBondContact O-N 2.59Å; E293-R296 IonicContact OE1-NH1 3.91Å; E293-R296 WeakPolarHBondContact OE2-CD 3.25Å; E293-R296 IonicContact OE2-CZ 3.88Å; E293-R296 IonicContact OE2-NH1 2.89Å; E293-R296 PolarHBondContact OE2-NH1 3.32Å; E293-N328 PolarHBondContact O-OD1 3.05Å
294S84.4Confident69.6Low2 Ų267.8 Ų67.81%0.01436%0.363CS..Hα-helixtrans-76.6-31.117379.60000114.6C290 L291 I292 N328C290-S294 WeakPolarHBondContact O-CB 3.26Å; C290-S294 PolarHBondContact O-N 3.41Å; L291-S294 PolarHBondContact O-N 3.13Å; L291-S294 PolarHBondContact O-OG 2.94Å; I292-S294 PolarHBondContact O-N 3.2Å; S294-N328 WeakPolarHBondContact O-CB 3.22Å; S294-N328 PolarHBondContact O-ND2 3.33Å
295I82.6Confident67.4Low39 Ų3970.2 Ų70.220%0.238%0.379CS..Hα-helixtrans-86.8-25178.7-65.5170.9000110.9L291 I292 T297 N459 K462 I463L291-I295 HydrophobicContact CD1-CD1 3.8Å; L291-I295 HydrophobicContact CD1-CG1 4.31Å; L291-I295 HydrophobicContact CG-CD1 3.96Å; L291-I295 WeakPolarHBondContact O-CG1 3.49Å; L291-I295 PolarHBondContact O-N 3.5Å; I292-I295 PolarHBondContact O-N 3.34Å; I295-T297 PolarHBondContact O-N 3.5Å; I295-N459 HydrophobicContact CD1-CB 4.16Å; I295-K462 HydrophobicContact CD1-CB 4.43Å; I295-K462 HydrophobicContact CG2-CB 4.39Å; I295-I463 HydrophobicContact CD1-CG1 4.19Å; I295-I463 HydrophobicContact CG1-CG1 4.46Å
296R74.6Confident64.9Low44 Ų4474.3 Ų74.317%0.16640%0.401CS..  trans-55.6122.2-173.1-174.4169.5169.7-151.7-6113.6I292 E293 E300 A302 W324I292-R296 VanDerWaalsContact O-CB 3.32Å; I292-R296 WeakPolarHBondContact O-CB 3.31Å; I292-R296 PolarHBondContact O-N 3.04Å; E293-R296 IonicContact OE1-NH1 3.91Å; E293-R296 WeakPolarHBondContact OE2-CD 3.25Å; E293-R296 IonicContact OE2-CZ 3.88Å; E293-R296 IonicContact OE2-NH1 2.89Å; E293-R296 PolarHBondContact OE2-NH1 3.32Å; R296-E300 PolarHBondContact NE-O 3.17Å; R296-E300 PolarHBondContact NH2-O 3.49Å; R296-A302 VanDerWaalsContact NH2-CA 3.28Å; R296-A302 VanDerWaalsContact NH2-N 3.13Å; R296-W324 PolarHBondContact O-NE1 3.24Å
297T64.3Low62.2Low69 Ų6981 Ų8142%0.42343%0.433SS..  trans-77.7147171.9630000110.3I295 S299 E300I295-T297 PolarHBondContact O-N 3.5Å; T297-S299 PolarHBondContact O-N 2.94Å; T297-S299 PolarHBondContact OG1-OG 3.21Å; T297-E300 PolarHBondContact O-N 2.74Å
298Q59.3Low59.4Low103 Ų10390.2 Ų90.248%0.48148%0.476SS..THydrogen-bonded Turntrans-61.1-13.3-171.7-164.8175.317.600114.2L319Q298-L319 PolarHBondContact NE2-O 3.45Å; Q298-L319 VanDerWaalsContact NE2-O 3.07Å
299S49.3Very low56.6Low105 Ų10593 Ų9373%0.73450%0.495SS*.THydrogen-bonded Turntrans-86.6-12.9-176.338.80000115.7T297T297-S299 PolarHBondContact O-N 2.94Å; T297-S299 PolarHBondContact OG1-OG 3.21Å
300E45.7Very low53.9Low121 Ų12195 Ų9557%0.56551%0.514SS*.SBendtrans-91.2127178.7-73.9-171.4135.800112.6R296 T297R296-E300 PolarHBondContact NE-O 3.17Å; R296-E300 PolarHBondContact NH2-O 3.49Å; T297-E300 PolarHBondContact O-N 2.74Å
301P39.8Very low51Low115 Ų11599.2 Ų99.275%0.74754%0.544SS*.PPolyproline II helixtrans-66.3150.2170.629.8-34000110.8P303P301-P303 WeakPolarHBondContact O-CD 3.26Å
302A36.1Very low48.2Very low59 Ų59107.1 Ų107.149%0.48858%0.58SS.*PPolyproline II helixtrans-74.8125.1-17100000111.9R296 L304R296-A302 VanDerWaalsContact NH2-CA 3.28Å; R296-A302 VanDerWaalsContact NH2-N 3.13Å; A302-L304 VanDerWaalsContact C-N 3.26Å; A302-L304 PolarHBondContact O-N 3.45Å; A302-L304 VanDerWaalsContact O-N 3.1Å
303P33.3Very low45.5Very low104 Ų104110.1 Ų110.168%0.67560%0.603SS**  trans-84.270.2166.835.3-32.5000109.8P301 I305P301-P303 WeakPolarHBondContact O-CD 3.26Å; P303-I305 PolarHBondContact O-N 3Å
304L35.7Very low42.8Very low162 Ų162114.6 Ų114.685%0.84864%0.637SS**  trans-78113.5159.1-78.5176.6000107.6A302A302-L304 VanDerWaalsContact C-N 3.26Å; A302-L304 PolarHBondContact O-N 3.45Å; A302-L304 VanDerWaalsContact O-N 3.1Å
305I34.2Very low40.3Very low143 Ų143119 Ų11973%0.73367%0.668SS**  trans-84.7125.1-167.5-72.8177.5000110.8P303P303-I305 PolarHBondContact O-N 3Å
306L31.8Very low38.1Very low142 Ų142122.8 Ų122.874%0.74370%0.698SS**  trans74.8125.3159.1-69.6165.3000120.9
307Q29.3Very low36.8Very low171 Ų171126.4 Ų126.480%0.79971%0.711SS**  trans56.6101.7149.7-71.5174.9-62.100118.7
308E28.8Very low36.5Very low195 Ų195132.7 Ų132.791%0.91173%0.733SS**  -163.5164.583.4-104179.9176.800113
309Q28.3Very low37Very low188 Ų188128.9 Ų128.988%0.87972%0.716SS**  trans-91.8120.9-176-61.3168.5-3.400110.4
310S28.5Very low38.4Very low112 Ų112129 Ų12978%0.78371%0.708SS**  trans163.3136.7132.749.90000114.3
311S27.3Very low40.2Very low89 Ų89130.7 Ų130.762%0.62271%0.709SS**  trans50.8116.7144.5610000122.2
312H29.2Very low42.3Very low174 Ų174128.1 Ų128.181%0.80669%0.689SS**  trans60.5102.6151.2-43.3-55.5000117.3
313T29.8Very low44.7Very low146 Ų146126.7 Ų126.790%0.89667%0.673SS**  -172139.57031.90000111.3
314S27.4Very low47.2Very low123 Ų123123.4 Ų123.486%0.8665%0.648SS**  trans-89.4119179.751.70000112.5
315S31.3Very low49.7Very low94 Ų94116.3 Ų116.366%0.65761%0.61SS**  trans-155.275.9156.4174.60000111.2R317S315-R317 VanDerWaalsContact C-N 3.28Å; S315-R317 PolarHBondContact O-N 2.91Å
316S35.8Very low52.3Low119 Ų119109.6 Ų109.683%0.83258%0.576SS**  trans-65.589.9164.545.30000109.6K318S316-K318 PolarHBondContact O-N 2.75Å
317R48.5Very low54.9Low120 Ų120102.9 Ų102.945%0.45354%0.541SS..  trans-60.2110.3-179.6-74174.8166.1-178.1-6.1109.8D144 S315 L319D144-R317 VanDerWaalsContact CG-CZ 3.48Å; D144-R317 IonicContact OD1-CZ 3Å; D144-R317 IonicContact OD1-NH1 2.66Å; D144-R317 PolarHBondContact OD1-NH1 2.64Å; D144-R317 IonicContact OD1-NH2 2.79Å; D144-R317 PolarHBondContact OD1-NH2 3.25Å; D144-R317 IonicContact OD2-CZ 3.31Å; D144-R317 VanDerWaalsContact OD2-CZ 3.31Å; D144-R317 IonicContact OD2-NH1 3.78Å; D144-R317 IonicContact OD2-NH2 2.69Å; D144-R317 PolarHBondContact OD2-NH2 3.4Å; S315-R317 VanDerWaalsContact C-N 3.28Å; S315-R317 PolarHBondContact O-N 2.91Å; R317-L319 VanDerWaalsContact C-N 3.31Å; R317-L319 PolarHBondContact O-N 3.11Å
318K56.4Low57.8Low201 Ų20194.9 Ų94.987%0.87450%0.504SS*.  trans-6492.2169.7-68.1-176.6179.6179.70109.1S316S316-K318 PolarHBondContact O-N 2.75Å
319L70.8Confident60.7Low23 Ų2385.6 Ų85.612%0.1246%0.46CS..  trans-67.1144.8166.2-81.4146.2000109.6R184 K186 Q298 R317 D323 W324R184-L319 HydrophobicContact CB-CD1 4.08Å; R184-L319 VanDerWaalsContact O-CD1 3.31Å; R184-L319 WeakPolarHBondContact O-CD1 3.48Å; R184-L319 WeakPolarHBondContact O-CD2 3.19Å; K186-L319 HydrophobicContact CG-CD2 4.49Å; Q298-L319 PolarHBondContact NE2-O 3.45Å; Q298-L319 VanDerWaalsContact NE2-O 3.07Å; R317-L319 VanDerWaalsContact C-N 3.31Å; R317-L319 PolarHBondContact O-N 3.11Å; L319-D323 HydrophobicContact CD2-CB 4.18Å; L319-W324 HydrophobicContact CB-CE3 4.26Å; L319-W324 HydrophobicContact CD1-CE3 3.74Å; L319-W324 HydrophobicContact CD1-CZ3 3.82Å
320N78.1Confident63.6Low108 Ų10877 Ų7758%0.57842%0.42SS*.  trans-62.4146.7170.3-60-47.9000109.2D322 D323 W324N320-D322 PolarHBondContact O-N 3.11Å; N320-D323 HydrophobicContact CB-CB 4.27Å; N320-D323 WeakPolarHBondContact CB-OD2 3.27Å; N320-D323 PolarHBondContact ND2-OD2 3.38Å; N320-D323 PolarHBondContact O-N 3.31Å; N320-W324 PolarHBondContact O-N 2.89Å
321R83.1Confident66.5Low156 Ų15671.7 Ų71.759%0.58938%0.383SS*.Hα-helixtrans-53.4-43.4176.4180178.7176174.60.3111.6D323 W324 I325R321-D323 VanDerWaalsContact C-N 3.35Å; R321-D323 PolarHBondContact O-N 3.4Å; R321-W324 PolarHBondContact O-N 2.88Å; R321-I325 HydrophobicContact CG-CD1 3.89Å; R321-I325 VanDerWaalsContact O-CG1 3.27Å; R321-I325 WeakPolarHBondContact O-CG1 3.39Å; R321-I325 PolarHBondContact O-N 3.35Å
322D84.9Confident69.5Low62 Ų6267.6 Ų67.633%0.33235%0.354SS..Hα-helixtrans-61.9-40.9177.2-74.922.2000112.5N320 W324 I325 H326 N475 I478N320-D322 PolarHBondContact O-N 3.11Å; D322-W324 VanDerWaalsContact C-N 3.34Å; D322-W324 PolarHBondContact O-N 3.42Å; D322-I325 PolarHBondContact O-N 3.44Å; D322-H326 WeakPolarHBondContact O-CB 3.31Å; D322-H326 PolarHBondContact O-N 3.24Å; D322-N475 WeakPolarHBondContact OD2-CB 3.36Å; D322-N475 PolarHBondContact OD2-ND2 3.33Å; D322-I478 HydrophobicContact CB-CD1 3.91Å
323D85.9Confident72.3Confident28 Ų2859.8 Ų59.815%0.1532%0.318CS..Hα-helixtrans-68.6-36.5-179-71.6-44.1000112.2R191 L319 N320 R321 G327R191-D323 IonicContact CZ-OD1 3.74Å; R191-D323 VanDerWaalsContact CZ-OD1 3.24Å; R191-D323 PolarHBondContact NH1-O 3.04Å; R191-D323 VanDerWaalsContact NH1-O 3.13Å; R191-D323 IonicContact NH1-OD1 3.72Å; R191-D323 PolarHBondContact NH1-OD1 3.01Å; R191-D323 IonicContact NH2-OD1 2.76Å; R191-D323 PolarHBondContact NH2-OD1 3.21Å; L319-D323 HydrophobicContact CD2-CB 4.18Å; N320-D323 HydrophobicContact CB-CB 4.27Å; N320-D323 WeakPolarHBondContact CB-OD2 3.27Å; N320-D323 PolarHBondContact ND2-OD2 3.38Å; N320-D323 PolarHBondContact O-N 3.31Å; R321-D323 VanDerWaalsContact C-N 3.35Å; R321-D323 PolarHBondContact O-N 3.4Å; D323-G327 PolarHBondContact O-N 2.78Å
324W86Confident75.1Confident36 Ų3653 Ų5314%0.13628%0.276CS..Hα-helixtrans-63.6-47.1172.8-166.6-88.6000111.9R184 R296 L319 N320 R321 D322 G327 N328R184-W324 HydrophobicContact CG-CZ3 4.38Å; R184-W324 PolarHBondContact NH1-O 2.94Å; R296-W324 PolarHBondContact O-NE1 3.24Å; L319-W324 HydrophobicContact CB-CE3 4.26Å; L319-W324 HydrophobicContact CD1-CE3 3.74Å; L319-W324 HydrophobicContact CD1-CZ3 3.82Å; N320-W324 PolarHBondContact O-N 2.89Å; R321-W324 PolarHBondContact O-N 2.88Å; D322-W324 VanDerWaalsContact C-N 3.34Å; D322-W324 PolarHBondContact O-N 3.42Å; W324-G327 PolarHBondContact O-N 2.84Å; W324-N328 PolarHBondContact O-N 3.45Å; W324-N328 PolarHBondContact O-OD1 3.27Å
325I87.5Confident78Confident12 Ų1247.2 Ų47.26%0.06224%0.235CC..Hα-helixtrans-62.4-43.7178-68.3165.8000110.9R321 D322 G327 N328 I329 W470 I478R321-I325 HydrophobicContact CG-CD1 3.89Å; R321-I325 VanDerWaalsContact O-CG1 3.27Å; R321-I325 WeakPolarHBondContact O-CG1 3.39Å; R321-I325 PolarHBondContact O-N 3.35Å; D322-I325 PolarHBondContact O-N 3.44Å; I325-G327 VanDerWaalsContact C-N 3.33Å; I325-G327 PolarHBondContact O-N 2.88Å; I325-N328 PolarHBondContact O-N 3.38Å; I325-I329 HydrophobicContact CG2-CD1 3.66Å; I325-I329 HydrophobicContact CG2-CG1 4.33Å; I325-I329 WeakPolarHBondContact O-CG1 3.32Å; I325-I329 PolarHBondContact O-N 2.7Å; I325-W470 HydrophobicContact CG2-CB 4.35Å; I325-W470 HydrophobicContact CG2-CD2 4.12Å; I325-W470 HydrophobicContact CG2-CG 3.8Å; I325-I478 HydrophobicContact CB-CD1 4.1Å; I325-I478 HydrophobicContact CG2-CD1 3.94Å; I325-I478 HydrophobicContact CG2-CG1 4.49Å; I325-I478 HydrophobicContact CG2-CG2 3.88Å
326H88.9Confident80.7Confident3 Ų342.8 Ų42.81%0.01420%0.204CC..Hα-helixtrans-57.9-44176.6-176.2-77.9000111.9D322 I329 L330D322-H326 WeakPolarHBondContact O-CB 3.31Å; D322-H326 PolarHBondContact O-N 3.24Å; H326-I329 PolarHBondContact O-N 3.41Å; H326-L330 WeakPolarHBondContact O-CG 3.31Å; H326-L330 PolarHBondContact O-N 3.34Å
327G87.2Confident82.9Confident0 Ų039 Ų390%017%0.173CC..Hα-helixtrans-61.8-44.7174.100000113.1D323 W324 I325 I329 L330 I331D323-G327 PolarHBondContact O-N 2.78Å; W324-G327 PolarHBondContact O-N 2.84Å; I325-G327 VanDerWaalsContact C-N 3.33Å; I325-G327 PolarHBondContact O-N 2.88Å; G327-I329 PolarHBondContact O-N 2.89Å; G327-L330 PolarHBondContact O-N 3.33Å; G327-I331 WeakPolarHBondContact O-CG1 3.46Å; G327-I331 PolarHBondContact O-N 3.05Å; G327-I331 VanDerWaalsContact O-N 3.17Å
328N90Very high84.5Confident4 Ų433.6 Ų33.62%0.02115%0.153CC..Hα-helixtrans-61-43.5178.1-74.716.8000112.3R184 E293 S294 W324 I325 I331 L332 W470R184-N328 PolarHBondContact NH1-OD1 3.36Å; R184-N328 PolarHBondContact NH2-OD1 2.84Å; E293-N328 PolarHBondContact O-OD1 3.05Å; S294-N328 WeakPolarHBondContact O-CB 3.22Å; S294-N328 PolarHBondContact O-ND2 3.33Å; W324-N328 PolarHBondContact O-N 3.45Å; W324-N328 PolarHBondContact O-OD1 3.27Å; I325-N328 PolarHBondContact O-N 3.38Å; N328-I331 PolarHBondContact O-N 3.4Å; N328-L332 WeakPolarHBondContact O-CB 3.48Å; N328-L332 PolarHBondContact O-N 3.11Å; N328-W470 HydrophobicContact CB-CH2 4.07Å; N328-W470 HydrophobicContact CB-CZ2 3.95Å
329I89.8Confident85.8Confident0 Ų024.6 Ų24.60%012%0.115CC..Hα-helixtrans-66.3-38.9-179.5-64.7164.2000111.1I325 H326 G327 L332 Q333 W470 I478 L481 L482 L485I325-I329 HydrophobicContact CG2-CD1 3.66Å; I325-I329 HydrophobicContact CG2-CG1 4.33Å; I325-I329 WeakPolarHBondContact O-CG1 3.32Å; I325-I329 PolarHBondContact O-N 2.7Å; H326-I329 PolarHBondContact O-N 3.41Å; G327-I329 PolarHBondContact O-N 2.89Å; I329-L332 PolarHBondContact O-N 3.43Å; I329-Q333 WeakPolarHBondContact O-CB 3.46Å; I329-Q333 PolarHBondContact O-N 2.99Å; I329-W470 HydrophobicContact CD1-CD2 4.28Å; I329-W470 HydrophobicContact CD1-CE3 3.95Å; I329-W470 HydrophobicContact CD1-CZ3 4.49Å; I329-W470 HydrophobicContact CG1-CD2 4.13Å; I329-W470 HydrophobicContact CG1-CE3 3.51Å; I329-W470 HydrophobicContact CG1-CH2 4.22Å; I329-W470 HydrophobicContact CG1-CZ3 3.56Å; I329-I478 HydrophobicContact CD1-CG2 3.67Å; I329-L481 HydrophobicContact CG2-CB 3.62Å; I329-L481 HydrophobicContact CG2-CD1 4.34Å; I329-L482 HydrophobicContact CD1-CD2 3.94Å; I329-L482 HydrophobicContact CD1-CG 4.15Å; I329-L485 HydrophobicContact CG2-CD2 4.34Å
330L88.6Confident86.3Confident8 Ų824.2 Ų24.24%0.04211%0.113CC..Hα-helixtrans-60.8-47.5174.9-71.6174.8000111.6L183 R191 E192 H326 G327 L332 Q333 E334 L481L183-L330 HydrophobicContact CD2-CB 4.39Å; L183-L330 HydrophobicContact CD2-CD1 4.32Å; R191-L330 HydrophobicContact CB-CD1 4.12Å; E192-L330 HydrophobicContact CG-CD1 4.2Å; H326-L330 WeakPolarHBondContact O-CG 3.31Å; H326-L330 PolarHBondContact O-N 3.34Å; G327-L330 PolarHBondContact O-N 3.33Å; L330-L332 PolarHBondContact O-N 3.38Å; L330-Q333 PolarHBondContact O-N 3.17Å; L330-E334 WeakPolarHBondContact O-CG 3.41Å; L330-E334 PolarHBondContact O-N 3.03Å; L330-E334 VanDerWaalsContact O-N 3.11Å; L330-L481 HydrophobicContact CD2-CD1 4.16Å; L330-L481 HydrophobicContact CD2-CD2 3.99Å; L330-L481 HydrophobicContact CG-CD1 4.26Å
331I91.2Very high86.3Confident0 Ų020.1 Ų20.10%09%0.092CC..Hα-helixtrans-58.3-49.1177.8-63163000110.6L180 L183 C290 G327 N328 Q333 E334 L335L180-I331 HydrophobicContact CD2-CD1 3.83Å; L180-I331 HydrophobicContact CD2-CG1 4.46Å; L183-I331 HydrophobicContact CD1-CD1 4.14Å; L183-I331 HydrophobicContact CD1-CG1 3.64Å; C290-I331 HydrophobicContact CB-CG2 3.96Å; C290-I331 WeakPolarHBondContact O-CG2 3.39Å; G327-I331 WeakPolarHBondContact O-CG1 3.46Å; G327-I331 PolarHBondContact O-N 3.05Å; G327-I331 VanDerWaalsContact O-N 3.17Å; N328-I331 PolarHBondContact O-N 3.4Å; I331-Q333 VanDerWaalsContact C-N 3.32Å; I331-Q333 PolarHBondContact O-N 3.2Å; I331-E334 PolarHBondContact O-N 3.42Å; I331-L335 HydrophobicContact CG2-CD1 4.09Å; I331-L335 HydrophobicContact CG2-CG 4.49Å; I331-L335 WeakPolarHBondContact O-CG 3.29Å; I331-L335 PolarHBondContact O-N 3.27Å
332L90.4Very high86.1Confident2 Ų220 Ų201%0.0110%0.099CC..Hα-helixtrans-62.7-38.3179.5-172.171.7000112.2N328 I329 L330 E334 L335 L336 L456 I463 V467 W470 L485N328-L332 WeakPolarHBondContact O-CB 3.48Å; N328-L332 PolarHBondContact O-N 3.11Å; I329-L332 PolarHBondContact O-N 3.43Å; L330-L332 PolarHBondContact O-N 3.38Å; L332-E334 VanDerWaalsContact C-N 3.31Å; L332-E334 PolarHBondContact O-N 3.12Å; L332-L335 PolarHBondContact O-N 2.74Å; L332-L336 HydrophobicContact CG-CD1 4.2Å; L332-L336 WeakPolarHBondContact O-CB 3.33Å; L332-L336 WeakPolarHBondContact O-CG 3.45Å; L332-L336 PolarHBondContact O-N 3.37Å; L332-L456 HydrophobicContact CD1-CD2 4.34Å; L332-I463 HydrophobicContact CD1-CD1 4.17Å; L332-I463 HydrophobicContact CD1-CG1 4.23Å; L332-I463 HydrophobicContact CD1-CG2 4.01Å; L332-I463 HydrophobicContact CD2-CG2 3.77Å; L332-I463 HydrophobicContact CG-CG2 4.48Å; L332-V467 HydrophobicContact CD2-CG2 4.48Å; L332-W470 HydrophobicContact CD2-CH2 4.46Å; L332-W470 HydrophobicContact CD2-CZ3 4.07Å; L332-L485 HydrophobicContact CB-CD1 4.36Å; L332-L485 HydrophobicContact CD2-CD1 3.78Å; L332-L485 HydrophobicContact CD2-CD2 3.8Å; L332-L485 HydrophobicContact CD2-CG 4.33Å; L332-L485 HydrophobicContact CG-CD1 3.98Å
333Q87.8Confident86Confident10 Ų1017.3 Ų17.35%0.0478%0.084CC..Hα-helixtrans-63-36.3177.2-178.2175.4300112.1I329 L330 I331 F337 L485 R488I329-Q333 WeakPolarHBondContact O-CB 3.46Å; I329-Q333 PolarHBondContact O-N 2.99Å; L330-Q333 PolarHBondContact O-N 3.17Å; I331-Q333 VanDerWaalsContact C-N 3.32Å; I331-Q333 PolarHBondContact O-N 3.2Å; Q333-F337 WeakPolarHBondContact O-CB 3.23Å; Q333-F337 PolarHBondContact O-N 3.45Å; Q333-F337 VanDerWaalsContact O-N 3.16Å; Q333-L485 HydrophobicContact CB-CD1 4.4Å; Q333-R488 VanDerWaalsContact CG-NH1 3.28Å; Q333-R488 PolarHBondContact O-NH1 3.11Å
334E87.3Confident85.5Confident4 Ų416.9 Ų16.92%0.0198%0.083CC..Hα-helixtrans-79.1-35.4176.6-58.6-44.7148.100113.5L198 R199 F202 L330 I331 L332 F337 C338L198-E334 HydrophobicContact CD2-CB 4.49Å; R199-E334 HydrophobicContact CB-CG 4.38Å; R199-E334 VanDerWaalsContact CB-OE2 3.29Å; R199-E334 WeakPolarHBondContact CB-OE2 3.29Å; R199-E334 VanDerWaalsContact CG-OE2 3.28Å; R199-E334 WeakPolarHBondContact CG-OE2 3.33Å; R199-E334 IonicContact CZ-OE1 3.48Å; R199-E334 IonicContact CZ-OE2 3.71Å; R199-E334 IonicContact NE-OE1 2.78Å; R199-E334 PolarHBondContact NE-OE1 2.96Å; R199-E334 IonicContact NE-OE2 3.19Å; R199-E334 PolarHBondContact NE-OE2 3.13Å; R199-E334 IonicContact NH2-OE1 3.7Å; R199-E334 PolarHBondContact NH2-OE1 2.78Å; R199-E334 IonicContact NH2-OE2 3.99Å; R199-E334 PolarHBondContact NH2-OE2 3.46Å; F202-E334 HydrophobicContact CD2-CB 4.14Å; F202-E334 HydrophobicContact CE2-CB 4.2Å; L330-E334 WeakPolarHBondContact O-CG 3.41Å; L330-E334 PolarHBondContact O-N 3.03Å; L330-E334 VanDerWaalsContact O-N 3.11Å; I331-E334 PolarHBondContact O-N 3.42Å; L332-E334 VanDerWaalsContact C-N 3.31Å; L332-E334 PolarHBondContact O-N 3.12Å; E334-F337 WeakPolarHBondContact O-CB 3.5Å; E334-F337 PolarHBondContact O-N 2.73Å; E334-C338 PolarHBondContact O-N 2.8Å
335L89.1Confident85.2Confident1 Ų120.3 Ų20.31%0.00510%0.099CC..Hα-helixtrans-60.3-46.8171.1-70171.4000111.2F202 Y287 C290 L291 I331 L332 F337 C338 L456F202-L335 HydrophobicContact CD2-CD2 4.38Å; F202-L335 HydrophobicContact CE1-CD2 4.5Å; F202-L335 HydrophobicContact CE2-CD2 3.59Å; F202-L335 HydrophobicContact CE2-CG 4.03Å; F202-L335 HydrophobicContact CZ-CD2 3.66Å; F202-L335 HydrophobicContact CZ-CG 4.4Å; Y287-L335 HydrophobicContact CD1-CD2 3.77Å; C290-L335 HydrophobicContact CB-CD1 4.39Å; C290-L335 HydrophobicContact CB-CD2 4.36Å; L291-L335 HydrophobicContact CB-CD1 4.18Å; L291-L335 HydrophobicContact CD1-CD1 4.24Å; I331-L335 HydrophobicContact CG2-CD1 4.09Å; I331-L335 HydrophobicContact CG2-CG 4.49Å; I331-L335 WeakPolarHBondContact O-CG 3.29Å; I331-L335 PolarHBondContact O-N 3.27Å; L332-L335 PolarHBondContact O-N 2.74Å; L335-F337 VanDerWaalsContact C-N 3.31Å; L335-F337 PolarHBondContact O-N 2.88Å; L335-C338 PolarHBondContact O-N 3.37Å; L335-L456 HydrophobicContact CB-CD1 4.41Å; L335-L456 HydrophobicContact CB-CD2 4.45Å
336L87.1Confident85Confident1 Ų120.1 Ų20.11%0.00510%0.098CC..Hα-helixtrans-63.3-35.2176.1-72.9164.2000112.8L332 C338 V339 Q340 L456 L485 R488 L489 L492L332-L336 HydrophobicContact CG-CD1 4.2Å; L332-L336 WeakPolarHBondContact O-CB 3.33Å; L332-L336 WeakPolarHBondContact O-CG 3.45Å; L332-L336 PolarHBondContact O-N 3.37Å; L336-C338 VanDerWaalsContact C-N 3.28Å; L336-C338 PolarHBondContact O-N 3.38Å; L336-V339 PolarHBondContact O-N 2.78Å; L336-Q340 PolarHBondContact O-N 3.04Å; L336-L456 HydrophobicContact CD2-CD1 4.06Å; L336-L456 HydrophobicContact CG-CD1 4.48Å; L336-L485 HydrophobicContact CD1-CD1 3.53Å; L336-L485 HydrophobicContact CD1-CG 4.45Å; L336-R488 HydrophobicContact CB-CB 4.4Å; L336-R488 HydrophobicContact CD1-CB 4.25Å; L336-L489 HydrophobicContact CD1-CD2 3.73Å; L336-L489 HydrophobicContact CD1-CG 3.94Å; L336-L489 HydrophobicContact CD2-CD2 3.97Å; L336-L489 HydrophobicContact CG-CD2 4.46Å; L336-L492 HydrophobicContact CD2-CD2 4Å
337F83.3Confident84.6Confident41 Ų4121.1 Ų21.118%0.1810%0.103CC..Hα-helixtrans-59.1-40.1177.5-178.9-93.7000111.8R199 I203 Q333 E334 L335 V339 Q340 S344R199-F337 HydrophobicContact CG-CD1 3.86Å; R199-F337 HydrophobicContact CG-CE1 3.97Å; I203-F337 HydrophobicContact CD1-CE1 3.83Å; I203-F337 HydrophobicContact CG1-CE1 4Å; Q333-F337 WeakPolarHBondContact O-CB 3.23Å; Q333-F337 PolarHBondContact O-N 3.45Å; Q333-F337 VanDerWaalsContact O-N 3.16Å; E334-F337 WeakPolarHBondContact O-CB 3.5Å; E334-F337 PolarHBondContact O-N 2.73Å; L335-F337 VanDerWaalsContact C-N 3.31Å; L335-F337 PolarHBondContact O-N 2.88Å; F337-V339 PolarHBondContact O-N 3.08Å; F337-Q340 PolarHBondContact O-N 3.33Å; F337-S344 VanDerWaalsContact CE2-OG 3.26Å; F337-S344 WeakPolarHBondContact CE2-OG 3.36Å
338C81.2Confident84Confident5 Ų523.4 Ų23.43%0.03411%0.114CC..THydrogen-bonded Turntrans-76.6-5.8-178.6-68.30000115F202 E334 L335 L336 S448 S449F202-C338 HydrophobicContact CB-CB 4.4Å; F202-C338 WeakPolarHBondContact CB-SG 3.4Å; E334-C338 PolarHBondContact O-N 2.8Å; L335-C338 PolarHBondContact O-N 3.37Å; L336-C338 VanDerWaalsContact C-N 3.28Å; L336-C338 PolarHBondContact O-N 3.38Å; C338-S448 WeakPolarHBondContact O-CA 3.42Å; C338-S449 PolarHBondContact O-N 3.34Å
339V83.1Confident83.5Confident13 Ų1326.1 Ų26.18%0.07913%0.127CC..THydrogen-bonded Turntrans-103.9-23176.9171.10000112.2L336 F337 P341 C452 L453 L456 L492L336-V339 PolarHBondContact O-N 2.78Å; F337-V339 PolarHBondContact O-N 3.08Å; V339-P341 VanDerWaalsContact C-CD 3.44Å; V339-P341 WeakPolarHBondContact O-CD 3.43Å; V339-C452 HydrophobicContact CG2-CB 3.77Å; V339-L453 HydrophobicContact CG1-CB 3.84Å; V339-L453 HydrophobicContact CG1-CD1 3.54Å; V339-L453 HydrophobicContact CG1-CG 4.19Å; V339-L453 HydrophobicContact CG2-CB 4.21Å; V339-L456 HydrophobicContact CG2-CD1 3.97Å; V339-L492 HydrophobicContact CG1-CD1 3.63Å
340Q81.2Confident83.1Confident14 Ų1426.2 Ų26.27%0.06513%0.128CC..  trans-118.473.7-167.9-63.9-177.7-2000114.3L336 F337 Q342 F343 S344 R488L336-Q340 PolarHBondContact O-N 3.04Å; F337-Q340 PolarHBondContact O-N 3.33Å; Q340-Q342 VanDerWaalsContact C-N 3.28Å; Q340-Q342 PolarHBondContact O-N 2.91Å; Q340-F343 HydrophobicContact CB-CB 3.99Å; Q340-F343 PolarHBondContact O-N 2.97Å; Q340-S344 PolarHBondContact O-N 3Å; Q340-S344 PolarHBondContact O-OG 3.21Å; Q340-R488 PolarHBondContact NE2-O 3.29Å; Q340-R488 PolarHBondContact OE1-O 3.47Å
341P78Confident82.4Confident23 Ų2326.7 Ų26.715%0.14913%0.13CC..Hα-helixtrans-62.5-35.5173.623.7-31.1000112.2V339 F343 S344 K345 S445V339-P341 VanDerWaalsContact C-CD 3.44Å; V339-P341 WeakPolarHBondContact O-CD 3.43Å; P341-F343 PolarHBondContact O-N 3.44Å; P341-S344 PolarHBondContact O-N 3.22Å; P341-K345 WeakPolarHBondContact O-CB 3.47Å; P341-K345 PolarHBondContact O-N 3.05Å; P341-S445 VanDerWaalsContact CB-O 3.27Å; P341-S445 WeakPolarHBondContact CB-O 3.44Å
342Q79Confident81.6Confident154 Ų15431.7 Ų31.772%0.7215%0.153SC*.Hα-helixtrans-61.7-44.9179.8-63.1-1774.300112.7Q340 S344 K345 L346Q340-Q342 VanDerWaalsContact C-N 3.28Å; Q340-Q342 PolarHBondContact O-N 2.91Å; Q342-S344 VanDerWaalsContact C-N 3.33Å; Q342-S344 PolarHBondContact O-N 2.85Å; Q342-K345 PolarHBondContact O-N 2.91Å; Q342-L346 WeakPolarHBondContact O-CB 3.34Å; Q342-L346 PolarHBondContact O-N 3.32Å
343F82.9Confident80.8Confident5 Ų533 Ų332%0.02216%0.16CC..Hα-helixtrans-60.9-44.9175.8-170.5-75.4000110.9Q340 P341 L346 L347 P487 R488 A491 L529 F533Q340-F343 HydrophobicContact CB-CB 3.99Å; Q340-F343 PolarHBondContact O-N 2.97Å; P341-F343 PolarHBondContact O-N 3.44Å; F343-L346 PolarHBondContact O-N 3.18Å; F343-L347 WeakPolarHBondContact O-CB 3.42Å; F343-L347 PolarHBondContact O-N 3.34Å; F343-P487 HydrophobicContact CE2-CB 3.75Å; F343-P487 HydrophobicContact CZ-CB 4.02Å; F343-R488 HydrophobicContact CD1-CG 4.14Å; F343-R488 HydrophobicContact CD2-CG 4.25Å; F343-R488 HydrophobicContact CE1-CG 3.91Å; F343-R488 HydrophobicContact CE2-CG 4.03Å; F343-R488 HydrophobicContact CG-CG 4.32Å; F343-R488 HydrophobicContact CZ-CG 3.86Å; F343-A491 HydrophobicContact CD2-CB 3.93Å; F343-L529 HydrophobicContact CZ-CD1 4Å; F343-F533 HydrophobicContact CB-CZ 4.18Å; F343-F533 HydrophobicContact CD2-CD2 4.31Å; F343-F533 AromaticContact CD2-CE2 3.33Å; F343-F533 HydrophobicContact CD2-CE2 3.33Å; F343-F533 AromaticContact CD2-CZ 3.49Å; F343-F533 HydrophobicContact CD2-CZ 3.49Å; F343-F533 VanDerWaalsContact CD2-CZ 3.49Å; F343-F533 HydrophobicContact CE2-CD2 4.42Å; F343-F533 AromaticContact CE2-CE2 3.6Å; F343-F533 HydrophobicContact CE2-CE2 3.6Å; F343-F533 HydrophobicContact CE2-CZ 4.22Å; F343-F533 HydrophobicContact CG-CE2 4.38Å; F343-F533 HydrophobicContact CG-CZ 4.17Å
344S75.6Confident80Confident19 Ų1932.7 Ų32.713%0.13316%0.159CC..Hα-helixtrans-65.5-39.5179.1-61.20000112.4F337 Q340 P341 Q342 L347 M348F337-S344 VanDerWaalsContact CE2-OG 3.26Å; F337-S344 WeakPolarHBondContact CE2-OG 3.36Å; Q340-S344 PolarHBondContact O-N 3Å; Q340-S344 PolarHBondContact O-OG 3.21Å; P341-S344 PolarHBondContact O-N 3.22Å; Q342-S344 VanDerWaalsContact C-N 3.33Å; Q342-S344 PolarHBondContact O-N 2.85Å; S344-L347 PolarHBondContact O-N 2.83Å; S344-M348 WeakPolarHBondContact O-CG 3.4Å; S344-M348 PolarHBondContact O-N 3.23Å
345K80.1Confident78.7Confident108 Ų10834 Ų3447%0.4717%0.173SC..Hα-helixtrans-62.5-47.7173.7-177.6-177.5176-175.10111.5P341 Q342 L347 M348 E349P341-K345 WeakPolarHBondContact O-CB 3.47Å; P341-K345 PolarHBondContact O-N 3.05Å; Q342-K345 PolarHBondContact O-N 2.91Å; K345-L347 VanDerWaalsContact C-N 3.31Å; K345-L347 PolarHBondContact O-N 3.48Å; K345-M348 WeakPolarHBondContact O-CB 3.45Å; K345-M348 PolarHBondContact O-N 2.91Å; K345-M348 VanDerWaalsContact O-N 3.11Å; K345-E349 VanDerWaalsContact CE-OE1 3.26Å; K345-E349 WeakPolarHBondContact CE-OE1 3.17Å; K345-E349 PolarHBondContact O-N 3.31Å
346L83.3Confident77.6Confident7 Ų736.3 Ų36.34%0.03719%0.185CC..Hα-helixtrans-62.6-38.5177.7178.2142.4000111.9Q342 F343 M348 E349 L350 L529 Y532 L580Q342-L346 WeakPolarHBondContact O-CB 3.34Å; Q342-L346 PolarHBondContact O-N 3.32Å; F343-L346 PolarHBondContact O-N 3.18Å; L346-M348 VanDerWaalsContact C-N 3.34Å; L346-E349 PolarHBondContact O-N 3.47Å; L346-L350 HydrophobicContact CD2-CD1 3.53Å; L346-L350 HydrophobicContact CD2-CG 4.35Å; L346-L350 HydrophobicContact CG-CD1 4.37Å; L346-L350 VanDerWaalsContact O-CG 3.31Å; L346-L350 WeakPolarHBondContact O-CG 3.25Å; L346-L350 PolarHBondContact O-N 2.88Å; L346-L529 HydrophobicContact CD2-CD2 3.3Å; L346-Y532 HydrophobicContact CD1-CD1 3.46Å; L346-Y532 VanDerWaalsContact CD1-CD1 3.46Å; L346-Y532 HydrophobicContact CD1-CD2 4.01Å; L346-Y532 HydrophobicContact CD1-CE1 3.19Å; L346-Y532 HydrophobicContact CD1-CE2 3.79Å; L346-Y532 HydrophobicContact CD1-CG 3.87Å; L346-L580 HydrophobicContact CD1-CD2 4.36Å; L346-L580 HydrophobicContact CD2-CD2 4.32Å
347L80.7Confident76.3Confident25 Ų2538.2 Ų38.213%0.13120%0.198CC..Hα-helixtrans-65.3-36.7173.4-175.162000112.2F343 S344 K345 L350 D351 F359F343-L347 WeakPolarHBondContact O-CB 3.42Å; F343-L347 PolarHBondContact O-N 3.34Å; S344-L347 PolarHBondContact O-N 2.83Å; K345-L347 VanDerWaalsContact C-N 3.31Å; K345-L347 PolarHBondContact O-N 3.48Å; L347-L350 PolarHBondContact O-N 2.88Å; L347-D351 WeakPolarHBondContact O-CB 3.38Å; L347-D351 PolarHBondContact O-N 3.46Å; L347-F359 HydrophobicContact CD1-CD2 3.85Å; L347-F359 HydrophobicContact CD1-CE2 3.42Å; L347-F359 VanDerWaalsContact CD1-CE2 3.42Å; L347-F359 HydrophobicContact CD1-CZ 4.15Å; L347-F359 HydrophobicContact CD2-CD2 3.94Å; L347-F359 HydrophobicContact CD2-CE2 3.7Å; L347-F359 HydrophobicContact CG-CE2 4.22Å
348M74.7Confident75.5Confident47 Ų4736.3 Ų36.323%0.23219%0.189CC..Hα-helixtrans-67.2-38.3173-74.917960.500112.8S344 K345 L346 L350 D351 Q352 R441S344-M348 WeakPolarHBondContact O-CG 3.4Å; S344-M348 PolarHBondContact O-N 3.23Å; K345-M348 WeakPolarHBondContact O-CB 3.45Å; K345-M348 PolarHBondContact O-N 2.91Å; K345-M348 VanDerWaalsContact O-N 3.11Å; L346-M348 VanDerWaalsContact C-N 3.34Å; M348-L350 VanDerWaalsContact C-N 3.33Å; M348-D351 PolarHBondContact O-N 3.45Å; M348-Q352 WeakPolarHBondContact O-CB 3.4Å; M348-Q352 VanDerWaalsContact O-CG 3.31Å; M348-Q352 WeakPolarHBondContact O-CG 3.37Å; M348-Q352 PolarHBondContact O-N 2.76Å; M348-R441 HydrophobicContact CE-CB 4.32Å
349E79.2Confident74.7Confident62 Ų6237.4 Ų37.429%0.2919%0.193SC..Hα-helixtrans-61.5-43.3172.1-71172.3-161.900110.6K345 L346 Q352 M353 K583K345-E349 VanDerWaalsContact CE-OE1 3.26Å; K345-E349 WeakPolarHBondContact CE-OE1 3.17Å; K345-E349 PolarHBondContact O-N 3.31Å; L346-E349 PolarHBondContact O-N 3.47Å; E349-Q352 WeakPolarHBondContact O-CB 3.41Å; E349-Q352 PolarHBondContact O-N 3.29Å; E349-M353 WeakPolarHBondContact O-CG 3.19Å; E349-M353 PolarHBondContact O-N 3.08Å; E349-K583 IonicContact OE2-NZ 3.47Å; E349-K583 PolarHBondContact OE2-NZ 3.09Å
350L80.4Confident73.5Confident2 Ų239.1 Ų39.11%0.0120%0.2CC..Hα-helixtrans-65.6-43.6175.8-70.2166.3000112.6L346 L347 M348 Q352 M353 C354 L358 L529 L580L346-L350 HydrophobicContact CD2-CD1 3.53Å; L346-L350 HydrophobicContact CD2-CG 4.35Å; L346-L350 HydrophobicContact CG-CD1 4.37Å; L346-L350 VanDerWaalsContact O-CG 3.31Å; L346-L350 WeakPolarHBondContact O-CG 3.25Å; L346-L350 PolarHBondContact O-N 2.88Å; L347-L350 PolarHBondContact O-N 2.88Å; M348-L350 VanDerWaalsContact C-N 3.33Å; L350-Q352 VanDerWaalsContact C-N 3.27Å; L350-Q352 PolarHBondContact O-N 3.4Å; L350-M353 HydrophobicContact CD2-CE 3.51Å; L350-M353 HydrophobicContact CG-CE 4.38Å; L350-M353 PolarHBondContact O-N 3.1Å; L350-M353 VanDerWaalsContact O-N 3.16Å; L350-C354 PolarHBondContact O-N 3.25Å; L350-L358 HydrophobicContact CB-CD1 3.33Å; L350-L358 HydrophobicContact CG-CD1 4.47Å; L350-L358 WeakPolarHBondContact O-CD1 3.4Å; L350-L529 HydrophobicContact CD1-CD2 3.88Å; L350-L580 HydrophobicContact CD1-CD1 4.03Å; L350-L580 HydrophobicContact CD1-CD2 4.19Å; L350-L580 HydrophobicContact CD2-CD1 3.88Å; L350-L580 HydrophobicContact CD2-CD2 3.93Å; L350-L580 HydrophobicContact CD2-CG 3.85Å; L350-L580 HydrophobicContact CG-CD2 4.41Å
351D74.8Confident72.6Confident18 Ų1840.7 Ų40.710%0.09621%0.207CC..Hα-helixtrans-55.5-43172.7-80-10.7000110.3L347 M348 C354 G355 L356 L358 R441L347-D351 WeakPolarHBondContact O-CB 3.38Å; L347-D351 PolarHBondContact O-N 3.46Å; M348-D351 PolarHBondContact O-N 3.45Å; D351-C354 PolarHBondContact O-N 2.83Å; D351-G355 PolarHBondContact O-N 2.95Å; D351-L356 PolarHBondContact O-N 2.88Å; D351-L358 PolarHBondContact OD1-N 3.28Å; D351-R441 IonicContact OD2-CZ 3.71Å; D351-R441 IonicContact OD2-NH1 3.42Å; D351-R441 PolarHBondContact OD2-NH1 3.03Å; D351-R441 IonicContact OD2-NH2 3.63Å
352Q74.9Confident71.8Confident104 Ų10439.6 Ų39.649%0.48620%0.2SC..Hα-helixtrans-65.9-40176.2-74.6174.1-0.800112.8M348 E349 L350 C354 G355M348-Q352 WeakPolarHBondContact O-CB 3.4Å; M348-Q352 VanDerWaalsContact O-CG 3.31Å; M348-Q352 WeakPolarHBondContact O-CG 3.37Å; M348-Q352 PolarHBondContact O-N 2.76Å; E349-Q352 WeakPolarHBondContact O-CB 3.41Å; E349-Q352 PolarHBondContact O-N 3.29Å; L350-Q352 VanDerWaalsContact C-N 3.27Å; L350-Q352 PolarHBondContact O-N 3.4Å; Q352-C354 VanDerWaalsContact C-N 3.31Å; Q352-C354 PolarHBondContact O-N 2.99Å; Q352-G355 PolarHBondContact O-N 3.37Å
353M73.8Confident70.9Confident31 Ų3133 Ų3315%0.15317%0.17CC..Hα-helixtrans-64.5-36.1176.2-69.1-158.3-64.800112.3E349 L350 L576 P608 A611 V615E349-M353 WeakPolarHBondContact O-CG 3.19Å; E349-M353 PolarHBondContact O-N 3.08Å; L350-M353 HydrophobicContact CD2-CE 3.51Å; L350-M353 HydrophobicContact CG-CE 4.38Å; L350-M353 PolarHBondContact O-N 3.1Å; L350-M353 VanDerWaalsContact O-N 3.16Å; M353-L576 HydrophobicContact CB-CD2 4Å; M353-L576 HydrophobicContact CE-CD2 4.08Å; M353-P608 WeakPolarHBondContact O-CA 3.4Å; M353-A611 HydrophobicContact CB-CB 3.6Å; M353-A611 HydrophobicContact CG-CB 3.71Å; M353-A611 HydrophobicContact SD-CB 4.04Å; M353-V615 HydrophobicContact SD-CG2 3.68Å
354C70.3Confident69.4Low3 Ų337.5 Ų37.52%0.0220%0.198CC..Hα-helixtrans-77-31.7175.6-170.80000113L350 D351 Q352 L356 L358 L576L350-C354 PolarHBondContact O-N 3.25Å; D351-C354 PolarHBondContact O-N 2.83Å; Q352-C354 VanDerWaalsContact C-N 3.31Å; Q352-C354 PolarHBondContact O-N 2.99Å; C354-L356 PolarHBondContact O-N 3.08Å; C354-L358 HydrophobicContact CB-CD1 4.44Å; C354-L358 HydrophobicContact CB-CD2 3.63Å; C354-L358 HydrophobicContact CB-CG 3.84Å; C354-L576 HydrophobicContact CB-CD1 4.37Å
355G61Low68.2Low30 Ų3038.1 Ų38.131%0.30920%0.202SC..THydrogen-bonded Turntrans79.40.2-17100000113.9D351 Q352D351-G355 PolarHBondContact O-N 2.95Å; Q352-G355 PolarHBondContact O-N 3.37Å
356L64.8Low67.1Low51 Ų5134.9 Ų34.927%0.26719%0.189SC..SBendtrans-137.6151.7-179.8-68.5173.1000109.6D351 C354 L358 F361 I756D351-L356 PolarHBondContact O-N 2.88Å; C354-L356 PolarHBondContact O-N 3.08Å; L356-L358 PolarHBondContact O-N 3.43Å; L356-L358 VanDerWaalsContact O-N 3.09Å; L356-F361 HydrophobicContact CD1-CD2 4.02Å; L356-F361 HydrophobicContact CD1-CG 4.33Å; L356-I756 HydrophobicContact CD1-CD1 3.81Å; L356-I756 HydrophobicContact CD1-CG1 4.43Å
357P60.7Low66.2Low41 Ų4135.1 Ų35.127%0.26619%0.191SC..  trans-60.8112.2171.924.2-32.5000110.4F359 E360 F361P357-F359 PolarHBondContact O-N 2.98Å; P357-E360 HydrophobicContact CB-CB 4.3Å; P357-E360 HydrophobicContact CB-CG 4.06Å; P357-E360 HydrophobicContact CG-CB 4.06Å; P357-E360 HydrophobicContact CG-CG 4.07Å; P357-E360 VanDerWaalsContact CG-OE2 3.27Å; P357-E360 WeakPolarHBondContact CG-OE2 3.44Å; P357-E360 WeakPolarHBondContact O-CB 3.39Å; P357-E360 PolarHBondContact O-N 3.32Å; P357-F361 PolarHBondContact O-N 2.94Å; P357-F361 VanDerWaalsContact O-N 3.1Å
358L66.4Low65.4Low0 Ų040.5 Ų40.50%022%0.216CC..Hα-helixtrans-63.5-48-162.4-91.6168.9000113.9L350 D351 C354 L356 E360 F361 L362 L525 L576L350-L358 HydrophobicContact CB-CD1 3.33Å; L350-L358 HydrophobicContact CG-CD1 4.47Å; L350-L358 WeakPolarHBondContact O-CD1 3.4Å; D351-L358 PolarHBondContact OD1-N 3.28Å; C354-L358 HydrophobicContact CB-CD1 4.44Å; C354-L358 HydrophobicContact CB-CD2 3.63Å; C354-L358 HydrophobicContact CB-CG 3.84Å; L356-L358 PolarHBondContact O-N 3.43Å; L356-L358 VanDerWaalsContact O-N 3.09Å; L358-E360 PolarHBondContact O-N 3.22Å; L358-E360 VanDerWaalsContact O-N 3.14Å; L358-F361 PolarHBondContact O-N 3.37Å; L358-F361 VanDerWaalsContact O-N 3.08Å; L358-L362 HydrophobicContact CB-CD1 4.35Å; L358-L362 HydrophobicContact CD2-CD1 4.03Å; L358-L362 HydrophobicContact CD2-CG 4.33Å; L358-L362 WeakPolarHBondContact O-CB 3.15Å; L358-L362 WeakPolarHBondContact O-CG 3.3Å; L358-L362 PolarHBondContact O-N 3.14Å; L358-L525 HydrophobicContact CD1-CD2 4.4Å; L358-L576 HydrophobicContact CD1-CD1 4.14Å; L358-L576 HydrophobicContact CD2-CD1 3.45Å; L358-L576 VanDerWaalsContact CD2-CD1 3.45Å; L358-L576 HydrophobicContact CG-CD1 4.43Å
359F64.8Low64.9Low28 Ų2838.3 Ų38.312%0.12321%0.205CC..Hα-helixtrans-68.2-12.7-179.3-69-51.3000113.4L347 P357 T363 M522 L525 L529L347-F359 HydrophobicContact CD1-CD2 3.85Å; L347-F359 HydrophobicContact CD1-CE2 3.42Å; L347-F359 VanDerWaalsContact CD1-CE2 3.42Å; L347-F359 HydrophobicContact CD1-CZ 4.15Å; L347-F359 HydrophobicContact CD2-CD2 3.94Å; L347-F359 HydrophobicContact CD2-CE2 3.7Å; L347-F359 HydrophobicContact CG-CE2 4.22Å; P357-F359 PolarHBondContact O-N 2.98Å; F359-T363 PolarHBondContact O-OG1 3.16Å; F359-M522 HydrophobicContact CD1-CE 3.6Å; F359-M522 HydrophobicContact CD1-SD 3.34Å; F359-M522 WeakPolarHBondContact CD1-SD 3.24Å; F359-M522 HydrophobicContact CE1-CE 3.63Å; F359-M522 HydrophobicContact CE1-SD 3.53Å; F359-M522 VanDerWaalsContact CE1-SD 3.53Å; F359-M522 HydrophobicContact CG-CE 4.44Å; F359-M522 HydrophobicContact CG-SD 4.5Å; F359-M522 HydrophobicContact CZ-CE 4.5Å; F359-L525 HydrophobicContact CD1-CD2 4.43Å; F359-L525 HydrophobicContact CE1-CD2 3.85Å; F359-L525 HydrophobicContact CZ-CD2 4.29Å; F359-L529 HydrophobicContact CZ-CD1 4.17Å
360E57.9Low64.4Low49 Ų4936.1 Ų36.123%0.22920%0.196CC..Hα-helixtrans-86.4-36.5169.2-60.9177.8-157.600112.5P357 L358 T363 R374P357-E360 HydrophobicContact CB-CB 4.3Å; P357-E360 HydrophobicContact CB-CG 4.06Å; P357-E360 HydrophobicContact CG-CB 4.06Å; P357-E360 HydrophobicContact CG-CG 4.07Å; P357-E360 VanDerWaalsContact CG-OE2 3.27Å; P357-E360 WeakPolarHBondContact CG-OE2 3.44Å; P357-E360 WeakPolarHBondContact O-CB 3.39Å; P357-E360 PolarHBondContact O-N 3.32Å; L358-E360 PolarHBondContact O-N 3.22Å; L358-E360 VanDerWaalsContact O-N 3.14Å; E360-T363 PolarHBondContact O-OG1 3.28Å; E360-R374 HydrophobicContact CG-CG 4.38Å; E360-R374 WeakPolarHBondContact OE2-CD 3.46Å; E360-R374 WeakPolarHBondContact OE2-CG 3.37Å; E360-R374 IonicContact OE2-CZ 3.3Å; E360-R374 IonicContact OE2-NE 2.7Å; E360-R374 PolarHBondContact OE2-NE 3.2Å; E360-R374 IonicContact OE2-NH2 3.66Å
361F62.3Low63.7Low47 Ų4739.7 Ų39.721%0.20622%0.215CC..Hα-helixtrans-73.5-36.3176.6178.9-113.2000112.6L356 P357 L358 T363 A569 T572 I756L356-F361 HydrophobicContact CD1-CD2 4.02Å; L356-F361 HydrophobicContact CD1-CG 4.33Å; P357-F361 PolarHBondContact O-N 2.94Å; P357-F361 VanDerWaalsContact O-N 3.1Å; L358-F361 PolarHBondContact O-N 3.37Å; L358-F361 VanDerWaalsContact O-N 3.08Å; F361-T363 PolarHBondContact O-N 3.49Å; F361-A569 HydrophobicContact CE1-CB 4.12Å; F361-A569 HydrophobicContact CZ-CB 4.3Å; F361-T572 HydrophobicContact CD1-CG2 4.26Å; F361-T572 HydrophobicContact CE1-CG2 3.92Å; F361-I756 HydrophobicContact CD1-CD1 4.14Å; F361-I756 HydrophobicContact CD2-CD1 4.27Å; F361-I756 HydrophobicContact CE1-CD1 3.58Å; F361-I756 HydrophobicContact CE2-CD1 3.75Å; F361-I756 HydrophobicContact CG-CD1 4.46Å; F361-I756 HydrophobicContact CZ-CB 4.43Å; F361-I756 HydrophobicContact CZ-CD1 3.38Å; F361-I756 HydrophobicContact CZ-CG1 4.47Å; F361-I756 HydrophobicContact CZ-CG2 4.16Å
362L61.3Low63.4Low1 Ų139.1 Ų39.11%0.00521%0.213CC..THydrogen-bonded Turntrans-79.40.8-176.9-61.4172.8000113.8L358 P521 L525 A569L358-L362 HydrophobicContact CB-CD1 4.35Å; L358-L362 HydrophobicContact CD2-CD1 4.03Å; L358-L362 HydrophobicContact CD2-CG 4.33Å; L358-L362 WeakPolarHBondContact O-CB 3.15Å; L358-L362 WeakPolarHBondContact O-CG 3.3Å; L358-L362 PolarHBondContact O-N 3.14Å; L362-P521 HydrophobicContact CB-CB 4.29Å; L362-P521 HydrophobicContact CD2-CB 3.85Å; L362-P521 WeakPolarHBondContact O-CG 3.26Å; L362-L525 HydrophobicContact CD1-CB 4.14Å; L362-L525 HydrophobicContact CD1-CD2 3.43Å; L362-L525 VanDerWaalsContact CD1-CD2 3.43Å; L362-L525 HydrophobicContact CD1-CG 4.37Å; L362-A569 HydrophobicContact CD2-CB 4.38Å; L362-A569 VanDerWaalsContact CD2-O 3.28Å; L362-A569 WeakPolarHBondContact CD2-O 3.34Å
363T58.7Low63Low15 Ų1535.2 Ų35.29%0.09220%0.196CC..  trans-106.1105.4178.524.70000113.7F359 E360 F361 S365 H366 F480F359-T363 PolarHBondContact O-OG1 3.16Å; E360-T363 PolarHBondContact O-OG1 3.28Å; F361-T363 PolarHBondContact O-N 3.49Å; T363-S365 PolarHBondContact O-N 3.07Å; T363-H366 PolarHBondContact OG1-CE1 3.41Å; T363-H366 PolarHBondContact OG1-ND1 3.23Å; T363-F480 HydrophobicContact CG2-CD2 3.89Å; T363-F480 HydrophobicContact CG2-CE1 3.99Å; T363-F480 HydrophobicContact CG2-CE2 3.12Å; T363-F480 HydrophobicContact CG2-CZ 3.17Å
364V51.8Low62.5Low100 Ų10036.8 Ų36.861%0.60620%0.2SC*.SBendtrans-78.3-5.8169.2-171.30000111.9
365S49.7Very low62Low32 Ų3238.5 Ų38.522%0.22421%0.211CC..SBendtrans-147.388-178.842.30000110.6T363 H476T363-S365 PolarHBondContact O-N 3.07Å; S365-H476 PolarHBondContact OG-NE2 3.21Å
366H58Low62.2Low40 Ų4037.2 Ų37.219%0.18520%0.197CC..  trans-76.2146.4170.2-64.4-84.5000110.6T363 S370 L371 R374T363-H366 PolarHBondContact OG1-CE1 3.41Å; T363-H366 PolarHBondContact OG1-ND1 3.23Å; H366-S370 PolarHBondContact ND1-OG 3.36Å; H366-L371 HydrophobicContact CB-CD1 4.33Å; H366-L371 HydrophobicContact CB-CD2 3.58Å; H366-L371 HydrophobicContact CB-CG 3.52Å; H366-L371 VanDerWaalsContact CD2-CD2 3.43Å; H366-L371 WeakPolarHBondContact CD2-CD2 3.31Å; H366-R374 PolarHBondContact NE2-NH1 2.72Å
367S64.2Low62.3Low11 Ų1136.8 Ų36.88%0.07719%0.194CC..  trans-62.8153.4156.143.70000109.7E192 G369 S370 L371E192-S367 WeakPolarHBondContact OE1-CB 3.43Å; E192-S367 PolarHBondContact OE1-OG 3.47Å; S367-G369 PolarHBondContact O-N 3.21Å; S367-S370 PolarHBondContact O-N 3.46Å; S367-S370 WeakPolarHBondContact OG-CB 3.27Å; S367-S370 PolarHBondContact OG-N 3.17Å; S367-S370 VanDerWaalsContact OG-N 3.15Å; S367-L371 PolarHBondContact O-N 3.34Å
368E63.3Low62.3Low139 Ų13936.3 Ų36.365%0.6519%0.192SC*.Hα-helixtrans-57.1-35.9171.4-65.9178.2168.300111.1I189 L371 A372I189-E368 HydrophobicContact CD1-CB 4.45Å; I189-E368 HydrophobicContact CG1-CB 4.31Å; E368-L371 PolarHBondContact O-N 3.06Å; E368-A372 WeakPolarHBondContact O-CB 3.35Å; E368-A372 PolarHBondContact O-N 3.49Å
369G65.1Low62Low0 Ų036.9 Ų36.90%020%0.195CC..Hα-helixtrans-63.1-38.5171.500000114.3S188 E192 S367 A372 V373S188-G369 PolarHBondContact OG-N 3.15Å; E192-G369 VanDerWaalsContact OE1-C 3.23Å; E192-G369 VanDerWaalsContact OE1-CA 3.29Å; E192-G369 WeakPolarHBondContact OE1-CA 3.17Å; S367-G369 PolarHBondContact O-N 3.21Å; G369-A372 WeakPolarHBondContact O-CB 3.11Å; G369-A372 PolarHBondContact O-N 3.35Å; G369-V373 WeakPolarHBondContact O-CG2 3.1Å; G369-V373 PolarHBondContact O-N 3.02Å
370S68.9Low61.8Low16 Ų1640 Ų4011%0.11221%0.206CC..Hα-helixtrans-74.3-36.1178.5177.20000111.3E192 H366 S367 A372 R374E192-S370 PolarHBondContact OE1-N 3.42Å; E192-S370 WeakPolarHBondContact OE2-CA 3.41Å; E192-S370 WeakPolarHBondContact OE2-CB 3.39Å; E192-S370 PolarHBondContact OE2-N 3.34Å; E192-S370 VanDerWaalsContact OE2-N 3.14Å; H366-S370 PolarHBondContact ND1-OG 3.36Å; S367-S370 PolarHBondContact O-N 3.46Å; S367-S370 WeakPolarHBondContact OG-CB 3.27Å; S367-S370 PolarHBondContact OG-N 3.17Å; S367-S370 VanDerWaalsContact OG-N 3.15Å; S370-A372 VanDerWaalsContact C-N 3.33Å; S370-R374 WeakPolarHBondContact O-CB 3.21Å; S370-R374 PolarHBondContact O-N 3.42Å
371L64.4Low62.1Low78 Ų7838.5 Ų38.541%0.40820%0.199SC..Hα-helixtrans-61.7-42167-70176.8000111.4H366 S367 E368 R374 T375H366-L371 HydrophobicContact CB-CD1 4.33Å; H366-L371 HydrophobicContact CB-CD2 3.58Å; H366-L371 HydrophobicContact CB-CG 3.52Å; H366-L371 VanDerWaalsContact CD2-CD2 3.43Å; H366-L371 WeakPolarHBondContact CD2-CD2 3.31Å; S367-L371 PolarHBondContact O-N 3.34Å; E368-L371 PolarHBondContact O-N 3.06Å; L371-R374 PolarHBondContact O-N 3.24Å; L371-T375 VanDerWaalsContact O-CB 3.23Å; L371-T375 WeakPolarHBondContact O-CB 3.35Å; L371-T375 PolarHBondContact O-N 3.17Å; L371-T375 PolarHBondContact O-OG1 3.29Å
372A68.3Low61.8Low6 Ų637.5 Ų37.55%0.0520%0.197CC..Hα-helixtrans-64.9-50.6179.100000111.9L108 I189 E368 G369 S370 R374 T375 V376L108-A372 HydrophobicContact CD2-CB 3.3Å; L108-A372 VanDerWaalsContact CD2-O 3.28Å; L108-A372 WeakPolarHBondContact CD2-O 3.4Å; I189-A372 HydrophobicContact CB-CB 4.17Å; I189-A372 HydrophobicContact CD1-CB 4.35Å; I189-A372 HydrophobicContact CG1-CB 3.87Å; I189-A372 HydrophobicContact CG2-CB 3.47Å; I189-A372 VanDerWaalsContact CG2-CB 3.47Å; E368-A372 WeakPolarHBondContact O-CB 3.35Å; E368-A372 PolarHBondContact O-N 3.49Å; G369-A372 WeakPolarHBondContact O-CB 3.11Å; G369-A372 PolarHBondContact O-N 3.35Å; S370-A372 VanDerWaalsContact C-N 3.33Å; A372-R374 VanDerWaalsContact C-N 3.33Å; A372-R374 PolarHBondContact O-N 3.07Å; A372-T375 WeakPolarHBondContact O-CB 3.24Å; A372-T375 PolarHBondContact O-N 3.24Å; A372-T375 VanDerWaalsContact O-N 3.17Å; A372-V376 WeakPolarHBondContact O-CG2 3.18Å; A372-V376 PolarHBondContact O-N 3.37Å
373V68.2Low61.4Low21 Ų2139.7 Ų39.713%0.12721%0.208CC..Hα-helixtrans-57.6-46.5172.4165.20000111E192 L193 V196 G369 T375 V376 L377E192-V373 HydrophobicContact CB-CG2 3.71Å; L193-V373 HydrophobicContact CD2-CG2 3.99Å; V196-V373 HydrophobicContact CG2-CB 4.36Å; V196-V373 HydrophobicContact CG2-CG1 3.64Å; V196-V373 HydrophobicContact CG2-CG2 3.74Å; G369-V373 WeakPolarHBondContact O-CG2 3.1Å; G369-V373 PolarHBondContact O-N 3.02Å; V373-T375 VanDerWaalsContact C-N 3.29Å; V373-T375 PolarHBondContact O-N 2.86Å; V373-V376 PolarHBondContact O-N 3.22Å; V373-L377 HydrophobicContact CG1-CD1 3.68Å; V373-L377 HydrophobicContact CG1-CG 4.27Å; V373-L377 WeakPolarHBondContact O-CB 3.07Å; V373-L377 VanDerWaalsContact O-CG 3.25Å; V373-L377 WeakPolarHBondContact O-CG 3.26Å; V373-L377 PolarHBondContact O-N 3.5Å
374R63.1Low60.5Low65 Ų6540.7 Ų40.725%0.24521%0.214CC..Hα-helixtrans-57.7-43.4176.2-177.5174.7-169.8-163.8-7.6111.2E360 H366 S370 L371 A372 L377 S378E360-R374 HydrophobicContact CG-CG 4.38Å; E360-R374 WeakPolarHBondContact OE2-CD 3.46Å; E360-R374 WeakPolarHBondContact OE2-CG 3.37Å; E360-R374 IonicContact OE2-CZ 3.3Å; E360-R374 IonicContact OE2-NE 2.7Å; E360-R374 PolarHBondContact OE2-NE 3.2Å; E360-R374 IonicContact OE2-NH2 3.66Å; H366-R374 PolarHBondContact NE2-NH1 2.72Å; S370-R374 WeakPolarHBondContact O-CB 3.21Å; S370-R374 PolarHBondContact O-N 3.42Å; L371-R374 PolarHBondContact O-N 3.24Å; A372-R374 VanDerWaalsContact C-N 3.33Å; A372-R374 PolarHBondContact O-N 3.07Å; R374-L377 PolarHBondContact O-N 2.91Å; R374-S378 WeakPolarHBondContact O-CB 3.36Å; R374-S378 PolarHBondContact O-N 3.03Å; R374-S378 PolarHBondContact O-OG 3.29Å
375T59.6Low59.8Low39 Ų3937 Ų3724%0.23919%0.191CC..Hα-helixtrans-63.6-50.4177.8-61.50000111.2Q109 L371 A372 V373 L377 S378 T379Q109-T375 HydrophobicContact CB-CG2 4.43Å; Q109-T375 HydrophobicContact CG-CG2 3.25Å; L371-T375 VanDerWaalsContact O-CB 3.23Å; L371-T375 WeakPolarHBondContact O-CB 3.35Å; L371-T375 PolarHBondContact O-N 3.17Å; L371-T375 PolarHBondContact O-OG1 3.29Å; A372-T375 WeakPolarHBondContact O-CB 3.24Å; A372-T375 PolarHBondContact O-N 3.24Å; A372-T375 VanDerWaalsContact O-N 3.17Å; V373-T375 VanDerWaalsContact C-N 3.29Å; V373-T375 PolarHBondContact O-N 2.86Å; T375-L377 VanDerWaalsContact C-N 3.27Å; T375-L377 PolarHBondContact O-N 2.96Å; T375-S378 PolarHBondContact O-N 3.04Å; T375-S378 PolarHBondContact O-OG 3.31Å; T375-T379 WeakPolarHBondContact O-CG2 3.46Å; T375-T379 PolarHBondContact O-N 3.24Å
376V65.2Low58.8Low3 Ų337 Ų372%0.01819%0.193CC..Hα-helixtrans-57.6-41.1175.6169.70000111.6L108 A112 R116 L155 L193 A372 V373 T379L108-V376 HydrophobicContact CD1-CG2 3.7Å; L108-V376 HydrophobicContact CD2-CG2 3.73Å; L108-V376 HydrophobicContact CG-CG2 3.54Å; A112-V376 HydrophobicContact CB-CB 4.42Å; A112-V376 HydrophobicContact CB-CG1 4.19Å; A112-V376 HydrophobicContact CB-CG2 4.2Å; R116-V376 PolarHBondContact NH2-O 2.84Å; L155-V376 HydrophobicContact CD1-CG2 4.11Å; L155-V376 HydrophobicContact CD2-CB 4.39Å; L155-V376 HydrophobicContact CD2-CG1 3.44Å; L155-V376 VanDerWaalsContact CD2-CG1 3.44Å; L155-V376 HydrophobicContact CD2-CG2 4.02Å; L193-V376 HydrophobicContact CD2-CB 4.36Å; L193-V376 HydrophobicContact CD2-CG2 3.74Å; A372-V376 WeakPolarHBondContact O-CG2 3.18Å; A372-V376 PolarHBondContact O-N 3.37Å; V373-V376 PolarHBondContact O-N 3.22Å; V376-T379 PolarHBondContact O-OG1 3Å
377L66.3Low57.5Low41 Ų4138.5 Ų38.522%0.21521%0.208CC..Hα-helixtrans-72.6-47.7179.3-69.6177.1000110.9R116 V373 R374 T375 T379 Q437R116-L377 PolarHBondContact NH2-O 3.34Å; V373-L377 HydrophobicContact CG1-CD1 3.68Å; V373-L377 HydrophobicContact CG1-CG 4.27Å; V373-L377 WeakPolarHBondContact O-CB 3.07Å; V373-L377 VanDerWaalsContact O-CG 3.25Å; V373-L377 WeakPolarHBondContact O-CG 3.26Å; V373-L377 PolarHBondContact O-N 3.5Å; R374-L377 PolarHBondContact O-N 2.91Å; T375-L377 VanDerWaalsContact C-N 3.27Å; T375-L377 PolarHBondContact O-N 2.96Å; L377-T379 VanDerWaalsContact C-N 3.33Å; L377-T379 PolarHBondContact O-N 3.27Å; L377-Q437 VanDerWaalsContact C-NE2 3.32Å; L377-Q437 VanDerWaalsContact O-CD 3.31Å; L377-Q437 PolarHBondContact O-NE2 3.35Å
378S61.3Low55.8Low31 Ų3140.2 Ų40.222%0.21722%0.219CC..Hα-helixtrans-73.9-16.6-176.773.10000114.4R374 T375 R380R374-S378 WeakPolarHBondContact O-CB 3.36Å; R374-S378 PolarHBondContact O-N 3.03Å; R374-S378 PolarHBondContact O-OG 3.29Å; T375-S378 PolarHBondContact O-N 3.04Å; T375-S378 PolarHBondContact O-OG 3.31Å; S378-R380 PolarHBondContact O-N 2.68Å
379T59.6Low54.1Low12 Ų1239.8 Ų39.87%0.07422%0.22CC..SBendtrans-50.8121.2170.7470000109Q109 A112 R116 T375 V376 L377Q109-T379 HydrophobicContact CB-CG2 3.78Å; Q109-T379 HydrophobicContact CG-CG2 3.78Å; A112-T379 HydrophobicContact CB-CG2 4.37Å; R116-T379 VanDerWaalsContact CZ-OG1 3.27Å; R116-T379 PolarHBondContact NH1-O 3Å; R116-T379 PolarHBondContact NH2-O 2.58Å; R116-T379 VanDerWaalsContact NH2-O 3.13Å; R116-T379 PolarHBondContact NH2-OG1 3.36Å; T375-T379 WeakPolarHBondContact O-CG2 3.46Å; T375-T379 PolarHBondContact O-N 3.24Å; V376-T379 PolarHBondContact O-OG1 3Å; L377-T379 VanDerWaalsContact C-N 3.33Å; L377-T379 PolarHBondContact O-N 3.27Å
380R60.5Low52.3Low93 Ų9340.7 Ų40.735%0.35123%0.227SC..  trans-74.8136.5178.7-59.7-174.4-165.6173.311.2108.9E21 D22 F25 S378E21-R380 WeakPolarHBondContact OE1-CD 3.42Å; E21-R380 IonicContact OE1-NE 2.82Å; D22-R380 IonicContact OD1-CZ 2.64Å; D22-R380 IonicContact OD1-NH1 2.65Å; D22-R380 PolarHBondContact OD1-NH1 3.48Å; D22-R380 IonicContact OD1-NH2 2.64Å; F25-R380 HydrophobicContact CE2-CB 3.57Å; F25-R380 HydrophobicContact CE2-CG 4.21Å; F25-R380 HydrophobicContact CZ-CB 3.62Å; S378-R380 PolarHBondContact O-N 2.68Å
381W64.4Low50.2Low19 Ų1941.5 Ų41.57%0.07223%0.231CC..  trans-120.2121.7161.6-168.4-82.9000107.5I74 L113 R116 L117 Q120 I383 Q436I74-W381 HydrophobicContact CG2-CH2 3.98Å; I74-W381 HydrophobicContact CG2-CZ3 3.97Å; L113-W381 HydrophobicContact CB-CZ3 4.05Å; L113-W381 HydrophobicContact CD2-CE3 3.56Å; L113-W381 HydrophobicContact CD2-CZ3 3.88Å; L113-W381 WeakPolarHBondContact O-CZ3 3.29Å; R116-W381 HydrophobicContact CB-CD2 4.46Å; R116-W381 HydrophobicContact CB-CE3 3.87Å; R116-W381 HydrophobicContact CB-CH2 4.49Å; R116-W381 HydrophobicContact CB-CZ3 3.91Å; L117-W381 HydrophobicContact CB-CH2 3.82Å; L117-W381 HydrophobicContact CD1-CH2 4.19Å; L117-W381 HydrophobicContact CD1-CZ2 4.33Å; L117-W381 HydrophobicContact CG-CH2 4.49Å; Q120-W381 VanDerWaalsContact OE1-CE2 3.31Å; W381-I383 PolarHBondContact O-N 3.29Å; W381-I383 VanDerWaalsContact O-N 3.09Å; W381-Q436 VanDerWaalsContact CB-OE1 3.25Å; W381-Q436 VanDerWaalsContact CD1-CD 3.47Å
382P56.1Low48.5Very low26 Ų2638.4 Ų38.417%0.16922%0.216CC..  trans-74.9102.2172.931.7-31.5000107.3F25 V75 C79 V384F25-P382 HydrophobicContact CD1-CB 4.31Å; F25-P382 HydrophobicContact CD1-CG 3.74Å; F25-P382 HydrophobicContact CE1-CG 3.92Å; V75-P382 HydrophobicContact CG1-CG 3.38Å; C79-P382 PolarHBondContact SG-O 3.5Å; P382-V384 HydrophobicContact CB-CG2 3.99Å; P382-V384 PolarHBondContact O-N 2.96Å; P382-V384 VanDerWaalsContact O-N 3.16Å
383I51.9Low46.5Very low47 Ų4740 Ų4024%0.24122%0.223CC..  trans-61.2114.2151-60.6156.9000104.3W381 E435 Q436W381-I383 PolarHBondContact O-N 3.29Å; W381-I383 VanDerWaalsContact O-N 3.09Å; I383-E435 HydrophobicContact CD1-CB 3.54Å; I383-Q436 HydrophobicContact CD1-CB 3.65Å; I383-Q436 HydrophobicContact CD1-CG 3.76Å; I383-Q436 HydrophobicContact CG1-CB 3.85Å; I383-Q436 HydrophobicContact CG1-CG 3.64Å
384V40.2Very low44.5Very low35 Ų3540 Ų4021%0.21223%0.228CC..  trans-94.9-11.6173.3-174.50000110.2C32 C79 E82 P382C32-V384 HydrophobicContact CB-CB 4.41Å; C32-V384 HydrophobicContact CB-CG1 3.44Å; C32-V384 VanDerWaalsContact CB-CG1 3.44Å; C79-V384 HydrophobicContact CB-CB 4.28Å; C79-V384 HydrophobicContact CB-CG2 3.87Å; C79-V384 WeakPolarHBondContact SG-CG2 3.4Å; E82-V384 PolarHBondContact OE2-N 2.85Å; P382-V384 HydrophobicContact CB-CG2 3.99Å; P382-V384 PolarHBondContact O-N 2.96Å; P382-V384 VanDerWaalsContact O-N 3.16Å
385N36.6Very low42.9Very low22 Ų2239.8 Ų39.812%0.11823%0.234CC..  trans-136.2103.2176.4-80-43.5000116.5E82 V83 C388E82-N385 HydrophobicContact CB-CB 4.41Å; E82-N385 PolarHBondContact O-ND2 2.95Å; E82-N385 VanDerWaalsContact O-ND2 3.14Å; E82-N385 PolarHBondContact OE2-N 2.74Å; E82-N385 VanDerWaalsContact OE2-N 3.14Å; V83-N385 WeakPolarHBondContact CG2-ND2 3.41Å; N385-C388 HydrophobicContact CB-CB 4.05Å; N385-C388 VanDerWaalsContact CG-CB 3.41Å; N385-C388 WeakPolarHBondContact ND2-CB 3.48Å; N385-C388 PolarHBondContact ND2-SG 3.3Å; N385-C388 VanDerWaalsContact ND2-SG 3.38Å; N385-C388 WeakPolarHBondContact OD1-CB 3.29Å; N385-C388 PolarHBondContact OD1-N 3.36Å; N385-C388 PolarHBondContact OD1-SG 2.94Å
386A29.5Very low41.4Very low34 Ų3440.1 Ų40.128%0.28123%0.234SC..SBend-86.5-21.7125.300000111.3C388 I389A386-C388 VanDerWaalsContact C-N 3.3Å; A386-C388 PolarHBondContact O-N 3.06Å; A386-I389 PolarHBondContact O-N 3.47Å
387S30.9Very low39.6Very low70 Ų7045.2 Ų45.249%0.4927%0.267SS..THydrogen-bonded Turntrans-66.3-18-174.4-51.90000115.8V391S387-V391 WeakPolarHBondContact O-CG2 3.4Å
388C27.6Very low37.6Very low47 Ų4746.9 Ų46.932%0.31829%0.294SS..THydrogen-bonded Turntrans-108.6-5.4179.9-68.20000116.2N385 A386N385-C388 HydrophobicContact CB-CB 4.05Å; N385-C388 VanDerWaalsContact CG-CB 3.41Å; N385-C388 WeakPolarHBondContact ND2-CB 3.48Å; N385-C388 PolarHBondContact ND2-SG 3.3Å; N385-C388 VanDerWaalsContact ND2-SG 3.38Å; N385-C388 WeakPolarHBondContact OD1-CB 3.29Å; N385-C388 PolarHBondContact OD1-N 3.36Å; N385-C388 PolarHBondContact OD1-SG 2.94Å; A386-C388 VanDerWaalsContact C-N 3.3Å; A386-C388 PolarHBondContact O-N 3.06Å
389I28.2Very low36Very low131 Ų13152.6 Ų52.667%0.67232%0.322SS*.THydrogen-bonded Turntrans-109.9-12.7178.2-61.5-179.5000112.3A386A386-I389 PolarHBondContact O-N 3.47Å
390S26.8Very low34.3Very low19 Ų1957.5 Ų57.513%0.13335%0.354CS..  trans-96.714.6175.4-62.60000114.8A392S390-A392 VanDerWaalsContact C-N 3.27Å; S390-A392 PolarHBondContact O-N 3.1Å
391V25.5Very low32.6Very low32 Ų3260.9 Ų60.919%0.19437%0.372CS..  trans-78.472.2-171-1570000112.8S387 V416S387-V391 WeakPolarHBondContact O-CG2 3.4Å; V391-V416 HydrophobicContact CG1-CG2 4.48Å
392A28.2Very low30.6Very low13 Ų1365.4 Ų65.411%0.10741%0.405CS..  trans-145.292.517200000110.9S390S390-A392 VanDerWaalsContact C-N 3.27Å; S390-A392 PolarHBondContact O-N 3.1Å
393I26.1Very low29.1Very low39 Ų3968.7 Ų68.720%0.243%0.429CS..  trans-13.5129163.9-54.1105.8000116.4
394G26.6Very low27.7Very low21 Ų2170.9 Ų70.922%0.21645%0.448CS..  trans-171.284.7179.500000114.4A413G394-A413 WeakPolarHBondContact O-CB 3.4Å
395V29.7Very low26.9Very low61 Ų6175.1 Ų75.137%0.3747%0.47SS..  trans58.8107.1146.9-169.80000117.7
396L27.4Very low26.3Very low46 Ų4679.3 Ų79.324%0.24150%0.501CS..  trans-73.2130.7147.6-89.185.7000107.9L414L396-L414 HydrophobicContact CD1-CD2 4.14Å; L396-L414 HydrophobicContact CG-CD2 4.34Å
397P28.3Very low26Very low110 Ų11085.1 Ų85.171%0.71452%0.522SS*.  trans-75140.7170.932-33.2000110.4
398G25.4Very low25.7Very low77 Ų7789 Ų8979%0.79453%0.533SS*.  trans-160.452.3-174.500000112.6
399N26.1Very low25.6Very low150 Ų15092.6 Ų92.680%0.80255%0.548SS*.  trans-163.7127.2153.1-136.712.1000110.1F401N399-F401 PolarHBondContact O-N 2.91Å
400P25.3Very low25.4Very low115 Ų11590.1 Ų90.175%0.74754%0.541SS*.  trans-99.361.6-175.838.8-34.7000112.6
401F23.3Very low25.4Very low164 Ų16494.8 Ų94.872%0.71956%0.564SS**  trans-145.297.4164.8-96.2-82.1000109.1N399 R875N399-F401 PolarHBondContact O-N 2.91Å; F401-R875 VanDerWaalsContact CD1-NH2 3.28Å; F401-R875 VanDerWaalsContact CG-NH2 3.28Å; F401-R875 VanDerWaalsContact CZ-NE 3.33Å
402C24Very low25.5Very low113.5 Ų113.595.5 Ų95.577%0.76757%0.567SS**  trans-137122.4154-132.60000108.7
403S23.1Very low25.5Very low96.5 Ų96.597 Ų9768%0.67558%0.579SS**  trans-102.4133.5177.454.40000111.4
404S23.4Very low25.7Very low92.5 Ų92.598.7 Ų98.765%0.64759%0.588SS**  trans58.113315245.20000119.9
405D23Very low25.9Very low123 Ų123103.1 Ų103.166%0.65860%0.603SS**  trans86.781.2149.6-52.2-15000119.7K778D405-K778 IonicContact OD2-NZ 2.7Å
406S23.8Very low26Very low110.5 Ų110.5102.5 Ų102.577%0.77360%0.599SS**  trans120.291.1133.71240000115.8
407E23.9Very low26.2Very low157 Ų157102.6 Ų102.673%0.73460%0.6SS**  trans-108.3123.8159.7-70.5-169.3150.200111.4L409E407-L409 PolarHBondContact O-N 3.23Å
408Q24Very low26.3Very low150.5 Ų150.598.2 Ų98.270%0.70357%0.574SS**  trans-135.3114.1160.6-85.6178.3-14.200110.8N411 H753 A755Q408-N411 PolarHBondContact O-ND2 3.43Å; Q408-H753 PolarHBondContact NE2-O 2.94Å; Q408-A755 HydrophobicContact CG-CB 3.92Å; Q408-A755 VanDerWaalsContact NE2-CB 3.32Å
409L24.7Very low26.7Very low123 Ų12396 Ų9664%0.64454%0.544SS*.  trans154.5153.2171.8-93.186.1000115.5E407 N411E407-L409 PolarHBondContact O-N 3.23Å; L409-N411 PolarHBondContact O-N 3.02Å; L409-N411 PolarHBondContact O-ND2 2.96Å
410P25Very low27Very low79 Ų7995.9 Ų95.951%0.51353%0.532SS..  trans-81.2107.2-158.130.9-35.8000114L412 A413P410-L412 VanDerWaalsContact C-N 3.27Å; P410-L412 PolarHBondContact O-N 3.12Å; P410-A413 PolarHBondContact O-N 3.19Å
411N25.8Very low27.1Very low117.5 Ų117.593.4 Ų93.463%0.62851%0.513SS*.Hα-helixtrans-72.850.2178.2-64.8-57.7000112.9Q408 L409 A413 L414 E415Q408-N411 PolarHBondContact O-ND2 3.43Å; L409-N411 PolarHBondContact O-N 3.02Å; L409-N411 PolarHBondContact O-ND2 2.96Å; N411-A413 VanDerWaalsContact C-N 3.27Å; N411-A413 PolarHBondContact O-N 3.15Å; N411-L414 PolarHBondContact O-N 2.94Å; N411-L414 VanDerWaalsContact O-N 3.13Å; N411-E415 PolarHBondContact O-N 3.49Å; N411-E415 VanDerWaalsContact O-N 3.09Å
412L28.3Very low27.2Very low47.5 Ų47.587.9 Ų87.925%0.24950%0.502CS..Hα-helixtrans-108.9-18.5175-139.280.4000114.1P410 E415 V416 D899 C902 L903P410-L412 VanDerWaalsContact C-N 3.27Å; P410-L412 PolarHBondContact O-N 3.12Å; L412-E415 PolarHBondContact O-N 3.41Å; L412-V416 WeakPolarHBondContact O-CB 3.29Å; L412-V416 VanDerWaalsContact O-CG2 3.26Å; L412-V416 WeakPolarHBondContact O-CG2 3.21Å; L412-V416 PolarHBondContact O-N 3.46Å; L412-D899 HydrophobicContact CD2-CB 3.85Å; L412-D899 WeakPolarHBondContact CD2-O 3.43Å; L412-C902 HydrophobicContact CD2-CB 3.45Å; L412-C902 VanDerWaalsContact CD2-CB 3.45Å; L412-L903 HydrophobicContact CD1-CD2 4.11Å; L412-L903 HydrophobicContact CD1-CG 4.35Å
413A27.5Very low27.4Very low44.5 Ų44.588.7 Ų88.737%0.36850%0.497SS..Hα-helixtrans-85.9-11-173.500000113.5G394 P410 N411 E415 V416 L417G394-A413 WeakPolarHBondContact O-CB 3.4Å; P410-A413 PolarHBondContact O-N 3.19Å; N411-A413 VanDerWaalsContact C-N 3.27Å; N411-A413 PolarHBondContact O-N 3.15Å; A413-E415 PolarHBondContact O-N 2.82Å; A413-V416 PolarHBondContact O-N 3.42Å; A413-L417 VanDerWaalsContact O-CB 3.25Å; A413-L417 WeakPolarHBondContact O-CB 3.32Å; A413-L417 VanDerWaalsContact O-CD1 3.28Å; A413-L417 WeakPolarHBondContact O-CD1 3.41Å; A413-L417 WeakPolarHBondContact O-CG 3.06Å; A413-L417 PolarHBondContact O-N 3.12Å
414L30.8Very low27.5Very low74 Ų7493.6 Ų93.639%0.38751%0.507SS..Hα-helixtrans-93.6-18.1177.7-89.4134.9000114.3L396 N411 R420L396-L414 HydrophobicContact CD1-CD2 4.14Å; L396-L414 HydrophobicContact CG-CD2 4.34Å; N411-L414 PolarHBondContact O-N 2.94Å; N411-L414 VanDerWaalsContact O-N 3.13Å; L414-R420 HydrophobicContact CD1-CG 4.39Å
415E31Very low27.7Very low112.5 Ų112.594.9 Ų94.953%0.52650%0.502SS..Hα-helixtrans-72.2-33.4178.3-68.8-172.7143.300112.8N411 L412 A413 G418 R1252N411-E415 PolarHBondContact O-N 3.49Å; N411-E415 VanDerWaalsContact O-N 3.09Å; L412-E415 PolarHBondContact O-N 3.41Å; A413-E415 PolarHBondContact O-N 2.82Å; E415-G418 PolarHBondContact O-N 3.33Å; E415-R1252 PolarHBondContact O-NH2 2.94Å; E415-R1252 VanDerWaalsContact O-NH2 3.16Å
416V33Very low27.8Very low48 Ų4896.6 Ų96.629%0.29151%0.507SS..Hα-helixtrans-76.2-23.6-178.7179.60000112.1V391 L412 A413 G418 L948 A951 T1248 R1252V391-V416 HydrophobicContact CG1-CG2 4.48Å; L412-V416 WeakPolarHBondContact O-CB 3.29Å; L412-V416 VanDerWaalsContact O-CG2 3.26Å; L412-V416 WeakPolarHBondContact O-CG2 3.21Å; L412-V416 PolarHBondContact O-N 3.46Å; A413-V416 PolarHBondContact O-N 3.42Å; V416-G418 PolarHBondContact O-N 3.48Å; V416-L948 HydrophobicContact CG1-CB 4.47Å; V416-L948 HydrophobicContact CG1-CD2 3.75Å; V416-A951 HydrophobicContact CG1-CB 4.43Å; V416-T1248 HydrophobicContact CG1-CG2 4.38Å; V416-T1248 VanDerWaalsContact O-CG2 3.26Å; V416-T1248 WeakPolarHBondContact O-CG2 3Å; V416-R1252 PolarHBondContact O-NH2 3.35Å
417L31.4Very low27.8Very low50 Ų5094.2 Ų94.226%0.26249%0.49SS..THydrogen-bonded Turntrans-93.30.3179.8-76.2170.8000115.3A413 L419 V1244 I1287A413-L417 VanDerWaalsContact O-CB 3.25Å; A413-L417 WeakPolarHBondContact O-CB 3.32Å; A413-L417 VanDerWaalsContact O-CD1 3.28Å; A413-L417 WeakPolarHBondContact O-CD1 3.41Å; A413-L417 WeakPolarHBondContact O-CG 3.06Å; A413-L417 PolarHBondContact O-N 3.12Å; L417-L419 VanDerWaalsContact C-N 3.27Å; L417-L419 HydrophobicContact CB-CD1 4.38Å; L417-L419 VanDerWaalsContact O-CD1 3.32Å; L417-L419 WeakPolarHBondContact O-CD1 3.42Å; L417-L419 WeakPolarHBondContact O-CG 3.46Å; L417-L419 PolarHBondContact O-N 3.17Å; L417-V1244 HydrophobicContact CD2-CG1 3.23Å; L417-I1287 HydrophobicContact CD2-CD1 4.39Å
418G30.1Very low27.8Very low16 Ų1692.9 Ų92.917%0.16549%0.488CS..  trans68.95.6164.600000117.5E415 V416 R420 D421 R866 W1290E415-G418 PolarHBondContact O-N 3.33Å; V416-G418 PolarHBondContact O-N 3.48Å; G418-R420 PolarHBondContact O-N 3.36Å; G418-D421 PolarHBondContact O-N 2.96Å; G418-R866 PolarHBondContact O-NH2 3.4Å; G418-W1290 VanDerWaalsContact C-NE1 3.27Å; G418-W1290 PolarHBondContact O-NE1 3.07Å
419L33.7Very low27.9Very low32 Ų3288.2 Ų88.217%0.16848%0.479CS..THydrogen-bonded Turntrans-91.337.6-172.3-71.9161.5000114L417 C902 L903 W1290L417-L419 VanDerWaalsContact C-N 3.27Å; L417-L419 HydrophobicContact CB-CD1 4.38Å; L417-L419 VanDerWaalsContact O-CD1 3.32Å; L417-L419 WeakPolarHBondContact O-CD1 3.42Å; L417-L419 WeakPolarHBondContact O-CG 3.46Å; L417-L419 PolarHBondContact O-N 3.17Å; L419-C902 HydrophobicContact CD1-CB 4.1Å; L419-L903 HydrophobicContact CD2-CB 4.44Å; L419-L903 HydrophobicContact CD2-CD2 3.42Å; L419-L903 VanDerWaalsContact CD2-CD2 3.42Å; L419-L903 HydrophobicContact CD2-CG 3.57Å; L419-W1290 HydrophobicContact CD2-CB 3.98Å; L419-W1290 HydrophobicContact CD2-CG 4.12Å
420R31.1Very low27.8Very low147.5 Ų147.590.5 Ų90.556%0.55748%0.481SS*.THydrogen-bonded Turntrans-119.732.8179.2-151-178.1-175.6-166-0.4113.5L414 G418 G422 Q425L414-R420 HydrophobicContact CD1-CG 4.39Å; G418-R420 PolarHBondContact O-N 3.36Å; R420-G422 PolarHBondContact O-N 2.89Å; R420-Q425 PolarHBondContact O-NE2 3.25Å
421D27.6Very low28.1Very low62 Ų6293.3 Ų93.333%0.33249%0.487SS..  trans-109.1114173.7-77.9-36.3000111.6G418 L870 R1252 R1294 R1334G418-D421 PolarHBondContact O-N 2.96Å; D421-L870 WeakPolarHBondContact OD2-CB 3.41Å; D421-L870 WeakPolarHBondContact OD2-CD2 3.46Å; D421-R1252 IonicContact OD2-CZ 2.74Å; D421-R1252 IonicContact OD2-NH1 3.54Å; D421-R1252 PolarHBondContact OD2-NH1 2.95Å; D421-R1252 IonicContact OD2-NH2 3.4Å; D421-R1294 PolarHBondContact O-NH1 3.28Å; D421-R1334 PolarHBondContact O-NH1 3.16Å
422G26.2Very low28.2Very low48 Ų4894.5 Ų94.550%0.49549%0.489SS..  trans136.666.8171.500000117.4R420R420-G422 PolarHBondContact O-N 2.89Å
423I27.7Very low28.1Very low131.5 Ų131.599.8 Ų99.867%0.67451%0.512SS*.  trans-169.1121.7138.1-84.2137.7000107Q425I423-Q425 PolarHBondContact O-N 3.47Å
424K25.9Very low28.2Very low199.5 Ų199.5103.1 Ų103.187%0.86752%0.52SS*.  trans-29.393.8168.3-64.9-177.6-179.6-178.80111.6E426K424-E426 PolarHBondContact O-N 3.14Å
425Q26.9Very low28.2Very low118.5 Ų118.5103.1 Ų103.155%0.55452%0.518SS*.  trans-115.1122.3166.6-159.1178.946.800108.7R420 I423 S427 F719R420-Q425 PolarHBondContact O-NE2 3.25Å; I423-Q425 PolarHBondContact O-N 3.47Å; Q425-S427 PolarHBondContact O-N 2.85Å; Q425-F719 WeakPolarHBondContact O-CE1 3.42Å; Q425-F719 WeakPolarHBondContact O-CZ 3.46Å
426E25.4Very low28.1Very low160.5 Ų160.5101.4 Ų101.475%0.7551%0.51SS*.  trans-69.1143.5-172.4-71.1-179.3141.400111.7K424 N428K424-E426 PolarHBondContact O-N 3.14Å; E426-N428 PolarHBondContact O-N 3.34Å
427S23.6Very low28.1Very low60 Ų60104.9 Ų104.942%0.4252%0.523SS..  trans-62.5124.8-177.159.60000111.8Q425 F719 S720 S721Q425-S427 PolarHBondContact O-N 2.85Å; S427-F719 WeakPolarHBondContact OG-CA 3.45Å; S427-F719 WeakPolarHBondContact OG-CB 3.48Å; S427-F719 WeakPolarHBondContact OG-CD1 3.4Å; S427-S720 CarbonylContact O-C 3Å; S427-S720 VanDerWaalsContact O-CA 3.3Å; S427-S720 WeakPolarHBondContact O-CA 3.42Å; S427-S720 PolarHBondContact O-N 3.03Å; S427-S720 WeakPolarHBondContact OG-CA 3.49Å; S427-S720 PolarHBondContact OG-N 3.4Å; S427-S721 VanDerWaalsContact C-N 3.29Å; S427-S721 VanDerWaalsContact CA-OG 3.3Å; S427-S721 WeakPolarHBondContact CA-OG 3.45Å; S427-S721 WeakPolarHBondContact CB-OG 3.39Å; S427-S721 PolarHBondContact O-N 3Å; S427-S721 PolarHBondContact OG-N 3.41Å
428N24.1Very low28.2Very low128.5 Ų128.5105.4 Ų105.469%0.68752%0.524SS*.BIsolated β-bridgetrans175.6128.1145.9-97.1-29000109.5E426 S720 S721E426-N428 PolarHBondContact O-N 3.34Å; N428-S720 WeakPolarHBondContact CA-O 3.5Å; N428-S720 PolarHBondContact OD1-O 2.98Å; N428-S721 PolarHBondContact N-OG 2.94Å
429G25.3Very low28.1Very low51.5 Ų51.5111.9 Ų111.953%0.53154%0.544SS..  trans103.898.6168.900000116.5Q431G429-Q431 PolarHBondContact O-N 2.66Å
430Y24.4Very low27.9Very low172.5 Ų172.5112.3 Ų112.368%0.67656%0.557SS**  trans-71.4104144.7-71.3-119.6000107.5A722 T723 K818Y430-A722 WeakPolarHBondContact CA-O 3.49Å; Y430-A722 WeakPolarHBondContact CB-O 3.34Å; Y430-A722 VanDerWaalsContact CD2-O 3.27Å; Y430-A722 WeakPolarHBondContact CD2-O 3.39Å; Y430-A722 PolarHBondContact N-O 3.06Å; Y430-T723 HydrophobicContact CD1-CG2 4.09Å; Y430-T723 HydrophobicContact CE1-CG2 3.86Å; Y430-T723 HydrophobicContact CE2-CG2 4.48Å; Y430-K818 WeakPolarHBondContact OH-CE 3.13Å; Y430-K818 PolarHBondContact OH-NZ 3.42Å
431Q29.7Very low28.1Very low137 Ų137113.4 Ų113.464%0.6456%0.561SS**  trans-174.86.4165.5-85.5177.8-23.300114.7G429 H433 H434G429-Q431 PolarHBondContact O-N 2.66Å; Q431-H433 PolarHBondContact O-N 3.42Å; Q431-H434 PolarHBondContact O-N 3.44Å
432Q28.5Very low28.3Very low142.5 Ų142.5115.8 Ų115.867%0.66657%0.57SS**THydrogen-bonded Turntrans-79.4-1.2-178-71.3-175.2-38.900116H434 E435Q432-H434 VanDerWaalsContact C-N 3.26Å; Q432-H434 PolarHBondContact O-N 3.24Å; Q432-E435 PolarHBondContact O-N 2.84Å
433H27.3Very low28.8Very low158.5 Ų158.5118.7 Ų118.773%0.73457%0.574SS**THydrogen-bonded Turntrans-82.23.1-178.7-78.7-69.2000116.2Q431Q431-H433 PolarHBondContact O-N 3.42Å
434H29Very low29.4Very low114.5 Ų114.5117.5 Ų117.553%0.5356%0.564SS.*SBendtrans-103.4-3.8172.9-109.3-59.1000114.2Q431 Q432 Q436 Q437 Q438Q431-H434 PolarHBondContact O-N 3.44Å; Q432-H434 VanDerWaalsContact C-N 3.26Å; Q432-H434 PolarHBondContact O-N 3.24Å; H434-Q436 VanDerWaalsContact C-N 3.31Å; H434-Q436 PolarHBondContact O-N 2.77Å; H434-Q436 VanDerWaalsContact O-N 3.15Å; H434-Q437 PolarHBondContact ND1-OE1 3.06Å; H434-Q437 VanDerWaalsContact ND1-OE1 3.09Å; H434-Q437 PolarHBondContact O-N 2.81Å; H434-Q438 HydrophobicContact CB-CG 4.19Å; H434-Q438 WeakPolarHBondContact O-CG 3.15Å; H434-Q438 PolarHBondContact O-N 2.9Å; H434-Q438 VanDerWaalsContact O-N 3.13Å
435E29.6Very low30.3Very low74.5 Ų74.5110.6 Ų110.635%0.34854%0.541SS..Hα-helixtrans-75.6-29.3-168.5-69.8179.1143.100113.8I383 Q432 Q437 Q438 Y439I383-E435 HydrophobicContact CD1-CB 3.54Å; Q432-E435 PolarHBondContact O-N 2.84Å; E435-Q437 PolarHBondContact O-N 3.34Å; E435-Q438 CarbonylContact O-C 3.58Å; E435-Q438 WeakPolarHBondContact O-CA 3.42Å; E435-Q438 VanDerWaalsContact O-CB 3.31Å; E435-Q438 WeakPolarHBondContact O-CB 3.45Å; E435-Q438 PolarHBondContact O-N 3.32Å; E435-Y439 HydrophobicContact CB-CE2 4.2Å; E435-Y439 VanDerWaalsContact O-CD2 3.24Å; E435-Y439 WeakPolarHBondContact O-CD2 3.27Å; E435-Y439 PolarHBondContact O-N 3.18Å
436Q30.5Very low31.4Very low77 Ų77110.5 Ų110.536%0.3654%0.544SS..Hα-helixtrans-73.6-21.7-175.9-99.7-178.725.300114.9Q120 W381 I383 H434 Q438Q120-Q436 VanDerWaalsContact NE2-OE1 3.09Å; W381-Q436 VanDerWaalsContact CB-OE1 3.25Å; W381-Q436 VanDerWaalsContact CD1-CD 3.47Å; I383-Q436 HydrophobicContact CD1-CB 3.65Å; I383-Q436 HydrophobicContact CD1-CG 3.76Å; I383-Q436 HydrophobicContact CG1-CB 3.85Å; I383-Q436 HydrophobicContact CG1-CG 3.64Å; H434-Q436 VanDerWaalsContact C-N 3.31Å; H434-Q436 PolarHBondContact O-N 2.77Å; H434-Q436 VanDerWaalsContact O-N 3.15Å; Q436-Q438 VanDerWaalsContact C-N 3.29Å
437Q32.2Very low32.8Very low121 Ų121106.7 Ų106.757%0.56553%0.529SS*.Hα-helixtrans-85.3-20.9165.1-67.9-170.7-30.300112.7L377 H434 E435 R441L377-Q437 VanDerWaalsContact C-NE2 3.32Å; L377-Q437 VanDerWaalsContact O-CD 3.31Å; L377-Q437 PolarHBondContact O-NE2 3.35Å; H434-Q437 PolarHBondContact ND1-OE1 3.06Å; H434-Q437 VanDerWaalsContact ND1-OE1 3.09Å; H434-Q437 PolarHBondContact O-N 2.81Å; E435-Q437 PolarHBondContact O-N 3.34Å; Q437-R441 PolarHBondContact O-N 3.42Å; Q437-R441 VanDerWaalsContact O-N 3.09Å
438Q32.6Very low34.9Very low60 Ų60106 Ų10628%0.2852%0.524SS..Hα-helixtrans-83-28.1179.9-65-1714.600113.4H434 E435 Q436 G440 R441 Q442H434-Q438 HydrophobicContact CB-CG 4.19Å; H434-Q438 WeakPolarHBondContact O-CG 3.15Å; H434-Q438 PolarHBondContact O-N 2.9Å; H434-Q438 VanDerWaalsContact O-N 3.13Å; E435-Q438 CarbonylContact O-C 3.58Å; E435-Q438 WeakPolarHBondContact O-CA 3.42Å; E435-Q438 VanDerWaalsContact O-CB 3.31Å; E435-Q438 WeakPolarHBondContact O-CB 3.45Å; E435-Q438 PolarHBondContact O-N 3.32Å; Q436-Q438 VanDerWaalsContact C-N 3.29Å; Q438-G440 CarbonylContact O-C 3.28Å; Q438-G440 VanDerWaalsContact O-C 3.28Å; Q438-G440 PolarHBondContact O-N 3.09Å; Q438-G440 VanDerWaalsContact O-N 3.14Å; Q438-R441 CarbonylContact O-C 3.21Å; Q438-R441 WeakPolarHBondContact O-CA 3.47Å; Q438-R441 PolarHBondContact O-N 3.33Å; Q438-R441 VanDerWaalsContact O-N 3.16Å; Q438-Q442 HydrophobicContact CB-CG 4.18Å; Q438-Q442 WeakPolarHBondContact O-CB 3.39Å; Q438-Q442 WeakPolarHBondContact O-CG 3.49Å; Q438-Q442 PolarHBondContact O-N 3.07Å
439Y29.6Very low37.3Very low152.5 Ų152.5100.5 Ų100.560%0.59850%0.495SS*.Hα-helixtrans-54.6-29171.5-93.2-82.2000113.3E435 N443E435-Y439 HydrophobicContact CB-CE2 4.2Å; E435-Y439 VanDerWaalsContact O-CD2 3.24Å; E435-Y439 WeakPolarHBondContact O-CD2 3.27Å; E435-Y439 PolarHBondContact O-N 3.18Å; Y439-N443 VanDerWaalsContact O-CG 3.29Å; Y439-N443 PolarHBondContact O-ND2 3.34Å
440G29.7Very low39.7Very low41.5 Ų41.5104.2 Ų104.243%0.42850%0.499SS..Hα-helixtrans-74.2-52.6165.600000113.7Q438 Q442 N443 F444Q438-G440 CarbonylContact O-C 3.28Å; Q438-G440 VanDerWaalsContact O-C 3.28Å; Q438-G440 PolarHBondContact O-N 3.09Å; Q438-G440 VanDerWaalsContact O-N 3.14Å; G440-Q442 VanDerWaalsContact C-N 3.3Å; G440-Q442 PolarHBondContact O-N 3.46Å; G440-Q442 VanDerWaalsContact O-N 3.07Å; G440-N443 PolarHBondContact O-N 3.11Å; G440-F444 WeakPolarHBondContact O-CD1 3.37Å; G440-F444 WeakPolarHBondContact O-CD2 3.3Å; G440-F444 WeakPolarHBondContact O-CE2 3.3Å; G440-F444 WeakPolarHBondContact O-CG 3.33Å
441R33.6Very low42.2Very low169.5 Ų169.598.8 Ų98.864%0.6448%0.481SS*.Hα-helixtrans-73.2-28.4-174-90-167.2178-163.54114.3M348 D351 Q437 Q438 N443 F444M348-R441 HydrophobicContact CE-CB 4.32Å; D351-R441 IonicContact OD2-CZ 3.71Å; D351-R441 IonicContact OD2-NH1 3.42Å; D351-R441 PolarHBondContact OD2-NH1 3.03Å; D351-R441 IonicContact OD2-NH2 3.63Å; Q437-R441 PolarHBondContact O-N 3.42Å; Q437-R441 VanDerWaalsContact O-N 3.09Å; Q438-R441 CarbonylContact O-C 3.21Å; Q438-R441 WeakPolarHBondContact O-CA 3.47Å; Q438-R441 PolarHBondContact O-N 3.33Å; Q438-R441 VanDerWaalsContact O-N 3.16Å; R441-N443 PolarHBondContact O-N 3.11Å; R441-F444 PolarHBondContact O-N 3.49Å
442Q33.6Very low44.6Very low112.5 Ų112.592.4 Ų92.453%0.52645%0.452SS..THydrogen-bonded Turntrans-84.4-22.3-176.4-68.9-177.1-0.200113.6Q438 G440 F444 S445Q438-Q442 HydrophobicContact CB-CG 4.18Å; Q438-Q442 WeakPolarHBondContact O-CB 3.39Å; Q438-Q442 WeakPolarHBondContact O-CG 3.49Å; Q438-Q442 PolarHBondContact O-N 3.07Å; G440-Q442 VanDerWaalsContact C-N 3.3Å; G440-Q442 PolarHBondContact O-N 3.46Å; G440-Q442 VanDerWaalsContact O-N 3.07Å; Q442-F444 VanDerWaalsContact C-N 3.3Å; Q442-F444 PolarHBondContact O-N 3.03Å; Q442-S445 PolarHBondContact O-N 3.42Å
443N35.5Very low47.2Very low108.5 Ų108.588.4 Ų88.458%0.5843%0.434SS*.THydrogen-bonded Turntrans-87.58.5-179.5-77.2-29.1000114.7K207 Y439 G440 R441 S445K207-N443 PolarHBondContact NZ-O 3.49Å; Y439-N443 VanDerWaalsContact O-CG 3.29Å; Y439-N443 PolarHBondContact O-ND2 3.34Å; G440-N443 PolarHBondContact O-N 3.11Å; R441-N443 PolarHBondContact O-N 3.11Å; N443-S445 PolarHBondContact O-N 2.64Å
444F39.7Very low49.9Very low107 Ų10783.9 Ų83.947%0.46942%0.42SS..SBendtrans-101.530.2166.9-70.3-50000111.2I203 G440 R441 Q442 N446I203-F444 HydrophobicContact CD1-CD2 4Å; I203-F444 HydrophobicContact CD1-CE2 3.89Å; I203-F444 HydrophobicContact CD1-CG 4.37Å; I203-F444 HydrophobicContact CD1-CZ 4.16Å; I203-F444 HydrophobicContact CG2-CD1 3.5Å; I203-F444 VanDerWaalsContact CG2-CD1 3.5Å; I203-F444 HydrophobicContact CG2-CE1 3.41Å; I203-F444 VanDerWaalsContact CG2-CE1 3.41Å; I203-F444 HydrophobicContact CG2-CG 4.19Å; I203-F444 HydrophobicContact CG2-CZ 4.02Å; G440-F444 WeakPolarHBondContact O-CD1 3.37Å; G440-F444 WeakPolarHBondContact O-CD2 3.3Å; G440-F444 WeakPolarHBondContact O-CE2 3.3Å; G440-F444 WeakPolarHBondContact O-CG 3.33Å; R441-F444 PolarHBondContact O-N 3.49Å; Q442-F444 VanDerWaalsContact C-N 3.3Å; Q442-F444 PolarHBondContact O-N 3.03Å; F444-N446 VanDerWaalsContact C-N 3.33Å; F444-N446 PolarHBondContact O-N 2.98Å
445S45.5Very low52.5Low55 Ų5579 Ų7939%0.38540%0.397SS..THydrogen-bonded Turntrans-69.737.9-173.559.90000113.6P341 Q442 N443 L447P341-S445 VanDerWaalsContact CB-O 3.27Å; P341-S445 WeakPolarHBondContact CB-O 3.44Å; Q442-S445 PolarHBondContact O-N 3.42Å; N443-S445 PolarHBondContact O-N 2.64Å; S445-L447 VanDerWaalsContact C-N 3.28Å; S445-L447 WeakPolarHBondContact O-CD1 3.36Å; S445-L447 PolarHBondContact O-N 3.12Å
446N49.3Very low55.1Low115.5 Ų115.575.5 Ų75.562%0.61838%0.381SS*.THydrogen-bonded Turntrans-48.232.9161.5-68.9-18.3000115F444 S448F444-N446 VanDerWaalsContact C-N 3.33Å; F444-N446 PolarHBondContact O-N 2.98Å; N446-S448 VanDerWaalsContact C-N 3.32Å; N446-S448 PolarHBondContact O-N 2.74Å
447L55Low57.7Low81 Ų8174.8 Ų74.842%0.42438%0.38SS..  trans-86.6103.3-178.7-90.8123.1000110.6A206 K207 Q210 S445 S449A206-L447 HydrophobicContact CB-CD2 4.35Å; K207-L447 HydrophobicContact CB-CD2 4.19Å; K207-L447 HydrophobicContact CD-CD1 4.36Å; K207-L447 HydrophobicContact CG-CD1 3.71Å; K207-L447 HydrophobicContact CG-CD2 3.6Å; K207-L447 HydrophobicContact CG-CG 4.3Å; Q210-L447 VanDerWaalsContact CD-CD2 3.44Å; Q210-L447 HydrophobicContact CG-CD2 4.06Å; S445-L447 VanDerWaalsContact C-N 3.28Å; S445-L447 WeakPolarHBondContact O-CD1 3.36Å; S445-L447 PolarHBondContact O-N 3.12Å; L447-S449 PolarHBondContact O-N 2.69Å
448S67.7Low60.2Low46.5 Ų46.575.1 Ų75.133%0.32538%0.381SS..  trans-90.5132.7167.950.60000109.5Q210 C338 N446 E450Q210-S448 PolarHBondContact NE2-O 2.99Å; C338-S448 WeakPolarHBondContact O-CA 3.42Å; N446-S448 VanDerWaalsContact C-N 3.32Å; N446-S448 PolarHBondContact O-N 2.74Å; S448-E450 PolarHBondContact O-N 3.31Å
449S75Confident62.7Low11.5 Ų11.573.6 Ų73.68%0.0838%0.375CS..  trans-80.5107.1171.3-179.80000110.2E209 Y287 C338 L447 I451 C452 L453E209-S449 WeakPolarHBondContact OE2-CB 3.46Å; E209-S449 PolarHBondContact OE2-OG 2.98Å; Y287-S449 WeakPolarHBondContact CE2-OG 3.38Å; Y287-S449 PolarHBondContact OH-OG 3.39Å; C338-S449 PolarHBondContact O-N 3.34Å; L447-S449 PolarHBondContact O-N 2.69Å; S449-I451 PolarHBondContact O-N 3.19Å; S449-C452 WeakPolarHBondContact O-CA 2.97Å; S449-C452 WeakPolarHBondContact O-CB 3.37Å; S449-C452 PolarHBondContact O-N 3.39Å; S449-C452 PolarHBondContact OG-N 3.39Å; S449-L453 PolarHBondContact O-N 2.94Å; S449-L453 VanDerWaalsContact O-N 3.13Å
450E74.9Confident65.3Low129 Ų12966.5 Ų66.560%0.60335%0.348SS*.Hα-helixtrans-61.3-37.8176-65.8177.9170.300111.7S448 C452 L453 C454S448-E450 PolarHBondContact O-N 3.31Å; E450-C452 VanDerWaalsContact C-N 3.32Å; E450-C452 PolarHBondContact O-N 3.23Å; E450-L453 WeakPolarHBondContact O-CB 3.44Å; E450-L453 PolarHBondContact O-N 3.32Å; E450-C454 PolarHBondContact O-N 3.04Å; E450-C454 PolarHBondContact O-SG 3.29Å; E450-C454 VanDerWaalsContact O-SG 3.37Å
451I77.2Confident67.9Low60 Ų6069 Ų6931%0.30835%0.351SS..Hα-helixtrans-61.9-43.6177-62.6176000110.9F284 Y287 S449 L453 C454 L455F284-I451 HydrophobicContact CB-CG2 4.2Å; F284-I451 HydrophobicContact CD2-CG2 3.87Å; Y287-I451 HydrophobicContact CD2-CG2 4.32Å; S449-I451 PolarHBondContact O-N 3.19Å; I451-L453 VanDerWaalsContact C-N 3.34Å; I451-C454 PolarHBondContact O-N 3.19Å; I451-L455 HydrophobicContact CG2-CD1 4.25Å; I451-L455 WeakPolarHBondContact O-CG 3.24Å; I451-L455 PolarHBondContact O-N 3.38Å; I451-L455 VanDerWaalsContact O-N 3.17Å
452C80.9Confident70.4Confident2.5 Ų2.566.4 Ų66.42%0.01734%0.344CS..Hα-helixtrans-69.8-34.2176.5-168.60000112.1Y287 V339 S449 E450 L456Y287-C452 HydrophobicContact CD1-CB 4.21Å; Y287-C452 HydrophobicContact CD2-CB 4.01Å; Y287-C452 HydrophobicContact CE1-CB 4.24Å; Y287-C452 HydrophobicContact CE2-CB 4.02Å; Y287-C452 HydrophobicContact CG-CB 4.1Å; V339-C452 HydrophobicContact CG2-CB 3.77Å; S449-C452 WeakPolarHBondContact O-CA 2.97Å; S449-C452 WeakPolarHBondContact O-CB 3.37Å; S449-C452 PolarHBondContact O-N 3.39Å; S449-C452 PolarHBondContact OG-N 3.39Å; E450-C452 VanDerWaalsContact C-N 3.32Å; E450-C452 PolarHBondContact O-N 3.23Å; C452-L456 WeakPolarHBondContact O-CB 3.39Å; C452-L456 VanDerWaalsContact O-CG 3.29Å; C452-L456 WeakPolarHBondContact O-CG 3.44Å; C452-L456 PolarHBondContact O-N 3.14Å
453L83.2Confident72.9Confident58.5 Ų58.561.1 Ų61.131%0.30632%0.32SS..Hα-helixtrans-61.6-49.8174.7174.561.3000111V339 S449 E450 I451 L455 L456 L457 L492V339-L453 HydrophobicContact CG1-CB 3.84Å; V339-L453 HydrophobicContact CG1-CD1 3.54Å; V339-L453 HydrophobicContact CG1-CG 4.19Å; V339-L453 HydrophobicContact CG2-CB 4.21Å; S449-L453 PolarHBondContact O-N 2.94Å; S449-L453 VanDerWaalsContact O-N 3.13Å; E450-L453 WeakPolarHBondContact O-CB 3.44Å; E450-L453 PolarHBondContact O-N 3.32Å; I451-L453 VanDerWaalsContact C-N 3.34Å; L453-L455 PolarHBondContact O-N 3.2Å; L453-L456 PolarHBondContact O-N 3.31Å; L453-L457 HydrophobicContact CD1-CD1 3.71Å; L453-L457 HydrophobicContact CD1-CG 3.9Å; L453-L457 HydrophobicContact CG-CD1 3.91Å; L453-L457 HydrophobicContact CG-CG 4.44Å; L453-L457 WeakPolarHBondContact O-CB 3.37Å; L453-L457 VanDerWaalsContact O-CG 3.29Å; L453-L457 WeakPolarHBondContact O-CG 3.32Å; L453-L457 PolarHBondContact O-N 2.91Å; L453-L492 HydrophobicContact CD1-CD1 3.64Å
454C82.7Confident75.3Confident63.5 Ų63.556.2 Ų56.243%0.42929%0.293SS..Hα-helixtrans-57.8-49.9176.6-66.90000111.7E450 I451 L456 L457 E458E450-C454 PolarHBondContact O-N 3.04Å; E450-C454 PolarHBondContact O-SG 3.29Å; E450-C454 VanDerWaalsContact O-SG 3.37Å; I451-C454 PolarHBondContact O-N 3.19Å; C454-L456 VanDerWaalsContact C-N 3.32Å; C454-L456 PolarHBondContact O-N 3.24Å; C454-L457 PolarHBondContact O-N 3.16Å; C454-E458 WeakPolarHBondContact O-CB 3.29Å; C454-E458 WeakPolarHBondContact O-CG 3.34Å; C454-E458 PolarHBondContact O-N 3Å
455L83.6Confident77.5Confident11 Ų1154 Ų546%0.05829%0.294CS..Hα-helixtrans-60.5-37.5179.7-75.7170.9000113.4F284 R288 L291 I451 L453 N459F284-L455 HydrophobicContact CD2-CD1 4.05Å; F284-L455 HydrophobicContact CD2-CD2 4.41Å; F284-L455 HydrophobicContact CD2-CG 4.4Å; F284-L455 HydrophobicContact CE2-CD1 4.1Å; F284-L455 HydrophobicContact CE2-CD2 3.63Å; F284-L455 HydrophobicContact CE2-CG 4.04Å; F284-L455 HydrophobicContact CZ-CD2 4.01Å; R288-L455 HydrophobicContact CB-CD1 4.49Å; L291-L455 HydrophobicContact CD2-CB 4.1Å; L291-L455 WeakPolarHBondContact CD2-O 3.28Å; I451-L455 HydrophobicContact CG2-CD1 4.25Å; I451-L455 WeakPolarHBondContact O-CG 3.24Å; I451-L455 PolarHBondContact O-N 3.38Å; I451-L455 VanDerWaalsContact O-N 3.17Å; L453-L455 PolarHBondContact O-N 3.2Å; L455-N459 PolarHBondContact O-ND2 3.09Å
456L85.1Confident79.3Confident1 Ų152.1 Ų52.11%0.00528%0.281CS..Hα-helixtrans-71.9-42.5175.8-73.5172.8000112L291 L332 L335 L336 V339 C452 L453 C454 N459 I460 I463 L492L291-L456 HydrophobicContact CD1-CD2 3.8Å; L332-L456 HydrophobicContact CD1-CD2 4.34Å; L335-L456 HydrophobicContact CB-CD1 4.41Å; L335-L456 HydrophobicContact CB-CD2 4.45Å; L336-L456 HydrophobicContact CD2-CD1 4.06Å; L336-L456 HydrophobicContact CG-CD1 4.48Å; V339-L456 HydrophobicContact CG2-CD1 3.97Å; C452-L456 WeakPolarHBondContact O-CB 3.39Å; C452-L456 VanDerWaalsContact O-CG 3.29Å; C452-L456 WeakPolarHBondContact O-CG 3.44Å; C452-L456 PolarHBondContact O-N 3.14Å; L453-L456 PolarHBondContact O-N 3.31Å; C454-L456 VanDerWaalsContact C-N 3.32Å; C454-L456 PolarHBondContact O-N 3.24Å; L456-N459 CarbonylContact O-C 3.55Å; L456-N459 PolarHBondContact O-N 3.14Å; L456-I460 WeakPolarHBondContact O-CA 2.98Å; L456-I460 PolarHBondContact O-N 3.21Å; L456-I463 HydrophobicContact CD2-CD1 3.74Å; L456-L492 HydrophobicContact CB-CD2 4.19Å
457L85.2Confident81.1Confident63 Ų6346.6 Ų46.633%0.3325%0.252SS..Hα-helixtrans-65-37.7177.1-71.7175.8000112.3L453 C454 N459 I460 L492 K493L453-L457 HydrophobicContact CD1-CD1 3.71Å; L453-L457 HydrophobicContact CD1-CG 3.9Å; L453-L457 HydrophobicContact CG-CD1 3.91Å; L453-L457 HydrophobicContact CG-CG 4.44Å; L453-L457 WeakPolarHBondContact O-CB 3.37Å; L453-L457 VanDerWaalsContact O-CG 3.29Å; L453-L457 WeakPolarHBondContact O-CG 3.32Å; L453-L457 PolarHBondContact O-N 2.91Å; C454-L457 PolarHBondContact O-N 3.16Å; L457-N459 PolarHBondContact O-N 2.94Å; L457-I460 HydrophobicContact CD2-CD1 4.2Å; L457-I460 VanDerWaalsContact O-CG2 3.27Å; L457-I460 WeakPolarHBondContact O-CG2 3.37Å; L457-L492 HydrophobicContact CD2-CD2 4.47Å; L457-L492 HydrophobicContact CD2-CG 4.21Å; L457-K493 HydrophobicContact CD2-CB 4.32Å; L457-K493 HydrophobicContact CD2-CD 4.09Å
458E85.5Confident82.5Confident127.5 Ų127.545.1 Ų45.160%0.59624%0.244SC*.Hα-helixtrans-64.9-22.6175.4-76.5172.5-165.900113.8C454C454-E458 WeakPolarHBondContact O-CB 3.29Å; C454-E458 WeakPolarHBondContact O-CG 3.34Å; C454-E458 PolarHBondContact O-N 3Å
459N84.2Confident83.4Confident28 Ų2846.9 Ų46.915%0.1525%0.248CC..THydrogen-bonded Turntrans-118.912.8-175.3-66.5-81.2000113.3L291 I295 L455 L456 L457 D461 K462 I463L291-N459 HydrophobicContact CD2-CB 4.36Å; I295-N459 HydrophobicContact CD1-CB 4.16Å; L455-N459 PolarHBondContact O-ND2 3.09Å; L456-N459 CarbonylContact O-C 3.55Å; L456-N459 PolarHBondContact O-N 3.14Å; L457-N459 PolarHBondContact O-N 2.94Å; N459-D461 VanDerWaalsContact C-N 3.34Å; N459-D461 PolarHBondContact O-N 3.3Å; N459-K462 HydrophobicContact CB-CD 4.44Å; N459-K462 WeakPolarHBondContact O-CB 3.34Å; N459-K462 PolarHBondContact O-N 2.97Å; N459-K462 PolarHBondContact OD1-NZ 3.02Å; N459-I463 WeakPolarHBondContact O-CG1 3.36Å; N459-I463 PolarHBondContact O-N 3.31Å; N459-I463 VanDerWaalsContact O-N 3.12Å
460I85.1Confident83.8Confident5 Ų546.7 Ų46.73%0.02625%0.246CC..Hα-helixtrans-60.1-38.1-171-164.3155.9000113.3L456 L457 K462 I463 W464 L492 K493 E496L456-I460 WeakPolarHBondContact O-CA 2.98Å; L456-I460 PolarHBondContact O-N 3.21Å; L457-I460 HydrophobicContact CD2-CD1 4.2Å; L457-I460 VanDerWaalsContact O-CG2 3.27Å; L457-I460 WeakPolarHBondContact O-CG2 3.37Å; I460-K462 VanDerWaalsContact C-N 3.34Å; I460-K462 PolarHBondContact O-N 3.2Å; I460-I463 WeakPolarHBondContact O-CB 3.2Å; I460-I463 PolarHBondContact O-N 3.21Å; I460-W464 PolarHBondContact O-N 3.13Å; I460-L492 HydrophobicContact CD1-CD2 3.93Å; I460-L492 HydrophobicContact CD1-CG 4.43Å; I460-K493 HydrophobicContact CD1-CB 4.16Å; I460-E496 WeakPolarHBondContact CD1-OE2 3.47Å; I460-E496 VanDerWaalsContact CG1-OE2 3.25Å; I460-E496 WeakPolarHBondContact CG1-OE2 3.42Å; I460-E496 WeakPolarHBondContact CG2-OE2 3.37Å
461D84.3Confident84.3Confident92.5 Ų92.541.1 Ų41.150%0.49522%0.22SC..Hα-helixtrans-62.9-38.2174.3-71.5-54.7000113N459 I463 W464 A465 R502N459-D461 VanDerWaalsContact C-N 3.34Å; N459-D461 PolarHBondContact O-N 3.3Å; D461-I463 VanDerWaalsContact C-N 3.34Å; D461-W464 PolarHBondContact O-N 3.2Å; D461-A465 WeakPolarHBondContact O-CB 3.39Å; D461-A465 PolarHBondContact O-N 3.21Å; D461-R502 IonicContact OD1-CZ 3.23Å; D461-R502 IonicContact OD1-NH1 2.73Å; D461-R502 IonicContact OD1-NH2 2.71Å; D461-R502 PolarHBondContact OD1-NH2 3Å
462K84.9Confident84.6Confident115 Ų11544.7 Ų44.750%0.524%0.24SC..Hα-helixtrans-69.4-36.8177.2-58174.8-170160.40111I295 N459 I460 S466I295-K462 HydrophobicContact CD1-CB 4.43Å; I295-K462 HydrophobicContact CG2-CB 4.39Å; N459-K462 HydrophobicContact CB-CD 4.44Å; N459-K462 WeakPolarHBondContact O-CB 3.34Å; N459-K462 PolarHBondContact O-N 2.97Å; N459-K462 PolarHBondContact OD1-NZ 3.02Å; I460-K462 VanDerWaalsContact C-N 3.34Å; I460-K462 PolarHBondContact O-N 3.2Å; K462-S466 WeakPolarHBondContact O-CB 3.28Å; K462-S466 PolarHBondContact O-N 3.17Å; K462-S466 PolarHBondContact O-OG 3Å
463I86.1Confident84.6Confident2 Ų245.6 Ų45.61%0.0125%0.246CC..Hα-helixtrans-65.2-49.2174.7-63.1166.6000109.4L291 I295 L332 L456 N459 I460 D461 A465 S466 V467 L489L291-I463 HydrophobicContact CD1-CD1 4.25Å; I295-I463 HydrophobicContact CD1-CG1 4.19Å; I295-I463 HydrophobicContact CG1-CG1 4.46Å; L332-I463 HydrophobicContact CD1-CD1 4.17Å; L332-I463 HydrophobicContact CD1-CG1 4.23Å; L332-I463 HydrophobicContact CD1-CG2 4.01Å; L332-I463 HydrophobicContact CD2-CG2 3.77Å; L332-I463 HydrophobicContact CG-CG2 4.48Å; L456-I463 HydrophobicContact CD2-CD1 3.74Å; N459-I463 WeakPolarHBondContact O-CG1 3.36Å; N459-I463 PolarHBondContact O-N 3.31Å; N459-I463 VanDerWaalsContact O-N 3.12Å; I460-I463 WeakPolarHBondContact O-CB 3.2Å; I460-I463 PolarHBondContact O-N 3.21Å; D461-I463 VanDerWaalsContact C-N 3.34Å; I463-A465 PolarHBondContact O-N 3.13Å; I463-S466 WeakPolarHBondContact O-CB 3.43Å; I463-S466 PolarHBondContact O-N 3.19Å; I463-S466 VanDerWaalsContact O-N 3.16Å; I463-V467 HydrophobicContact CG2-CG2 4.43Å; I463-V467 WeakPolarHBondContact O-CG2 3.38Å; I463-V467 PolarHBondContact O-N 3.07Å; I463-L489 HydrophobicContact CG2-CD1 4.34Å; I463-L489 HydrophobicContact CG2-CD2 3.81Å
464W86.4Confident84.4Confident4.5 Ų4.554.9 Ų54.92%0.01728%0.277CS..Hα-helixtrans-60.8-42.9176.6-83.2119.4000113I460 D461 S466 V467 L468 L489 V490 F497 V506I460-W464 PolarHBondContact O-N 3.13Å; D461-W464 PolarHBondContact O-N 3.2Å; W464-S466 VanDerWaalsContact C-N 3.29Å; W464-S466 PolarHBondContact O-N 3.06Å; W464-V467 HydrophobicContact CE3-CG1 4.43Å; W464-V467 HydrophobicContact CZ3-CG1 4.43Å; W464-V467 PolarHBondContact O-N 3.16Å; W464-L468 WeakPolarHBondContact O-CB 3.39Å; W464-L468 VanDerWaalsContact O-CG 3.29Å; W464-L468 WeakPolarHBondContact O-CG 3.42Å; W464-L468 PolarHBondContact O-N 3.39Å; W464-L489 HydrophobicContact CH2-CB 3.99Å; W464-L489 HydrophobicContact CH2-CD1 4.47Å; W464-L489 HydrophobicContact CZ2-CB 3.8Å; W464-L489 HydrophobicContact CZ3-CD1 4.44Å; W464-V490 HydrophobicContact CH2-CG2 4.42Å; W464-F497 AromaticContact CH2-CD2 3.69Å; W464-F497 HydrophobicContact CH2-CD2 3.69Å; W464-F497 AromaticContact CH2-CE2 3.88Å; W464-F497 HydrophobicContact CH2-CE2 3.98Å; W464-F497 AromaticContact CZ2-CD2 3.85Å; W464-F497 HydrophobicContact CZ2-CD2 3.94Å; W464-F497 HydrophobicContact CZ3-CD2 4.37Å; W464-F497 HydrophobicContact CZ3-CE2 4.4Å; W464-V506 HydrophobicContact CZ3-CG2 4.48Å
465A85.7Confident84.4Confident60.5 Ų60.553.8 Ų53.850%0.527%0.267SS..Hα-helixtrans-59.2-40.1174.500000112.2D461 I463 M469D461-A465 WeakPolarHBondContact O-CB 3.39Å; D461-A465 PolarHBondContact O-N 3.21Å; I463-A465 PolarHBondContact O-N 3.13Å; A465-M469 PolarHBondContact O-N 3.37Å; A465-M469 VanDerWaalsContact O-N 3.12Å
466S84.3Confident84.2Confident15.5 Ų15.556.6 Ų56.611%0.10828%0.28CS..Hα-helixtrans-66.7-43.6176-56.40000111.9K462 I463 W464 M469 W470K462-S466 WeakPolarHBondContact O-CB 3.28Å; K462-S466 PolarHBondContact O-N 3.17Å; K462-S466 PolarHBondContact O-OG 3Å; I463-S466 WeakPolarHBondContact O-CB 3.43Å; I463-S466 PolarHBondContact O-N 3.19Å; I463-S466 VanDerWaalsContact O-N 3.16Å; W464-S466 VanDerWaalsContact C-N 3.29Å; W464-S466 PolarHBondContact O-N 3.06Å; S466-M469 WeakPolarHBondContact O-CB 3.35Å; S466-M469 PolarHBondContact O-N 3.33Å; S466-W470 VanDerWaalsContact O-CD2 3.24Å; S466-W470 PolarHBondContact O-N 3.17Å
467V86.1Confident83.8Confident0 Ų059.6 Ų59.60%029%0.294CS..Hα-helixtrans-65-42.8178.1170.90000111.9L332 I463 W464 M469 W470 I471 L482 L485 I486 L489L332-V467 HydrophobicContact CD2-CG2 4.48Å; I463-V467 HydrophobicContact CG2-CG2 4.43Å; I463-V467 WeakPolarHBondContact O-CG2 3.38Å; I463-V467 PolarHBondContact O-N 3.07Å; W464-V467 HydrophobicContact CE3-CG1 4.43Å; W464-V467 HydrophobicContact CZ3-CG1 4.43Å; W464-V467 PolarHBondContact O-N 3.16Å; V467-M469 VanDerWaalsContact C-N 3.28Å; V467-M469 PolarHBondContact O-N 2.95Å; V467-W470 HydrophobicContact CG2-CE3 3.94Å; V467-W470 HydrophobicContact CG2-CZ3 3.96Å; V467-W470 PolarHBondContact O-N 3.11Å; V467-W470 VanDerWaalsContact O-N 3.09Å; V467-I471 HydrophobicContact CG1-CD1 4.25Å; V467-I471 WeakPolarHBondContact O-CG1 3.33Å; V467-I471 PolarHBondContact O-N 3.2Å; V467-L482 HydrophobicContact CG1-CD2 4.42Å; V467-L485 HydrophobicContact CG2-CD2 3.72Å; V467-I486 HydrophobicContact CG1-CG1 4.33Å; V467-L489 HydrophobicContact CG1-CD1 4.45Å; V467-L489 HydrophobicContact CG2-CD1 3.81Å
468L85.4Confident83.7Confident50.5 Ų50.556.6 Ų56.626%0.26428%0.278SS..Hα-helixtrans-62.4-34.7174.4-70.6168.7000112W464 I471 N472 T505W464-L468 WeakPolarHBondContact O-CB 3.39Å; W464-L468 VanDerWaalsContact O-CG 3.29Å; W464-L468 WeakPolarHBondContact O-CG 3.42Å; W464-L468 PolarHBondContact O-N 3.39Å; L468-I471 HydrophobicContact CD2-CD1 4.33Å; L468-N472 PolarHBondContact O-ND2 3.33Å; L468-T505 HydrophobicContact CD2-CG2 4.16Å
469M84.7Confident83.7Confident83.5 Ų83.551 Ų5141%0.41125%0.252SS..Hα-helixtrans-67-40.4170.9-177.7-177.857.900112.1A465 S466 V467 N472A465-M469 PolarHBondContact O-N 3.37Å; A465-M469 VanDerWaalsContact O-N 3.12Å; S466-M469 WeakPolarHBondContact O-CB 3.35Å; S466-M469 PolarHBondContact O-N 3.33Å; V467-M469 VanDerWaalsContact C-N 3.28Å; V467-M469 PolarHBondContact O-N 2.95Å; M469-N472 PolarHBondContact O-N 2.88Å
470W84.9Confident83.5Confident8 Ų851 Ų513%0.0325%0.251CS..Hα-helixtrans-72.9-26.8-178.8-58.6-26.3000114I325 N328 I329 L332 S466 V467 N472 S473 L482 L485I325-W470 HydrophobicContact CG2-CB 4.35Å; I325-W470 HydrophobicContact CG2-CD2 4.12Å; I325-W470 HydrophobicContact CG2-CG 3.8Å; N328-W470 HydrophobicContact CB-CH2 4.07Å; N328-W470 HydrophobicContact CB-CZ2 3.95Å; I329-W470 HydrophobicContact CD1-CD2 4.28Å; I329-W470 HydrophobicContact CD1-CE3 3.95Å; I329-W470 HydrophobicContact CD1-CZ3 4.49Å; I329-W470 HydrophobicContact CG1-CD2 4.13Å; I329-W470 HydrophobicContact CG1-CE3 3.51Å; I329-W470 HydrophobicContact CG1-CH2 4.22Å; I329-W470 HydrophobicContact CG1-CZ3 3.56Å; L332-W470 HydrophobicContact CD2-CH2 4.46Å; L332-W470 HydrophobicContact CD2-CZ3 4.07Å; S466-W470 VanDerWaalsContact O-CD2 3.24Å; S466-W470 PolarHBondContact O-N 3.17Å; V467-W470 HydrophobicContact CG2-CE3 3.94Å; V467-W470 HydrophobicContact CG2-CZ3 3.96Å; V467-W470 PolarHBondContact O-N 3.11Å; V467-W470 VanDerWaalsContact O-N 3.09Å; W470-N472 PolarHBondContact O-N 3.04Å; W470-N472 VanDerWaalsContact O-N 3.14Å; W470-S473 VanDerWaalsContact O-CB 3.23Å; W470-S473 WeakPolarHBondContact O-CB 3.47Å; W470-S473 PolarHBondContact O-N 3.03Å; W470-S473 PolarHBondContact O-OG 3.12Å; W470-L482 HydrophobicContact CB-CD1 4.11Å; W470-L482 HydrophobicContact CB-CD2 4.04Å; W470-L482 HydrophobicContact CE3-CD2 4.14Å; W470-L485 HydrophobicContact CZ3-CD2 4.4Å
471I84.7Confident83.4Confident12 Ų1251 Ų516%0.06225%0.251CS..THydrogen-bonded Turntrans-55.7-26.5174.5-84.9169.9000112.9V467 L468 S473 L482 I486 V506 W509V467-I471 HydrophobicContact CG1-CD1 4.25Å; V467-I471 WeakPolarHBondContact O-CG1 3.33Å; V467-I471 PolarHBondContact O-N 3.2Å; L468-I471 HydrophobicContact CD2-CD1 4.33Å; I471-S473 VanDerWaalsContact C-N 3.31Å; I471-S473 PolarHBondContact O-N 3.18Å; I471-L482 HydrophobicContact CG1-CD1 4.47Å; I471-I486 HydrophobicContact CD1-CD1 4.25Å; I471-V506 HydrophobicContact CD1-CG2 4.16Å; I471-W509 HydrophobicContact CG1-CD2 4.39Å; I471-W509 HydrophobicContact CG1-CH2 4.43Å; I471-W509 HydrophobicContact CG1-CZ2 4.2Å; I471-W509 HydrophobicContact CG2-CD2 4.21Å; I471-W509 HydrophobicContact CG2-CG 3.94Å; I471-W509 PolarHBondContact O-NE1 3.19Å
472N82.9Confident83.5Confident135 Ų13546.6 Ų46.672%0.72223%0.227SC*.THydrogen-bonded Turntrans-82.1-0.4176.1-68-56.3000114.5L468 M469 W470L468-N472 PolarHBondContact O-ND2 3.33Å; M469-N472 PolarHBondContact O-N 2.88Å; W470-N472 PolarHBondContact O-N 3.04Å; W470-N472 VanDerWaalsContact O-N 3.14Å
473S82.3Confident83.5Confident21.5 Ų21.541.3 Ų41.315%0.1520%0.204CC..  trans-71.8146.6178.367.60000112W470 I471 I478W470-S473 VanDerWaalsContact O-CB 3.23Å; W470-S473 WeakPolarHBondContact O-CB 3.47Å; W470-S473 PolarHBondContact O-N 3.03Å; W470-S473 PolarHBondContact O-OG 3.12Å; I471-S473 VanDerWaalsContact C-N 3.31Å; I471-S473 PolarHBondContact O-N 3.18Å; S473-I478 VanDerWaalsContact OG-CG2 3.27Å; S473-I478 WeakPolarHBondContact OG-CG2 3.31Å
474R78.9Confident83.4Confident253 Ų25342.4 Ų42.496%0.95521%0.209SC*.  trans-94.6-4.4179.4-65.2-177.5-179.6172.60.1113.5
475N81.9Confident83.4Confident40.5 Ų40.542.2 Ų42.222%0.21721%0.208CC..  trans-83.9118.8-171.5-173.7-30.1000111.4D322 Q477 I478 M479D322-N475 WeakPolarHBondContact OD2-CB 3.36Å; D322-N475 PolarHBondContact OD2-ND2 3.33Å; N475-Q477 VanDerWaalsContact C-N 3.26Å; N475-Q477 PolarHBondContact O-N 2.99Å; N475-Q477 WeakPolarHBondContact OD1-CB 3.3Å; N475-Q477 PolarHBondContact OD1-N 3.21Å; N475-I478 HydrophobicContact CB-CB 4.26Å; N475-I478 HydrophobicContact CB-CD1 3.89Å; N475-I478 HydrophobicContact CB-CG1 3.99Å; N475-I478 PolarHBondContact O-N 3.39Å; N475-I478 VanDerWaalsContact O-N 3.11Å; N475-M479 VanDerWaalsContact O-CG 3.3Å; N475-M479 WeakPolarHBondContact O-CG 3.4Å; N475-M479 PolarHBondContact O-N 3.24Å
476H79.4Confident83.5Confident70.5 Ų70.539.4 Ų39.433%0.32618%0.184SC..Hα-helixtrans-55.4-35.2-178.1-174.673.7000113.8S365 M479 F480 E519S365-H476 PolarHBondContact OG-NE2 3.21Å; H476-M479 PolarHBondContact O-N 3.48Å; H476-F480 WeakPolarHBondContact O-CB 3.41Å; H476-F480 PolarHBondContact O-N 3.26Å; H476-E519 IonicContact CE1-OE1 3.35Å; H476-E519 PolarHBondContact CE1-OE1 2.98Å; H476-E519 VanDerWaalsContact CE1-OE1 3.29Å; H476-E519 IonicContact ND1-OE1 3.56Å; H476-E519 PolarHBondContact ND1-OE1 3.08Å
477Q77.3Confident83.6Confident64.5 Ų64.538.7 Ų38.730%0.30118%0.179SC..Hα-helixtrans-68.4-42178.9-61.3-178.9-12.200111.5N475 F480 L481N475-Q477 VanDerWaalsContact C-N 3.26Å; N475-Q477 PolarHBondContact O-N 2.99Å; N475-Q477 WeakPolarHBondContact OD1-CB 3.3Å; N475-Q477 PolarHBondContact OD1-N 3.21Å; Q477-F480 PolarHBondContact O-N 3.49Å; Q477-L481 WeakPolarHBondContact O-CG 3.14Å; Q477-L481 PolarHBondContact O-N 3.24Å; Q477-L481 VanDerWaalsContact O-N 3.12Å
478I83.7Confident83.5Confident0 Ų039.6 Ų39.60%018%0.183CC..Hα-helixtrans-64.7-46.6176.5-60.6-179.7000109.7D322 I325 I329 S473 N475 F480 L481 L482D322-I478 HydrophobicContact CB-CD1 3.91Å; I325-I478 HydrophobicContact CB-CD1 4.1Å; I325-I478 HydrophobicContact CG2-CD1 3.94Å; I325-I478 HydrophobicContact CG2-CG1 4.49Å; I325-I478 HydrophobicContact CG2-CG2 3.88Å; I329-I478 HydrophobicContact CD1-CG2 3.67Å; S473-I478 VanDerWaalsContact OG-CG2 3.27Å; S473-I478 WeakPolarHBondContact OG-CG2 3.31Å; N475-I478 HydrophobicContact CB-CB 4.26Å; N475-I478 HydrophobicContact CB-CD1 3.89Å; N475-I478 HydrophobicContact CB-CG1 3.99Å; N475-I478 PolarHBondContact O-N 3.39Å; N475-I478 VanDerWaalsContact O-N 3.11Å; I478-F480 VanDerWaalsContact C-N 3.31Å; I478-F480 PolarHBondContact O-N 3.09Å; I478-L481 PolarHBondContact O-N 3.05Å; I478-L482 HydrophobicContact CG2-CD1 4.02Å; I478-L482 HydrophobicContact CG2-CG 4.31Å; I478-L482 WeakPolarHBondContact O-CG 3.21Å; I478-L482 PolarHBondContact O-N 3.13Å
479M83.7Confident83.6Confident9.5 Ų9.537.3 Ų37.35%0.04717%0.171CC..Hα-helixtrans-56.8-43.5176.7-63.2-71.6-72.100112N475 H476 L481 L482 Y483 W509N475-M479 VanDerWaalsContact O-CG 3.3Å; N475-M479 WeakPolarHBondContact O-CG 3.4Å; N475-M479 PolarHBondContact O-N 3.24Å; H476-M479 PolarHBondContact O-N 3.48Å; M479-L481 PolarHBondContact O-N 3.07Å; M479-L482 PolarHBondContact O-N 3.28Å; M479-Y483 HydrophobicContact CB-CE2 4.34Å; M479-Y483 WeakPolarHBondContact CE-OH 3.32Å; M479-Y483 VanDerWaalsContact O-CD2 3.27Å; M479-Y483 WeakPolarHBondContact O-CD2 3.26Å; M479-Y483 VanDerWaalsContact O-CG 3.28Å; M479-Y483 PolarHBondContact O-N 3.27Å; M479-W509 HydrophobicContact CE-CH2 4.46Å; M479-W509 HydrophobicContact CE-CZ2 3.41Å; M479-W509 VanDerWaalsContact CE-CZ2 3.44Å; M479-W509 HydrophobicContact SD-CZ2 3.77Å
480F80.7Confident83.7Confident28.5 Ų28.533.3 Ų33.313%0.12515%0.151CC..Hα-helixtrans-63.9-38.7177.5179.8-112.5000113.5T363 H476 Q477 I478 K484 M522T363-F480 HydrophobicContact CG2-CD2 3.89Å; T363-F480 HydrophobicContact CG2-CE1 3.99Å; T363-F480 HydrophobicContact CG2-CE2 3.12Å; T363-F480 HydrophobicContact CG2-CZ 3.17Å; H476-F480 WeakPolarHBondContact O-CB 3.41Å; H476-F480 PolarHBondContact O-N 3.26Å; Q477-F480 PolarHBondContact O-N 3.49Å; I478-F480 VanDerWaalsContact C-N 3.31Å; I478-F480 PolarHBondContact O-N 3.09Å; F480-K484 HydrophobicContact CE1-CD 4.39Å; F480-K484 VanDerWaalsContact CE1-CE 3.43Å; F480-K484 HydrophobicContact CZ-CD 4.48Å; F480-K484 VanDerWaalsContact CZ-CE 3.43Å; F480-K484 VanDerWaalsContact CZ-NZ 3.31Å; F480-K484 PolarHBondContact O-N 2.69Å; F480-M522 HydrophobicContact CD2-CE 4.11Å; F480-M522 HydrophobicContact CD2-CG 4.13Å; F480-M522 HydrophobicContact CD2-SD 4.44Å; F480-M522 HydrophobicContact CE2-CE 3.64Å; F480-M522 HydrophobicContact CE2-CG 3.96Å; F480-M522 HydrophobicContact CE2-SD 3.89Å; F480-M522 HydrophobicContact CZ-CE 4.27Å
481L82.7Confident83.7Confident5 Ų534.1 Ų34.13%0.02616%0.16CC..Hα-helixtrans-69.3-39.5173.3-67.7175.3000111.7I329 L330 Q477 I478 M479 Y483 K484 L485I329-L481 HydrophobicContact CG2-CB 3.62Å; I329-L481 HydrophobicContact CG2-CD1 4.34Å; L330-L481 HydrophobicContact CD2-CD1 4.16Å; L330-L481 HydrophobicContact CD2-CD2 3.99Å; L330-L481 HydrophobicContact CG-CD1 4.26Å; Q477-L481 WeakPolarHBondContact O-CG 3.14Å; Q477-L481 PolarHBondContact O-N 3.24Å; Q477-L481 VanDerWaalsContact O-N 3.12Å; I478-L481 PolarHBondContact O-N 3.05Å; M479-L481 PolarHBondContact O-N 3.07Å; L481-Y483 VanDerWaalsContact C-N 3.34Å; L481-Y483 PolarHBondContact O-N 3.26Å; L481-K484 WeakPolarHBondContact O-CB 3.32Å; L481-K484 PolarHBondContact O-N 3.11Å; L481-K484 VanDerWaalsContact O-N 3.07Å; L481-L485 WeakPolarHBondContact O-CB 3.33Å; L481-L485 PolarHBondContact O-N 3.01Å
482L87Confident83.6Confident0 Ų034.7 Ų34.70%016%0.163CC..Hα-helixtrans-59.8-41.2175-71.1171.9000112.1I329 V467 W470 I471 I478 M479 K484 L485 I486 W509I329-L482 HydrophobicContact CD1-CD2 3.94Å; I329-L482 HydrophobicContact CD1-CG 4.15Å; V467-L482 HydrophobicContact CG1-CD2 4.42Å; W470-L482 HydrophobicContact CB-CD1 4.11Å; W470-L482 HydrophobicContact CB-CD2 4.04Å; W470-L482 HydrophobicContact CE3-CD2 4.14Å; I471-L482 HydrophobicContact CG1-CD1 4.47Å; I478-L482 HydrophobicContact CG2-CD1 4.02Å; I478-L482 HydrophobicContact CG2-CG 4.31Å; I478-L482 WeakPolarHBondContact O-CG 3.21Å; I478-L482 PolarHBondContact O-N 3.13Å; M479-L482 PolarHBondContact O-N 3.28Å; L482-K484 PolarHBondContact O-N 3.28Å; L482-L485 HydrophobicContact CD2-CD2 4.31Å; L482-L485 PolarHBondContact O-N 3.11Å; L482-L485 VanDerWaalsContact O-N 3.1Å; L482-I486 WeakPolarHBondContact O-CG1 3.41Å; L482-I486 PolarHBondContact O-N 2.81Å; L482-W509 HydrophobicContact CB-CH2 4.1Å; L482-W509 HydrophobicContact CD1-CZ2 4.49Å
483Y85.4Confident83.6Confident3.5 Ų3.532.1 Ų32.11%0.01415%0.145CC..Hα-helixtrans-59.1-31.8174.3-60.1-38.7000113M479 L481 P487 W509 C513 E519 M522 I523 N526M479-Y483 HydrophobicContact CB-CE2 4.34Å; M479-Y483 WeakPolarHBondContact CE-OH 3.32Å; M479-Y483 VanDerWaalsContact O-CD2 3.27Å; M479-Y483 WeakPolarHBondContact O-CD2 3.26Å; M479-Y483 VanDerWaalsContact O-CG 3.28Å; M479-Y483 PolarHBondContact O-N 3.27Å; L481-Y483 VanDerWaalsContact C-N 3.34Å; L481-Y483 PolarHBondContact O-N 3.26Å; Y483-P487 WeakPolarHBondContact O-CD 3.44Å; Y483-P487 WeakPolarHBondContact O-CG 3.49Å; Y483-W509 AromaticContact CD1-CH2 3.51Å; Y483-W509 HydrophobicContact CD1-CH2 3.51Å; Y483-W509 VanDerWaalsContact CD1-CH2 3.49Å; Y483-W509 HydrophobicContact CD1-CZ2 4.45Å; Y483-W509 AromaticContact CD1-CZ3 3.78Å; Y483-W509 HydrophobicContact CD1-CZ3 3.78Å; Y483-W509 HydrophobicContact CE1-CE3 4.41Å; Y483-W509 AromaticContact CE1-CH2 3.26Å; Y483-W509 HydrophobicContact CE1-CH2 3.26Å; Y483-W509 AromaticContact CE1-CZ2 3.81Å; Y483-W509 HydrophobicContact CE1-CZ2 3.81Å; Y483-W509 AromaticContact CE1-CZ3 3.65Å; Y483-W509 HydrophobicContact CE1-CZ3 3.65Å; Y483-C513 HydrophobicContact CE1-CB 4.37Å; Y483-C513 VanDerWaalsContact OH-CB 3.31Å; Y483-C513 WeakPolarHBondContact OH-CB 3.36Å; Y483-C513 PolarHBondContact OH-SG 3.22Å; Y483-E519 HydrophobicContact CE2-CB 4.41Å; Y483-E519 HydrophobicContact CE2-CG 4.46Å; Y483-E519 WeakPolarHBondContact CE2-OE2 3.49Å; Y483-E519 PolarHBondContact OH-OE2 2.71Å; Y483-M522 HydrophobicContact CD2-CG 4.23Å; Y483-M522 HydrophobicContact CG-CG 4.47Å; Y483-I523 HydrophobicContact CD1-CG1 4.28Å; Y483-I523 HydrophobicContact CD2-CG1 4.21Å; Y483-I523 HydrophobicContact CE1-CD1 4.41Å; Y483-I523 HydrophobicContact CE1-CG1 3.99Å; Y483-I523 HydrophobicContact CE2-CD1 4.23Å; Y483-I523 HydrophobicContact CE2-CG1 3.93Å; Y483-I523 HydrophobicContact CG-CG1 4.42Å; Y483-N526 PolarHBondContact O-ND2 3.42Å; Y483-N526 PolarHBondContact O-OD1 3.03Å; Y483-N526 VanDerWaalsContact O-OD1 3.12Å
484K82.9Confident83.6Confident25 Ų2533.5 Ų33.511%0.10915%0.154CC..Hα-helixtrans-80.4-30.7174.5-66.8-179.4179.3179.30113.3F480 L481 L482 M522F480-K484 HydrophobicContact CE1-CD 4.39Å; F480-K484 VanDerWaalsContact CE1-CE 3.43Å; F480-K484 HydrophobicContact CZ-CD 4.48Å; F480-K484 VanDerWaalsContact CZ-CE 3.43Å; F480-K484 VanDerWaalsContact CZ-NZ 3.31Å; F480-K484 PolarHBondContact O-N 2.69Å; L481-K484 WeakPolarHBondContact O-CB 3.32Å; L481-K484 PolarHBondContact O-N 3.11Å; L481-K484 VanDerWaalsContact O-N 3.07Å; L482-K484 PolarHBondContact O-N 3.28Å; K484-M522 HydrophobicContact CB-CE 4.49Å; K484-M522 HydrophobicContact CD-CE 4.16Å; K484-M522 VanDerWaalsContact CE-CE 3.43Å; K484-M522 HydrophobicContact CG-CE 3.33Å
485L87.3Confident83.5Confident0 Ų024.3 Ų24.30%013%0.128CC..Hα-helixtrans-75.9-45.5-176.6-173.175.9000111.9I329 L332 Q333 L336 V467 W470 L481 L482 R488 L489I329-L485 HydrophobicContact CG2-CD2 4.34Å; L332-L485 HydrophobicContact CB-CD1 4.36Å; L332-L485 HydrophobicContact CD2-CD1 3.78Å; L332-L485 HydrophobicContact CD2-CD2 3.8Å; L332-L485 HydrophobicContact CD2-CG 4.33Å; L332-L485 HydrophobicContact CG-CD1 3.98Å; Q333-L485 HydrophobicContact CB-CD1 4.4Å; L336-L485 HydrophobicContact CD1-CD1 3.53Å; L336-L485 HydrophobicContact CD1-CG 4.45Å; V467-L485 HydrophobicContact CG2-CD2 3.72Å; W470-L485 HydrophobicContact CZ3-CD2 4.4Å; L481-L485 WeakPolarHBondContact O-CB 3.33Å; L481-L485 PolarHBondContact O-N 3.01Å; L482-L485 HydrophobicContact CD2-CD2 4.31Å; L482-L485 PolarHBondContact O-N 3.11Å; L482-L485 VanDerWaalsContact O-N 3.1Å; L485-R488 WeakPolarHBondContact O-CB 3.32Å; L485-R488 PolarHBondContact O-N 3.17Å; L485-R488 VanDerWaalsContact O-N 3.1Å; L485-L489 HydrophobicContact CD2-CD1 3.99Å; L485-L489 HydrophobicContact CG-CD1 3.87Å; L485-L489 HydrophobicContact CG-CG 4.3Å; L485-L489 PolarHBondContact O-N 3.19Å
486I88.3Confident83Confident1 Ų123.7 Ų23.71%0.00512%0.124CC..Hα-helixtrans-59.3-48.5-171.9-70.3161.9000112.6V467 I471 L482 R488 L489 V490 V506 W509 I530V467-I486 HydrophobicContact CG1-CG1 4.33Å; I471-I486 HydrophobicContact CD1-CD1 4.25Å; L482-I486 WeakPolarHBondContact O-CG1 3.41Å; L482-I486 PolarHBondContact O-N 2.81Å; I486-R488 PolarHBondContact O-N 3.28Å; I486-L489 PolarHBondContact O-N 3.1Å; I486-L489 VanDerWaalsContact O-N 3.09Å; I486-V490 HydrophobicContact CG2-CG2 4.46Å; I486-V490 WeakPolarHBondContact O-CG2 3.31Å; I486-V490 PolarHBondContact O-N 3.31Å; I486-V506 HydrophobicContact CD1-CG1 4.36Å; I486-V506 HydrophobicContact CG2-CG1 3.79Å; I486-W509 HydrophobicContact CD1-CE3 4.28Å; I486-W509 HydrophobicContact CD1-CH2 3.9Å; I486-W509 HydrophobicContact CD1-CZ3 3.43Å; I486-W509 VanDerWaalsContact CD1-CZ3 3.47Å; I486-I530 HydrophobicContact CG2-CD1 3.93Å; I486-I530 HydrophobicContact CG2-CG1 4.49Å
487P85.5Confident82.8Confident0.5 Ų0.520.4 Ų20.40%0.00311%0.109CC..Hα-helixtrans-62.9-29.1177.6-23.134.7000113.5F343 Y483 A491 N526 L529 I530F343-P487 HydrophobicContact CE2-CB 3.75Å; F343-P487 HydrophobicContact CZ-CB 4.02Å; Y483-P487 WeakPolarHBondContact O-CD 3.44Å; Y483-P487 WeakPolarHBondContact O-CG 3.49Å; P487-A491 WeakPolarHBondContact O-CB 3.39Å; P487-A491 PolarHBondContact O-N 3.16Å; P487-A491 VanDerWaalsContact O-N 3.09Å; P487-N526 HydrophobicContact CG-CB 3.74Å; P487-L529 HydrophobicContact CB-CB 3.98Å; P487-L529 HydrophobicContact CB-CD1 4.47Å; P487-L529 HydrophobicContact CG-CB 4.43Å; P487-I530 HydrophobicContact CB-CG1 4.19Å; P487-I530 HydrophobicContact CG-CD1 4.36Å; P487-I530 HydrophobicContact CG-CG1 4.08Å
488R84.2Confident82.4Confident19.5 Ų19.521.1 Ų21.17%0.07411%0.112CC..Hα-helixtrans-70-42.7172.7-64179.2-178-156.9-2.8111Q333 L336 Q340 F343 L485 I486 V490 A491 L492Q333-R488 VanDerWaalsContact CG-NH1 3.28Å; Q333-R488 PolarHBondContact O-NH1 3.11Å; L336-R488 HydrophobicContact CB-CB 4.4Å; L336-R488 HydrophobicContact CD1-CB 4.25Å; Q340-R488 PolarHBondContact NE2-O 3.29Å; Q340-R488 PolarHBondContact OE1-O 3.47Å; F343-R488 HydrophobicContact CD1-CG 4.14Å; F343-R488 HydrophobicContact CD2-CG 4.25Å; F343-R488 HydrophobicContact CE1-CG 3.91Å; F343-R488 HydrophobicContact CE2-CG 4.03Å; F343-R488 HydrophobicContact CG-CG 4.32Å; F343-R488 HydrophobicContact CZ-CG 3.86Å; L485-R488 WeakPolarHBondContact O-CB 3.32Å; L485-R488 PolarHBondContact O-N 3.17Å; L485-R488 VanDerWaalsContact O-N 3.1Å; I486-R488 PolarHBondContact O-N 3.28Å; R488-V490 PolarHBondContact O-N 3.22Å; R488-A491 PolarHBondContact O-N 2.88Å; R488-L492 PolarHBondContact O-N 3.19Å
489L86.9Confident81.7Confident2.5 Ų2.524.7 Ų24.71%0.01313%0.131CC..Hα-helixtrans-62.6-43.1175.4-70.5169.6000112.1L336 I463 W464 V467 L485 I486 A491 L492L336-L489 HydrophobicContact CD1-CD2 3.73Å; L336-L489 HydrophobicContact CD1-CG 3.94Å; L336-L489 HydrophobicContact CD2-CD2 3.97Å; L336-L489 HydrophobicContact CG-CD2 4.46Å; I463-L489 HydrophobicContact CG2-CD1 4.34Å; I463-L489 HydrophobicContact CG2-CD2 3.81Å; W464-L489 HydrophobicContact CH2-CB 3.99Å; W464-L489 HydrophobicContact CH2-CD1 4.47Å; W464-L489 HydrophobicContact CZ2-CB 3.8Å; W464-L489 HydrophobicContact CZ3-CD1 4.44Å; V467-L489 HydrophobicContact CG1-CD1 4.45Å; V467-L489 HydrophobicContact CG2-CD1 3.81Å; L485-L489 HydrophobicContact CD2-CD1 3.99Å; L485-L489 HydrophobicContact CG-CD1 3.87Å; L485-L489 HydrophobicContact CG-CG 4.3Å; L485-L489 PolarHBondContact O-N 3.19Å; I486-L489 PolarHBondContact O-N 3.1Å; I486-L489 VanDerWaalsContact O-N 3.09Å; L489-A491 VanDerWaalsContact C-N 3.3Å; L489-A491 PolarHBondContact O-N 3.17Å; L489-L492 VanDerWaalsContact O-CB 3.28Å; L489-L492 WeakPolarHBondContact O-CB 3.37Å; L489-L492 PolarHBondContact O-N 3.15Å
490V86.2Confident80.9Confident0 Ų029.8 Ų29.80%016%0.163CC..Hα-helixtrans-60.8-40.1174.6177.20000111.4W464 I486 R488 L492 F497 I530 F533 M534W464-V490 HydrophobicContact CH2-CG2 4.42Å; I486-V490 HydrophobicContact CG2-CG2 4.46Å; I486-V490 WeakPolarHBondContact O-CG2 3.31Å; I486-V490 PolarHBondContact O-N 3.31Å; R488-V490 PolarHBondContact O-N 3.22Å; V490-L492 PolarHBondContact O-N 3.16Å; V490-F497 HydrophobicContact CG1-CD1 4.26Å; V490-F497 HydrophobicContact CG1-CG 4.44Å; V490-F497 HydrophobicContact CG2-CB 4.42Å; V490-F497 HydrophobicContact CG2-CD1 3.97Å; V490-F497 HydrophobicContact CG2-CD2 3.86Å; V490-F497 HydrophobicContact CG2-CE1 4.16Å; V490-F497 HydrophobicContact CG2-CE2 4.07Å; V490-F497 HydrophobicContact CG2-CG 3.81Å; V490-F497 HydrophobicContact CG2-CZ 4.21Å; V490-I530 HydrophobicContact CG1-CG2 4.37Å; V490-I530 HydrophobicContact CG2-CG1 4.36Å; V490-I530 HydrophobicContact CG2-CG2 4.29Å; V490-F533 HydrophobicContact CG1-CB 4.15Å; V490-M534 HydrophobicContact CG1-CG 4.22Å
491A85.1Confident80.7Confident25 Ų2536.1 Ų36.121%0.20719%0.193CC..Hα-helixtrans-67.3-11.2175.700000114.6F343 P487 R488 L489 F533F343-A491 HydrophobicContact CD2-CB 3.93Å; P487-A491 WeakPolarHBondContact O-CB 3.39Å; P487-A491 PolarHBondContact O-N 3.16Å; P487-A491 VanDerWaalsContact O-N 3.09Å; R488-A491 PolarHBondContact O-N 2.88Å; L489-A491 VanDerWaalsContact C-N 3.3Å; L489-A491 PolarHBondContact O-N 3.17Å; A491-F533 HydrophobicContact CB-CB 4.43Å; A491-F533 HydrophobicContact CB-CD1 3.6Å; A491-F533 HydrophobicContact CB-CD2 3.79Å; A491-F533 HydrophobicContact CB-CE1 3.7Å; A491-F533 HydrophobicContact CB-CE2 3.91Å; A491-F533 HydrophobicContact CB-CG 3.67Å; A491-F533 HydrophobicContact CB-CZ 3.87Å
492L84.2Confident80.4Confident24 Ų2438.3 Ų38.313%0.12620%0.201CC..Hα-helixtrans-81.6-45.4-178.7-171.464.2000111.3L336 V339 L453 L456 L457 I460 R488 L489 V490L336-L492 HydrophobicContact CD2-CD2 4Å; V339-L492 HydrophobicContact CG1-CD1 3.63Å; L453-L492 HydrophobicContact CD1-CD1 3.64Å; L456-L492 HydrophobicContact CB-CD2 4.19Å; L457-L492 HydrophobicContact CD2-CD2 4.47Å; L457-L492 HydrophobicContact CD2-CG 4.21Å; I460-L492 HydrophobicContact CD1-CD2 3.93Å; I460-L492 HydrophobicContact CD1-CG 4.43Å; R488-L492 PolarHBondContact O-N 3.19Å; L489-L492 VanDerWaalsContact O-CB 3.28Å; L489-L492 WeakPolarHBondContact O-CB 3.37Å; L489-L492 PolarHBondContact O-N 3.15Å; V490-L492 PolarHBondContact O-N 3.16Å
493K83.2Confident80.2Confident80 Ų8039.8 Ų39.835%0.34821%0.208SC..  trans-155.288.3178.9-172.1166.8172.1-165.50109.3L457 I460 S495 E496L457-K493 HydrophobicContact CD2-CB 4.32Å; L457-K493 HydrophobicContact CD2-CD 4.09Å; I460-K493 HydrophobicContact CD1-CB 4.16Å; K493-S495 WeakPolarHBondContact CG-OG 3.32Å; K493-S495 PolarHBondContact O-N 3.19Å; K493-S495 VanDerWaalsContact O-N 3.16Å; K493-E496 HydrophobicContact CD-CG 3.92Å; K493-E496 VanDerWaalsContact CD-OE1 3.32Å; K493-E496 WeakPolarHBondContact CD-OE1 3.27Å; K493-E496 VanDerWaalsContact CE-OE1 3.26Å; K493-E496 WeakPolarHBondContact CE-OE1 3.31Å; K493-E496 HydrophobicContact CG-CG 4.2Å; K493-E496 IonicContact NZ-OE1 2.93Å; K493-E496 PolarHBondContact NZ-OE1 3.27Å; K493-E496 PolarHBondContact O-N 3.06Å
494P80.6Confident80Confident51 Ų5146.5 Ų46.533%0.33123%0.233SC..Hα-helixtrans-61.1-27.8-17622.4-32.8000112.7E496 F497 Q498P494-E496 VanDerWaalsContact C-N 3.33Å; P494-E496 PolarHBondContact O-N 3.05Å; P494-F497 WeakPolarHBondContact O-CB 3.18Å; P494-F497 PolarHBondContact O-N 3.42Å; P494-F497 VanDerWaalsContact O-N 3.08Å; P494-Q498 PolarHBondContact O-N 3.09Å
495S76.9Confident80Confident59.5 Ų59.548.5 Ų48.542%0.41625%0.247SC..Hα-helixtrans-64.1-28.3-179.760.30000115K493 F497 Q498K493-S495 WeakPolarHBondContact CG-OG 3.32Å; K493-S495 PolarHBondContact O-N 3.19Å; K493-S495 VanDerWaalsContact O-N 3.16Å; S495-F497 VanDerWaalsContact C-N 3.35Å; S495-Q498 WeakPolarHBondContact O-CB 3.27Å; S495-Q498 PolarHBondContact O-N 3.38Å
496E72.1Confident79.9Confident28 Ų2848.5 Ų48.513%0.13125%0.247CC..Hα-helixtrans-81.9-18.6174.7-75.8177.1-169.500112.8I460 K493 P494 Q498I460-E496 WeakPolarHBondContact CD1-OE2 3.47Å; I460-E496 VanDerWaalsContact CG1-OE2 3.25Å; I460-E496 WeakPolarHBondContact CG1-OE2 3.42Å; I460-E496 WeakPolarHBondContact CG2-OE2 3.37Å; K493-E496 HydrophobicContact CD-CG 3.92Å; K493-E496 VanDerWaalsContact CD-OE1 3.32Å; K493-E496 WeakPolarHBondContact CD-OE1 3.27Å; K493-E496 VanDerWaalsContact CE-OE1 3.26Å; K493-E496 WeakPolarHBondContact CE-OE1 3.31Å; K493-E496 HydrophobicContact CG-CG 4.2Å; K493-E496 IonicContact NZ-OE1 2.93Å; K493-E496 PolarHBondContact NZ-OE1 3.27Å; K493-E496 PolarHBondContact O-N 3.06Å; P494-E496 VanDerWaalsContact C-N 3.33Å; P494-E496 PolarHBondContact O-N 3.05Å; E496-Q498 VanDerWaalsContact C-N 3.26Å
497F75.4Confident79.7Confident1 Ų148.5 Ų48.50%0.00425%0.247CC..Hα-helixtrans-78.7-13.5172.5-168.1-108.4000112.1W464 V490 P494 S495 D499 Q503 V506 M507 I530 M534W464-F497 AromaticContact CH2-CD2 3.69Å; W464-F497 HydrophobicContact CH2-CD2 3.69Å; W464-F497 AromaticContact CH2-CE2 3.88Å; W464-F497 HydrophobicContact CH2-CE2 3.98Å; W464-F497 AromaticContact CZ2-CD2 3.85Å; W464-F497 HydrophobicContact CZ2-CD2 3.94Å; W464-F497 HydrophobicContact CZ3-CD2 4.37Å; W464-F497 HydrophobicContact CZ3-CE2 4.4Å; V490-F497 HydrophobicContact CG1-CD1 4.26Å; V490-F497 HydrophobicContact CG1-CG 4.44Å; V490-F497 HydrophobicContact CG2-CB 4.42Å; V490-F497 HydrophobicContact CG2-CD1 3.97Å; V490-F497 HydrophobicContact CG2-CD2 3.86Å; V490-F497 HydrophobicContact CG2-CE1 4.16Å; V490-F497 HydrophobicContact CG2-CE2 4.07Å; V490-F497 HydrophobicContact CG2-CG 3.81Å; V490-F497 HydrophobicContact CG2-CZ 4.21Å; P494-F497 WeakPolarHBondContact O-CB 3.18Å; P494-F497 PolarHBondContact O-N 3.42Å; P494-F497 VanDerWaalsContact O-N 3.08Å; S495-F497 VanDerWaalsContact C-N 3.35Å; F497-D499 PolarHBondContact O-N 3.07Å; F497-Q503 HydrophobicContact CD1-CG 4.42Å; F497-Q503 HydrophobicContact CE1-CB 4.38Å; F497-Q503 HydrophobicContact CE1-CG 3.9Å; F497-Q503 HydrophobicContact CZ-CB 4.49Å; F497-Q503 HydrophobicContact CZ-CG 4.35Å; F497-Q503 WeakPolarHBondContact O-CB 3.04Å; F497-V506 HydrophobicContact CE2-CB 3.97Å; F497-V506 HydrophobicContact CE2-CG1 4.09Å; F497-V506 HydrophobicContact CE2-CG2 4.11Å; F497-V506 HydrophobicContact CZ-CB 4.02Å; F497-V506 HydrophobicContact CZ-CG1 3.98Å; F497-M507 HydrophobicContact CE1-CE 3.9Å; F497-M507 HydrophobicContact CZ-CE 4.22Å; F497-I530 HydrophobicContact CE1-CG2 4.11Å; F497-M534 HydrophobicContact CD1-CE 4.3Å; F497-M534 HydrophobicContact CD1-CG 4.48Å; F497-M534 HydrophobicContact CD1-SD 3.9Å; F497-M534 HydrophobicContact CE1-CE 4.43Å; F497-M534 HydrophobicContact CE1-SD 3.87Å
498Q68.3Low79.6Confident80.5 Ų80.552.6 Ų52.638%0.37627%0.267SS..THydrogen-bonded Turntrans-70.7-11.3174.3-63.8168.7-0.400113.3P494 S495 E496 T500 E537P494-Q498 PolarHBondContact O-N 3.09Å; S495-Q498 WeakPolarHBondContact O-CB 3.27Å; S495-Q498 PolarHBondContact O-N 3.38Å; E496-Q498 VanDerWaalsContact C-N 3.26Å; Q498-T500 PolarHBondContact O-N 3.12Å; Q498-E537 PolarHBondContact NE2-OE1 3.35Å; Q498-E537 PolarHBondContact NE2-OE2 3.02Å
499D68.9Low79.7Confident75.5 Ų75.552.8 Ų52.840%0.40427%0.267SS..SBendtrans-57112.8172.4-71.4-30.8000109.8F497 E501 R502 Q503F497-D499 PolarHBondContact O-N 3.07Å; D499-E501 PolarHBondContact O-N 2.91Å; D499-R502 HydrophobicContact CB-CB 4.18Å; D499-R502 HydrophobicContact CB-CG 4Å; D499-R502 PolarHBondContact O-N 3.23Å; D499-R502 IonicContact OD2-CZ 2.76Å; D499-R502 VanDerWaalsContact OD2-CZ 3.31Å; D499-R502 IonicContact OD2-NE 3.36Å; D499-R502 IonicContact OD2-NH1 3.18Å; D499-R502 PolarHBondContact OD2-NH1 2.89Å; D499-Q503 PolarHBondContact O-N 3.3Å
500T66.6Low79.6Confident115 Ų11552.7 Ų52.771%0.70627%0.267SS*.Hα-helixtrans-52.1-36.1-165.7-42.50000113.7Q498 R504Q498-T500 PolarHBondContact O-N 3.12Å; T500-R504 WeakPolarHBondContact O-CB 3.23Å; T500-R504 PolarHBondContact O-N 2.81Å; T500-R504 VanDerWaalsContact O-N 3.08Å
501E76.6Confident79.5Confident162.5 Ų162.554.3 Ų54.376%0.75928%0.275SS*.Hα-helixtrans-73.8-41.6178.7-60.6-171.816600112.8D499 R504 T505D499-E501 PolarHBondContact O-N 2.91Å; E501-R504 PolarHBondContact O-N 3.44Å; E501-T505 WeakPolarHBondContact O-CB 3.44Å; E501-T505 PolarHBondContact O-N 3.04Å; E501-T505 PolarHBondContact O-OG1 3.03Å; E501-T505 VanDerWaalsContact O-OG1 3.07Å
502R78.1Confident79.4Confident50.5 Ų50.559.3 Ų59.319%0.19129%0.294CS..Hα-helixtrans-65.5-50179.1-64.1-179.3175167.7-14.8110.3D461 D499 R504 T505 V506D461-R502 IonicContact OD1-CZ 3.23Å; D461-R502 IonicContact OD1-NH1 2.73Å; D461-R502 IonicContact OD1-NH2 2.71Å; D461-R502 PolarHBondContact OD1-NH2 3Å; D499-R502 HydrophobicContact CB-CB 4.18Å; D499-R502 HydrophobicContact CB-CG 4Å; D499-R502 PolarHBondContact O-N 3.23Å; D499-R502 IonicContact OD2-CZ 2.76Å; D499-R502 VanDerWaalsContact OD2-CZ 3.31Å; D499-R502 IonicContact OD2-NE 3.36Å; D499-R502 IonicContact OD2-NH1 3.18Å; D499-R502 PolarHBondContact OD2-NH1 2.89Å; R502-R504 VanDerWaalsContact C-N 3.34Å; R502-R504 PolarHBondContact O-N 3.44Å; R502-T505 PolarHBondContact O-N 3.11Å; R502-V506 WeakPolarHBondContact O-CG2 3.24Å; R502-V506 PolarHBondContact O-N 3.3Å; R502-V506 VanDerWaalsContact O-N 3.13Å
503Q80.9Confident79.3Confident32 Ų3258.4 Ų58.415%0.1529%0.29CS..Hα-helixtrans-56.1-50.2176.2-170.2-175.7-5.900110.8F497 D499 V506 M507F497-Q503 HydrophobicContact CD1-CG 4.42Å; F497-Q503 HydrophobicContact CE1-CB 4.38Å; F497-Q503 HydrophobicContact CE1-CG 3.9Å; F497-Q503 HydrophobicContact CZ-CB 4.49Å; F497-Q503 HydrophobicContact CZ-CG 4.35Å; F497-Q503 WeakPolarHBondContact O-CB 3.04Å; D499-Q503 PolarHBondContact O-N 3.3Å; Q503-V506 PolarHBondContact O-N 3.19Å; Q503-M507 HydrophobicContact CG-CG 4.14Å; Q503-M507 VanDerWaalsContact O-CB 3.26Å; Q503-M507 WeakPolarHBondContact O-CB 3.42Å; Q503-M507 WeakPolarHBondContact O-CG 3.37Å; Q503-M507 PolarHBondContact O-N 3.14Å
504R81.6Confident79.1Confident142.5 Ų142.555 Ų5554%0.53828%0.275SS..Hα-helixtrans-60.1-50.2-177.5-178.3175.1-173.7164.95.8111.8T500 E501 R502 V506 M507 E508T500-R504 WeakPolarHBondContact O-CB 3.23Å; T500-R504 PolarHBondContact O-N 2.81Å; T500-R504 VanDerWaalsContact O-N 3.08Å; E501-R504 PolarHBondContact O-N 3.44Å; R502-R504 VanDerWaalsContact C-N 3.34Å; R502-R504 PolarHBondContact O-N 3.44Å; R504-V506 PolarHBondContact O-N 3.15Å; R504-M507 PolarHBondContact O-N 2.83Å; R504-E508 HydrophobicContact CG-CG 4.17Å; R504-E508 WeakPolarHBondContact CG-OE1 3.44Å; R504-E508 IonicContact CZ-OE1 3.22Å; R504-E508 IonicContact NE-OE1 3.78Å; R504-E508 PolarHBondContact NE-OE1 3.1Å; R504-E508 IonicContact NE-OE2 3.24Å; R504-E508 IonicContact NH2-OE1 3.33Å; R504-E508 PolarHBondContact NH2-OE1 3.02Å; R504-E508 VanDerWaalsContact O-CB 3.27Å; R504-E508 WeakPolarHBondContact O-CB 3.3Å; R504-E508 VanDerWaalsContact O-CG 3.31Å; R504-E508 WeakPolarHBondContact O-CG 3.3Å; R504-E508 PolarHBondContact O-N 3.16Å
505T83.7Confident79Confident67.5 Ų67.562.7 Ų62.741%0.41430%0.298SS..Hα-helixtrans-59.7-45.4-179.4-57.90000111.9L468 E501 R502 W509L468-T505 HydrophobicContact CD2-CG2 4.16Å; E501-T505 WeakPolarHBondContact O-CB 3.44Å; E501-T505 PolarHBondContact O-N 3.04Å; E501-T505 PolarHBondContact O-OG1 3.03Å; E501-T505 VanDerWaalsContact O-OG1 3.07Å; R502-T505 PolarHBondContact O-N 3.11Å; T505-W509 VanDerWaalsContact O-CB 3.22Å; T505-W509 WeakPolarHBondContact O-CB 3.28Å; T505-W509 PolarHBondContact O-N 3.3Å
506V84.7Confident79Confident0 Ų063.9 Ų63.90%030%0.296CS..Hα-helixtrans-69.8-41.8-179.6173.70000111.6W464 I471 I486 F497 R502 Q503 R504 W509 M510W464-V506 HydrophobicContact CZ3-CG2 4.48Å; I471-V506 HydrophobicContact CD1-CG2 4.16Å; I486-V506 HydrophobicContact CD1-CG1 4.36Å; I486-V506 HydrophobicContact CG2-CG1 3.79Å; F497-V506 HydrophobicContact CE2-CB 3.97Å; F497-V506 HydrophobicContact CE2-CG1 4.09Å; F497-V506 HydrophobicContact CE2-CG2 4.11Å; F497-V506 HydrophobicContact CZ-CB 4.02Å; F497-V506 HydrophobicContact CZ-CG1 3.98Å; R502-V506 WeakPolarHBondContact O-CG2 3.24Å; R502-V506 PolarHBondContact O-N 3.3Å; R502-V506 VanDerWaalsContact O-N 3.13Å; Q503-V506 PolarHBondContact O-N 3.19Å; R504-V506 PolarHBondContact O-N 3.15Å; V506-W509 PolarHBondContact O-N 3.12Å; V506-M510 HydrophobicContact CG1-SD 4.42Å; V506-M510 WeakPolarHBondContact O-CG 3.45Å; V506-M510 PolarHBondContact O-N 3.45Å
507M83.3Confident78.8Confident0.5 Ų0.570 Ų700%0.00232%0.324CS..Hα-helixtrans-68.4-45.5178.7-70.9-66.8-127.200112.1F497 Q503 R504 W509 M510 L511 L527 I530 M534 F538 Y543F497-M507 HydrophobicContact CE1-CE 3.9Å; F497-M507 HydrophobicContact CZ-CE 4.22Å; Q503-M507 HydrophobicContact CG-CG 4.14Å; Q503-M507 VanDerWaalsContact O-CB 3.26Å; Q503-M507 WeakPolarHBondContact O-CB 3.42Å; Q503-M507 WeakPolarHBondContact O-CG 3.37Å; Q503-M507 PolarHBondContact O-N 3.14Å; R504-M507 PolarHBondContact O-N 2.83Å; M507-W509 VanDerWaalsContact C-N 3.31Å; M507-W509 PolarHBondContact O-N 2.78Å; M507-M510 PolarHBondContact O-N 2.78Å; M507-L511 WeakPolarHBondContact O-CB 3.45Å; M507-L511 WeakPolarHBondContact O-CG 3.49Å; M507-L511 PolarHBondContact O-N 3.1Å; M507-L527 HydrophobicContact CE-CD1 4.05Å; M507-L527 HydrophobicContact SD-CD1 3.73Å; M507-I530 HydrophobicContact CE-CB 4.41Å; M507-I530 HydrophobicContact CE-CG2 3.43Å; M507-I530 VanDerWaalsContact CE-CG2 3.43Å; M507-M534 HydrophobicContact CE-SD 4.09Å; M507-F538 HydrophobicContact CE-CE2 3.79Å; M507-F538 HydrophobicContact CE-CZ 3.83Å; M507-F538 HydrophobicContact SD-CE2 4.36Å; M507-Y543 HydrophobicContact CB-CE1 4.29Å; M507-Y543 HydrophobicContact CB-CE2 4.45Å; M507-Y543 HydrophobicContact CE-CD1 4.45Å; M507-Y543 HydrophobicContact CE-CD2 4.01Å; M507-Y543 HydrophobicContact CE-CG 3.89Å
508E84.8Confident78.6Confident88.5 Ų88.577.2 Ų77.241%0.41436%0.355SS..Hα-helixtrans-60.6-40.5175.1-72.8177.9173.300111R504 L511 Q512R504-E508 HydrophobicContact CG-CG 4.17Å; R504-E508 WeakPolarHBondContact CG-OE1 3.44Å; R504-E508 IonicContact CZ-OE1 3.22Å; R504-E508 IonicContact NE-OE1 3.78Å; R504-E508 PolarHBondContact NE-OE1 3.1Å; R504-E508 IonicContact NE-OE2 3.24Å; R504-E508 IonicContact NH2-OE1 3.33Å; R504-E508 PolarHBondContact NH2-OE1 3.02Å; R504-E508 VanDerWaalsContact O-CB 3.27Å; R504-E508 WeakPolarHBondContact O-CB 3.3Å; R504-E508 VanDerWaalsContact O-CG 3.31Å; R504-E508 WeakPolarHBondContact O-CG 3.3Å; R504-E508 PolarHBondContact O-N 3.16Å; E508-L511 PolarHBondContact O-N 3.28Å; E508-Q512 VanDerWaalsContact O-CB 3.27Å; E508-Q512 WeakPolarHBondContact O-CB 3.45Å; E508-Q512 PolarHBondContact O-N 2.94Å
509W85.8Confident78.9Confident22 Ų2274.2 Ų74.28%0.08334%0.342CS..Hα-helixtrans-64.6-44.8174.4174.184.2000113I471 M479 L482 Y483 I486 T505 V506 M507 Q512 C513I471-W509 HydrophobicContact CG1-CD2 4.39Å; I471-W509 HydrophobicContact CG1-CH2 4.43Å; I471-W509 HydrophobicContact CG1-CZ2 4.2Å; I471-W509 HydrophobicContact CG2-CD2 4.21Å; I471-W509 HydrophobicContact CG2-CG 3.94Å; I471-W509 PolarHBondContact O-NE1 3.19Å; M479-W509 HydrophobicContact CE-CH2 4.46Å; M479-W509 HydrophobicContact CE-CZ2 3.41Å; M479-W509 VanDerWaalsContact CE-CZ2 3.44Å; M479-W509 HydrophobicContact SD-CZ2 3.77Å; L482-W509 HydrophobicContact CB-CH2 4.1Å; L482-W509 HydrophobicContact CD1-CZ2 4.49Å; Y483-W509 AromaticContact CD1-CH2 3.51Å; Y483-W509 HydrophobicContact CD1-CH2 3.51Å; Y483-W509 VanDerWaalsContact CD1-CH2 3.49Å; Y483-W509 HydrophobicContact CD1-CZ2 4.45Å; Y483-W509 AromaticContact CD1-CZ3 3.78Å; Y483-W509 HydrophobicContact CD1-CZ3 3.78Å; Y483-W509 HydrophobicContact CE1-CE3 4.41Å; Y483-W509 AromaticContact CE1-CH2 3.26Å; Y483-W509 HydrophobicContact CE1-CH2 3.26Å; Y483-W509 AromaticContact CE1-CZ2 3.81Å; Y483-W509 HydrophobicContact CE1-CZ2 3.81Å; Y483-W509 AromaticContact CE1-CZ3 3.65Å; Y483-W509 HydrophobicContact CE1-CZ3 3.65Å; I486-W509 HydrophobicContact CD1-CE3 4.28Å; I486-W509 HydrophobicContact CD1-CH2 3.9Å; I486-W509 HydrophobicContact CD1-CZ3 3.43Å; I486-W509 VanDerWaalsContact CD1-CZ3 3.47Å; T505-W509 VanDerWaalsContact O-CB 3.22Å; T505-W509 WeakPolarHBondContact O-CB 3.28Å; T505-W509 PolarHBondContact O-N 3.3Å; V506-W509 PolarHBondContact O-N 3.12Å; M507-W509 VanDerWaalsContact C-N 3.31Å; M507-W509 PolarHBondContact O-N 2.78Å; W509-Q512 PolarHBondContact O-N 3.05Å; W509-C513 WeakPolarHBondContact O-CB 3.18Å; W509-C513 PolarHBondContact O-N 3.24Å; W509-C513 PolarHBondContact O-SG 3.24Å
510M84.9Confident79.7Confident2 Ų272.5 Ų72.51%0.0133%0.331CS..Hα-helixtrans-64.9-42.2176.2-71.9-171.673.500111.8V506 M507 Q512 C513 L514 I523 N526 L527 I530V506-M510 HydrophobicContact CG1-SD 4.42Å; V506-M510 WeakPolarHBondContact O-CG 3.45Å; V506-M510 PolarHBondContact O-N 3.45Å; M507-M510 PolarHBondContact O-N 2.78Å; M510-Q512 VanDerWaalsContact C-N 3.33Å; M510-Q512 PolarHBondContact O-N 2.89Å; M510-C513 PolarHBondContact O-N 3.35Å; M510-L514 PolarHBondContact O-N 3.01Å; M510-I523 HydrophobicContact CB-CG2 4.31Å; M510-I523 HydrophobicContact CE-CG2 4.04Å; M510-N526 HydrophobicContact CE-CB 3.95Å; M510-L527 HydrophobicContact CB-CD1 4.5Å; M510-L527 HydrophobicContact CE-CB 4.1Å; M510-L527 HydrophobicContact CE-CD1 4.36Å; M510-L527 HydrophobicContact SD-CD1 4.4Å; M510-I530 HydrophobicContact CE-CD1 4.01Å; M510-I530 HydrophobicContact SD-CD1 3.4Å; M510-I530 WeakPolarHBondContact SD-CD1 3.41Å
511L83.5Confident80.4Confident33 Ų3367.3 Ų67.317%0.17330%0.298CS..Hα-helixtrans-65.5-34.9175.5-68.6170.7000112.2M507 E508 L514 L527 Y543 I547M507-L511 WeakPolarHBondContact O-CB 3.45Å; M507-L511 WeakPolarHBondContact O-CG 3.49Å; M507-L511 PolarHBondContact O-N 3.1Å; E508-L511 PolarHBondContact O-N 3.28Å; L511-L514 HydrophobicContact CD2-CD1 3.97Å; L511-L527 HydrophobicContact CD2-CD2 4.35Å; L511-Y543 HydrophobicContact CD1-CD1 3.78Å; L511-Y543 HydrophobicContact CD1-CE1 4.1Å; L511-I547 HydrophobicContact CD2-CG1 4.46Å
512Q83.7Confident80.6Confident129.5 Ų129.559.7 Ų59.761%0.60526%0.263SS*.Hα-helixtrans-66.5-40.7171.2-171.5-179.920.400111.2E508 W509 M510 L514 R515E508-Q512 VanDerWaalsContact O-CB 3.27Å; E508-Q512 WeakPolarHBondContact O-CB 3.45Å; E508-Q512 PolarHBondContact O-N 2.94Å; W509-Q512 PolarHBondContact O-N 3.05Å; M510-Q512 VanDerWaalsContact C-N 3.33Å; M510-Q512 PolarHBondContact O-N 2.89Å; Q512-L514 VanDerWaalsContact C-N 3.32Å; Q512-L514 PolarHBondContact O-N 2.88Å; Q512-R515 WeakPolarHBondContact O-CB 3.32Å; Q512-R515 WeakPolarHBondContact O-CG 3.36Å; Q512-R515 PolarHBondContact O-N 2.94Å
513C81.9Confident80.9Confident5.5 Ų5.557.3 Ų57.34%0.03725%0.254CS..Hα-helixtrans-69.5-27.1178.9-66.90000113.2Y483 W509 M510 R515 K516 I523Y483-C513 HydrophobicContact CE1-CB 4.37Å; Y483-C513 VanDerWaalsContact OH-CB 3.31Å; Y483-C513 WeakPolarHBondContact OH-CB 3.36Å; Y483-C513 PolarHBondContact OH-SG 3.22Å; W509-C513 WeakPolarHBondContact O-CB 3.18Å; W509-C513 PolarHBondContact O-N 3.24Å; W509-C513 PolarHBondContact O-SG 3.24Å; M510-C513 PolarHBondContact O-N 3.35Å; C513-R515 PolarHBondContact O-N 3.14Å; C513-K516 WeakPolarHBondContact O-CB 3.46Å; C513-K516 PolarHBondContact O-N 3.49Å; C513-I523 VanDerWaalsContact C-CD1 3.47Å; C513-I523 HydrophobicContact CB-CD1 3.51Å; C513-I523 VanDerWaalsContact CB-CD1 3.46Å; C513-I523 HydrophobicContact CB-CG1 4.4Å; C513-I523 WeakPolarHBondContact O-CD1 3.48Å
514L79.6Confident81.2Confident8 Ų855.8 Ų55.84%0.04225%0.247CC..THydrogen-bonded Turntrans-56.6-18.1171.5-77.4174.8000113.8M510 L511 Q512 K516 K520 I523 L524 L527M510-L514 PolarHBondContact O-N 3.01Å; L511-L514 HydrophobicContact CD2-CD1 3.97Å; Q512-L514 VanDerWaalsContact C-N 3.32Å; Q512-L514 PolarHBondContact O-N 2.88Å; L514-K516 VanDerWaalsContact C-N 3.27Å; L514-K516 PolarHBondContact O-N 3.31Å; L514-K520 WeakPolarHBondContact O-CE 3.29Å; L514-K520 VanDerWaalsContact O-CG 3.31Å; L514-K520 WeakPolarHBondContact O-CG 3.34Å; L514-I523 HydrophobicContact CD2-CB 3.94Å; L514-I523 HydrophobicContact CD2-CG2 3.67Å; L514-I523 HydrophobicContact CG-CG2 3.81Å; L514-L524 HydrophobicContact CD2-CB 4.42Å; L514-L527 HydrophobicContact CD1-CD2 4.27Å
515R77.5Confident81.4Confident213.5 Ų213.549 Ų4981%0.80622%0.222SC*.THydrogen-bonded Turntrans-69.5-24.1173.4-58.7-177.1-176.7-164.71.2112.7Q512 C513 E517Q512-R515 WeakPolarHBondContact O-CB 3.32Å; Q512-R515 WeakPolarHBondContact O-CG 3.36Å; Q512-R515 PolarHBondContact O-N 2.94Å; C513-R515 PolarHBondContact O-N 3.14Å; R515-E517 PolarHBondContact O-N 3.11Å
516K76.6Confident81.4Confident85 Ų8545.9 Ų45.937%0.3720%0.202SC..SBendtrans-82.4109.4-177.7-62.6173.5175.3178.40111.6C513 L514 K518 E519 K520C513-K516 WeakPolarHBondContact O-CB 3.46Å; C513-K516 PolarHBondContact O-N 3.49Å; L514-K516 VanDerWaalsContact C-N 3.27Å; L514-K516 PolarHBondContact O-N 3.31Å; K516-K518 VanDerWaalsContact C-N 3.35Å; K516-K518 PolarHBondContact O-N 3.01Å; K516-E519 HydrophobicContact CB-CB 4.4Å; K516-E519 HydrophobicContact CD-CG 4.48Å; K516-E519 VanDerWaalsContact CD-OE1 3.25Å; K516-E519 WeakPolarHBondContact CD-OE1 3.43Å; K516-E519 VanDerWaalsContact CD-OE2 3.27Å; K516-E519 WeakPolarHBondContact CD-OE2 3.36Å; K516-E519 IonicContact NZ-OE1 2.84Å; K516-E519 PolarHBondContact NZ-OE1 2.85Å; K516-E519 IonicContact NZ-OE2 3.23Å; K516-E519 PolarHBondContact NZ-OE2 3.2Å; K516-E519 PolarHBondContact O-N 3.23Å; K516-E519 VanDerWaalsContact O-N 3.11Å; K516-K520 PolarHBondContact O-N 3.01Å
517E69.7Low81.6Confident155.5 Ų155.545.9 Ų45.973%0.72720%0.202SC*.THydrogen-bonded Turntrans-53.1-42.8-171.2-170.7162.5-131.200115.6R515 E519R515-E517 PolarHBondContact O-N 3.11Å; E517-E519 VanDerWaalsContact C-N 3.28Å; E517-E519 PolarHBondContact O-N 3Å
518K70.8Confident81.7Confident151.5 Ų151.545.9 Ų45.966%0.65920%0.202SC*.THydrogen-bonded Turntrans-70.8-18.5-178.1-62.7-174.8179.3-176.30114.6K516K516-K518 VanDerWaalsContact C-N 3.35Å; K516-K518 PolarHBondContact O-N 3.01Å
519E74.9Confident81.8Confident18.5 Ų18.541.7 Ų41.79%0.08618%0.183CC..THydrogen-bonded Turntrans-106.4-15.8-173.7-63.1169.7-15400112.5H476 Y483 K516 E517 P521 M522 I523H476-E519 IonicContact CE1-OE1 3.35Å; H476-E519 PolarHBondContact CE1-OE1 2.98Å; H476-E519 VanDerWaalsContact CE1-OE1 3.29Å; H476-E519 IonicContact ND1-OE1 3.56Å; H476-E519 PolarHBondContact ND1-OE1 3.08Å; Y483-E519 HydrophobicContact CE2-CB 4.41Å; Y483-E519 HydrophobicContact CE2-CG 4.46Å; Y483-E519 WeakPolarHBondContact CE2-OE2 3.49Å; Y483-E519 PolarHBondContact OH-OE2 2.71Å; K516-E519 HydrophobicContact CB-CB 4.4Å; K516-E519 HydrophobicContact CD-CG 4.48Å; K516-E519 VanDerWaalsContact CD-OE1 3.25Å; K516-E519 WeakPolarHBondContact CD-OE1 3.43Å; K516-E519 VanDerWaalsContact CD-OE2 3.27Å; K516-E519 WeakPolarHBondContact CD-OE2 3.36Å; K516-E519 IonicContact NZ-OE1 2.84Å; K516-E519 PolarHBondContact NZ-OE1 2.85Å; K516-E519 IonicContact NZ-OE2 3.23Å; K516-E519 PolarHBondContact NZ-OE2 3.2Å; K516-E519 PolarHBondContact O-N 3.23Å; K516-E519 VanDerWaalsContact O-N 3.11Å; E517-E519 VanDerWaalsContact C-N 3.28Å; E517-E519 PolarHBondContact O-N 3Å; E519-P521 VanDerWaalsContact C-CD 3.49Å; E519-M522 WeakPolarHBondContact O-CB 3.43Å; E519-M522 PolarHBondContact O-N 3.22Å; E519-M522 VanDerWaalsContact O-N 3.11Å; E519-I523 HydrophobicContact CB-CD1 3.55Å; E519-I523 HydrophobicContact CB-CG1 4.26Å; E519-I523 WeakPolarHBondContact O-CG1 3.1Å; E519-I523 PolarHBondContact O-N 3.26Å
520K84.3Confident81.9Confident40 Ų4040.7 Ų40.717%0.17418%0.179CC..Hα-helixtrans-40.7-56.4-179.6-76.9175.1-176.3170.90115.5L514 K516 M522 I523 L524 Y554 L570L514-K520 WeakPolarHBondContact O-CE 3.29Å; L514-K520 VanDerWaalsContact O-CG 3.31Å; L514-K520 WeakPolarHBondContact O-CG 3.34Å; K516-K520 PolarHBondContact O-N 3.01Å; K520-M522 VanDerWaalsContact C-N 3.3Å; K520-M522 PolarHBondContact O-N 3.09Å; K520-I523 PolarHBondContact O-N 3.06Å; K520-L524 WeakPolarHBondContact O-CB 3.43Å; K520-L524 PolarHBondContact O-N 3.23Å; K520-Y554 HydrophobicContact CD-CE1 4.35Å; K520-L570 HydrophobicContact CB-CD1 3.84Å
521P81Confident81.9Confident4.5 Ų4.540.6 Ų40.63%0.02918%0.178CC..Hα-helixtrans-66.3-32.5-174.427.5-36.4000112.5L362 E519 L525 A569 L570 S573L362-P521 HydrophobicContact CB-CB 4.29Å; L362-P521 HydrophobicContact CD2-CB 3.85Å; L362-P521 WeakPolarHBondContact O-CG 3.26Å; E519-P521 VanDerWaalsContact C-CD 3.49Å; P521-L525 PolarHBondContact O-N 2.88Å; P521-A569 HydrophobicContact CB-CB 4.3Å; P521-A569 WeakPolarHBondContact CB-O 3.34Å; P521-A569 HydrophobicContact CG-CB 4.4Å; P521-L570 HydrophobicContact CB-CD1 4.35Å; P521-S573 WeakPolarHBondContact O-CB 3.3Å; P521-S573 PolarHBondContact O-OG 3.19Å
522M80.5Confident82.1Confident4 Ų442.4 Ų42.42%0.0218%0.183CC..Hα-helixtrans-69.3-47.4175-178.961.2175.800111.1F359 F480 Y483 K484 E519 K520 L524 L525 N526F359-M522 HydrophobicContact CD1-CE 3.6Å; F359-M522 HydrophobicContact CD1-SD 3.34Å; F359-M522 WeakPolarHBondContact CD1-SD 3.24Å; F359-M522 HydrophobicContact CE1-CE 3.63Å; F359-M522 HydrophobicContact CE1-SD 3.53Å; F359-M522 VanDerWaalsContact CE1-SD 3.53Å; F359-M522 HydrophobicContact CG-CE 4.44Å; F359-M522 HydrophobicContact CG-SD 4.5Å; F359-M522 HydrophobicContact CZ-CE 4.5Å; F480-M522 HydrophobicContact CD2-CE 4.11Å; F480-M522 HydrophobicContact CD2-CG 4.13Å; F480-M522 HydrophobicContact CD2-SD 4.44Å; F480-M522 HydrophobicContact CE2-CE 3.64Å; F480-M522 HydrophobicContact CE2-CG 3.96Å; F480-M522 HydrophobicContact CE2-SD 3.89Å; F480-M522 HydrophobicContact CZ-CE 4.27Å; Y483-M522 HydrophobicContact CD2-CG 4.23Å; Y483-M522 HydrophobicContact CG-CG 4.47Å; K484-M522 HydrophobicContact CB-CE 4.49Å; K484-M522 HydrophobicContact CD-CE 4.16Å; K484-M522 VanDerWaalsContact CE-CE 3.43Å; K484-M522 HydrophobicContact CG-CE 3.33Å; E519-M522 WeakPolarHBondContact O-CB 3.43Å; E519-M522 PolarHBondContact O-N 3.22Å; E519-M522 VanDerWaalsContact O-N 3.11Å; K520-M522 VanDerWaalsContact C-N 3.3Å; K520-M522 PolarHBondContact O-N 3.09Å; M522-L524 PolarHBondContact O-N 2.93Å; M522-L525 PolarHBondContact O-N 2.99Å; M522-N526 VanDerWaalsContact CE-ND2 3.27Å; M522-N526 WeakPolarHBondContact CE-ND2 3.4Å; M522-N526 PolarHBondContact O-N 3.08Å; M522-N526 VanDerWaalsContact O-N 3.15Å; M522-N526 PolarHBondContact O-ND2 3.15Å; M522-N526 PolarHBondContact SD-ND2 3.27Å; M522-N526 VanDerWaalsContact SD-ND2 3.39Å
523I84.9Confident82.1Confident0 Ų038 Ų380%016%0.163CC..Hα-helixtrans-66.4-42.3-176.7-62.3160000110.8Y483 M510 C513 L514 E519 K520 L525 N526 L527Y483-I523 HydrophobicContact CD1-CG1 4.28Å; Y483-I523 HydrophobicContact CD2-CG1 4.21Å; Y483-I523 HydrophobicContact CE1-CD1 4.41Å; Y483-I523 HydrophobicContact CE1-CG1 3.99Å; Y483-I523 HydrophobicContact CE2-CD1 4.23Å; Y483-I523 HydrophobicContact CE2-CG1 3.93Å; Y483-I523 HydrophobicContact CG-CG1 4.42Å; M510-I523 HydrophobicContact CB-CG2 4.31Å; M510-I523 HydrophobicContact CE-CG2 4.04Å; C513-I523 VanDerWaalsContact C-CD1 3.47Å; C513-I523 HydrophobicContact CB-CD1 3.51Å; C513-I523 VanDerWaalsContact CB-CD1 3.46Å; C513-I523 HydrophobicContact CB-CG1 4.4Å; C513-I523 WeakPolarHBondContact O-CD1 3.48Å; L514-I523 HydrophobicContact CD2-CB 3.94Å; L514-I523 HydrophobicContact CD2-CG2 3.67Å; L514-I523 HydrophobicContact CG-CG2 3.81Å; E519-I523 HydrophobicContact CB-CD1 3.55Å; E519-I523 HydrophobicContact CB-CG1 4.26Å; E519-I523 WeakPolarHBondContact O-CG1 3.1Å; E519-I523 PolarHBondContact O-N 3.26Å; K520-I523 PolarHBondContact O-N 3.06Å; I523-L525 PolarHBondContact O-N 2.78Å; I523-N526 PolarHBondContact O-N 3.12Å; I523-L527 WeakPolarHBondContact O-CB 3.38Å; I523-L527 PolarHBondContact O-N 3.35Å
524L86.7Confident82.1Confident0.5 Ų0.538.4 Ų38.40%0.00316%0.164CC..Hα-helixtrans-60.8-44.4-179.7-173.263.7000112L514 K520 M522 L527 S528 I551 Y554 L570 A574 S577L514-L524 HydrophobicContact CD2-CB 4.42Å; K520-L524 WeakPolarHBondContact O-CB 3.43Å; K520-L524 PolarHBondContact O-N 3.23Å; M522-L524 PolarHBondContact O-N 2.93Å; L524-L527 PolarHBondContact O-N 3.15Å; L524-S528 PolarHBondContact O-N 3.13Å; L524-S528 PolarHBondContact O-OG 3.44Å; L524-I551 HydrophobicContact CD1-CD1 4.31Å; L524-I551 HydrophobicContact CD1-CG1 3.93Å; L524-I551 HydrophobicContact CD2-CG1 4.37Å; L524-Y554 HydrophobicContact CD2-CD2 4.11Å; L524-Y554 HydrophobicContact CD2-CE2 4.45Å; L524-L570 HydrophobicContact CD2-CD1 4.48Å; L524-A574 HydrophobicContact CD2-CB 4.1Å; L524-S577 PolarHBondContact O-OG 3.35Å
525L85.8Confident82.1Confident0.5 Ų0.538.6 Ų38.60%0.00317%0.168CC..Hα-helixtrans-62.4-48.1174.9-176.366000111.5L358 F359 L362 P521 M522 I523 L527 S528 L529 S573 L580L358-L525 HydrophobicContact CD1-CD2 4.4Å; F359-L525 HydrophobicContact CD1-CD2 4.43Å; F359-L525 HydrophobicContact CE1-CD2 3.85Å; F359-L525 HydrophobicContact CZ-CD2 4.29Å; L362-L525 HydrophobicContact CD1-CB 4.14Å; L362-L525 HydrophobicContact CD1-CD2 3.43Å; L362-L525 VanDerWaalsContact CD1-CD2 3.43Å; L362-L525 HydrophobicContact CD1-CG 4.37Å; P521-L525 PolarHBondContact O-N 2.88Å; M522-L525 PolarHBondContact O-N 2.99Å; I523-L525 PolarHBondContact O-N 2.78Å; L525-L527 VanDerWaalsContact C-N 3.27Å; L525-L527 PolarHBondContact O-N 3.05Å; L525-S528 WeakPolarHBondContact CA-OG 3.48Å; L525-S528 PolarHBondContact O-N 2.97Å; L525-S528 VanDerWaalsContact O-N 3.15Å; L525-S528 PolarHBondContact O-OG 3.13Å; L525-L529 HydrophobicContact CG-CD1 4.49Å; L525-L529 WeakPolarHBondContact O-CG 3.47Å; L525-L529 PolarHBondContact O-N 2.82Å; L525-S573 PolarHBondContact N-OG 3.29Å; L525-L580 HydrophobicContact CD1-CD1 3.76Å
526N85.4Confident81.9Confident0.5 Ų0.533.3 Ų33.30%0.00316%0.161CC..Hα-helixtrans-65-30.8-179.7-70.3-60.2000112.8Y483 P487 M510 M522 I523 L529 I530Y483-N526 PolarHBondContact O-ND2 3.42Å; Y483-N526 PolarHBondContact O-OD1 3.03Å; Y483-N526 VanDerWaalsContact O-OD1 3.12Å; P487-N526 HydrophobicContact CG-CB 3.74Å; M510-N526 HydrophobicContact CE-CB 3.95Å; M522-N526 VanDerWaalsContact CE-ND2 3.27Å; M522-N526 WeakPolarHBondContact CE-ND2 3.4Å; M522-N526 PolarHBondContact O-N 3.08Å; M522-N526 VanDerWaalsContact O-N 3.15Å; M522-N526 PolarHBondContact O-ND2 3.15Å; M522-N526 PolarHBondContact SD-ND2 3.27Å; M522-N526 VanDerWaalsContact SD-ND2 3.39Å; I523-N526 PolarHBondContact O-N 3.12Å; N526-L529 WeakPolarHBondContact O-CB 3.34Å; N526-L529 PolarHBondContact O-N 3.12Å; N526-I530 WeakPolarHBondContact O-CG1 3.33Å; N526-I530 PolarHBondContact O-N 3.06Å
527L88.2Confident81.7Confident0.5 Ų0.533.7 Ų33.70%0.00317%0.165CC..Hα-helixtrans-66.9-41.2173.4-16861.9000111.8M507 M510 L511 L514 I523 L524 L525 L529 I530 C531 I547M507-L527 HydrophobicContact CE-CD1 4.05Å; M507-L527 HydrophobicContact SD-CD1 3.73Å; M510-L527 HydrophobicContact CB-CD1 4.5Å; M510-L527 HydrophobicContact CE-CB 4.1Å; M510-L527 HydrophobicContact CE-CD1 4.36Å; M510-L527 HydrophobicContact SD-CD1 4.4Å; L511-L527 HydrophobicContact CD2-CD2 4.35Å; L514-L527 HydrophobicContact CD1-CD2 4.27Å; I523-L527 WeakPolarHBondContact O-CB 3.38Å; I523-L527 PolarHBondContact O-N 3.35Å; L524-L527 PolarHBondContact O-N 3.15Å; L525-L527 VanDerWaalsContact C-N 3.27Å; L525-L527 PolarHBondContact O-N 3.05Å; L527-L529 VanDerWaalsContact C-N 3.35Å; L527-I530 PolarHBondContact O-N 3.15Å; L527-C531 PolarHBondContact O-N 3.17Å; L527-C531 VanDerWaalsContact O-N 3.09Å; L527-I547 HydrophobicContact CD1-CD1 4.34Å; L527-I547 HydrophobicContact CD2-CD1 3.56Å; L527-I547 HydrophobicContact CD2-CG1 3.65Å; L527-I547 HydrophobicContact CD2-CG2 4.37Å; L527-I547 HydrophobicContact CG-CD1 3.85Å; L527-I547 HydrophobicContact CG-CG1 4.46Å
528S85.6Confident81.9Confident0 Ų026.3 Ų26.30%013%0.13CC..Hα-helixtrans-68-31.6172.762.90000113.2L524 L525 C531 Y532 S577 L580L524-S528 PolarHBondContact O-N 3.13Å; L524-S528 PolarHBondContact O-OG 3.44Å; L525-S528 WeakPolarHBondContact CA-OG 3.48Å; L525-S528 PolarHBondContact O-N 2.97Å; L525-S528 VanDerWaalsContact O-N 3.15Å; L525-S528 PolarHBondContact O-OG 3.13Å; S528-C531 PolarHBondContact O-N 3.32Å; S528-Y532 WeakPolarHBondContact O-CB 3.32Å; S528-Y532 PolarHBondContact O-N 3.03Å; S528-S577 WeakPolarHBondContact OG-CB 3.07Å; S528-S577 PolarHBondContact OG-OG 3.19Å; S528-L580 WeakPolarHBondContact OG-CD1 3.45Å
529L87Confident81.6Confident1.5 Ų1.521.4 Ų21.41%0.00812%0.117CC..Hα-helixtrans-65.3-42.9171.1-68.9175.3000111.8F343 L346 L350 F359 P487 L525 N526 L527 C531 Y532 F533 L580F343-L529 HydrophobicContact CZ-CD1 4Å; L346-L529 HydrophobicContact CD2-CD2 3.3Å; L350-L529 HydrophobicContact CD1-CD2 3.88Å; F359-L529 HydrophobicContact CZ-CD1 4.17Å; P487-L529 HydrophobicContact CB-CB 3.98Å; P487-L529 HydrophobicContact CB-CD1 4.47Å; P487-L529 HydrophobicContact CG-CB 4.43Å; L525-L529 HydrophobicContact CG-CD1 4.49Å; L525-L529 WeakPolarHBondContact O-CG 3.47Å; L525-L529 PolarHBondContact O-N 2.82Å; N526-L529 WeakPolarHBondContact O-CB 3.34Å; N526-L529 PolarHBondContact O-N 3.12Å; L527-L529 VanDerWaalsContact C-N 3.35Å; L529-C531 PolarHBondContact O-N 3.15Å; L529-Y532 WeakPolarHBondContact O-CB 3.39Å; L529-Y532 PolarHBondContact O-N 3.14Å; L529-Y532 VanDerWaalsContact O-N 3.14Å; L529-F533 WeakPolarHBondContact O-CD2 3.32Å; L529-F533 PolarHBondContact O-N 3.14Å; L529-F533 VanDerWaalsContact O-N 3.14Å; L529-L580 HydrophobicContact CD2-CD1 4.14Å
530I86.8Confident81.1Confident0 Ų026.6 Ų26.60%015%0.151CC..Hα-helixtrans-61.1-47175.8-68.9162.3000110.5I486 P487 V490 F497 M507 M510 N526 L527 Y532 F533 M534I486-I530 HydrophobicContact CG2-CD1 3.93Å; I486-I530 HydrophobicContact CG2-CG1 4.49Å; P487-I530 HydrophobicContact CB-CG1 4.19Å; P487-I530 HydrophobicContact CG-CD1 4.36Å; P487-I530 HydrophobicContact CG-CG1 4.08Å; V490-I530 HydrophobicContact CG1-CG2 4.37Å; V490-I530 HydrophobicContact CG2-CG1 4.36Å; V490-I530 HydrophobicContact CG2-CG2 4.29Å; F497-I530 HydrophobicContact CE1-CG2 4.11Å; M507-I530 HydrophobicContact CE-CB 4.41Å; M507-I530 HydrophobicContact CE-CG2 3.43Å; M507-I530 VanDerWaalsContact CE-CG2 3.43Å; M510-I530 HydrophobicContact CE-CD1 4.01Å; M510-I530 HydrophobicContact SD-CD1 3.4Å; M510-I530 WeakPolarHBondContact SD-CD1 3.41Å; N526-I530 WeakPolarHBondContact O-CG1 3.33Å; N526-I530 PolarHBondContact O-N 3.06Å; L527-I530 PolarHBondContact O-N 3.15Å; I530-Y532 VanDerWaalsContact C-N 3.26Å; I530-Y532 PolarHBondContact O-N 2.9Å; I530-F533 PolarHBondContact O-N 3.33Å; I530-M534 HydrophobicContact CG2-CG 4.3Å; I530-M534 HydrophobicContact CG2-SD 3.73Å; I530-M534 WeakPolarHBondContact O-CG 3.39Å; I530-M534 PolarHBondContact O-N 3.2Å
531C85.7Confident80.3Confident0 Ų025.7 Ų25.70%015%0.15CC..Hα-helixtrans-58.7-37.5174.2178.30000112.4L527 S528 L529 F533 M534 G535 F538 F581L527-C531 PolarHBondContact O-N 3.17Å; L527-C531 VanDerWaalsContact O-N 3.09Å; S528-C531 PolarHBondContact O-N 3.32Å; L529-C531 PolarHBondContact O-N 3.15Å; C531-F533 PolarHBondContact O-N 3.01Å; C531-M534 PolarHBondContact O-N 2.87Å; C531-G535 PolarHBondContact O-N 3.37Å; C531-F538 HydrophobicContact CB-CD1 3.96Å; C531-F538 HydrophobicContact CB-CD2 4.28Å; C531-F538 HydrophobicContact CB-CE1 4.14Å; C531-F538 HydrophobicContact CB-CE2 4.47Å; C531-F538 HydrophobicContact CB-CG 4.09Å; C531-F538 HydrophobicContact CB-CZ 4.38Å; C531-F538 WeakPolarHBondContact SG-CD1 3.34Å; C531-F581 HydrophobicContact CB-CD1 3.97Å; C531-F581 HydrophobicContact CB-CE1 3.56Å; C531-F581 VanDerWaalsContact SG-CD1 3.55Å
532Y86.5Confident80Confident71.5 Ų71.532 Ų3228%0.2818%0.183SC..Hα-helixtrans-60.4-43.1176.1179.7-88.5000112.9L346 S528 L529 I530 L580 K583L346-Y532 HydrophobicContact CD1-CD1 3.46Å; L346-Y532 VanDerWaalsContact CD1-CD1 3.46Å; L346-Y532 HydrophobicContact CD1-CD2 4.01Å; L346-Y532 HydrophobicContact CD1-CE1 3.19Å; L346-Y532 HydrophobicContact CD1-CE2 3.79Å; L346-Y532 HydrophobicContact CD1-CG 3.87Å; S528-Y532 WeakPolarHBondContact O-CB 3.32Å; S528-Y532 PolarHBondContact O-N 3.03Å; L529-Y532 WeakPolarHBondContact O-CB 3.39Å; L529-Y532 PolarHBondContact O-N 3.14Å; L529-Y532 VanDerWaalsContact O-N 3.14Å; I530-Y532 VanDerWaalsContact C-N 3.26Å; I530-Y532 PolarHBondContact O-N 2.9Å; Y532-L580 HydrophobicContact CD2-CD2 4.44Å; Y532-K583 HydrophobicContact CD2-CD 4.45Å; Y532-K583 HydrophobicContact CE2-CB 4.4Å; Y532-K583 HydrophobicContact CE2-CD 3.85Å; Y532-K583 HydrophobicContact CE2-CG 3.98Å
533F84.4Confident79.9Confident38 Ų3834 Ų3417%0.16719%0.191CC..Hα-helixtrans-79.8-24.2179.2-67.9-68.7000114.3F343 V490 A491 L529 I530 C531F343-F533 HydrophobicContact CB-CZ 4.18Å; F343-F533 HydrophobicContact CD2-CD2 4.31Å; F343-F533 AromaticContact CD2-CE2 3.33Å; F343-F533 HydrophobicContact CD2-CE2 3.33Å; F343-F533 AromaticContact CD2-CZ 3.49Å; F343-F533 HydrophobicContact CD2-CZ 3.49Å; F343-F533 VanDerWaalsContact CD2-CZ 3.49Å; F343-F533 HydrophobicContact CE2-CD2 4.42Å; F343-F533 AromaticContact CE2-CE2 3.6Å; F343-F533 HydrophobicContact CE2-CE2 3.6Å; F343-F533 HydrophobicContact CE2-CZ 4.22Å; F343-F533 HydrophobicContact CG-CE2 4.38Å; F343-F533 HydrophobicContact CG-CZ 4.17Å; V490-F533 HydrophobicContact CG1-CB 4.15Å; A491-F533 HydrophobicContact CB-CB 4.43Å; A491-F533 HydrophobicContact CB-CD1 3.6Å; A491-F533 HydrophobicContact CB-CD2 3.79Å; A491-F533 HydrophobicContact CB-CE1 3.7Å; A491-F533 HydrophobicContact CB-CE2 3.91Å; A491-F533 HydrophobicContact CB-CG 3.67Å; A491-F533 HydrophobicContact CB-CZ 3.87Å; L529-F533 WeakPolarHBondContact O-CD2 3.32Å; L529-F533 PolarHBondContact O-N 3.14Å; L529-F533 VanDerWaalsContact O-N 3.14Å; I530-F533 PolarHBondContact O-N 3.33Å; C531-F533 PolarHBondContact O-N 3.01Å
534M82.4Confident79.7Confident12.5 Ų12.535 Ų356%0.06220%0.196CC..Hα-helixtrans-78.5-23.5172.5-67.3-178.771.200113.2V490 F497 M507 I530 C531 F538V490-M534 HydrophobicContact CG1-CG 4.22Å; F497-M534 HydrophobicContact CD1-CE 4.3Å; F497-M534 HydrophobicContact CD1-CG 4.48Å; F497-M534 HydrophobicContact CD1-SD 3.9Å; F497-M534 HydrophobicContact CE1-CE 4.43Å; F497-M534 HydrophobicContact CE1-SD 3.87Å; M507-M534 HydrophobicContact CE-SD 4.09Å; I530-M534 HydrophobicContact CG2-CG 4.3Å; I530-M534 HydrophobicContact CG2-SD 3.73Å; I530-M534 WeakPolarHBondContact O-CG 3.39Å; I530-M534 PolarHBondContact O-N 3.2Å; C531-M534 PolarHBondContact O-N 2.87Å; M534-F538 HydrophobicContact CB-CB 4.21Å; M534-F538 HydrophobicContact CE-CD2 4.21Å; M534-F538 HydrophobicContact SD-CD2 3.82Å; M534-F538 HydrophobicContact SD-CE2 4.45Å
535G79.1Confident79.4Confident13.5 Ų13.539.5 Ų39.514%0.13922%0.224CC..G310 helixtrans61.3-138.717800000113.3C531 E537 F538 L585C531-G535 PolarHBondContact O-N 3.37Å; G535-E537 VanDerWaalsContact C-N 3.28Å; G535-E537 PolarHBondContact O-N 3.05Å; G535-F538 PolarHBondContact O-N 3.08Å; G535-L585 WeakPolarHBondContact O-CD2 3.29Å
536P74.2Confident79.2Confident101 Ų10143.8 Ų43.866%0.65624%0.244SC*.G310 helixtrans-68.9-22.5-169.229.2-35.9000114F538 A539P536-F538 PolarHBondContact O-N 2.98Å; P536-A539 VanDerWaalsContact O-CB 3.32Å; P536-A539 WeakPolarHBondContact O-CB 3.38Å; P536-A539 PolarHBondContact O-N 3.04Å
537E70.9Confident79.1Confident94.5 Ų94.543.9 Ų43.944%0.44224%0.244SC..G310 helixtrans-60.5-32.5178.9-61.3175.7167.100111.9Q498 G535 A539 T540Q498-E537 PolarHBondContact NE2-OE1 3.35Å; Q498-E537 PolarHBondContact NE2-OE2 3.02Å; G535-E537 VanDerWaalsContact C-N 3.28Å; G535-E537 PolarHBondContact O-N 3.05Å; E537-A539 PolarHBondContact O-N 3.45Å; E537-T540 WeakPolarHBondContact O-CB 3.41Å; E537-T540 PolarHBondContact O-N 2.7Å; E537-T540 VanDerWaalsContact O-N 3.11Å
538F74.6Confident78.9Confident0 Ų044.4 Ų44.40%025%0.246CC..G310 helixtrans-63.2-29.1176.6-166.3-93.6000112.6M507 C531 M534 G535 P536 T540 S541 L544 I547M507-F538 HydrophobicContact CE-CE2 3.79Å; M507-F538 HydrophobicContact CE-CZ 3.83Å; M507-F538 HydrophobicContact SD-CE2 4.36Å; C531-F538 HydrophobicContact CB-CD1 3.96Å; C531-F538 HydrophobicContact CB-CD2 4.28Å; C531-F538 HydrophobicContact CB-CE1 4.14Å; C531-F538 HydrophobicContact CB-CE2 4.47Å; C531-F538 HydrophobicContact CB-CG 4.09Å; C531-F538 HydrophobicContact CB-CZ 4.38Å; C531-F538 WeakPolarHBondContact SG-CD1 3.34Å; M534-F538 HydrophobicContact CB-CB 4.21Å; M534-F538 HydrophobicContact CE-CD2 4.21Å; M534-F538 HydrophobicContact SD-CD2 3.82Å; M534-F538 HydrophobicContact SD-CE2 4.45Å; G535-F538 PolarHBondContact O-N 3.08Å; P536-F538 PolarHBondContact O-N 2.98Å; F538-T540 VanDerWaalsContact C-N 3.28Å; F538-T540 PolarHBondContact O-N 3.36Å; F538-S541 WeakPolarHBondContact O-CB 3.39Å; F538-S541 PolarHBondContact O-N 3.16Å; F538-S541 PolarHBondContact O-OG 3.18Å; F538-L544 HydrophobicContact CD1-CB 4.36Å; F538-L544 HydrophobicContact CD1-CD1 4.47Å; F538-L544 HydrophobicContact CE1-CB 4.19Å; F538-I547 HydrophobicContact CE1-CD1 4.01Å; F538-I547 HydrophobicContact CZ-CD1 3.65Å
539A64.9Low78.8Confident47.5 Ų47.551.3 Ų51.339%0.39328%0.278SS..G310 helixtrans-69.1-23.5178.500000113.2P536 E537 S541 L544 L585P536-A539 VanDerWaalsContact O-CB 3.32Å; P536-A539 WeakPolarHBondContact O-CB 3.38Å; P536-A539 PolarHBondContact O-N 3.04Å; E537-A539 PolarHBondContact O-N 3.45Å; A539-S541 PolarHBondContact O-N 3.15Å; A539-L544 HydrophobicContact CB-CD1 4.44Å; A539-L585 HydrophobicContact CB-CD2 4.11Å
540T64.6Low78.5Confident127.5 Ų127.552.7 Ų52.778%0.78229%0.289SS*.G310 helixtrans-74.3-14.2172.8-450000111.8E537 F538E537-T540 WeakPolarHBondContact O-CB 3.41Å; E537-T540 PolarHBondContact O-N 2.7Å; E537-T540 VanDerWaalsContact O-N 3.11Å; F538-T540 VanDerWaalsContact C-N 3.28Å; F538-T540 PolarHBondContact O-N 3.36Å
541S67.3Low78.3Confident22.5 Ų22.552.7 Ų52.716%0.15729%0.289CS..SBendtrans-90.8137-177.582.40000112.6F538 A539 Y543 L544F538-S541 WeakPolarHBondContact O-CB 3.39Å; F538-S541 PolarHBondContact O-N 3.16Å; F538-S541 PolarHBondContact O-OG 3.18Å; A539-S541 PolarHBondContact O-N 3.15Å; S541-Y543 PolarHBondContact O-N 2.99Å; S541-Y543 WeakPolarHBondContact OG-CD2 3.45Å; S541-L544 PolarHBondContact O-N 3.34Å
542N74.6Confident78.2Confident136 Ų13658.9 Ų58.973%0.72731%0.312SS*.THydrogen-bonded Turntrans-62.5-4.7178.3-69.3-35.2000114.5
543Y78.2Confident78Confident46 Ų4658.7 Ų58.718%0.1832%0.321CS..Hα-helixtrans-72.8-30.7179.9-58.9-62.4000112.9M507 L511 S541 T545 Q546 I547M507-Y543 HydrophobicContact CB-CE1 4.29Å; M507-Y543 HydrophobicContact CB-CE2 4.45Å; M507-Y543 HydrophobicContact CE-CD1 4.45Å; M507-Y543 HydrophobicContact CE-CD2 4.01Å; M507-Y543 HydrophobicContact CE-CG 3.89Å; L511-Y543 HydrophobicContact CD1-CD1 3.78Å; L511-Y543 HydrophobicContact CD1-CE1 4.1Å; S541-Y543 PolarHBondContact O-N 2.99Å; S541-Y543 WeakPolarHBondContact OG-CD2 3.45Å; Y543-T545 PolarHBondContact O-N 3.1Å; Y543-Q546 PolarHBondContact O-N 3.36Å; Y543-I547 WeakPolarHBondContact O-CD1 3.4Å; Y543-I547 VanDerWaalsContact O-CG1 3.28Å; Y543-I547 WeakPolarHBondContact O-CG1 3.34Å; Y543-I547 PolarHBondContact O-N 3.28Å
544L80.8Confident77.7Confident21.5 Ų21.558.2 Ų58.211%0.11332%0.318CS..Hα-helixtrans-56.6-48.4-178-177149.6000111.7F538 A539 S541 Q546 I547 F548 L585 I589F538-L544 HydrophobicContact CD1-CB 4.36Å; F538-L544 HydrophobicContact CD1-CD1 4.47Å; F538-L544 HydrophobicContact CE1-CB 4.19Å; A539-L544 HydrophobicContact CB-CD1 4.44Å; S541-L544 PolarHBondContact O-N 3.34Å; L544-Q546 VanDerWaalsContact C-N 3.33Å; L544-Q546 PolarHBondContact O-N 2.83Å; L544-I547 PolarHBondContact O-N 3.24Å; L544-F548 HydrophobicContact CD1-CE2 4.33Å; L544-F548 HydrophobicContact CD2-CD2 3.52Å; L544-F548 HydrophobicContact CD2-CE2 3.78Å; L544-F548 HydrophobicContact CG-CD2 3.82Å; L544-F548 HydrophobicContact CG-CE2 3.84Å; L544-F548 WeakPolarHBondContact O-CD2 3.47Å; L544-F548 PolarHBondContact O-N 3.04Å; L544-L585 HydrophobicContact CD1-CD1 3.51Å; L544-I589 HydrophobicContact CD1-CG2 4.2Å
545T80.1Confident77.4Confident95.5 Ų95.557.7 Ų57.759%0.58632%0.316SS*.Hα-helixtrans-60.8-41178.9-47.60000112.1Y543 I547 Q549Y543-T545 PolarHBondContact O-N 3.1Å; T545-I547 VanDerWaalsContact C-N 3.34Å; T545-I547 PolarHBondContact O-N 2.99Å; T545-Q549 VanDerWaalsContact O-CB 3.3Å; T545-Q549 WeakPolarHBondContact O-CB 3.49Å; T545-Q549 PolarHBondContact O-N 3.16Å
546Q81.4Confident76.9Confident90 Ų9058.1 Ų58.142%0.42132%0.316SS..Hα-helixtrans-65.7-37.3178-59.6178.820.100111.8Y543 L544 S550Y543-Q546 PolarHBondContact O-N 3.36Å; L544-Q546 VanDerWaalsContact C-N 3.33Å; L544-Q546 PolarHBondContact O-N 2.83Å; Q546-S550 WeakPolarHBondContact O-CB 3.27Å; Q546-S550 PolarHBondContact O-N 3.11Å; Q546-S550 PolarHBondContact O-OG 3.15Å
547I84.5Confident76.2Confident2 Ų257.4 Ų57.41%0.0131%0.31CS..Hα-helixtrans-70.6-47.1178.6-65.6163.7000110.7L511 L527 F538 Y543 L544 T545 Q549 S550 I551 F581L511-I547 HydrophobicContact CD2-CG1 4.46Å; L527-I547 HydrophobicContact CD1-CD1 4.34Å; L527-I547 HydrophobicContact CD2-CD1 3.56Å; L527-I547 HydrophobicContact CD2-CG1 3.65Å; L527-I547 HydrophobicContact CD2-CG2 4.37Å; L527-I547 HydrophobicContact CG-CD1 3.85Å; L527-I547 HydrophobicContact CG-CG1 4.46Å; F538-I547 HydrophobicContact CE1-CD1 4.01Å; F538-I547 HydrophobicContact CZ-CD1 3.65Å; Y543-I547 WeakPolarHBondContact O-CD1 3.4Å; Y543-I547 VanDerWaalsContact O-CG1 3.28Å; Y543-I547 WeakPolarHBondContact O-CG1 3.34Å; Y543-I547 PolarHBondContact O-N 3.28Å; L544-I547 PolarHBondContact O-N 3.24Å; T545-I547 VanDerWaalsContact C-N 3.34Å; T545-I547 PolarHBondContact O-N 2.99Å; I547-Q549 VanDerWaalsContact C-N 3.34Å; I547-Q549 PolarHBondContact O-N 3.38Å; I547-S550 CarbonylContact O-C 3.53Å; I547-S550 WeakPolarHBondContact O-CA 3.19Å; I547-S550 WeakPolarHBondContact O-CB 3.38Å; I547-S550 PolarHBondContact O-N 3.22Å; I547-S550 VanDerWaalsContact O-N 3.12Å; I547-I551 HydrophobicContact CG2-CD1 3.84Å; I547-I551 HydrophobicContact CG2-CG1 4.46Å; I547-I551 WeakPolarHBondContact O-CG1 3.39Å; I547-I551 PolarHBondContact O-N 3.06Å; I547-F581 HydrophobicContact CG2-CE2 4.02Å; I547-F581 HydrophobicContact CG2-CZ 3.76Å
548F83.5Confident75.3Confident12 Ų1260.7 Ų60.75%0.05333%0.325CS..Hα-helixtrans-64.3-37.5176.7-84.6-72.4000112.5L544 S550 I551 R552 F581 I589 I596L544-F548 HydrophobicContact CD1-CE2 4.33Å; L544-F548 HydrophobicContact CD2-CD2 3.52Å; L544-F548 HydrophobicContact CD2-CE2 3.78Å; L544-F548 HydrophobicContact CG-CD2 3.82Å; L544-F548 HydrophobicContact CG-CE2 3.84Å; L544-F548 WeakPolarHBondContact O-CD2 3.47Å; L544-F548 PolarHBondContact O-N 3.04Å; F548-S550 VanDerWaalsContact C-N 3.32Å; F548-S550 PolarHBondContact O-N 3.39Å; F548-I551 HydrophobicContact CD1-CD1 4.37Å; F548-I551 PolarHBondContact O-N 2.96Å; F548-R552 WeakPolarHBondContact O-CB 3.24Å; F548-R552 PolarHBondContact O-N 3.29Å; F548-F581 HydrophobicContact CE1-CD2 4.41Å; F548-F581 HydrophobicContact CE2-CB 4.48Å; F548-F581 HydrophobicContact CE2-CD2 4.25Å; F548-F581 HydrophobicContact CE2-CG 4.31Å; F548-F581 HydrophobicContact CZ-CB 3.99Å; F548-F581 AromaticContact CZ-CD2 3.86Å; F548-F581 HydrophobicContact CZ-CD2 3.98Å; F548-F581 HydrophobicContact CZ-CG 4.09Å; F548-I589 HydrophobicContact CE2-CG2 4.26Å; F548-I589 HydrophobicContact CZ-CB 4.47Å; F548-I589 HydrophobicContact CZ-CD1 4.05Å; F548-I589 HydrophobicContact CZ-CG2 4.43Å; F548-I596 HydrophobicContact CB-CD1 4.35Å; F548-I596 HydrophobicContact CD1-CD1 3.55Å; F548-I596 VanDerWaalsContact CD1-CD1 3.5Å; F548-I596 HydrophobicContact CE1-CD1 4.29Å; F548-I596 HydrophobicContact CG-CD1 4.36Å
549Q82.5Confident73.9Confident144 Ų14469.9 Ų69.967%0.67337%0.365SS*.Hα-helixtrans-62.3-39.7171.2-172.3176.4900111.9T545 I547 R552 S553T545-Q549 VanDerWaalsContact O-CB 3.3Å; T545-Q549 WeakPolarHBondContact O-CB 3.49Å; T545-Q549 PolarHBondContact O-N 3.16Å; I547-Q549 VanDerWaalsContact C-N 3.34Å; I547-Q549 PolarHBondContact O-N 3.38Å; Q549-R552 PolarHBondContact O-N 3.37Å; Q549-S553 PolarHBondContact O-N 3.14Å
550S80.7Confident73.1Confident31.5 Ų31.570.9 Ų70.922%0.2236%0.364CS..Hα-helixtrans-65.2-45.4174.9-58.50000111.8Q546 I547 F548 R552 S553 Y554Q546-S550 WeakPolarHBondContact O-CB 3.27Å; Q546-S550 PolarHBondContact O-N 3.11Å; Q546-S550 PolarHBondContact O-OG 3.15Å; I547-S550 CarbonylContact O-C 3.53Å; I547-S550 WeakPolarHBondContact O-CA 3.19Å; I547-S550 WeakPolarHBondContact O-CB 3.38Å; I547-S550 PolarHBondContact O-N 3.22Å; I547-S550 VanDerWaalsContact O-N 3.12Å; F548-S550 VanDerWaalsContact C-N 3.32Å; F548-S550 PolarHBondContact O-N 3.39Å; S550-R552 VanDerWaalsContact C-N 3.34Å; S550-R552 PolarHBondContact O-N 2.96Å; S550-S553 WeakPolarHBondContact O-CB 3.27Å; S550-S553 PolarHBondContact O-N 2.78Å; S550-S553 PolarHBondContact O-OG 2.88Å; S550-Y554 VanDerWaalsContact O-CD2 3.28Å; S550-Y554 WeakPolarHBondContact O-CD2 3.38Å; S550-Y554 PolarHBondContact O-N 3.07Å
551I83.3Confident72.4Confident0 Ų071.5 Ų71.50%037%0.367CS..Hα-helixtrans-58.1-45.2176.5-72.8165.9000111.2L524 I547 F548 S553 Y554 L555 A574 V578 F581 I596L524-I551 HydrophobicContact CD1-CD1 4.31Å; L524-I551 HydrophobicContact CD1-CG1 3.93Å; L524-I551 HydrophobicContact CD2-CG1 4.37Å; I547-I551 HydrophobicContact CG2-CD1 3.84Å; I547-I551 HydrophobicContact CG2-CG1 4.46Å; I547-I551 WeakPolarHBondContact O-CG1 3.39Å; I547-I551 PolarHBondContact O-N 3.06Å; F548-I551 HydrophobicContact CD1-CD1 4.37Å; F548-I551 PolarHBondContact O-N 2.96Å; I551-S553 PolarHBondContact O-N 3.35Å; I551-Y554 PolarHBondContact O-N 2.83Å; I551-L555 HydrophobicContact CG2-CD1 4.01Å; I551-L555 PolarHBondContact O-N 3.4Å; I551-L555 VanDerWaalsContact O-N 3.15Å; I551-A574 HydrophobicContact CG2-CB 4.37Å; I551-V578 HydrophobicContact CG2-CG2 4.09Å; I551-F581 HydrophobicContact CD1-CD2 4.36Å; I551-F581 HydrophobicContact CD1-CE2 3.76Å; I551-I596 HydrophobicContact CG2-CD1 4.48Å
552R83.1Confident71.2Confident130 Ų13075 Ų7549%0.49139%0.392SS..Hα-helixtrans-60.9-27.9176.5-167.5173.9-175.3164.95.1113F548 Q549 S550F548-R552 WeakPolarHBondContact O-CB 3.24Å; F548-R552 PolarHBondContact O-N 3.29Å; Q549-R552 PolarHBondContact O-N 3.37Å; S550-R552 VanDerWaalsContact C-N 3.34Å; S550-R552 PolarHBondContact O-N 2.96Å
553S82Confident69.3Low67.5 Ų67.574.6 Ų74.647%0.47239%0.389SS..Hα-helixtrans-79.4-18.317481.70000114.3Q549 S550 I551 R566Q549-S553 PolarHBondContact O-N 3.14Å; S550-S553 WeakPolarHBondContact O-CB 3.27Å; S550-S553 PolarHBondContact O-N 2.78Å; S550-S553 PolarHBondContact O-OG 2.88Å; I551-S553 PolarHBondContact O-N 3.35Å; S553-R566 PolarHBondContact O-NH2 3.18Å
554Y79.2Confident67.7Low28 Ų2881.3 Ų81.311%0.1142%0.42CS..Hα-helixtrans-91.8-30.4-179.3-60.1-31.1000113.1K520 L524 S550 I551 R566 L570K520-Y554 HydrophobicContact CD-CE1 4.35Å; L524-Y554 HydrophobicContact CD2-CD2 4.11Å; L524-Y554 HydrophobicContact CD2-CE2 4.45Å; S550-Y554 VanDerWaalsContact O-CD2 3.28Å; S550-Y554 WeakPolarHBondContact O-CD2 3.38Å; S550-Y554 PolarHBondContact O-N 3.07Å; I551-Y554 PolarHBondContact O-N 2.83Å; Y554-R566 PolarHBondContact O-NE 3.46Å; Y554-L570 HydrophobicContact CD1-CD2 4.13Å; Y554-L570 HydrophobicContact CD2-CD1 4.25Å; Y554-L570 HydrophobicContact CG-CD1 4.25Å; Y554-L570 HydrophobicContact CG-CD2 4.15Å; Y554-L570 HydrophobicContact CG-CG 4.35Å
555L76.5Confident66Low0.5 Ų0.590 Ų900%0.00346%0.456CS..SBendtrans-72.7151.8174.7-70.3167.1000112.2I551 A574 I575 I596 A599 M600I551-L555 HydrophobicContact CG2-CD1 4.01Å; I551-L555 PolarHBondContact O-N 3.4Å; I551-L555 VanDerWaalsContact O-N 3.15Å; L555-A574 HydrophobicContact CD2-CB 4.15Å; L555-A574 HydrophobicContact CG-CB 4.3Å; L555-I575 HydrophobicContact CD2-CG1 4.26Å; L555-I596 HydrophobicContact CD1-CG2 3.61Å; L555-A599 HydrophobicContact CB-CB 3.95Å; L555-A599 HydrophobicContact CD1-CB 4.12Å; L555-M600 HydrophobicContact CD1-CG 3.95Å
556P67.8Low64.8Low22.5 Ų22.590.6 Ų90.615%0.14645%0.448CS..  trans-67.9137.7175.627.7-33.4000111.5A602P556-A602 HydrophobicContact CG-CB 4.16Å
557T60.5Low64.1Low86 Ų8688.9 Ų88.953%0.52845%0.446SS..PPolyproline II helixtrans-103147.6169.3-43.80000108.6K559 D560T557-K559 PolarHBondContact O-N 3.08Å; T557-D560 PolarHBondContact O-N 3.26Å; T557-D560 VanDerWaalsContact O-N 3.09Å
558Q51.6Low63.4Low164 Ų16491.3 Ų91.377%0.76646%0.461SS*.THydrogen-bonded Turntrans-53.8-6.5-172.9-70.4-178.6-12.400116.9
559K45.4Very low63Low193 Ų19391 Ų9184%0.83946%0.462SS*.THydrogen-bonded Turntrans-99.4-10178.8-66.2-175.9176.4-178.90114.8T557 V561T557-K559 PolarHBondContact O-N 3.08Å; K559-V561 PolarHBondContact O-N 3.09Å
560D48Very low62.9Low69 Ų6984.9 Ų84.937%0.36943%0.433SS..  trans-97.719-167.2-74-9.3000115.3T557 S562 N563 R566T557-D560 PolarHBondContact O-N 3.26Å; T557-D560 VanDerWaalsContact O-N 3.09Å; D560-S562 PolarHBondContact O-N 3.13Å; D560-N563 PolarHBondContact O-N 3.14Å; D560-R566 IonicContact OD2-NH1 2.87Å; D560-R566 PolarHBondContact OD2-NH1 3.04Å
561V48.9Very low62.9Low140 Ų14085 Ų8585%0.84843%0.431SS*.THydrogen-bonded Turntrans-59.4-15.7-173.4-175.90000113.9K559K559-V561 PolarHBondContact O-N 3.09Å
562S41.7Very low62.8Low95.5 Ų95.585.5 Ų85.567%0.66843%0.434SS*.THydrogen-bonded Turntrans-88.3-16.8-174.753.30000116.3D560 K564D560-S562 PolarHBondContact O-N 3.13Å; S562-K564 PolarHBondContact O-N 3.16Å
563N36.6Very low62.8Low127.5 Ų127.579.4 Ų79.468%0.68241%0.411SS*.  trans-98.586.3-169.6-83.8-36.2000113.9D560 K565D560-N563 PolarHBondContact O-N 3.14Å; N563-K565 PolarHBondContact O-N 2.96Å
564K44.2Very low63Low187.5 Ų187.576.2 Ų76.282%0.81539%0.388SS*.THydrogen-bonded Turntrans-63.437.1-178-64.6-175.9171.6-177.50117S562 F760S562-K564 PolarHBondContact O-N 3.16Å; K564-F760 HydrophobicContact CB-CE2 3.91Å; K564-F760 HydrophobicContact CB-CZ 3.93Å; K564-F760 HydrophobicContact CD-CE1 4.12Å; K564-F760 HydrophobicContact CD-CZ 4.15Å; K564-F760 HydrophobicContact CG-CE1 4.35Å; K564-F760 HydrophobicContact CG-CE2 4.35Å; K564-F760 HydrophobicContact CG-CZ 3.86Å
565K45.3Very low63.4Low204 Ų20474.9 Ų74.989%0.88738%0.383SS*.THydrogen-bonded Turntrans-137.911.1-171.8-123178.4-175178.10117.3N563N563-K565 PolarHBondContact O-N 2.96Å
566R55.1Low63.8Low108.5 Ų108.574.9 Ų74.941%0.40938%0.383SS..  trans-81.8148172.6-108.4177.3179.2124.3-4.3111.2S553 Y554 D560S553-R566 PolarHBondContact O-NH2 3.18Å; Y554-R566 PolarHBondContact O-NE 3.46Å; D560-R566 IonicContact OD2-NH1 2.87Å; D560-R566 PolarHBondContact OD2-NH1 3.04Å
567S65.1Low64.7Low54 Ų5473.8 Ų73.838%0.37838%0.376SS..  trans-93.9125.5-177.154.90000111.8A569 L570S567-A569 PolarHBondContact O-N 3.33Å; S567-A569 VanDerWaalsContact O-N 3.14Å; S567-L570 WeakPolarHBondContact O-CB 3.28Å; S567-L570 PolarHBondContact O-N 3.23Å; S567-L570 WeakPolarHBondContact OG-CB 3.37Å
568P71.3Confident66.1Low51.5 Ų51.569.7 Ų69.733%0.33435%0.351SS..Hα-helixtrans-64.3-22.7-176.925-34.8000113.5L570 E571 T572 I756P568-L570 VanDerWaalsContact C-N 3.29Å; P568-L570 PolarHBondContact O-N 3.46Å; P568-E571 PolarHBondContact O-N 3.19Å; P568-T572 WeakPolarHBondContact O-CB 3.37Å; P568-T572 PolarHBondContact O-N 3.24Å; P568-T572 PolarHBondContact O-OG1 2.78Å; P568-I756 HydrophobicContact CB-CG2 3.96Å
569A74.4Confident67.8Low7 Ų762 Ų626%0.05832%0.315CS..Hα-helixtrans-62.3-32.817200000113.2F361 L362 P521 S567 S573F361-A569 HydrophobicContact CE1-CB 4.12Å; F361-A569 HydrophobicContact CZ-CB 4.3Å; L362-A569 HydrophobicContact CD2-CB 4.38Å; L362-A569 VanDerWaalsContact CD2-O 3.28Å; L362-A569 WeakPolarHBondContact CD2-O 3.34Å; P521-A569 HydrophobicContact CB-CB 4.3Å; P521-A569 WeakPolarHBondContact CB-O 3.34Å; P521-A569 HydrophobicContact CG-CB 4.4Å; S567-A569 PolarHBondContact O-N 3.33Å; S567-A569 VanDerWaalsContact O-N 3.14Å; A569-S573 VanDerWaalsContact O-CB 3.3Å; A569-S573 WeakPolarHBondContact O-CB 3.33Å; A569-S573 PolarHBondContact O-N 3.02Å; A569-S573 VanDerWaalsContact O-N 3.12Å
570L80.9Confident69.8Low15 Ų1552.9 Ų52.98%0.07928%0.276CS..Hα-helixtrans-73.4-43.7178.1-176.461.8000111.6K520 P521 L524 Y554 S567 P568 S573 A574K520-L570 HydrophobicContact CB-CD1 3.84Å; P521-L570 HydrophobicContact CB-CD1 4.35Å; L524-L570 HydrophobicContact CD2-CD1 4.48Å; Y554-L570 HydrophobicContact CD1-CD2 4.13Å; Y554-L570 HydrophobicContact CD2-CD1 4.25Å; Y554-L570 HydrophobicContact CG-CD1 4.25Å; Y554-L570 HydrophobicContact CG-CD2 4.15Å; Y554-L570 HydrophobicContact CG-CG 4.35Å; S567-L570 WeakPolarHBondContact O-CB 3.28Å; S567-L570 PolarHBondContact O-N 3.23Å; S567-L570 WeakPolarHBondContact OG-CB 3.37Å; P568-L570 VanDerWaalsContact C-N 3.29Å; P568-L570 PolarHBondContact O-N 3.46Å; L570-S573 PolarHBondContact O-N 2.89Å; L570-A574 WeakPolarHBondContact O-CB 3.42Å; L570-A574 PolarHBondContact O-N 2.94Å
571E79.8Confident71.7Confident35 Ų3549.7 Ų49.716%0.16426%0.259CS..Hα-helixtrans-64.4-45.6177.5-65.7175.3-160.700111P568 S573 A574 I575 S603P568-E571 PolarHBondContact O-N 3.19Å; E571-S573 PolarHBondContact O-N 3.39Å; E571-A574 PolarHBondContact O-N 3.31Å; E571-A574 VanDerWaalsContact O-N 3.17Å; E571-I575 WeakPolarHBondContact O-CB 3.31Å; E571-I575 VanDerWaalsContact O-CG1 3.31Å; E571-I575 WeakPolarHBondContact O-CG1 3.4Å; E571-I575 PolarHBondContact O-N 3.39Å; E571-S603 PolarHBondContact OE2-OG 3.4Å
572T81.7Confident73.6Confident10 Ų1043 Ų436%0.06122%0.218CC..Hα-helixtrans-58.5-45.5174.2-60.10000111.7F361 P568 A574 I575 L576 P608F361-T572 HydrophobicContact CD1-CG2 4.26Å; F361-T572 HydrophobicContact CE1-CG2 3.92Å; P568-T572 WeakPolarHBondContact O-CB 3.37Å; P568-T572 PolarHBondContact O-N 3.24Å; P568-T572 PolarHBondContact O-OG1 2.78Å; T572-A574 PolarHBondContact O-N 3.32Å; T572-I575 PolarHBondContact O-N 3.22Å; T572-L576 HydrophobicContact CG2-CD1 3.86Å; T572-L576 HydrophobicContact CG2-CG 4.47Å; T572-L576 WeakPolarHBondContact O-CB 3.38Å; T572-L576 VanDerWaalsContact O-CG 3.3Å; T572-L576 WeakPolarHBondContact O-CG 3.38Å; T572-L576 PolarHBondContact O-N 2.99Å; T572-P608 HydrophobicContact CG2-CB 4.09Å; T572-P608 HydrophobicContact CG2-CG 3.93Å
573S82.8Confident75.8Confident1 Ų141.4 Ų41.41%0.00720%0.199CC..Hα-helixtrans-63.1-40.6176.2-177.50000112.4P521 L525 A569 L570 E571 L576 S577P521-S573 WeakPolarHBondContact O-CB 3.3Å; P521-S573 PolarHBondContact O-OG 3.19Å; L525-S573 PolarHBondContact N-OG 3.29Å; A569-S573 VanDerWaalsContact O-CB 3.3Å; A569-S573 WeakPolarHBondContact O-CB 3.33Å; A569-S573 PolarHBondContact O-N 3.02Å; A569-S573 VanDerWaalsContact O-N 3.12Å; L570-S573 PolarHBondContact O-N 2.89Å; E571-S573 PolarHBondContact O-N 3.39Å; S573-L576 PolarHBondContact O-N 3.33Å; S573-S577 VanDerWaalsContact O-CB 3.3Å; S573-S577 WeakPolarHBondContact O-CB 3.41Å; S573-S577 PolarHBondContact O-N 3.34Å; S573-S577 PolarHBondContact O-OG 3.22Å; S573-S577 VanDerWaalsContact O-OG 3.08Å
574A86.3Confident78.1Confident0 Ų036.5 Ų36.50%018%0.175CC..Hα-helixtrans-62.9-47.5178.100000111.6L524 I551 L555 L570 E571 T572 L576 S577 V578L524-A574 HydrophobicContact CD2-CB 4.1Å; I551-A574 HydrophobicContact CG2-CB 4.37Å; L555-A574 HydrophobicContact CD2-CB 4.15Å; L555-A574 HydrophobicContact CG-CB 4.3Å; L570-A574 WeakPolarHBondContact O-CB 3.42Å; L570-A574 PolarHBondContact O-N 2.94Å; E571-A574 PolarHBondContact O-N 3.31Å; E571-A574 VanDerWaalsContact O-N 3.17Å; T572-A574 PolarHBondContact O-N 3.32Å; A574-L576 PolarHBondContact O-N 3.23Å; A574-S577 PolarHBondContact O-N 3.31Å; A574-V578 WeakPolarHBondContact O-CG2 3.41Å; A574-V578 PolarHBondContact O-N 3.33Å; A574-V578 VanDerWaalsContact O-N 3.08Å
575I87.1Confident80Confident0.5 Ų0.528.4 Ų28.40%0.00314%0.14CC..Hα-helixtrans-59.6-46.6177.1-71.6165.6000111.5L555 E571 T572 S577 V578 S579 M600 S603 P608 L609 S612L555-I575 HydrophobicContact CD2-CG1 4.26Å; E571-I575 WeakPolarHBondContact O-CB 3.31Å; E571-I575 VanDerWaalsContact O-CG1 3.31Å; E571-I575 WeakPolarHBondContact O-CG1 3.4Å; E571-I575 PolarHBondContact O-N 3.39Å; T572-I575 PolarHBondContact O-N 3.22Å; I575-S577 VanDerWaalsContact C-N 3.31Å; I575-S577 PolarHBondContact O-N 3.41Å; I575-V578 PolarHBondContact O-N 3.29Å; I575-S579 PolarHBondContact O-N 3.1Å; I575-S579 VanDerWaalsContact O-N 3.14Å; I575-M600 HydrophobicContact CB-CE 4.42Å; I575-M600 HydrophobicContact CG1-CE 4.31Å; I575-M600 HydrophobicContact CG2-CE 4.08Å; I575-S603 WeakPolarHBondContact CD1-OG 3.29Å; I575-P608 HydrophobicContact CG2-CB 4.39Å; I575-P608 WeakPolarHBondContact CG2-O 3.1Å; I575-L609 HydrophobicContact CD1-CB 4.48Å; I575-L609 HydrophobicContact CD1-CD1 4.33Å; I575-L609 HydrophobicContact CG1-CD1 4.49Å; I575-L609 HydrophobicContact CG2-CB 4.45Å; I575-L609 HydrophobicContact CG2-CD1 4.36Å; I575-S612 VanDerWaalsContact CG2-OG 3.3Å; I575-S612 WeakPolarHBondContact CG2-OG 3.37Å; I575-S612 PolarHBondContact O-OG 2.93Å
576L85.9Confident81.8Confident1 Ų119.2 Ų19.21%0.00510%0.104CC..Hα-helixtrans-67.6-37.8178.3-69.9171.8000112.1M353 C354 L358 T572 S573 A574 V578 S579 L580 P608M353-L576 HydrophobicContact CB-CD2 4Å; M353-L576 HydrophobicContact CE-CD2 4.08Å; C354-L576 HydrophobicContact CB-CD1 4.37Å; L358-L576 HydrophobicContact CD1-CD1 4.14Å; L358-L576 HydrophobicContact CD2-CD1 3.45Å; L358-L576 VanDerWaalsContact CD2-CD1 3.45Å; L358-L576 HydrophobicContact CG-CD1 4.43Å; T572-L576 HydrophobicContact CG2-CD1 3.86Å; T572-L576 HydrophobicContact CG2-CG 4.47Å; T572-L576 WeakPolarHBondContact O-CB 3.38Å; T572-L576 VanDerWaalsContact O-CG 3.3Å; T572-L576 WeakPolarHBondContact O-CG 3.38Å; T572-L576 PolarHBondContact O-N 2.99Å; S573-L576 PolarHBondContact O-N 3.33Å; A574-L576 PolarHBondContact O-N 3.23Å; L576-V578 VanDerWaalsContact C-N 3.34Å; L576-V578 PolarHBondContact O-N 2.87Å; L576-S579 WeakPolarHBondContact O-CB 3.35Å; L576-S579 PolarHBondContact O-N 3.15Å; L576-S579 VanDerWaalsContact O-N 3.12Å; L576-S579 PolarHBondContact O-OG 3.32Å; L576-L580 PolarHBondContact O-N 3.34Å; L576-P608 HydrophobicContact CD2-CB 4.21Å; L576-P608 HydrophobicContact CG-CB 4.31Å
577S86.8Confident83.2Confident0 Ų018.9 Ų18.90%012%0.116CC..Hα-helixtrans-62-42.4175.4-660000111.7L524 S528 S573 A574 I575 S579 L580 F581L524-S577 PolarHBondContact O-OG 3.35Å; S528-S577 WeakPolarHBondContact OG-CB 3.07Å; S528-S577 PolarHBondContact OG-OG 3.19Å; S573-S577 VanDerWaalsContact O-CB 3.3Å; S573-S577 WeakPolarHBondContact O-CB 3.41Å; S573-S577 PolarHBondContact O-N 3.34Å; S573-S577 PolarHBondContact O-OG 3.22Å; S573-S577 VanDerWaalsContact O-OG 3.08Å; A574-S577 PolarHBondContact O-N 3.31Å; I575-S577 VanDerWaalsContact C-N 3.31Å; I575-S577 PolarHBondContact O-N 3.41Å; S577-S579 VanDerWaalsContact C-N 3.31Å; S577-S579 PolarHBondContact O-N 3.03Å; S577-L580 PolarHBondContact O-N 3.07Å; S577-L580 VanDerWaalsContact O-N 3.13Å; S577-F581 WeakPolarHBondContact O-CD2 3.35Å; S577-F581 WeakPolarHBondContact O-CG 3.46Å; S577-F581 PolarHBondContact O-N 3.29Å
578V88.9Confident83.9Confident0 Ų020.1 Ų20.10%013%0.129CC..Hα-helixtrans-58.4-42.7172.5176.60000111.2I551 A574 I575 L576 L580 F581 T582 V593 I596 M600 I616I551-V578 HydrophobicContact CG2-CG2 4.09Å; A574-V578 WeakPolarHBondContact O-CG2 3.41Å; A574-V578 PolarHBondContact O-N 3.33Å; A574-V578 VanDerWaalsContact O-N 3.08Å; I575-V578 PolarHBondContact O-N 3.29Å; L576-V578 VanDerWaalsContact C-N 3.34Å; L576-V578 PolarHBondContact O-N 2.87Å; V578-L580 VanDerWaalsContact C-N 3.32Å; V578-L580 PolarHBondContact O-N 3.33Å; V578-F581 PolarHBondContact O-N 3.18Å; V578-T582 WeakPolarHBondContact O-CB 3.43Å; V578-T582 PolarHBondContact O-N 3.12Å; V578-T582 PolarHBondContact O-OG1 3.11Å; V578-T582 VanDerWaalsContact O-OG1 3.07Å; V578-V593 HydrophobicContact CG1-CG2 4.39Å; V578-I596 HydrophobicContact CG2-CG2 4.42Å; V578-M600 HydrophobicContact CB-CE 4.41Å; V578-M600 HydrophobicContact CB-SD 4.24Å; V578-M600 HydrophobicContact CG1-CE 4.36Å; V578-M600 HydrophobicContact CG1-SD 3.93Å; V578-M600 HydrophobicContact CG2-SD 4.31Å; V578-I616 HydrophobicContact CG1-CD1 4.24Å
579S87.3Confident84.5Confident2 Ų217.9 Ų17.91%0.01411%0.114CC..Hα-helixtrans-62.7-36.8176.481.80000113.2I575 L576 S577 T582 K583 S612I575-S579 PolarHBondContact O-N 3.1Å; I575-S579 VanDerWaalsContact O-N 3.14Å; L576-S579 WeakPolarHBondContact O-CB 3.35Å; L576-S579 PolarHBondContact O-N 3.15Å; L576-S579 VanDerWaalsContact O-N 3.12Å; L576-S579 PolarHBondContact O-OG 3.32Å; S577-S579 VanDerWaalsContact C-N 3.31Å; S577-S579 PolarHBondContact O-N 3.03Å; S579-T582 PolarHBondContact O-N 3.04Å; S579-K583 WeakPolarHBondContact O-CB 3.29Å; S579-K583 PolarHBondContact O-N 3Å; S579-S612 WeakPolarHBondContact CB-OG 3.26Å
580L87.2Confident85Confident2 Ų219.5 Ų19.51%0.0112%0.122CC..Hα-helixtrans-69.7-43.3176.8-77.7167.8000112.1L346 L350 L525 S528 L529 Y532 L576 S577 V578 T582 K583 S584L346-L580 HydrophobicContact CD1-CD2 4.36Å; L346-L580 HydrophobicContact CD2-CD2 4.32Å; L350-L580 HydrophobicContact CD1-CD1 4.03Å; L350-L580 HydrophobicContact CD1-CD2 4.19Å; L350-L580 HydrophobicContact CD2-CD1 3.88Å; L350-L580 HydrophobicContact CD2-CD2 3.93Å; L350-L580 HydrophobicContact CD2-CG 3.85Å; L350-L580 HydrophobicContact CG-CD2 4.41Å; L525-L580 HydrophobicContact CD1-CD1 3.76Å; S528-L580 WeakPolarHBondContact OG-CD1 3.45Å; L529-L580 HydrophobicContact CD2-CD1 4.14Å; Y532-L580 HydrophobicContact CD2-CD2 4.44Å; L576-L580 PolarHBondContact O-N 3.34Å; S577-L580 PolarHBondContact O-N 3.07Å; S577-L580 VanDerWaalsContact O-N 3.13Å; V578-L580 VanDerWaalsContact C-N 3.32Å; V578-L580 PolarHBondContact O-N 3.33Å; L580-T582 VanDerWaalsContact C-N 3.3Å; L580-T582 PolarHBondContact O-N 3.04Å; L580-K583 PolarHBondContact O-N 2.97Å; L580-S584 PolarHBondContact O-N 3.48Å; L580-S584 PolarHBondContact O-OG 3.14Å
581F89.3Confident85.1Confident2 Ų225.9 Ų25.91%0.00915%0.151CC..Hα-helixtrans-60.7-40172.5-64.7-56.7000111.6C531 I547 F548 I551 S577 V578 K583 S584 L585 I589C531-F581 HydrophobicContact CB-CD1 3.97Å; C531-F581 HydrophobicContact CB-CE1 3.56Å; C531-F581 VanDerWaalsContact SG-CD1 3.55Å; I547-F581 HydrophobicContact CG2-CE2 4.02Å; I547-F581 HydrophobicContact CG2-CZ 3.76Å; F548-F581 HydrophobicContact CE1-CD2 4.41Å; F548-F581 HydrophobicContact CE2-CB 4.48Å; F548-F581 HydrophobicContact CE2-CD2 4.25Å; F548-F581 HydrophobicContact CE2-CG 4.31Å; F548-F581 HydrophobicContact CZ-CB 3.99Å; F548-F581 AromaticContact CZ-CD2 3.86Å; F548-F581 HydrophobicContact CZ-CD2 3.98Å; F548-F581 HydrophobicContact CZ-CG 4.09Å; I551-F581 HydrophobicContact CD1-CD2 4.36Å; I551-F581 HydrophobicContact CD1-CE2 3.76Å; S577-F581 WeakPolarHBondContact O-CD2 3.35Å; S577-F581 WeakPolarHBondContact O-CG 3.46Å; S577-F581 PolarHBondContact O-N 3.29Å; V578-F581 PolarHBondContact O-N 3.18Å; F581-K583 VanDerWaalsContact C-N 3.33Å; F581-K583 PolarHBondContact O-N 3.22Å; F581-S584 PolarHBondContact O-N 2.87Å; F581-S584 PolarHBondContact O-OG 3.38Å; F581-L585 WeakPolarHBondContact O-CB 3.31Å; F581-L585 PolarHBondContact O-N 2.95Å; F581-I589 HydrophobicContact CB-CD1 3.85Å
582T88.4Confident85.3Confident0 Ų026.1 Ų26.10%016%0.156CC..Hα-helixtrans-66.5-36.3176-55.30000112.2V578 S579 L580 G586 I616 H619 I620V578-T582 WeakPolarHBondContact O-CB 3.43Å; V578-T582 PolarHBondContact O-N 3.12Å; V578-T582 PolarHBondContact O-OG1 3.11Å; V578-T582 VanDerWaalsContact O-OG1 3.07Å; S579-T582 PolarHBondContact O-N 3.04Å; L580-T582 VanDerWaalsContact C-N 3.3Å; L580-T582 PolarHBondContact O-N 3.04Å; T582-G586 VanDerWaalsContact O-CA 3.29Å; T582-G586 WeakPolarHBondContact O-CA 3.45Å; T582-G586 PolarHBondContact O-N 3.41Å; T582-G586 VanDerWaalsContact O-N 3.08Å; T582-I616 HydrophobicContact CG2-CB 4.27Å; T582-I616 HydrophobicContact CG2-CG1 3.92Å; T582-I616 HydrophobicContact CG2-CG2 4.4Å; T582-H619 HydrophobicContact CG2-CB 3.98Å; T582-I620 HydrophobicContact CG2-CD1 3.67Å; T582-I620 HydrophobicContact CG2-CG1 3.82Å
583K87.2Confident85.5Confident60 Ų6025.6 Ų25.626%0.26115%0.153SC..Hα-helixtrans-69.8-31.4176.4-163.6-176.9-176.5-178.10113E349 Y532 S579 L580 F581 V615E349-K583 IonicContact OE2-NZ 3.47Å; E349-K583 PolarHBondContact OE2-NZ 3.09Å; Y532-K583 HydrophobicContact CD2-CD 4.45Å; Y532-K583 HydrophobicContact CE2-CB 4.4Å; Y532-K583 HydrophobicContact CE2-CD 3.85Å; Y532-K583 HydrophobicContact CE2-CG 3.98Å; S579-K583 WeakPolarHBondContact O-CB 3.29Å; S579-K583 PolarHBondContact O-N 3Å; L580-K583 PolarHBondContact O-N 2.97Å; F581-K583 VanDerWaalsContact C-N 3.33Å; F581-K583 PolarHBondContact O-N 3.22Å; K583-V615 HydrophobicContact CB-CG1 4.41Å
584S84.4Confident85.6Confident26 Ų2628.5 Ų28.518%0.18217%0.169CC..Hα-helixtrans-91.8-38.2-178.7610000114.7L580 F581L580-S584 PolarHBondContact O-N 3.48Å; L580-S584 PolarHBondContact O-OG 3.14Å; F581-S584 PolarHBondContact O-N 2.87Å; F581-S584 PolarHBondContact O-OG 3.38Å
585L85.3Confident85.5Confident17 Ų1733.6 Ų33.69%0.08919%0.193CC..Hα-helixtrans-103.1-14.4-174-59.7174000113.4G535 A539 L544 F581 A588 I589G535-L585 WeakPolarHBondContact O-CD2 3.29Å; A539-L585 HydrophobicContact CB-CD2 4.11Å; L544-L585 HydrophobicContact CD1-CD1 3.51Å; F581-L585 WeakPolarHBondContact O-CB 3.31Å; F581-L585 PolarHBondContact O-N 2.95Å; L585-A588 HydrophobicContact CB-CB 4.49Å; L585-A588 WeakPolarHBondContact O-CB 3.45Å; L585-A588 PolarHBondContact O-N 3.43Å; L585-I589 HydrophobicContact CB-CG1 4.46Å; L585-I589 HydrophobicContact CB-CG2 3.95Å; L585-I589 HydrophobicContact CD1-CG2 3.55Å; L585-I589 HydrophobicContact CG-CG2 4.4Å
586G83.7Confident85.4Confident11.5 Ų11.533.9 Ų33.912%0.11919%0.194CC..G310 helixtrans53-123.4177.700000112.7T582 A588 I620T582-G586 VanDerWaalsContact O-CA 3.29Å; T582-G586 WeakPolarHBondContact O-CA 3.45Å; T582-G586 PolarHBondContact O-N 3.41Å; T582-G586 VanDerWaalsContact O-N 3.08Å; G586-A588 VanDerWaalsContact C-N 3.25Å; G586-A588 PolarHBondContact O-N 3.1Å; G586-I620 WeakPolarHBondContact O-CD1 3.36Å
587P82.8Confident85.4Confident102 Ų10234.2 Ų34.266%0.66220%0.196SC*.G310 helixtrans-70.8-14.2-17430.8-36.4000114.5I589 N590P587-I589 VanDerWaalsContact C-N 3.25Å; P587-I589 PolarHBondContact O-N 2.9Å; P587-N590 WeakPolarHBondContact O-CB 3.45Å; P587-N590 PolarHBondContact O-N 3.3Å
588A81.5Confident85.2Confident78 Ų7839.5 Ų39.565%0.64522%0.224SC*.G310 helixtrans-65-25.5-174.400000113.7L585 G586L585-A588 HydrophobicContact CB-CB 4.49Å; L585-A588 WeakPolarHBondContact O-CB 3.45Å; L585-A588 PolarHBondContact O-N 3.43Å; G586-A588 VanDerWaalsContact C-N 3.25Å; G586-A588 PolarHBondContact O-N 3.1Å
589I83.2Confident85Confident5 Ų540.2 Ų40.23%0.02623%0.23CC..G310 helixtrans-10111.7-178.261.4167.5000114L544 F548 F581 L585 P587 E591 S592 V593 I620L544-I589 HydrophobicContact CD1-CG2 4.2Å; F548-I589 HydrophobicContact CE2-CG2 4.26Å; F548-I589 HydrophobicContact CZ-CB 4.47Å; F548-I589 HydrophobicContact CZ-CD1 4.05Å; F548-I589 HydrophobicContact CZ-CG2 4.43Å; F581-I589 HydrophobicContact CB-CD1 3.85Å; L585-I589 HydrophobicContact CB-CG1 4.46Å; L585-I589 HydrophobicContact CB-CG2 3.95Å; L585-I589 HydrophobicContact CD1-CG2 3.55Å; L585-I589 HydrophobicContact CG-CG2 4.4Å; P587-I589 VanDerWaalsContact C-N 3.25Å; P587-I589 PolarHBondContact O-N 2.9Å; I589-E591 VanDerWaalsContact C-N 3.29Å; I589-E591 PolarHBondContact O-N 3.27Å; I589-E591 VanDerWaalsContact O-N 3.14Å; I589-S592 PolarHBondContact O-N 3.35Å; I589-V593 HydrophobicContact CB-CG2 4.31Å; I589-V593 HydrophobicContact CD1-CG2 3.53Å; I589-V593 HydrophobicContact CG1-CG2 3.75Å; I589-V593 WeakPolarHBondContact O-CG2 3.26Å; I589-V593 PolarHBondContact O-N 3.34Å; I589-I620 HydrophobicContact CG1-CD1 4.49Å
590N83.7Confident84.8Confident42.5 Ų42.540.1 Ų40.123%0.22723%0.23CC..Hα-helixtrans-50.7-44-172.5-178.866000113.6P587 N594 I620P587-N590 WeakPolarHBondContact O-CB 3.45Å; P587-N590 PolarHBondContact O-N 3.3Å; N590-N594 WeakPolarHBondContact O-CB 3.33Å; N590-N594 PolarHBondContact O-N 3.15Å; N590-I620 VanDerWaalsContact OD1-CG2 3.29Å; N590-I620 WeakPolarHBondContact OD1-CG2 3.29Å
591E84.5Confident84.5Confident149 Ų14941.1 Ų41.170%0.69624%0.235SC*.Hα-helixtrans-69.6-39.8179.3-117.6175.4-167.500112.7I589 Q595I589-E591 VanDerWaalsContact C-N 3.29Å; I589-E591 PolarHBondContact O-N 3.27Å; I589-E591 VanDerWaalsContact O-N 3.14Å; E591-Q595 WeakPolarHBondContact O-CG 3.46Å; E591-Q595 PolarHBondContact O-N 2.93Å
592S82.8Confident84Confident38 Ų3842.9 Ų42.927%0.26625%0.25SS..Hα-helixtrans-69-36.6177.5-54.50000112.3I589 I596I589-S592 PolarHBondContact O-N 3.35Å; S592-I596 WeakPolarHBondContact O-CD1 3.43Å; S592-I596 WeakPolarHBondContact O-CG1 3.39Å
593V85.6Confident83.4Confident0 Ų043.7 Ų43.70%026%0.256CS..Hα-helixtrans-67.5-47.5175.1174.10000110.3V578 I589 Q595 I596 L597 I616 L623V578-V593 HydrophobicContact CG1-CG2 4.39Å; I589-V593 HydrophobicContact CB-CG2 4.31Å; I589-V593 HydrophobicContact CD1-CG2 3.53Å; I589-V593 HydrophobicContact CG1-CG2 3.75Å; I589-V593 WeakPolarHBondContact O-CG2 3.26Å; I589-V593 PolarHBondContact O-N 3.34Å; V593-Q595 VanDerWaalsContact C-N 3.34Å; V593-Q595 PolarHBondContact O-N 3.21Å; V593-I596 CarbonylContact O-C 3.56Å; V593-I596 WeakPolarHBondContact O-CA 3.17Å; V593-I596 PolarHBondContact O-N 3.19Å; V593-L597 HydrophobicContact CG1-CD2 4.14Å; V593-L597 HydrophobicContact CG1-CG 4.36Å; V593-L597 PolarHBondContact O-N 3.2Å; V593-I616 HydrophobicContact CG1-CG2 4.31Å; V593-L623 HydrophobicContact CB-CD1 4.33Å; V593-L623 HydrophobicContact CG1-CD1 3.82Å
594N85.1Confident82.9Confident62 Ų6242.2 Ų42.233%0.33226%0.258SS..Hα-helixtrans-57.2-45.7-179.5-168.5-37.1000111.6N590 I596 L597 L623 E626N590-N594 WeakPolarHBondContact O-CB 3.33Å; N590-N594 PolarHBondContact O-N 3.15Å; N594-I596 PolarHBondContact O-N 3.11Å; N594-L597 PolarHBondContact O-N 2.95Å; N594-L597 VanDerWaalsContact O-N 3.17Å; N594-L623 HydrophobicContact CB-CD2 4.21Å; N594-E626 PolarHBondContact ND2-OE1 3.1Å; N594-E626 VanDerWaalsContact ND2-OE1 3.08Å; N594-E626 PolarHBondContact ND2-OE2 3.42Å
595Q84.1Confident82.6Confident108 Ų10841.5 Ų41.551%0.50525%0.252SS..Hα-helixtrans-60-11.5174.9-70.2-179.335.600115.7E591 V593E591-Q595 WeakPolarHBondContact O-CG 3.46Å; E591-Q595 PolarHBondContact O-N 2.93Å; V593-Q595 VanDerWaalsContact C-N 3.34Å; V593-Q595 PolarHBondContact O-N 3.21Å
596I86.1Confident82.4Confident5.5 Ų5.542.7 Ų42.73%0.02826%0.259CS..Hα-helixtrans-114.5-16.2-176.1-70.6173.2000111.9F548 I551 L555 V578 S592 V593 N594 D598 A599 M600F548-I596 HydrophobicContact CB-CD1 4.35Å; F548-I596 HydrophobicContact CD1-CD1 3.55Å; F548-I596 VanDerWaalsContact CD1-CD1 3.5Å; F548-I596 HydrophobicContact CE1-CD1 4.29Å; F548-I596 HydrophobicContact CG-CD1 4.36Å; I551-I596 HydrophobicContact CG2-CD1 4.48Å; L555-I596 HydrophobicContact CD1-CG2 3.61Å; V578-I596 HydrophobicContact CG2-CG2 4.42Å; S592-I596 WeakPolarHBondContact O-CD1 3.43Å; S592-I596 WeakPolarHBondContact O-CG1 3.39Å; V593-I596 CarbonylContact O-C 3.56Å; V593-I596 WeakPolarHBondContact O-CA 3.17Å; V593-I596 PolarHBondContact O-N 3.19Å; N594-I596 PolarHBondContact O-N 3.11Å; I596-D598 PolarHBondContact O-N 3Å; I596-A599 PolarHBondContact O-N 2.81Å; I596-M600 HydrophobicContact CG2-CG 3.87Å; I596-M600 HydrophobicContact CG2-SD 4Å; I596-M600 WeakPolarHBondContact O-CG 3.31Å; I596-M600 PolarHBondContact O-N 3.03Å
597L84.8Confident82.3Confident7.5 Ų7.545.8 Ų45.84%0.03927%0.27CS..Hα-helixtrans-53.2-50.9179.3-73.8179.6000111.7V593 N594 A599 M600 V601 F613 L623 E626 I627V593-L597 HydrophobicContact CG1-CD2 4.14Å; V593-L597 HydrophobicContact CG1-CG 4.36Å; V593-L597 PolarHBondContact O-N 3.2Å; N594-L597 PolarHBondContact O-N 2.95Å; N594-L597 VanDerWaalsContact O-N 3.17Å; L597-A599 VanDerWaalsContact C-N 3.27Å; L597-A599 PolarHBondContact O-N 3.16Å; L597-M600 WeakPolarHBondContact O-CB 3.35Å; L597-M600 PolarHBondContact O-N 3.32Å; L597-V601 VanDerWaalsContact O-CG2 3.29Å; L597-V601 WeakPolarHBondContact O-CG2 3.48Å; L597-V601 PolarHBondContact O-N 2.95Å; L597-F613 HydrophobicContact CD2-CE1 4.03Å; L597-L623 HydrophobicContact CD1-CD1 4.43Å; L597-L623 HydrophobicContact CD1-CD2 4.32Å; L597-E626 HydrophobicContact CD1-CG 4.31Å; L597-I627 HydrophobicContact CD1-CG1 4.42Å; L597-I627 HydrophobicContact CD2-CG1 4.33Å
598D84Confident82.2Confident110.5 Ų110.541.4 Ų41.459%0.59124%0.241SC*.Hα-helixtrans-56.5-37.2178.2-68.6-27.5000113.2I596 V601 A602I596-D598 PolarHBondContact O-N 3Å; D598-V601 PolarHBondContact O-N 2.67Å; D598-A602 WeakPolarHBondContact O-CB 3.4Å; D598-A602 PolarHBondContact O-N 3.34Å; D598-A602 VanDerWaalsContact O-N 3.07Å
599A83.4Confident82.4Confident16.5 Ų16.537.7 Ų37.714%0.13621%0.211CC..Hα-helixtrans-76.4-29.2178.900000112.5L555 I596 L597L555-A599 HydrophobicContact CB-CB 3.95Å; L555-A599 HydrophobicContact CD1-CB 4.12Å; I596-A599 PolarHBondContact O-N 2.81Å; L597-A599 VanDerWaalsContact C-N 3.27Å; L597-A599 PolarHBondContact O-N 3.16Å
600M83.2Confident82.5Confident0 Ų038.1 Ų38.10%021%0.213CC..Hα-helixtrans-70.8-41.8170.2-67.7175.766.600111.2L555 I575 V578 I596 L597 A602 S603 L609 F613 I616L555-M600 HydrophobicContact CD1-CG 3.95Å; I575-M600 HydrophobicContact CB-CE 4.42Å; I575-M600 HydrophobicContact CG1-CE 4.31Å; I575-M600 HydrophobicContact CG2-CE 4.08Å; V578-M600 HydrophobicContact CB-CE 4.41Å; V578-M600 HydrophobicContact CB-SD 4.24Å; V578-M600 HydrophobicContact CG1-CE 4.36Å; V578-M600 HydrophobicContact CG1-SD 3.93Å; V578-M600 HydrophobicContact CG2-SD 4.31Å; I596-M600 HydrophobicContact CG2-CG 3.87Å; I596-M600 HydrophobicContact CG2-SD 4Å; I596-M600 WeakPolarHBondContact O-CG 3.31Å; I596-M600 PolarHBondContact O-N 3.03Å; L597-M600 WeakPolarHBondContact O-CB 3.35Å; L597-M600 PolarHBondContact O-N 3.32Å; M600-A602 VanDerWaalsContact C-N 3.3Å; M600-A602 PolarHBondContact O-N 3.11Å; M600-S603 WeakPolarHBondContact O-CB 3.38Å; M600-S603 PolarHBondContact O-N 3.33Å; M600-S603 VanDerWaalsContact O-N 3.13Å; M600-S603 PolarHBondContact O-OG 2.88Å; M600-L609 HydrophobicContact CB-CD1 3.81Å; M600-L609 HydrophobicContact CE-CD1 3.95Å; M600-F613 HydrophobicContact CB-CE1 4.35Å; M600-F613 HydrophobicContact CB-CZ 4.47Å; M600-F613 HydrophobicContact CE-CD1 4.38Å; M600-F613 HydrophobicContact CE-CE1 3.96Å; M600-F613 HydrophobicContact SD-CE1 4.48Å; M600-I616 HydrophobicContact CE-CD1 4.29Å
601V81.1Confident82.4Confident22 Ų2236.8 Ų36.813%0.13321%0.208CC..Hα-helixtrans-63.5-37.7177171.50000111.2L597 D598 S603 G604 F613 C630 N634L597-V601 VanDerWaalsContact O-CG2 3.29Å; L597-V601 WeakPolarHBondContact O-CG2 3.48Å; L597-V601 PolarHBondContact O-N 2.95Å; D598-V601 PolarHBondContact O-N 2.67Å; V601-S603 PolarHBondContact O-N 3.08Å; V601-S603 VanDerWaalsContact O-N 3.14Å; V601-G604 PolarHBondContact O-N 3.16Å; V601-G604 VanDerWaalsContact O-N 3.12Å; V601-F613 HydrophobicContact CG2-CE2 4.36Å; V601-F613 HydrophobicContact CG2-CZ 3.86Å; V601-C630 HydrophobicContact CG1-CB 4.45Å; V601-C630 WeakPolarHBondContact CG1-SG 3.44Å; V601-C630 HydrophobicContact CG2-CB 4.15Å; V601-C630 WeakPolarHBondContact CG2-SG 3.44Å; V601-N634 WeakPolarHBondContact CG1-ND2 3.42Å; V601-N634 PolarHBondContact O-ND2 2.6Å
602A79Confident82.5Confident39 Ų3929.7 Ų29.732%0.32218%0.175SC..THydrogen-bonded Turntrans-64.6-13.4176.600000114.6P556 D598 M600 G604P556-A602 HydrophobicContact CG-CB 4.16Å; D598-A602 WeakPolarHBondContact O-CB 3.4Å; D598-A602 PolarHBondContact O-N 3.34Å; D598-A602 VanDerWaalsContact O-N 3.07Å; M600-A602 VanDerWaalsContact C-N 3.3Å; M600-A602 PolarHBondContact O-N 3.11Å; A602-G604 VanDerWaalsContact C-N 3.27Å; A602-G604 PolarHBondContact O-N 3.19Å
603S75Confident82.7Confident17 Ų1728 Ų2812%0.11916%0.163CC..THydrogen-bonded Turntrans-75.4-8.5173.41020000114E571 I575 M600 V601 N606E571-S603 PolarHBondContact OE2-OG 3.4Å; I575-S603 WeakPolarHBondContact CD1-OG 3.29Å; M600-S603 WeakPolarHBondContact O-CB 3.38Å; M600-S603 PolarHBondContact O-N 3.33Å; M600-S603 VanDerWaalsContact O-N 3.13Å; M600-S603 PolarHBondContact O-OG 2.88Å; V601-S603 PolarHBondContact O-N 3.08Å; V601-S603 VanDerWaalsContact O-N 3.14Å; S603-N606 PolarHBondContact O-ND2 3.17Å; S603-N606 VanDerWaalsContact O-ND2 3.11Å
604G76.7Confident82.7Confident29.6667 Ų29.666732.3 Ų32.331%0.30618%0.182SC..  trans84.3174.1-17800000113.9V601 A602 N606 L609V601-G604 PolarHBondContact O-N 3.16Å; V601-G604 VanDerWaalsContact O-N 3.12Å; A602-G604 VanDerWaalsContact C-N 3.27Å; A602-G604 PolarHBondContact O-N 3.19Å; G604-N606 PolarHBondContact O-N 3.24Å; G604-N606 VanDerWaalsContact O-N 3.1Å; G604-L609 VanDerWaalsContact O-CD2 3.24Å; G604-L609 WeakPolarHBondContact O-CD2 3.27Å
605L79.5Confident82.8Confident10 Ų1030.4 Ų30.45%0.05217%0.172CC..SBendtrans-73.999.2-179.3-73178.8000110.9L631 N634 I635 V638 L775 A776L605-L631 HydrophobicContact CD2-CD2 3.91Å; L605-N634 HydrophobicContact CD1-CB 4.32Å; L605-N634 HydrophobicContact CD2-CB 3.95Å; L605-N634 HydrophobicContact CG-CB 4.08Å; L605-I635 HydrophobicContact CD1-CG1 4.06Å; L605-I635 HydrophobicContact CD2-CG1 4.46Å; L605-V638 HydrophobicContact CD1-CB 4.43Å; L605-V638 HydrophobicContact CD1-CG2 3.95Å; L605-L775 VanDerWaalsContact O-CD2 3.3Å; L605-L775 WeakPolarHBondContact O-CD2 3.29Å; L605-A776 HydrophobicContact CD1-CB 3.99Å
606N81.1Confident83Confident43.3333 Ų43.333325.3 Ų25.323%0.23215%0.148CC..  trans-119.8143.6178.8-63.7-39.3000110.9S603 G604 P608 L609 I610 P757S603-N606 PolarHBondContact O-ND2 3.17Å; S603-N606 VanDerWaalsContact O-ND2 3.11Å; G604-N606 PolarHBondContact O-N 3.24Å; G604-N606 VanDerWaalsContact O-N 3.1Å; N606-P608 VanDerWaalsContact C-CD 3.48Å; N606-P608 HydrophobicContact CB-CG 4.13Å; N606-L609 HydrophobicContact CB-CB 4.34Å; N606-L609 WeakPolarHBondContact O-CA 3.45Å; N606-L609 VanDerWaalsContact O-CB 3.28Å; N606-L609 WeakPolarHBondContact O-CB 3.34Å; N606-L609 PolarHBondContact O-N 3.22Å; N606-I610 WeakPolarHBondContact O-CD1 3.14Å; N606-I610 PolarHBondContact O-N 3.08Å; N606-I610 VanDerWaalsContact O-N 3.15Å; N606-P757 VanDerWaalsContact OD1-CD 3.22Å; N606-P757 WeakPolarHBondContact OD1-CD 3.49Å; N606-P757 WeakPolarHBondContact OD1-CG 3.27Å
607Q80.9Confident83Confident76.3333 Ų76.333325.7 Ų25.736%0.35715%0.153SC..Hα-helixtrans-51.7-44.1177.2-176.793.119.800114L609 I610 A611 L775Q607-L609 VanDerWaalsContact C-N 3.3Å; Q607-L609 PolarHBondContact O-N 3.34Å; Q607-I610 PolarHBondContact O-N 3.1Å; Q607-A611 WeakPolarHBondContact O-CB 2.94Å; Q607-A611 PolarHBondContact O-N 3.31Å; Q607-A611 VanDerWaalsContact O-N 3.13Å; Q607-L775 HydrophobicContact CB-CD1 4.25Å; Q607-L775 HydrophobicContact CB-CD2 4.49Å
608P80.2Confident83Confident8.66667 Ų8.6666731.6 Ų31.66%0.05618%0.181CC..Hα-helixtrans-62.2-33.9173.48.1-13.7000113.7M353 T572 I575 L576 N606 A611 S612 I756M353-P608 WeakPolarHBondContact O-CA 3.4Å; T572-P608 HydrophobicContact CG2-CB 4.09Å; T572-P608 HydrophobicContact CG2-CG 3.93Å; I575-P608 HydrophobicContact CG2-CB 4.39Å; I575-P608 WeakPolarHBondContact CG2-O 3.1Å; L576-P608 HydrophobicContact CD2-CB 4.21Å; L576-P608 HydrophobicContact CG-CB 4.31Å; N606-P608 VanDerWaalsContact C-CD 3.48Å; N606-P608 HydrophobicContact CB-CG 4.13Å; P608-A611 PolarHBondContact O-N 3.07Å; P608-S612 VanDerWaalsContact O-CB 3.27Å; P608-S612 WeakPolarHBondContact O-CB 3.41Å; P608-S612 PolarHBondContact O-N 3.1Å; P608-S612 PolarHBondContact O-OG 3.2Å; P608-S612 VanDerWaalsContact O-OG 3.09Å; P608-I756 HydrophobicContact CG-CD1 3.73Å
609L85.9Confident83.1Confident1 Ų129.1 Ų29.11%0.00517%0.166CC..Hα-helixtrans-64.6-47.3177.2-177.568.1000110.9I575 M600 G604 N606 Q607 A611 S612 F613I575-L609 HydrophobicContact CD1-CB 4.48Å; I575-L609 HydrophobicContact CD1-CD1 4.33Å; I575-L609 HydrophobicContact CG1-CD1 4.49Å; I575-L609 HydrophobicContact CG2-CB 4.45Å; I575-L609 HydrophobicContact CG2-CD1 4.36Å; M600-L609 HydrophobicContact CB-CD1 3.81Å; M600-L609 HydrophobicContact CE-CD1 3.95Å; G604-L609 VanDerWaalsContact O-CD2 3.24Å; G604-L609 WeakPolarHBondContact O-CD2 3.27Å; N606-L609 HydrophobicContact CB-CB 4.34Å; N606-L609 WeakPolarHBondContact O-CA 3.45Å; N606-L609 VanDerWaalsContact O-CB 3.28Å; N606-L609 WeakPolarHBondContact O-CB 3.34Å; N606-L609 PolarHBondContact O-N 3.22Å; Q607-L609 VanDerWaalsContact C-N 3.3Å; Q607-L609 PolarHBondContact O-N 3.34Å; L609-A611 VanDerWaalsContact C-N 3.34Å; L609-A611 PolarHBondContact O-N 3.06Å; L609-S612 PolarHBondContact O-N 3.15Å; L609-F613 HydrophobicContact CD1-CD1 4.25Å; L609-F613 HydrophobicContact CD1-CD2 4.25Å; L609-F613 HydrophobicContact CD1-CE1 3.73Å; L609-F613 HydrophobicContact CD1-CE2 3.94Å; L609-F613 HydrophobicContact CD1-CZ 3.57Å; L609-F613 HydrophobicContact CD2-CD2 4.45Å; L609-F613 HydrophobicContact CD2-CE2 4.03Å; L609-F613 HydrophobicContact CD2-CZ 4.3Å; L609-F613 HydrophobicContact CG-CD2 4.12Å; L609-F613 HydrophobicContact CG-CE1 4.36Å; L609-F613 HydrophobicContact CG-CE2 3.81Å; L609-F613 HydrophobicContact CG-CZ 3.98Å; L609-F613 WeakPolarHBondContact O-CB 3.36Å; L609-F613 WeakPolarHBondContact O-CG 3.43Å; L609-F613 PolarHBondContact O-N 3.22Å
610I84.9Confident83.3Confident13 Ų1328.5 Ų28.57%0.06716%0.16CC..Hα-helixtrans-62.6-43.7179.6-63.2148.5000110.7N606 Q607 S612 F613 K614 L631 L775 T779N606-I610 WeakPolarHBondContact O-CD1 3.14Å; N606-I610 PolarHBondContact O-N 3.08Å; N606-I610 VanDerWaalsContact O-N 3.15Å; Q607-I610 PolarHBondContact O-N 3.1Å; I610-S612 VanDerWaalsContact C-N 3.35Å; I610-F613 PolarHBondContact O-N 3.12Å; I610-K614 WeakPolarHBondContact O-CG 3.43Å; I610-K614 PolarHBondContact O-N 3.33Å; I610-L631 HydrophobicContact CG1-CD1 4.41Å; I610-L775 HydrophobicContact CD1-CD1 3.62Å; I610-L775 HydrophobicContact CD1-CD2 3.88Å; I610-L775 HydrophobicContact CD1-CG 3.68Å; I610-T779 HydrophobicContact CB-CG2 4.38Å; I610-T779 HydrophobicContact CD1-CG2 3.81Å; I610-T779 WeakPolarHBondContact CD1-OG1 3.39Å; I610-T779 HydrophobicContact CG1-CG2 3.72Å; I610-T779 VanDerWaalsContact CG1-CG2 3.48Å; I610-T779 HydrophobicContact CG2-CG2 3.84Å
611A83Confident83.2Confident15 Ų1532.9 Ų32.912%0.12419%0.189CC..Hα-helixtrans-61.7-46.3175.400000111.6M353 Q607 P608 L609 F613 K614 V615M353-A611 HydrophobicContact CB-CB 3.6Å; M353-A611 HydrophobicContact CG-CB 3.71Å; M353-A611 HydrophobicContact SD-CB 4.04Å; Q607-A611 WeakPolarHBondContact O-CB 2.94Å; Q607-A611 PolarHBondContact O-N 3.31Å; Q607-A611 VanDerWaalsContact O-N 3.13Å; P608-A611 PolarHBondContact O-N 3.07Å; L609-A611 VanDerWaalsContact C-N 3.34Å; L609-A611 PolarHBondContact O-N 3.06Å; A611-F613 VanDerWaalsContact C-N 3.34Å; A611-F613 PolarHBondContact O-N 3.47Å; A611-K614 WeakPolarHBondContact O-CB 3.33Å; A611-K614 PolarHBondContact O-N 3.29Å; A611-V615 WeakPolarHBondContact O-CG2 3.33Å; A611-V615 PolarHBondContact O-N 3.23Å
612S85.6Confident83.5Confident0 Ų041.9 Ų41.90%022%0.221CC..Hα-helixtrans-62.5-42.3176.5-65.80000112.2I575 S579 P608 L609 I610 K614 V615 I616I575-S612 VanDerWaalsContact CG2-OG 3.3Å; I575-S612 WeakPolarHBondContact CG2-OG 3.37Å; I575-S612 PolarHBondContact O-OG 2.93Å; S579-S612 WeakPolarHBondContact CB-OG 3.26Å; P608-S612 VanDerWaalsContact O-CB 3.27Å; P608-S612 WeakPolarHBondContact O-CB 3.41Å; P608-S612 PolarHBondContact O-N 3.1Å; P608-S612 PolarHBondContact O-OG 3.2Å; P608-S612 VanDerWaalsContact O-OG 3.09Å; L609-S612 PolarHBondContact O-N 3.15Å; I610-S612 VanDerWaalsContact C-N 3.35Å; S612-K614 VanDerWaalsContact C-N 3.34Å; S612-K614 PolarHBondContact O-N 3.12Å; S612-V615 WeakPolarHBondContact O-CB 3.45Å; S612-V615 PolarHBondContact O-N 3.03Å; S612-V615 VanDerWaalsContact O-N 3.16Å; S612-I616 WeakPolarHBondContact O-CD1 3.37Å; S612-I616 VanDerWaalsContact O-CG1 3.23Å; S612-I616 WeakPolarHBondContact O-CG1 3.42Å; S612-I616 PolarHBondContact O-N 2.97Å
613F88.1Confident83.8Confident3 Ų340.3 Ų40.31%0.01321%0.207CC..Hα-helixtrans-64.1-35.9175.2-77.3-8.7000112.9L597 M600 V601 L609 I610 A611 V615 I616 A617 I627 L631 F783L597-F613 HydrophobicContact CD2-CE1 4.03Å; M600-F613 HydrophobicContact CB-CE1 4.35Å; M600-F613 HydrophobicContact CB-CZ 4.47Å; M600-F613 HydrophobicContact CE-CD1 4.38Å; M600-F613 HydrophobicContact CE-CE1 3.96Å; M600-F613 HydrophobicContact SD-CE1 4.48Å; V601-F613 HydrophobicContact CG2-CE2 4.36Å; V601-F613 HydrophobicContact CG2-CZ 3.86Å; L609-F613 HydrophobicContact CD1-CD1 4.25Å; L609-F613 HydrophobicContact CD1-CD2 4.25Å; L609-F613 HydrophobicContact CD1-CE1 3.73Å; L609-F613 HydrophobicContact CD1-CE2 3.94Å; L609-F613 HydrophobicContact CD1-CZ 3.57Å; L609-F613 HydrophobicContact CD2-CD2 4.45Å; L609-F613 HydrophobicContact CD2-CE2 4.03Å; L609-F613 HydrophobicContact CD2-CZ 4.3Å; L609-F613 HydrophobicContact CG-CD2 4.12Å; L609-F613 HydrophobicContact CG-CE1 4.36Å; L609-F613 HydrophobicContact CG-CE2 3.81Å; L609-F613 HydrophobicContact CG-CZ 3.98Å; L609-F613 WeakPolarHBondContact O-CB 3.36Å; L609-F613 WeakPolarHBondContact O-CG 3.43Å; L609-F613 PolarHBondContact O-N 3.22Å; I610-F613 PolarHBondContact O-N 3.12Å; A611-F613 VanDerWaalsContact C-N 3.34Å; A611-F613 PolarHBondContact O-N 3.47Å; F613-V615 VanDerWaalsContact C-N 3.34Å; F613-I616 HydrophobicContact CD1-CD1 4.2Å; F613-I616 PolarHBondContact O-N 3.44Å; F613-A617 VanDerWaalsContact O-CB 3.25Å; F613-A617 WeakPolarHBondContact O-CB 3.35Å; F613-A617 PolarHBondContact O-N 2.95Å; F613-I627 HydrophobicContact CB-CG2 3.79Å; F613-I627 HydrophobicContact CD1-CD1 4.5Å; F613-I627 HydrophobicContact CD1-CG1 4.45Å; F613-I627 HydrophobicContact CD1-CG2 4.29Å; F613-I627 HydrophobicContact CD2-CG2 3.91Å; F613-I627 HydrophobicContact CE2-CG2 4.4Å; F613-I627 HydrophobicContact CG-CG2 3.8Å; F613-L631 HydrophobicContact CB-CD1 4.33Å; F613-L631 HydrophobicContact CD2-CD1 4.02Å; F613-L631 HydrophobicContact CD2-CD2 3.72Å; F613-L631 HydrophobicContact CD2-CG 3.82Å; F613-L631 HydrophobicContact CE2-CD2 3.97Å; F613-L631 HydrophobicContact CE2-CG 4.17Å; F613-F783 HydrophobicContact CB-CE2 4.38Å
614K86Confident84.2Confident90.6667 Ų90.666743.1 Ų43.139%0.39422%0.215SC..Hα-helixtrans-62.6-42.5171.8-142.2-180-176.5-174.70111.4I610 A611 S612 M618 P718 F719 S720 S782 F783I610-K614 WeakPolarHBondContact O-CG 3.43Å; I610-K614 PolarHBondContact O-N 3.33Å; A611-K614 WeakPolarHBondContact O-CB 3.33Å; A611-K614 PolarHBondContact O-N 3.29Å; S612-K614 VanDerWaalsContact C-N 3.34Å; S612-K614 PolarHBondContact O-N 3.12Å; K614-M618 WeakPolarHBondContact O-CB 3.41Å; K614-M618 PolarHBondContact O-N 2.95Å; K614-M618 VanDerWaalsContact O-N 3.09Å; K614-P718 PolarHBondContact NZ-O 3.44Å; K614-F719 PolarHBondContact NZ-O 3.24Å; K614-S720 PolarHBondContact NZ-OG 3.36Å; K614-S782 PolarHBondContact NZ-O 2.75Å; K614-S782 PolarHBondContact NZ-OG 2.97Å; K614-F783 HydrophobicContact CB-CE2 4.41Å; K614-F783 HydrophobicContact CD-CD2 4.37Å; K614-F783 HydrophobicContact CG-CD2 3.49Å; K614-F783 VanDerWaalsContact CG-CD2 3.49Å; K614-F783 HydrophobicContact CG-CE2 3.68Å
615V85.5Confident84.6Confident22.3333 Ų22.333348.9 Ų48.914%0.13523%0.231CC..Hα-helixtrans-65.3-45.5175.3174.40000111.2M353 K583 A611 S612 F613 M618 H619M353-V615 HydrophobicContact SD-CG2 3.68Å; K583-V615 HydrophobicContact CB-CG1 4.41Å; A611-V615 WeakPolarHBondContact O-CG2 3.33Å; A611-V615 PolarHBondContact O-N 3.23Å; S612-V615 WeakPolarHBondContact O-CB 3.45Å; S612-V615 PolarHBondContact O-N 3.03Å; S612-V615 VanDerWaalsContact O-N 3.16Å; F613-V615 VanDerWaalsContact C-N 3.34Å; V615-M618 PolarHBondContact O-N 3.38Å; V615-H619 PolarHBondContact O-CD2 3.09Å; V615-H619 VanDerWaalsContact O-CD2 3.27Å; V615-H619 PolarHBondContact O-N 3.05Å; V615-H619 VanDerWaalsContact O-N 3.12Å; V615-H619 PolarHBondContact O-ND1 3.29Å
616I88.3Confident85Confident0 Ų052.3 Ų52.30%025%0.247CC..Hα-helixtrans-64.6-46.8-179.5-65.4159.8000110.9V578 T582 V593 M600 S612 F613 M618 H619 I620 L623 I627V578-I616 HydrophobicContact CG1-CD1 4.24Å; T582-I616 HydrophobicContact CG2-CB 4.27Å; T582-I616 HydrophobicContact CG2-CG1 3.92Å; T582-I616 HydrophobicContact CG2-CG2 4.4Å; V593-I616 HydrophobicContact CG1-CG2 4.31Å; M600-I616 HydrophobicContact CE-CD1 4.29Å; S612-I616 WeakPolarHBondContact O-CD1 3.37Å; S612-I616 VanDerWaalsContact O-CG1 3.23Å; S612-I616 WeakPolarHBondContact O-CG1 3.42Å; S612-I616 PolarHBondContact O-N 2.97Å; F613-I616 HydrophobicContact CD1-CD1 4.2Å; F613-I616 PolarHBondContact O-N 3.44Å; I616-M618 VanDerWaalsContact C-N 3.25Å; I616-M618 PolarHBondContact O-N 3.09Å; I616-H619 PolarHBondContact O-N 3.08Å; I616-I620 WeakPolarHBondContact O-CA 3.41Å; I616-I620 WeakPolarHBondContact O-CB 3.43Å; I616-I620 PolarHBondContact O-N 3.25Å; I616-L623 HydrophobicContact CG2-CD1 4.27Å; I616-I627 HydrophobicContact CB-CD1 4.15Å; I616-I627 HydrophobicContact CG2-CD1 3.59Å
617A86.1Confident85.2Confident14.6667 Ų14.666750.3 Ų50.312%0.12124%0.236CC..Hα-helixtrans-63.1-27.6177.800000113.1F613 R624 F783F613-A617 VanDerWaalsContact O-CB 3.25Å; F613-A617 WeakPolarHBondContact O-CB 3.35Å; F613-A617 PolarHBondContact O-N 2.95Å; A617-R624 HydrophobicContact CB-CB 4.44Å; A617-R624 HydrophobicContact CB-CG 4.37Å; A617-F783 HydrophobicContact CB-CZ 4.17Å
618M86.4Confident85.5Confident130 Ų13046.9 Ų46.964%0.6422%0.22SC*.Hα-helixtrans-76.4-41.6175.8-175178.5175.100112.9K614 V615 I616K614-M618 WeakPolarHBondContact O-CB 3.41Å; K614-M618 PolarHBondContact O-N 2.95Å; K614-M618 VanDerWaalsContact O-N 3.09Å; V615-M618 PolarHBondContact O-N 3.38Å; I616-M618 VanDerWaalsContact C-N 3.25Å; I616-M618 PolarHBondContact O-N 3.09Å
619H84.8Confident85.8Confident58.3333 Ų58.333349.9 Ų49.927%0.2724%0.236SC..Hα-helixtrans-91.2-24.4-176.5-66.259.9000113.4T582 V615 I616T582-H619 HydrophobicContact CG2-CB 3.98Å; V615-H619 PolarHBondContact O-CD2 3.09Å; V615-H619 VanDerWaalsContact O-CD2 3.27Å; V615-H619 PolarHBondContact O-N 3.05Å; V615-H619 VanDerWaalsContact O-N 3.12Å; V615-H619 PolarHBondContact O-ND1 3.29Å; I616-H619 PolarHBondContact O-N 3.08Å
620I87.4Confident85.8Confident3.66667 Ų3.6666751.2 Ų51.22%0.01925%0.245CC..  trans-126.780178.3-49.7179.4000109.1T582 G586 I589 N590 I616 R622 L623T582-I620 HydrophobicContact CG2-CD1 3.67Å; T582-I620 HydrophobicContact CG2-CG1 3.82Å; G586-I620 WeakPolarHBondContact O-CD1 3.36Å; I589-I620 HydrophobicContact CG1-CD1 4.49Å; N590-I620 VanDerWaalsContact OD1-CG2 3.29Å; N590-I620 WeakPolarHBondContact OD1-CG2 3.29Å; I616-I620 WeakPolarHBondContact O-CA 3.41Å; I616-I620 WeakPolarHBondContact O-CB 3.43Å; I616-I620 PolarHBondContact O-N 3.25Å; I620-R622 HydrophobicContact CG2-CB 4.46Å; I620-R622 PolarHBondContact O-N 3.25Å; I620-R622 VanDerWaalsContact O-N 3.09Å; I620-L623 HydrophobicContact CB-CD1 4.34Å; I620-L623 HydrophobicContact CD1-CD1 4.31Å; I620-L623 HydrophobicContact CG2-CB 4.37Å; I620-L623 HydrophobicContact CG2-CD1 3.83Å; I620-L623 HydrophobicContact CG2-CG 3.82Å; I620-L623 PolarHBondContact O-N 2.95Å; I620-L623 VanDerWaalsContact O-N 3.14Å
621P82.7Confident85.8Confident93.6667 Ų93.666750.6 Ų50.661%0.60824%0.242SC*.G310 helixtrans-63.4-19-177.39.2-13.4000114L623 R624P621-L623 VanDerWaalsContact C-N 3.3Å; P621-L623 PolarHBondContact O-N 3.07Å; P621-R624 VanDerWaalsContact O-CB 3.31Å; P621-R624 WeakPolarHBondContact O-CB 3.37Å; P621-R624 PolarHBondContact O-N 3.07Å; P621-R624 VanDerWaalsContact O-N 3.15Å
622R85.7Confident86Confident210.667 Ų210.66750.5 Ų50.580%0.79524%0.239SC*.G310 helixtrans-63.1-36.1176.6-67.6-175.8179.51740.4112.7I620 R624I620-R622 HydrophobicContact CG2-CB 4.46Å; I620-R622 PolarHBondContact O-N 3.25Å; I620-R622 VanDerWaalsContact O-N 3.09Å; R622-R624 VanDerWaalsContact C-N 3.29Å; R622-R624 PolarHBondContact O-N 3.27Å
623L85.2Confident86.1Confident4.33333 Ų4.3333355.2 Ų55.22%0.02326%0.264CS..G310 helixtrans-84.8-4.4179.9-61174.6000112.7V593 N594 L597 I616 I620 P621 K625 E626 I627V593-L623 HydrophobicContact CB-CD1 4.33Å; V593-L623 HydrophobicContact CG1-CD1 3.82Å; N594-L623 HydrophobicContact CB-CD2 4.21Å; L597-L623 HydrophobicContact CD1-CD1 4.43Å; L597-L623 HydrophobicContact CD1-CD2 4.32Å; I616-L623 HydrophobicContact CG2-CD1 4.27Å; I620-L623 HydrophobicContact CB-CD1 4.34Å; I620-L623 HydrophobicContact CD1-CD1 4.31Å; I620-L623 HydrophobicContact CG2-CB 4.37Å; I620-L623 HydrophobicContact CG2-CD1 3.83Å; I620-L623 HydrophobicContact CG2-CG 3.82Å; I620-L623 PolarHBondContact O-N 2.95Å; I620-L623 VanDerWaalsContact O-N 3.14Å; P621-L623 VanDerWaalsContact C-N 3.3Å; P621-L623 PolarHBondContact O-N 3.07Å; L623-K625 VanDerWaalsContact C-N 3.34Å; L623-K625 PolarHBondContact O-N 3.18Å; L623-E626 VanDerWaalsContact CD2-OE2 3.24Å; L623-E626 WeakPolarHBondContact CD2-OE2 3.39Å; L623-E626 PolarHBondContact O-N 3.15Å; L623-I627 HydrophobicContact CB-CD1 3.95Å; L623-I627 HydrophobicContact CB-CG1 4.46Å; L623-I627 WeakPolarHBondContact O-CB 3.44Å; L623-I627 VanDerWaalsContact O-CG1 3.29Å; L623-I627 WeakPolarHBondContact O-CG1 3.38Å; L623-I627 PolarHBondContact O-N 3.03Å
624R84.9Confident85.8Confident77.6667 Ų77.666756.6 Ų56.629%0.29327%0.272SS..Hα-helixtrans-56.6-44.1-173.7179.5177.7172.5-176.1-0.8112.6A617 P621 R622 I627 Q628 N784 D786A617-R624 HydrophobicContact CB-CB 4.44Å; A617-R624 HydrophobicContact CB-CG 4.37Å; P621-R624 VanDerWaalsContact O-CB 3.31Å; P621-R624 WeakPolarHBondContact O-CB 3.37Å; P621-R624 PolarHBondContact O-N 3.07Å; P621-R624 VanDerWaalsContact O-N 3.15Å; R622-R624 VanDerWaalsContact C-N 3.29Å; R622-R624 PolarHBondContact O-N 3.27Å; R624-I627 PolarHBondContact O-N 3.42Å; R624-Q628 HydrophobicContact CG-CG 4.38Å; R624-Q628 WeakPolarHBondContact O-CB 3.39Å; R624-Q628 WeakPolarHBondContact O-CG 3.36Å; R624-Q628 PolarHBondContact O-N 3.18Å; R624-Q628 PolarHBondContact O-OE1 3.33Å; R624-N784 PolarHBondContact NH2-ND2 3.14Å; R624-N784 PolarHBondContact NH2-OD1 2.97Å; R624-N784 VanDerWaalsContact NH2-OD1 3.15Å; R624-D786 IonicContact CZ-OD2 2.97Å; R624-D786 IonicContact NH1-OD2 3.14Å; R624-D786 IonicContact NH2-OD2 3.41Å; R624-D786 PolarHBondContact NH2-OD2 3.24Å
625K85.5Confident85.8Confident150 Ų15052.3 Ų52.365%0.65225%0.253SS*.Hα-helixtrans-65.6-48.6-179.7-98.4-174.3175.9-173.90111.9L623 I627 Q628 D629L623-K625 VanDerWaalsContact C-N 3.34Å; L623-K625 PolarHBondContact O-N 3.18Å; K625-I627 VanDerWaalsContact C-N 3.31Å; K625-I627 PolarHBondContact O-N 2.94Å; K625-Q628 WeakPolarHBondContact O-CA 3.23Å; K625-Q628 WeakPolarHBondContact O-CB 3.4Å; K625-Q628 PolarHBondContact O-N 2.98Å; K625-D629 WeakPolarHBondContact O-CB 3.47Å; K625-D629 PolarHBondContact O-N 2.95Å
626E85.9Confident85.7Confident81 Ų8152.5 Ų52.538%0.37926%0.256SS..Hα-helixtrans-58.9-42.4178-143.4171.9-167.900111.5N594 L597 L623 D629 C630N594-E626 PolarHBondContact ND2-OE1 3.1Å; N594-E626 VanDerWaalsContact ND2-OE1 3.08Å; N594-E626 PolarHBondContact ND2-OE2 3.42Å; L597-E626 HydrophobicContact CD1-CG 4.31Å; L623-E626 VanDerWaalsContact CD2-OE2 3.24Å; L623-E626 WeakPolarHBondContact CD2-OE2 3.39Å; L623-E626 PolarHBondContact O-N 3.15Å; E626-D629 PolarHBondContact O-N 2.99Å; E626-C630 VanDerWaalsContact O-CB 3.23Å; E626-C630 WeakPolarHBondContact O-CB 3.45Å; E626-C630 PolarHBondContact O-N 3.23Å; E626-C630 PolarHBondContact O-SG 2.95Å
627I86.1Confident85.5Confident1.33333 Ų1.3333357.1 Ų57.11%0.00728%0.28CS..Hα-helixtrans-65-43.1174.2-68166.9000111.5L597 F613 I616 L623 R624 K625 C630 L631 F783L597-I627 HydrophobicContact CD1-CG1 4.42Å; L597-I627 HydrophobicContact CD2-CG1 4.33Å; F613-I627 HydrophobicContact CB-CG2 3.79Å; F613-I627 HydrophobicContact CD1-CD1 4.5Å; F613-I627 HydrophobicContact CD1-CG1 4.45Å; F613-I627 HydrophobicContact CD1-CG2 4.29Å; F613-I627 HydrophobicContact CD2-CG2 3.91Å; F613-I627 HydrophobicContact CE2-CG2 4.4Å; F613-I627 HydrophobicContact CG-CG2 3.8Å; I616-I627 HydrophobicContact CB-CD1 4.15Å; I616-I627 HydrophobicContact CG2-CD1 3.59Å; L623-I627 HydrophobicContact CB-CD1 3.95Å; L623-I627 HydrophobicContact CB-CG1 4.46Å; L623-I627 WeakPolarHBondContact O-CB 3.44Å; L623-I627 VanDerWaalsContact O-CG1 3.29Å; L623-I627 WeakPolarHBondContact O-CG1 3.38Å; L623-I627 PolarHBondContact O-N 3.03Å; R624-I627 PolarHBondContact O-N 3.42Å; K625-I627 VanDerWaalsContact C-N 3.31Å; K625-I627 PolarHBondContact O-N 2.94Å; I627-C630 PolarHBondContact O-N 3.34Å; I627-L631 HydrophobicContact CG2-CD1 3.95Å; I627-L631 HydrophobicContact CG2-CG 4.41Å; I627-L631 VanDerWaalsContact O-CB 3.27Å; I627-L631 WeakPolarHBondContact O-CB 3.35Å; I627-L631 WeakPolarHBondContact O-CG 3.44Å; I627-L631 PolarHBondContact O-N 3.25Å; I627-F783 HydrophobicContact CG2-CZ 4.02Å
628Q87.6Confident85.4Confident5.33333 Ų5.3333357.8 Ų57.83%0.02528%0.282CS..Hα-helixtrans-61.6-49.6177.2-77.6166.8-37.200111.4R624 K625 C630 L631 L632 F783 N784 F785 H788R624-Q628 HydrophobicContact CG-CG 4.38Å; R624-Q628 WeakPolarHBondContact O-CB 3.39Å; R624-Q628 WeakPolarHBondContact O-CG 3.36Å; R624-Q628 PolarHBondContact O-N 3.18Å; R624-Q628 PolarHBondContact O-OE1 3.33Å; K625-Q628 WeakPolarHBondContact O-CA 3.23Å; K625-Q628 WeakPolarHBondContact O-CB 3.4Å; K625-Q628 PolarHBondContact O-N 2.98Å; Q628-C630 VanDerWaalsContact C-N 3.33Å; Q628-C630 PolarHBondContact O-N 2.99Å; Q628-L631 PolarHBondContact O-N 3.11Å; Q628-L632 WeakPolarHBondContact O-CB 3.33Å; Q628-L632 VanDerWaalsContact O-CG 3.29Å; Q628-L632 WeakPolarHBondContact O-CG 3.42Å; Q628-L632 PolarHBondContact O-N 3.05Å; Q628-F783 HydrophobicContact CG-CE1 3.85Å; Q628-N784 PolarHBondContact NE2-O 3.04Å; Q628-F785 HydrophobicContact CB-CD1 4.23Å; Q628-F785 HydrophobicContact CG-CD1 4.23Å; Q628-H788 WeakPolarHBondContact CB-NE2 3.35Å
629D86.7Confident85.1Confident71.3333 Ų71.333351.7 Ų51.738%0.38125%0.252SS..Hα-helixtrans-60.6-46.9178.4-74.5-41.6000111.4K625 E626 L631 L632 N633 H788K625-D629 WeakPolarHBondContact O-CB 3.47Å; K625-D629 PolarHBondContact O-N 2.95Å; E626-D629 PolarHBondContact O-N 2.99Å; D629-L631 VanDerWaalsContact C-N 3.32Å; D629-L631 PolarHBondContact O-N 2.96Å; D629-L632 PolarHBondContact O-N 3.11Å; D629-N633 WeakPolarHBondContact O-CB 3.44Å; D629-N633 VanDerWaalsContact O-CG 3.25Å; D629-N633 PolarHBondContact O-N 3.29Å; D629-N633 PolarHBondContact O-ND2 3.12Å; D629-H788 IonicContact OD1-CE1 3.31Å; D629-H788 PolarHBondContact OD1-CE1 3.09Å; D629-H788 IonicContact OD1-ND1 3.83Å; D629-H788 IonicContact OD1-NE2 2.83Å
630C84.7Confident84.8Confident29 Ų2954.3 Ų54.320%0.19627%0.266CS..Hα-helixtrans-63.8-42.8179.1-140.10000112.6V601 E626 I627 Q628 N633 N634V601-C630 HydrophobicContact CG1-CB 4.45Å; V601-C630 WeakPolarHBondContact CG1-SG 3.44Å; V601-C630 HydrophobicContact CG2-CB 4.15Å; V601-C630 WeakPolarHBondContact CG2-SG 3.44Å; E626-C630 VanDerWaalsContact O-CB 3.23Å; E626-C630 WeakPolarHBondContact O-CB 3.45Å; E626-C630 PolarHBondContact O-N 3.23Å; E626-C630 PolarHBondContact O-SG 2.95Å; I627-C630 PolarHBondContact O-N 3.34Å; Q628-C630 VanDerWaalsContact C-N 3.33Å; Q628-C630 PolarHBondContact O-N 2.99Å; C630-N633 PolarHBondContact O-N 3.1Å; C630-N634 PolarHBondContact O-N 3.28Å; C630-N634 VanDerWaalsContact O-N 3.08Å
631L86.7Confident84.1Confident1.33333 Ų1.3333360.1 Ų60.11%0.00730%0.297CS..Hα-helixtrans-68.6-40.4178.9-141.6166.6000111.2L605 I610 F613 I627 Q628 D629 N633 N634 I635 T779 F783 F785L605-L631 HydrophobicContact CD2-CD2 3.91Å; I610-L631 HydrophobicContact CG1-CD1 4.41Å; F613-L631 HydrophobicContact CB-CD1 4.33Å; F613-L631 HydrophobicContact CD2-CD1 4.02Å; F613-L631 HydrophobicContact CD2-CD2 3.72Å; F613-L631 HydrophobicContact CD2-CG 3.82Å; F613-L631 HydrophobicContact CE2-CD2 3.97Å; F613-L631 HydrophobicContact CE2-CG 4.17Å; I627-L631 HydrophobicContact CG2-CD1 3.95Å; I627-L631 HydrophobicContact CG2-CG 4.41Å; I627-L631 VanDerWaalsContact O-CB 3.27Å; I627-L631 WeakPolarHBondContact O-CB 3.35Å; I627-L631 WeakPolarHBondContact O-CG 3.44Å; I627-L631 PolarHBondContact O-N 3.25Å; Q628-L631 PolarHBondContact O-N 3.11Å; D629-L631 VanDerWaalsContact C-N 3.32Å; D629-L631 PolarHBondContact O-N 2.96Å; L631-N633 VanDerWaalsContact C-N 3.33Å; L631-N633 PolarHBondContact O-N 2.94Å; L631-N634 PolarHBondContact O-N 3Å; L631-I635 HydrophobicContact CD2-CD1 3.41Å; L631-I635 HydrophobicContact CD2-CG1 4.06Å; L631-I635 HydrophobicContact CG-CD1 4.4Å; L631-I635 WeakPolarHBondContact O-CB 3.42Å; L631-I635 WeakPolarHBondContact O-CD1 3.37Å; L631-I635 WeakPolarHBondContact O-CG1 3.35Å; L631-I635 PolarHBondContact O-N 2.98Å; L631-T779 HydrophobicContact CD1-CG2 4.02Å; L631-T779 HydrophobicContact CD2-CG2 4.11Å; L631-T779 HydrophobicContact CG-CG2 4.33Å; L631-F783 HydrophobicContact CD1-CD1 4.14Å; L631-F783 HydrophobicContact CD1-CD2 3.99Å; L631-F783 HydrophobicContact CD1-CE1 4.06Å; L631-F783 HydrophobicContact CD1-CE2 3.9Å; L631-F783 HydrophobicContact CD1-CG 4.11Å; L631-F783 HydrophobicContact CD1-CZ 3.95Å; L631-F785 HydrophobicContact CB-CE1 4.28Å; L631-F785 HydrophobicContact CB-CZ 4.37Å; L631-F785 HydrophobicContact CD1-CZ 4.41Å; L631-F785 HydrophobicContact CD2-CE1 3.83Å; L631-F785 VanDerWaalsContact CD2-CE1 3.43Å; L631-F785 HydrophobicContact CD2-CZ 3.63Å
632L86.7Confident83.3Confident12.6667 Ų12.666758.2 Ų58.27%0.06628%0.282CS..Hα-helixtrans-63.4-39.6174.1-75.1173.3000112.1Q628 D629 I635 S636 L780 F785 H788 L790 F793Q628-L632 WeakPolarHBondContact O-CB 3.33Å; Q628-L632 VanDerWaalsContact O-CG 3.29Å; Q628-L632 WeakPolarHBondContact O-CG 3.42Å; Q628-L632 PolarHBondContact O-N 3.05Å; D629-L632 PolarHBondContact O-N 3.11Å; L632-I635 PolarHBondContact O-N 3.33Å; L632-S636 VanDerWaalsContact O-CB 3.24Å; L632-S636 WeakPolarHBondContact O-CB 3.36Å; L632-S636 PolarHBondContact O-N 3.19Å; L632-S636 PolarHBondContact O-OG 3.17Å; L632-L780 HydrophobicContact CD2-CD1 3.87Å; L632-F785 HydrophobicContact CD1-CD1 3.89Å; L632-F785 HydrophobicContact CD1-CE1 4.41Å; L632-F785 HydrophobicContact CD2-CD1 3.72Å; L632-F785 HydrophobicContact CD2-CE1 3.7Å; L632-F785 HydrophobicContact CD2-CG 4.23Å; L632-F785 HydrophobicContact CD2-CZ 4.19Å; L632-F785 HydrophobicContact CG-CD1 3.63Å; L632-F785 HydrophobicContact CG-CE1 3.65Å; L632-F785 HydrophobicContact CG-CG 4.48Å; L632-F785 HydrophobicContact CG-CZ 4.48Å; L632-H788 HydrophobicContact CD1-CB 3.88Å; L632-L790 HydrophobicContact CD2-CD2 4.1Å; L632-F793 HydrophobicContact CD2-CE2 4.16Å; L632-F793 HydrophobicContact CD2-CZ 4.24Å
633N86.3Confident82Confident98.3333 Ų98.333349.4 Ų49.453%0.52625%0.252SS..Hα-helixtrans-62.7-45.9175.2-73.6-25000111.5D629 C630 L631 I635 S636 L637D629-N633 WeakPolarHBondContact O-CB 3.44Å; D629-N633 VanDerWaalsContact O-CG 3.25Å; D629-N633 PolarHBondContact O-N 3.29Å; D629-N633 PolarHBondContact O-ND2 3.12Å; C630-N633 PolarHBondContact O-N 3.1Å; L631-N633 VanDerWaalsContact C-N 3.33Å; L631-N633 PolarHBondContact O-N 2.94Å; N633-I635 PolarHBondContact O-N 3.32Å; N633-S636 PolarHBondContact O-N 3.2Å; N633-S636 PolarHBondContact O-OG 3.25Å; N633-L637 VanDerWaalsContact O-CG 3.29Å; N633-L637 WeakPolarHBondContact O-CG 3.37Å; N633-L637 PolarHBondContact O-N 2.83Å; N633-L637 VanDerWaalsContact O-N 3.09Å
634N83.8Confident79.9Confident33 Ų3352.3 Ų52.318%0.17628%0.284CS..Hα-helixtrans-64.4-41175.7-82.2-5.5000112.8V601 L605 C630 L631 S636 L637 V638V601-N634 WeakPolarHBondContact CG1-ND2 3.42Å; V601-N634 PolarHBondContact O-ND2 2.6Å; L605-N634 HydrophobicContact CD1-CB 4.32Å; L605-N634 HydrophobicContact CD2-CB 3.95Å; L605-N634 HydrophobicContact CG-CB 4.08Å; C630-N634 PolarHBondContact O-N 3.28Å; C630-N634 VanDerWaalsContact O-N 3.08Å; L631-N634 PolarHBondContact O-N 3Å; N634-S636 VanDerWaalsContact C-N 3.33Å; N634-L637 PolarHBondContact O-N 3.42Å; N634-V638 WeakPolarHBondContact O-CG2 3.26Å; N634-V638 PolarHBondContact O-N 3.14Å; N634-V638 VanDerWaalsContact O-N 3.1Å
635I85.1Confident77.6Confident0 Ų051.9 Ų51.90%030%0.303CS..Hα-helixtrans-62.7-44.2174.7-71.2170.1000110.3L605 L631 L632 N633 L637 V638 L639 A776 T779 L780 F785 F793L605-I635 HydrophobicContact CD1-CG1 4.06Å; L605-I635 HydrophobicContact CD2-CG1 4.46Å; L631-I635 HydrophobicContact CD2-CD1 3.41Å; L631-I635 HydrophobicContact CD2-CG1 4.06Å; L631-I635 HydrophobicContact CG-CD1 4.4Å; L631-I635 WeakPolarHBondContact O-CB 3.42Å; L631-I635 WeakPolarHBondContact O-CD1 3.37Å; L631-I635 WeakPolarHBondContact O-CG1 3.35Å; L631-I635 PolarHBondContact O-N 2.98Å; L632-I635 PolarHBondContact O-N 3.33Å; N633-I635 PolarHBondContact O-N 3.32Å; I635-L637 VanDerWaalsContact C-N 3.34Å; I635-L637 PolarHBondContact O-N 3.1Å; I635-V638 PolarHBondContact O-N 3.26Å; I635-L639 HydrophobicContact CG2-CD1 3.59Å; I635-L639 HydrophobicContact CG2-CG 4.02Å; I635-L639 WeakPolarHBondContact O-CB 3.45Å; I635-L639 VanDerWaalsContact O-CG 3.27Å; I635-L639 WeakPolarHBondContact O-CG 3.28Å; I635-L639 PolarHBondContact O-N 3.22Å; I635-A776 HydrophobicContact CG1-CB 4.42Å; I635-A776 HydrophobicContact CG2-CB 4.41Å; I635-T779 HydrophobicContact CD1-CG2 3.93Å; I635-T779 VanDerWaalsContact CD1-OG1 3.31Å; I635-T779 WeakPolarHBondContact CD1-OG1 3.29Å; I635-L780 HydrophobicContact CD1-CB 4.33Å; I635-L780 HydrophobicContact CD1-CD1 4.34Å; I635-L780 HydrophobicContact CG2-CB 4.47Å; I635-L780 HydrophobicContact CG2-CD1 4.45Å; I635-F785 HydrophobicContact CD1-CZ 4.19Å; I635-F793 HydrophobicContact CG2-CE1 4.22Å
636S83.8Confident74.9Confident26.3333 Ų26.333348.2 Ų48.218%0.18430%0.296CS..Hα-helixtrans-62-43.5179.7730000111.7L632 N633 N634 V638 L639 M640L632-S636 VanDerWaalsContact O-CB 3.24Å; L632-S636 WeakPolarHBondContact O-CB 3.36Å; L632-S636 PolarHBondContact O-N 3.19Å; L632-S636 PolarHBondContact O-OG 3.17Å; N633-S636 PolarHBondContact O-N 3.2Å; N633-S636 PolarHBondContact O-OG 3.25Å; N634-S636 VanDerWaalsContact C-N 3.33Å; S636-V638 PolarHBondContact O-N 3.13Å; S636-L639 PolarHBondContact O-N 3.13Å; S636-M640 WeakPolarHBondContact O-CB 3.19Å; S636-M640 WeakPolarHBondContact O-CG 3.34Å; S636-M640 PolarHBondContact O-N 3.37Å
637L84.1Confident72.4Confident97 Ų9750.8 Ų50.851%0.50831%0.307SS..Hα-helixtrans-60.3-45.8175.5-71.9169.3000111.8N633 N634 I635 N641N633-L637 VanDerWaalsContact O-CG 3.29Å; N633-L637 WeakPolarHBondContact O-CG 3.37Å; N633-L637 PolarHBondContact O-N 2.83Å; N633-L637 VanDerWaalsContact O-N 3.09Å; N634-L637 PolarHBondContact O-N 3.42Å; I635-L637 VanDerWaalsContact C-N 3.34Å; I635-L637 PolarHBondContact O-N 3.1Å; L637-N641 VanDerWaalsContact O-CB 3.29Å; L637-N641 WeakPolarHBondContact O-CB 3.3Å; L637-N641 PolarHBondContact O-N 3.03Å; L637-N641 PolarHBondContact O-ND2 3.17Å
638V82.9Confident69.7Low28.6667 Ų28.666755.7 Ų55.717%0.17434%0.341CS..Hα-helixtrans-65-45.5178.5167.50000112L605 N634 I635 S636 N642 V772 V773 A776L605-V638 HydrophobicContact CD1-CB 4.43Å; L605-V638 HydrophobicContact CD1-CG2 3.95Å; N634-V638 WeakPolarHBondContact O-CG2 3.26Å; N634-V638 PolarHBondContact O-N 3.14Å; N634-V638 VanDerWaalsContact O-N 3.1Å; I635-V638 PolarHBondContact O-N 3.26Å; S636-V638 PolarHBondContact O-N 3.13Å; V638-N642 PolarHBondContact O-N 3.1Å; V638-N642 PolarHBondContact O-ND2 2.74Å; V638-V772 HydrophobicContact CG1-CG1 3.91Å; V638-V772 HydrophobicContact CG2-CG1 4.02Å; V638-V773 HydrophobicContact CG1-CG2 4.18Å; V638-A776 HydrophobicContact CB-CB 4.36Å; V638-A776 HydrophobicContact CG1-CB 3.85Å
639L81.4Confident66.9Low2 Ų262.2 Ų62.21%0.0137%0.371CS..Hα-helixtrans-72-36.5-178.4-64.3-178.7000112.1I635 S636 N642 S643 V773 A776 L777 F793 H796 I797 F801I635-L639 HydrophobicContact CG2-CD1 3.59Å; I635-L639 HydrophobicContact CG2-CG 4.02Å; I635-L639 WeakPolarHBondContact O-CB 3.45Å; I635-L639 VanDerWaalsContact O-CG 3.27Å; I635-L639 WeakPolarHBondContact O-CG 3.28Å; I635-L639 PolarHBondContact O-N 3.22Å; S636-L639 PolarHBondContact O-N 3.13Å; L639-N642 PolarHBondContact O-N 3.13Å; L639-S643 VanDerWaalsContact O-CB 3.31Å; L639-S643 WeakPolarHBondContact O-CB 3.17Å; L639-S643 PolarHBondContact O-N 3.24Å; L639-S643 PolarHBondContact O-OG 2.85Å; L639-V773 HydrophobicContact CD2-CG1 4.3Å; L639-A776 HydrophobicContact CD2-CB 4.26Å; L639-L777 HydrophobicContact CD1-CD2 4.38Å; L639-L777 HydrophobicContact CD2-CD2 3.92Å; L639-L777 HydrophobicContact CD2-CG 4.16Å; L639-F793 HydrophobicContact CD1-CD1 4.32Å; L639-H796 PolarHBondContact O-CE1 3.31Å; L639-I797 HydrophobicContact CD1-CD1 4.43Å; L639-I797 HydrophobicContact CD1-CG1 4.35Å; L639-F801 HydrophobicContact CB-CE2 4.24Å; L639-F801 HydrophobicContact CB-CZ 4.44Å; L639-F801 HydrophobicContact CD2-CD2 4.34Å; L639-F801 HydrophobicContact CD2-CE2 3.73Å; L639-F801 HydrophobicContact CD2-CZ 4.05Å; L639-F801 HydrophobicContact CG-CE2 4.4Å
640M77.1Confident64Low113.667 Ų113.66765 Ų6556%0.5639%0.385SS*.Hα-helixtrans-70.7-42.1178.3-73.5177.293.500112.3S636 N642 S643S636-M640 WeakPolarHBondContact O-CB 3.19Å; S636-M640 WeakPolarHBondContact O-CG 3.34Å; S636-M640 PolarHBondContact O-N 3.37Å; M640-N642 PolarHBondContact O-N 3.39Å; M640-S643 WeakPolarHBondContact CA-OG 3.41Å; M640-S643 PolarHBondContact O-N 3.16Å; M640-S643 PolarHBondContact O-OG 3.15Å; M640-S643 VanDerWaalsContact O-OG 3.07Å
641N72.4Confident61.3Low124 Ų12471.8 Ų71.866%0.66341%0.414SS*.Hα-helixtrans-63.5-31.1178.6-72.2-10000112.3L637L637-N641 VanDerWaalsContact O-CB 3.29Å; L637-N641 WeakPolarHBondContact O-CB 3.3Å; L637-N641 PolarHBondContact O-N 3.03Å; L637-N641 PolarHBondContact O-ND2 3.17Å
642N66.9Low58.5Low54.3333 Ų54.333375.6 Ų75.629%0.29144%0.441SS..THydrogen-bonded Turntrans-1005.2-175.5-65.51.7000113.7V638 L639 M640 F647 V773V638-N642 PolarHBondContact O-N 3.1Å; V638-N642 PolarHBondContact O-ND2 2.74Å; L639-N642 PolarHBondContact O-N 3.13Å; M640-N642 PolarHBondContact O-N 3.39Å; N642-F647 HydrophobicContact CB-CZ 4.43Å; N642-V773 HydrophobicContact CB-CG2 3.92Å; N642-V773 WeakPolarHBondContact ND2-CG2 3.43Å
643S57.6Low55.6Low25.6667 Ų25.666783.5 Ų83.518%0.17948%0.477CS..THydrogen-bonded Turntrans-94.427.1172.620.40000112.6L639 M640 G645 H796 N800L639-S643 VanDerWaalsContact O-CB 3.31Å; L639-S643 WeakPolarHBondContact O-CB 3.17Å; L639-S643 PolarHBondContact O-N 3.24Å; L639-S643 PolarHBondContact O-OG 2.85Å; M640-S643 WeakPolarHBondContact CA-OG 3.41Å; M640-S643 PolarHBondContact O-N 3.16Å; M640-S643 PolarHBondContact O-OG 3.15Å; M640-S643 VanDerWaalsContact O-OG 3.07Å; S643-G645 PolarHBondContact O-N 3.39Å; S643-H796 VanDerWaalsContact CB-NE2 3.27Å; S643-H796 WeakPolarHBondContact CB-NE2 3.45Å; S643-H796 PolarHBondContact OG-CE1 2.87Å; S643-H796 PolarHBondContact OG-NE2 3.29Å; S643-N800 VanDerWaalsContact CB-ND2 3.35Å; S643-N800 WeakPolarHBondContact CB-ND2 3.37Å; S643-N800 PolarHBondContact O-OD1 3.14Å; S643-N800 PolarHBondContact OG-ND2 3.32Å; S643-N800 VanDerWaalsContact OG-ND2 3.13Å
644G40.7Very low52.8Low65.6667 Ų65.666786.1 Ų86.168%0.67749%0.489SS*.SBendtrans-77.798.8171.200000112.3S646G644-S646 PolarHBondContact O-N 3.33Å
645G36.6Very low50Low68.6667 Ų68.666789.3 Ų89.371%0.70851%0.51SS*.SBendtrans-89.478.6-174.400000115.1S643 F647S643-G645 PolarHBondContact O-N 3.39Å; G645-F647 PolarHBondContact O-N 3.03Å
646S30Very low47.1Very low72.6667 Ų72.666796.1 Ų96.151%0.50855%0.547SS..  trans-97.758.9178.2-175.50000113.2G644 S648 H649G644-S646 PolarHBondContact O-N 3.33Å; S646-S648 PolarHBondContact O-N 3.02Å; S646-H649 PolarHBondContact O-N 3.46Å; S646-H649 WeakPolarHBondContact OG-CB 3.44Å; S646-H649 PolarHBondContact OG-N 3.24Å
647F33.4Very low44.4Very low136 Ų136100.8 Ų100.860%0.59657%0.574SS**THydrogen-bonded Turntrans-84.911.4164.5-88.5-78.5000112N642 G645 H649 L650 V770N642-F647 HydrophobicContact CB-CZ 4.43Å; G645-F647 PolarHBondContact O-N 3.03Å; F647-H649 PolarHBondContact O-N 3.06Å; F647-H649 VanDerWaalsContact O-N 3.07Å; F647-L650 HydrophobicContact CD1-CD1 4.45Å; F647-V770 HydrophobicContact CE1-CG2 4.28Å
648S29.2Very low41.6Very low104.333 Ų104.333102 Ų10273%0.7359%0.586SS**THydrogen-bonded Turntrans-92-4.117949.20000115.3S646S646-S648 PolarHBondContact O-N 3.02Å
649H28.3Very low38.9Very low142 Ų142106.2 Ų106.266%0.65762%0.617SS**THydrogen-bonded Turntrans-119.36-170.5-133.6-69.3000117.2S646 F647 H651S646-H649 PolarHBondContact O-N 3.46Å; S646-H649 WeakPolarHBondContact OG-CB 3.44Å; S646-H649 PolarHBondContact OG-N 3.24Å; F647-H649 PolarHBondContact O-N 3.06Å; F647-H649 VanDerWaalsContact O-N 3.07Å; H649-H651 VanDerWaalsContact C-N 3.33Å; H649-H651 PolarHBondContact O-N 3.09Å
650L27.2Very low36.3Very low129.333 Ų129.333109.7 Ų109.768%0.67765%0.653SS**SBendtrans-88.613.6176.8-82166000114.4F647 S652F647-L650 HydrophobicContact CD1-CD1 4.45Å; L650-S652 VanDerWaalsContact C-N 3.29Å; L650-S652 PolarHBondContact O-N 2.93Å
651H27.5Very low33.7Very low171.333 Ų171.333112.1 Ų112.179%0.79367%0.668SS**THydrogen-bonded Turntrans-85.316.6171.3-122.373.4000112.3H649 H653 T655H649-H651 VanDerWaalsContact C-N 3.33Å; H649-H651 PolarHBondContact O-N 3.09Å; H651-H653 VanDerWaalsContact C-N 3.28Å; H651-H653 PolarHBondContact O-N 2.92Å; H651-T655 PolarHBondContact NE2-OG1 3.08Å; H651-T655 PolarHBondContact O-OG1 3.22Å
652S26.8Very low31.4Very low82 Ų82111.4 Ų111.457%0.57367%0.673SS**  trans-123.355.9-176.2740000116.1L650L650-S652 VanDerWaalsContact C-N 3.29Å; L650-S652 PolarHBondContact O-N 2.93Å
653H26.5Very low29.4Very low178.333 Ų178.333115.1 Ų115.183%0.82670%0.698SS**  trans-125.649.1161.3-106.2-63.7000112.9H651H651-H653 VanDerWaalsContact C-N 3.28Å; H651-H653 PolarHBondContact O-N 2.92Å
654I27.1Very low27.8Very low152.333 Ų152.333120.1 Ų120.178%0.78173%0.727SS**  trans-101.3108.5156.3-50.8177.2000107.8
655T26.1Very low27.1Very low100 Ų100121.7 Ų121.761%0.61373%0.728SS**  trans-158.4128.8133.539.40000111.4H651H651-T655 PolarHBondContact NE2-OG1 3.08Å; H651-T655 PolarHBondContact O-OG1 3.22Å
656N24.5Very low26.5Very low144.667 Ų144.667124.7 Ų124.777%0.77473%0.732SS**  trans150.4110.8154.2-79.7-11.6000111.9
657T25.2Very low26.3Very low124.333 Ų124.333128.9 Ų128.976%0.76375%0.749SS**  cis-142.7148.314.231.60000109.2
658T27.1Very low25.9Very low121.667 Ų121.667126.2 Ų126.275%0.74675%0.747SS**  trans99.291.1163.438.20000116.7
659S25.4Very low25.6Very low117.667 Ų117.667130.2 Ų130.282%0.82375%0.751SS**  40.9119.5125.5600000120.7
660G25.8Very low25.6Very low76 Ų76131.7 Ų131.778%0.78476%0.756SS**  trans160100.115800000114.1
661D23.2Very low25.6Very low162.667 Ų162.667130.2 Ų130.287%0.8775%0.754SS**  trans-32.8156.2171.1-62.2-46.1000118
662S24.9Very low25.6Very low110.333 Ų110.333129 Ų12977%0.77275%0.753SS**  trans115.3103.615560.80000115.9
663T25Very low25.6Very low132 Ų132133.1 Ų133.181%0.8177%0.768SS**  33.2124.3124.155.50000116.4
664V24.3Very low25.6Very low129.333 Ų129.333131.4 Ų131.478%0.78476%0.764SS**  trans105.9112.9150.4169.70000116.1
665S25.3Very low25.6Very low101 Ų101131.3 Ų131.371%0.70677%0.765SS**  154.8100.2115.4-63.40000113.1L667S665-L667 PolarHBondContact O-N 3.3Å
666T24.5Very low25.6Very low129.667 Ų129.667134.2 Ų134.280%0.79678%0.776SS**  -19.1129.7122.444.10000113.7
667L24.3Very low25.7Very low161.667 Ų161.667134 Ų13485%0.84678%0.78SS**  trans163.8104.3161.1-73171.9000111S665S665-L667 PolarHBondContact O-N 3.3Å
668S25Very low25.6Very low80 Ų80132 Ų13256%0.55978%0.783SS**  130.6119.989.556.90000111.1
669F24.6Very low25.5Very low187.333 Ų187.333129.9 Ų129.982%0.82279%0.786SS**  trans-115.8121.8159.9-71.9-81000108.9P671F669-P671 WeakPolarHBondContact O-CD 3.46Å
670F26.8Very low25.4Very low174.667 Ų174.667130.6 Ų130.677%0.76679%0.786SS**  trans-135.2120.5-148.5-75.9-68.6000113.4
671P28.5Very low25.4Very low97.3333 Ų97.3333133.9 Ų133.963%0.63278%0.784SS**  trans-92.9159173.737.4-30.4000113.1F669F669-P671 WeakPolarHBondContact O-CD 3.46Å
672N27.5Very low25.4Very low145.333 Ų145.333134.3 Ų134.378%0.77778%0.78SS**  trans82.496.4162.7-55.9-19.8000118.9
673L25.6Very low25.4Very low169.667 Ų169.667134.1 Ų134.189%0.88878%0.778SS**SBend-134.555.2113.2-157.8114.3000113.4
674I27.6Very low25.4Very low141 Ų141131.2 Ų131.272%0.72378%0.775SS**  trans-119.792.1167.9-63.8176.7000109.2L676I674-L676 VanDerWaalsContact C-N 3.31Å; I674-L676 PolarHBondContact O-N 2.7Å
675N27.2Very low25.5Very low151.667 Ų151.667130.3 Ų130.381%0.81177%0.774SS**  trans163.288.7170-77-22.3000113.3
676L26Very low25.5Very low159.333 Ų159.333131.4 Ų131.483%0.83478%0.782SS**  trans-147.395.6138-15958.2000112.5I674I674-L676 VanDerWaalsContact C-N 3.31Å; I674-L676 PolarHBondContact O-N 2.7Å
677V25.4Very low25.7Very low141.667 Ų141.667128.4 Ų128.486%0.85978%0.777SS**SBendtrans74.4108.2163.2-175.40000114.6
678G23.5Very low25.8Very low82 Ų82126.4 Ų126.485%0.84577%0.771SS**  trans127.3109.813800000113.5
679G24Very low25.9Very low76.6667 Ų76.6667129.5 Ų129.579%0.7978%0.782SS**  trans-165.8104.4-169.200000111.9
680T25Very low26Very low134 Ų134126.8 Ų126.882%0.82278%0.78SS**  trans-119.9122.3144.532.60000110.8
681I24.2Very low26.3Very low145.333 Ų145.333124 Ų12475%0.74578%0.779SS**  trans-166.9117.1130.7-71169.1000110.8
682H24.8Very low26.2Very low170 Ų170125.6 Ų125.679%0.78779%0.788SS**  trans73.5140.4148.9-72-84.2000119.5
683S24.6Very low26.1Very low106.333 Ų106.333126.2 Ų126.274%0.74479%0.79SS**  cis145.8127.6-16.6420000112.3
684G25.1Very low26.1Very low71.6667 Ų71.6667123 Ų12374%0.73978%0.782SS**  trans94.2128.814900000116.4
685S26.1Very low26Very low109.333 Ų109.333120.9 Ų120.977%0.76578%0.78SS**  113.5120.878.369.70000114.3
686S26Very low26Very low125.667 Ų125.667120.9 Ų120.988%0.87978%0.78SS**  79.2122.6118.3-63.90000117.2
687G27.2Very low26Very low65.6667 Ų65.6667119.7 Ų119.768%0.67777%0.774SS**  trans149.569.1156.700000116.4
688T27.4Very low26Very low119.667 Ų119.667118.1 Ų118.173%0.73477%0.765SS**  51.1117.3128.557.50000118.8
689N25.9Very low26Very low146 Ų146124.3 Ų124.378%0.78176%0.764SS**  83.2135.1109.3-65.5-14.4000116.8
690V28Very low25.9Very low130 Ų130125.5 Ų125.579%0.78876%0.76SS**  159.8143.199.7-1730000113.1
691P33.5Very low25.9Very low114.667 Ų114.667124.6 Ų124.675%0.74576%0.76SS**  trans-112.1152.2-156.438.4-29.7000114
692T25.2Very low25.8Very low131.667 Ų131.667121.7 Ų121.781%0.80876%0.757SS**  trans-141.9143.6162.6320000112.8
693L26.3Very low25.7Very low158.667 Ų158.667121 Ų12183%0.83176%0.759SS**  trans166.1130.3146.1-110.598.8000113.4
694S25.1Very low25.7Very low101.333 Ų101.333119.8 Ų119.871%0.70976%0.755SS**  105.7144.9116.71520000114.9
695S25.8Very low25.6Very low98 Ų98123 Ų12369%0.68576%0.76SS**  trans148.3124.2171.660.20000114.2
696N26Very low25.5Very low150.667 Ų150.667121 Ų12181%0.80676%0.757SS**  trans-123.2116.9143.9-83.4-5.6000113.8
697N26Very low25.4Very low135.333 Ų135.333119.3 Ų119.372%0.72475%0.751SS**  -144.5141.3117.5-98.3-14.6000109.7
698T25.9Very low25.3Very low107.667 Ų107.667123.4 Ų123.466%0.66176%0.757SS**  trans109.9112.6136.752.10000117.1
699Y23.2Very low25.1Very low211.667 Ų211.667123.5 Ų123.583%0.8376%0.757SS**  trans92133.3146.5-54.3-70.3000116.1
700S23.5Very low25.1Very low101.333 Ų101.333122.9 Ų122.971%0.70976%0.759SS**  cis102.6117.138.7-70.80000114.9
701S23.8Very low24.9Very low115.667 Ų115.667123.6 Ų123.681%0.80976%0.758SS**  trans94.3141.5134.961.10000117.2L703S701-L703 PolarHBondContact O-N 3.46Å
702A23.3Very low24.5Very low84.3333 Ų84.3333123.3 Ų123.370%0.69776%0.759SS**  -160.9140.7127.300000115.1
703L21.7Very low24.5Very low156 Ų156122.3 Ų122.382%0.81776%0.757SS**  trans90.4106.3150.4-76.5148.7000116.4S701 V705 W836S701-L703 PolarHBondContact O-N 3.46Å; L703-V705 PolarHBondContact O-N 3.23Å; L703-W836 VanDerWaalsContact C-CH2 3.47Å; L703-W836 WeakPolarHBondContact O-CH2 3.3Å
704A24.1Very low24.3Very low80 Ų80121.6 Ų121.666%0.66176%0.76SS**  46.5138.1109.200000116.5
705V23.2Very low24.2Very low140 Ų140121.8 Ų121.885%0.84876%0.761SS**  trans101124172.1-170.90000112.2L703 A707L703-V705 PolarHBondContact O-N 3.23Å; V705-A707 PolarHBondContact O-N 3.18Å
706G24Very low24.1Very low67.3333 Ų67.3333121.3 Ų121.369%0.69476%0.763SS**  cis-169.4154.7-14.800000112.6
707A24.1Very low23.9Very low90.6667 Ų90.6667122.3 Ų122.375%0.74976%0.76SS**  trans91.4125.3168.800000116V705 T709V705-A707 PolarHBondContact O-N 3.18Å; A707-T709 PolarHBondContact O-N 3.27Å; A707-T709 VanDerWaalsContact O-N 3.16Å
708N24.5Very low23.8Very low151 Ų151121 Ų12181%0.80776%0.759SS**  trans-36.1132.3131.5-77.9-12.9000114.1V710N708-V710 PolarHBondContact O-N 2.99Å
709T23.7Very low23.6Very low122 Ų122123 Ų12375%0.74876%0.759SS**  trans176.4133.6148.8440000111.2A707 N711A707-T709 PolarHBondContact O-N 3.27Å; A707-T709 VanDerWaalsContact O-N 3.16Å; T709-N711 PolarHBondContact O-N 3.03Å
710V25.8Very low23.7Very low133.333 Ų133.333117 Ų11781%0.80875%0.747SS**  -141.3142.1120.7-168.10000109.5N708 S712N708-V710 PolarHBondContact O-N 2.99Å; V710-S712 PolarHBondContact O-N 3.12Å; V710-S712 VanDerWaalsContact O-N 3.1Å
711N24.4Very low23.6Very low145 Ų145116.4 Ų116.478%0.77574%0.743SS**  trans-70.4111.2176.1-62.8-25.5000116T709 S713T709-N711 PolarHBondContact O-N 3.03Å; N711-S713 PolarHBondContact O-N 3.3Å
712S24Very low23.7Very low108.667 Ų108.667114.1 Ų114.176%0.7673%0.732SS**  trans-72.8108.4141.351.20000113.5V710 T714V710-S712 PolarHBondContact O-N 3.12Å; V710-S712 VanDerWaalsContact O-N 3.1Å; S712-T714 PolarHBondContact O-N 2.93Å; S712-T714 VanDerWaalsContact O-N 3.07Å
713S25.2Very low23.7Very low110.667 Ų110.667114.7 Ų114.777%0.77473%0.727SS**  -157.382.512952.30000113.4N711 S715N711-S713 PolarHBondContact O-N 3.3Å; S713-S715 PolarHBondContact O-N 3.04Å; S713-S715 VanDerWaalsContact O-N 3.09Å
714T23.7Very low23.8Very low143.667 Ų143.667116.2 Ų116.288%0.88172%0.722SS**  trans-105.5110.7156.330.40000111.5S712 A716S712-T714 PolarHBondContact O-N 2.93Å; S712-T714 VanDerWaalsContact O-N 3.07Å; T714-A716 PolarHBondContact O-N 3.46Å
715S23.1Very low23.7Very low105 Ų105118.1 Ų118.173%0.73472%0.715SS**  trans-89132.7176.3500000113S713 F717S713-S715 PolarHBondContact O-N 3.04Å; S713-S715 VanDerWaalsContact O-N 3.09Å; S715-F717 PolarHBondContact O-N 3.14Å
716A22.6Very low23.7Very low88.3333 Ų88.3333117 Ų11773%0.7371%0.708SS**  163.8134.590.900000111T714T714-A716 PolarHBondContact O-N 3.46Å
717F22.7Very low23.6Very low171.667 Ų171.667122.3 Ų122.375%0.75371%0.713SS**  trans-87.7139.4171.7-67.7-83.3000112.1S715S715-F717 PolarHBondContact O-N 3.14Å
718P23.3Very low23.6Very low106.667 Ų106.667120.9 Ų120.969%0.69371%0.707SS**  trans-109.9104.9162.425.2-13.2000113.4K614 S720K614-P718 PolarHBondContact NZ-O 3.44Å; P718-S720 PolarHBondContact O-N 3.33Å
719F22.3Very low23.8Very low151 Ų151119.2 Ų119.266%0.66270%0.704SS**  trans-57.9121.4150.8-96.8-97.6000112.6Q425 S427 K614 S721Q425-F719 WeakPolarHBondContact O-CE1 3.42Å; Q425-F719 WeakPolarHBondContact O-CZ 3.46Å; S427-F719 WeakPolarHBondContact OG-CA 3.45Å; S427-F719 WeakPolarHBondContact OG-CB 3.48Å; S427-F719 WeakPolarHBondContact OG-CD1 3.4Å; K614-F719 PolarHBondContact NZ-O 3.24Å; F719-S721 PolarHBondContact O-N 3.11Å
720S23.5Very low23.9Very low83.6667 Ų83.6667118.7 Ų118.759%0.58571%0.706SS**  trans-108.8109.9173.7-93.70000113.3S427 N428 K614 P718 A722S427-S720 CarbonylContact O-C 3Å; S427-S720 VanDerWaalsContact O-CA 3.3Å; S427-S720 WeakPolarHBondContact O-CA 3.42Å; S427-S720 PolarHBondContact O-N 3.03Å; S427-S720 WeakPolarHBondContact OG-CA 3.49Å; S427-S720 PolarHBondContact OG-N 3.4Å; N428-S720 WeakPolarHBondContact CA-O 3.5Å; N428-S720 PolarHBondContact OD1-O 2.98Å; K614-S720 PolarHBondContact NZ-OG 3.36Å; P718-S720 PolarHBondContact O-N 3.33Å; S720-A722 PolarHBondContact O-N 3.42Å; S720-A722 VanDerWaalsContact O-N 3.16Å
721S23.3Very low23.9Very low89.3333 Ų89.3333118 Ų11863%0.62570%0.702SS**  trans-100.5134.1144.9-67.40000112.2S427 N428 F719 K778S427-S721 VanDerWaalsContact C-N 3.29Å; S427-S721 VanDerWaalsContact CA-OG 3.3Å; S427-S721 WeakPolarHBondContact CA-OG 3.45Å; S427-S721 WeakPolarHBondContact CB-OG 3.39Å; S427-S721 PolarHBondContact O-N 3Å; S427-S721 PolarHBondContact OG-N 3.41Å; N428-S721 PolarHBondContact N-OG 2.94Å; F719-S721 PolarHBondContact O-N 3.11Å; S721-K778 VanDerWaalsContact O-CE 3.25Å; S721-K778 WeakPolarHBondContact O-CE 3.24Å
722A24.8Very low23.9Very low68.3333 Ų68.3333120.7 Ų120.757%0.56571%0.707SS**  trans-112.6118172.300000111.4Y430 S720 K778Y430-A722 WeakPolarHBondContact CA-O 3.49Å; Y430-A722 WeakPolarHBondContact CB-O 3.34Å; Y430-A722 VanDerWaalsContact CD2-O 3.27Å; Y430-A722 WeakPolarHBondContact CD2-O 3.39Å; Y430-A722 PolarHBondContact N-O 3.06Å; S720-A722 PolarHBondContact O-N 3.42Å; S720-A722 VanDerWaalsContact O-N 3.16Å; A722-K778 VanDerWaalsContact CB-NZ 3.29Å
723T24.3Very low23.9Very low96.6667 Ų96.6667118.7 Ų118.759%0.59370%0.704SS**  trans-135127.7156.2-31.90000109.9Y430 F725 E815 K818Y430-T723 HydrophobicContact CD1-CG2 4.09Å; Y430-T723 HydrophobicContact CE1-CG2 3.86Å; Y430-T723 HydrophobicContact CE2-CG2 4.48Å; T723-F725 HydrophobicContact CG2-CD2 4.24Å; T723-F725 HydrophobicContact CG2-CE2 3.5Å; T723-F725 HydrophobicContact CG2-CZ 3.74Å; T723-E815 VanDerWaalsContact CB-OE2 3.27Å; T723-E815 WeakPolarHBondContact CB-OE2 3.5Å; T723-E815 PolarHBondContact OG1-OE2 3.49Å; T723-K818 PolarHBondContact OG1-NZ 2.96Å
724R22.1Very low24Very low188 Ų188122.2 Ų122.271%0.70971%0.707SS**  trans-115.4145.9170.3-165.2-177.1-83.6173.4-4.8109.2V754R724-V754 VanDerWaalsContact CZ-CG2 3.41Å
725F22.5Very low24Very low118.333 Ų118.333120.7 Ų120.752%0.51970%0.702SS.*  trans-88.8147.4-178.8-79.1-92.5000114.2T723 F727 F760 K810 E811 L814T723-F725 HydrophobicContact CG2-CD2 4.24Å; T723-F725 HydrophobicContact CG2-CE2 3.5Å; T723-F725 HydrophobicContact CG2-CZ 3.74Å; F725-F727 PolarHBondContact O-N 3.21Å; F725-F760 AromaticContact CD2-CE1 3.53Å; F725-F760 HydrophobicContact CD2-CE1 3.53Å; F725-F760 AromaticContact CD2-CZ 3.79Å; F725-F760 HydrophobicContact CD2-CZ 3.79Å; F725-F760 HydrophobicContact CE1-CE1 4.37Å; F725-F760 HydrophobicContact CE2-CD1 4.3Å; F725-F760 AromaticContact CE2-CE1 3.22Å; F725-F760 HydrophobicContact CE2-CE1 3.22Å; F725-F760 HydrophobicContact CE2-CE2 4.45Å; F725-F760 AromaticContact CE2-CZ 3.32Å; F725-F760 HydrophobicContact CE2-CZ 3.32Å; F725-F760 HydrophobicContact CG-CE1 4.23Å; F725-F760 HydrophobicContact CZ-CD1 4.39Å; F725-F760 AromaticContact CZ-CE1 3.69Å; F725-F760 HydrophobicContact CZ-CE1 3.69Å; F725-F760 HydrophobicContact CZ-CZ 4.09Å; F725-K810 HydrophobicContact CD1-CB 4.43Å; F725-K810 HydrophobicContact CD1-CG 4.04Å; F725-K810 HydrophobicContact CE1-CG 4.2Å; F725-K810 VanDerWaalsContact CE1-O 3.23Å; F725-K810 WeakPolarHBondContact CE1-O 3.36Å; F725-E811 HydrophobicContact CB-CB 4.31Å; F725-E811 HydrophobicContact CB-CG 3.73Å; F725-E811 VanDerWaalsContact CB-OE1 3.25Å; F725-E811 WeakPolarHBondContact CB-OE1 3.1Å; F725-E811 HydrophobicContact CD1-CB 3.54Å; F725-E811 HydrophobicContact CD1-CG 3.72Å; F725-E811 VanDerWaalsContact CD1-N 3.26Å; F725-E811 HydrophobicContact CD2-CB 3.5Å; F725-E811 HydrophobicContact CD2-CG 3.85Å; F725-E811 VanDerWaalsContact CD2-OE2 3.26Å; F725-E811 WeakPolarHBondContact CD2-OE2 3.36Å; F725-E811 HydrophobicContact CE1-CB 3.6Å; F725-E811 HydrophobicContact CE1-CG 4.3Å; F725-E811 WeakPolarHBondContact CE1-O 3.49Å; F725-E811 HydrophobicContact CE2-CB 3.6Å; F725-E811 HydrophobicContact CE2-CG 4.44Å; F725-E811 HydrophobicContact CG-CB 3.49Å; F725-E811 VanDerWaalsContact CG-CB 3.49Å; F725-E811 VanDerWaalsContact CG-CD 3.43Å; F725-E811 HydrophobicContact CG-CG 3.46Å; F725-E811 VanDerWaalsContact CG-CG 3.46Å; F725-E811 HydrophobicContact CZ-CB 3.65Å; F725-E811 WeakPolarHBondContact CZ-O 3.36Å; F725-L814 HydrophobicContact CD1-CD1 4.13Å; F725-L814 HydrophobicContact CE1-CB 3.57Å; F725-L814 HydrophobicContact CE1-CD1 3.45Å; F725-L814 VanDerWaalsContact CE1-CD1 3.45Å; F725-L814 HydrophobicContact CE1-CG 3.89Å; F725-L814 HydrophobicContact CZ-CB 3.56Å; F725-L814 HydrophobicContact CZ-CD1 4.02Å; F725-L814 HydrophobicContact CZ-CG 4.33Å
726V23.3Very low24.1Very low116.667 Ų116.667120.9 Ų120.971%0.70770%0.704SS**  trans-125.9129.8-158.8157.40000109.2G728 K810V726-G728 PolarHBondContact O-N 3.06Å; V726-K810 PolarHBondContact O-NZ 3.46Å; V726-K810 VanDerWaalsContact O-NZ 3.12Å
727F22.1Very low24.2Very low179 Ų179125.7 Ų125.779%0.78571%0.708SS**  trans-77.2131.6169.6-99.4-92.9000112.1F725 P729 V809 K810 E811F725-F727 PolarHBondContact O-N 3.21Å; F727-P729 WeakPolarHBondContact O-CD 3.45Å; F727-V809 HydrophobicContact CE2-CG1 3.86Å; F727-V809 HydrophobicContact CZ-CG1 4.28Å; F727-K810 HydrophobicContact CE2-CB 4.02Å; F727-K810 HydrophobicContact CZ-CB 4.13Å; F727-E811 HydrophobicContact CE2-CG 4.49Å
728G23.5Very low24.2Very low61 Ų61125.8 Ų125.863%0.62971%0.711SS**  trans-120130.2165.900000113V726 S730V726-G728 PolarHBondContact O-N 3.06Å; G728-S730 PolarHBondContact O-N 3.29Å; G728-S730 VanDerWaalsContact O-N 3.11Å
729P29.3Very low24.3Very low116.667 Ų116.667126.7 Ų126.776%0.75872%0.715SS**  trans-95.1149.6-177.335.8-32.3000112.8F727 T731F727-P729 WeakPolarHBondContact O-CD 3.45Å; P729-T731 PolarHBondContact O-N 3.39Å; P729-T731 VanDerWaalsContact O-N 3.1Å
730S25.2Very low24.3Very low112 Ų112124.8 Ų124.878%0.78372%0.721SS**  trans-82.4134.5166.6-170.20000112.4G728 K732G728-S730 PolarHBondContact O-N 3.29Å; G728-S730 VanDerWaalsContact O-N 3.11Å; S730-K732 PolarHBondContact O-N 3.36Å
731T25.9Very low24.3Very low116.667 Ų116.667126 Ų12672%0.71673%0.728SS**  trans-113.6137.9-167.237.50000113.3P729P729-T731 PolarHBondContact O-N 3.39Å; P729-T731 VanDerWaalsContact O-N 3.1Å
732K25.2Very low24.3Very low202 Ų202128.4 Ų128.488%0.87874%0.74SS**  trans158.3126.5141.5-78.4170.8-177.8177.70114.7S730S730-K732 PolarHBondContact O-N 3.36Å
733G23.8Very low24.3Very low67.6667 Ų67.6667128.8 Ų128.870%0.69875%0.751SS**  trans172.685.7159.300000118.7
734H27.5Very low24.2Very low184 Ų184132 Ų13285%0.85276%0.763SS**  trans86.2114.4143.7-78.7-69.8000119.2
735S23.9Very low24.2Very low111.333 Ų111.333130.5 Ų130.578%0.77977%0.769SS**  trans29130.8142.763.70000117.6
736S24.9Very low24.2Very low109.333 Ų109.333129.7 Ų129.777%0.76578%0.784SS**  -165.2149.359.558.10000112.6
737K24.5Very low24.2Very low189 Ų189130.4 Ų130.482%0.82279%0.789SS**  trans33.3129.4172-74.5176.6174.11770118T739K737-T739 PolarHBondContact O-N 2.93Å
738Q23.4Very low24.3Very low175.333 Ų175.333125.7 Ų125.782%0.81979%0.791SS**  -155.7130.1117.1-92.9173.6-1300110.4
739T24.1Very low24.4Very low125.667 Ų125.667128.9 Ų128.977%0.77180%0.799SS**  trans-165.6136.9132.257.10000113.4K737 S741K737-T739 PolarHBondContact O-N 2.93Å; T739-S741 PolarHBondContact O-N 3.28Å
740S22.7Very low24.2Very low111 Ų111131.4 Ų131.478%0.77680%0.8SS**  trans-59.3136.8-18046.10000113.9
741S24.8Very low24.2Very low107.333 Ų107.333132.9 Ų132.975%0.75179%0.793SS**  trans166.1115.2147.663.10000112.4T739 G743T739-S741 PolarHBondContact O-N 3.28Å; S741-G743 PolarHBondContact O-N 2.87Å
742T22.7Very low24.2Very low141.333 Ų141.333131.2 Ų131.287%0.86779%0.791SS**  trans7.1119.5133.853.80000114.7
743G24.6Very low24.1Very low76.6667 Ų76.6667129.7 Ų129.779%0.7979%0.786SS**  trans165.182.4145.700000112.2S741 N745S741-G743 PolarHBondContact O-N 2.87Å; G743-N745 PolarHBondContact O-N 3.45Å
744L21.8Very low24.3Very low162.333 Ų162.333130.8 Ų130.885%0.8578%0.779SS**  trans-87.9117171.3-75.5161.7000109.3
745N21.9Very low24.2Very low157.667 Ų157.667124.3 Ų124.384%0.84376%0.757SS**  trans152.2110.3131.2-86.2-11.5000112.1G743G743-N745 PolarHBondContact O-N 3.45Å
746A23.2Very low24.3Very low100 Ų100122.9 Ų122.983%0.82674%0.74SS**  trans-166100.4166.500000113.1
747T24.3Very low24.3Very low132.667 Ų132.667121.8 Ų121.881%0.81473%0.731SS**  trans-79.4105.516451.30000111.7T749T747-T749 VanDerWaalsContact C-N 3.29Å; T747-T749 PolarHBondContact O-N 3.12Å; T747-T749 VanDerWaalsContact O-N 3.11Å
748G24Very low24.4Very low79.3333 Ų79.3333115.4 Ų115.482%0.81872%0.718SS**  trans-90.879.7169.300000117
749T25.6Very low24.4Very low129.667 Ų129.667110.2 Ų110.280%0.79671%0.711SS**  trans-128.457.5174.351.40000112.9T747T747-T749 VanDerWaalsContact C-N 3.29Å; T747-T749 PolarHBondContact O-N 3.12Å; T747-T749 VanDerWaalsContact O-N 3.11Å
750E23.6Very low24.4Very low168.333 Ų168.333111.4 Ų111.479%0.78771%0.706SS**  trans-94.111.3171.5-68.2-173.9156.700113.9A752E750-A752 PolarHBondContact O-N 2.83Å
751F25.3Very low24.5Very low144 Ų144111.2 Ų111.263%0.63271%0.705SS**  trans-88.465.9179.2-74-85.7000114.4H753F751-H753 VanDerWaalsContact C-N 3.28Å; F751-H753 PolarHBondContact O-N 3.37Å
752A25.4Very low24.4Very low81.3333 Ų81.3333110.9 Ų110.967%0.67271%0.709SS**  trans-126.537-178.700000112.6E750 V754 A755E750-A752 PolarHBondContact O-N 2.83Å; A752-V754 VanDerWaalsContact C-N 3.33Å; A752-V754 PolarHBondContact O-N 3.26Å; A752-A755 VanDerWaalsContact O-CB 3.24Å; A752-A755 WeakPolarHBondContact O-CB 3.46Å; A752-A755 PolarHBondContact O-N 3.26Å; A752-A755 VanDerWaalsContact O-N 3.11Å
753H24.7Very low24.5Very low170.667 Ų170.667109.4 Ų109.479%0.7970%0.704SS**  trans-83.157.6175.4-92-90.5000112.9Q408 F751 A755Q408-H753 PolarHBondContact NE2-O 2.94Å; F751-H753 VanDerWaalsContact C-N 3.28Å; F751-H753 PolarHBondContact O-N 3.37Å; H753-A755 PolarHBondContact O-N 3.38Å
754V27.2Very low24.6Very low89 Ų89108.5 Ų108.554%0.53970%0.695SS.*SBendtrans-93.993.5158.2174.40000108.4R724 A752 I756R724-V754 VanDerWaalsContact CZ-CG2 3.41Å; A752-V754 VanDerWaalsContact C-N 3.33Å; A752-V754 PolarHBondContact O-N 3.26Å; V754-I756 PolarHBondContact O-N 3.18Å; V754-I756 VanDerWaalsContact O-N 3.11Å
755A25.5Very low24.8Very low48.3333 Ų48.3333109.5 Ų109.540%0.39970%0.695SS.*  trans-67111.7177.700000111.2Q408 A752 H753 A771Q408-A755 HydrophobicContact CG-CB 3.92Å; Q408-A755 VanDerWaalsContact NE2-CB 3.32Å; A752-A755 VanDerWaalsContact O-CB 3.24Å; A752-A755 WeakPolarHBondContact O-CB 3.46Å; A752-A755 PolarHBondContact O-N 3.26Å; A752-A755 VanDerWaalsContact O-N 3.11Å; H753-A755 PolarHBondContact O-N 3.38Å; A755-A771 HydrophobicContact CB-CB 3.46Å; A755-A771 VanDerWaalsContact CB-CB 3.46Å
756I27Very low25.2Very low81.6667 Ų81.6667107.2 Ų107.242%0.41968%0.682SS.*  trans-73.8123.3151.2-60.6169.2000107.5L356 F361 P568 P608 V754 G758 G759L356-I756 HydrophobicContact CD1-CD1 3.81Å; L356-I756 HydrophobicContact CD1-CG1 4.43Å; F361-I756 HydrophobicContact CD1-CD1 4.14Å; F361-I756 HydrophobicContact CD2-CD1 4.27Å; F361-I756 HydrophobicContact CE1-CD1 3.58Å; F361-I756 HydrophobicContact CE2-CD1 3.75Å; F361-I756 HydrophobicContact CG-CD1 4.46Å; F361-I756 HydrophobicContact CZ-CB 4.43Å; F361-I756 HydrophobicContact CZ-CD1 3.38Å; F361-I756 HydrophobicContact CZ-CG1 4.47Å; F361-I756 HydrophobicContact CZ-CG2 4.16Å; P568-I756 HydrophobicContact CB-CG2 3.96Å; P608-I756 HydrophobicContact CG-CD1 3.73Å; V754-I756 PolarHBondContact O-N 3.18Å; V754-I756 VanDerWaalsContact O-N 3.11Å; I756-G758 VanDerWaalsContact C-N 3.35Å; I756-G758 WeakPolarHBondContact O-CA 3.47Å; I756-G758 PolarHBondContact O-N 3.18Å; I756-G759 PolarHBondContact O-N 2.93Å
757P24.5Very low26.6Very low87.3333 Ų87.3333105.3 Ų105.357%0.56766%0.663SS**SBendtrans-62.4115.917726-32.4000109.1N606 V772N606-P757 VanDerWaalsContact OD1-CD 3.22Å; N606-P757 WeakPolarHBondContact OD1-CD 3.49Å; N606-P757 WeakPolarHBondContact OD1-CG 3.27Å; P757-V772 HydrophobicContact CB-CG2 4.45Å; P757-V772 HydrophobicContact CG-CG2 4.29Å
758G25.5Very low28.4Very low54 Ų54103.2 Ų103.256%0.55765%0.65SS**  trans152.2-0.7-167.400000113.5I756 F760I756-G758 VanDerWaalsContact C-N 3.35Å; I756-G758 WeakPolarHBondContact O-CA 3.47Å; I756-G758 PolarHBondContact O-N 3.18Å; G758-F760 PolarHBondContact O-N 2.78Å
759G24.1Very low30.7Very low65.6667 Ų65.6667103.5 Ų103.568%0.67763%0.633SS**  trans-95.194.9170.100000111.3I756 S761I756-G759 PolarHBondContact O-N 2.93Å; G759-S761 PolarHBondContact O-N 3.06Å
760F24.2Very low33.3Very low151 Ų15198.1 Ų98.166%0.66260%0.6SS**  trans-62.9114.4172.5-76.5-86.6000110.6K564 F725 G758 A762 L766K564-F760 HydrophobicContact CB-CE2 3.91Å; K564-F760 HydrophobicContact CB-CZ 3.93Å; K564-F760 HydrophobicContact CD-CE1 4.12Å; K564-F760 HydrophobicContact CD-CZ 4.15Å; K564-F760 HydrophobicContact CG-CE1 4.35Å; K564-F760 HydrophobicContact CG-CE2 4.35Å; K564-F760 HydrophobicContact CG-CZ 3.86Å; F725-F760 AromaticContact CD2-CE1 3.53Å; F725-F760 HydrophobicContact CD2-CE1 3.53Å; F725-F760 AromaticContact CD2-CZ 3.79Å; F725-F760 HydrophobicContact CD2-CZ 3.79Å; F725-F760 HydrophobicContact CE1-CE1 4.37Å; F725-F760 HydrophobicContact CE2-CD1 4.3Å; F725-F760 AromaticContact CE2-CE1 3.22Å; F725-F760 HydrophobicContact CE2-CE1 3.22Å; F725-F760 HydrophobicContact CE2-CE2 4.45Å; F725-F760 AromaticContact CE2-CZ 3.32Å; F725-F760 HydrophobicContact CE2-CZ 3.32Å; F725-F760 HydrophobicContact CG-CE1 4.23Å; F725-F760 HydrophobicContact CZ-CD1 4.39Å; F725-F760 AromaticContact CZ-CE1 3.69Å; F725-F760 HydrophobicContact CZ-CE1 3.69Å; F725-F760 HydrophobicContact CZ-CZ 4.09Å; G758-F760 PolarHBondContact O-N 2.78Å; F760-A762 PolarHBondContact O-N 2.74Å; F760-L766 HydrophobicContact CE1-CB 4.35Å; F760-L766 HydrophobicContact CE1-CD2 4.49Å
761S24.2Very low35.9Very low107.333 Ų107.33392.3 Ų92.375%0.75158%0.58SS**  trans-103.1116.6160.2-780000108.6G759 S763 G764G759-S761 PolarHBondContact O-N 3.06Å; S761-S763 PolarHBondContact O-N 3.11Å; S761-G764 PolarHBondContact O-N 3.02Å
762A23.9Very low38.6Very low99.6667 Ų99.666787.3 Ų87.382%0.82456%0.562SS**SBendtrans-106.474.3176.900000111.7F760F760-A762 PolarHBondContact O-N 2.74Å
763S23.8Very low41.5Very low110 Ų11083.5 Ų83.577%0.76953%0.53SS*.SBendtrans173.870.9173.930.60000113.4S761S761-S763 PolarHBondContact O-N 3.11Å
764G26.1Very low44.3Very low57.6667 Ų57.666776.1 Ų76.160%0.59550%0.498SS*.  trans136.682.8175.400000114.5S761 L766 S767S761-G764 PolarHBondContact O-N 3.02Å; G764-L766 VanDerWaalsContact C-N 3.29Å; G764-L766 PolarHBondContact O-N 3.22Å; G764-L766 VanDerWaalsContact O-N 3.13Å; G764-S767 WeakPolarHBondContact O-CB 3.29Å; G764-S767 PolarHBondContact O-N 3.03Å; G764-S767 PolarHBondContact O-OG 3.25Å
765E26.4Very low47Very low184.333 Ų184.33373.1 Ų73.186%0.86148%0.479SS*.  trans-62.463.9177-66.4176.2148.200110.9S767 T768E765-S767 VanDerWaalsContact C-N 3.28Å; E765-S767 PolarHBondContact O-N 2.91Å; E765-S767 VanDerWaalsContact O-N 3.14Å; E765-T768 PolarHBondContact O-OG1 3.44Å
766L31.5Very low49.9Very low108.333 Ų108.33370.8 Ų70.857%0.56746%0.46SS*.  trans-67.187.5170.6-128.678.7000109.5F760 G764 T768 V770 E811F760-L766 HydrophobicContact CE1-CB 4.35Å; F760-L766 HydrophobicContact CE1-CD2 4.49Å; G764-L766 VanDerWaalsContact C-N 3.29Å; G764-L766 PolarHBondContact O-N 3.22Å; G764-L766 VanDerWaalsContact O-N 3.13Å; L766-T768 PolarHBondContact O-N 3.15Å; L766-V770 HydrophobicContact CD2-CB 4.24Å; L766-V770 HydrophobicContact CD2-CG1 3.61Å; L766-V770 HydrophobicContact CG-CB 4.36Å; L766-V770 HydrophobicContact CG-CG1 4Å; L766-V770 WeakPolarHBondContact O-CG2 3.45Å; L766-E811 WeakPolarHBondContact CD2-OE2 3.34Å
767S50.9Low52.8Low60 Ų6066.9 Ų66.942%0.4244%0.44SS..  trans-62.5120.2-177.559.80000111.6G764 E765 D769 V770G764-S767 WeakPolarHBondContact O-CB 3.29Å; G764-S767 PolarHBondContact O-N 3.03Å; G764-S767 PolarHBondContact O-OG 3.25Å; E765-S767 VanDerWaalsContact C-N 3.28Å; E765-S767 PolarHBondContact O-N 2.91Å; E765-S767 VanDerWaalsContact O-N 3.14Å; S767-D769 PolarHBondContact O-N 3.32Å; S767-V770 PolarHBondContact O-N 3.12Å; S767-V770 WeakPolarHBondContact OG-CG2 3.26Å
768T63.8Low55.8Low90.3333 Ų90.333366 Ų6655%0.55443%0.427SS*.Hα-helixtrans-55.4-36.6179.844.30000112.4E765 L766 V770 A771 V772E765-T768 PolarHBondContact O-OG1 3.44Å; L766-T768 PolarHBondContact O-N 3.15Å; T768-V770 PolarHBondContact O-N 2.87Å; T768-A771 PolarHBondContact O-N 3.32Å; T768-V772 VanDerWaalsContact O-CG2 3.32Å; T768-V772 WeakPolarHBondContact O-CG2 3.41Å; T768-V772 PolarHBondContact O-N 3.26Å; T768-V772 VanDerWaalsContact O-N 3.12Å
769D72.3Confident58.7Low85 Ų8563.5 Ų63.546%0.45540%0.401SS..Hα-helixtrans-70.9-35.4-173.6-55.3-12000111.8S767 A771 V772 V773S767-D769 PolarHBondContact O-N 3.32Å; D769-A771 VanDerWaalsContact C-N 3.31Å; D769-A771 PolarHBondContact O-N 2.98Å; D769-V772 PolarHBondContact O-N 3.12Å; D769-V773 WeakPolarHBondContact O-CG2 3.31Å; D769-V773 PolarHBondContact O-N 3Å
770V78.9Confident61.7Low17 Ų1760.4 Ų60.410%0.10337%0.369CS..Hα-helixtrans-61.5-46174.7167.80000110.9F647 L766 S767 T768 V772 V773 A774 V809 E811 I812F647-V770 HydrophobicContact CE1-CG2 4.28Å; L766-V770 HydrophobicContact CD2-CB 4.24Å; L766-V770 HydrophobicContact CD2-CG1 3.61Å; L766-V770 HydrophobicContact CG-CB 4.36Å; L766-V770 HydrophobicContact CG-CG1 4Å; L766-V770 WeakPolarHBondContact O-CG2 3.45Å; S767-V770 PolarHBondContact O-N 3.12Å; S767-V770 WeakPolarHBondContact OG-CG2 3.26Å; T768-V770 PolarHBondContact O-N 2.87Å; V770-V772 VanDerWaalsContact C-N 3.3Å; V770-V772 PolarHBondContact O-N 3.27Å; V770-V773 PolarHBondContact O-N 3.26Å; V770-A774 WeakPolarHBondContact O-CB 3.44Å; V770-A774 PolarHBondContact O-N 3.1Å; V770-V809 HydrophobicContact CG1-CG1 3.77Å; V770-V809 HydrophobicContact CG2-CG1 4.42Å; V770-V809 HydrophobicContact CG2-CG2 4.27Å; V770-E811 HydrophobicContact CG1-CG 4.45Å; V770-I812 HydrophobicContact CB-CD1 4.47Å; V770-I812 HydrophobicContact CG1-CD1 4.14Å; V770-I812 HydrophobicContact CG1-CG1 4.31Å; V770-I812 HydrophobicContact CG2-CD1 4.36Å
771A78.3Confident64.5Low44.6667 Ų44.666753.7 Ų53.737%0.36934%0.343SS..Hα-helixtrans-66.6-35.9179.600000111.8A755 T768 D769 L775A755-A771 HydrophobicContact CB-CB 3.46Å; A755-A771 VanDerWaalsContact CB-CB 3.46Å; T768-A771 PolarHBondContact O-N 3.32Å; D769-A771 VanDerWaalsContact C-N 3.31Å; D769-A771 PolarHBondContact O-N 2.98Å; A771-L775 WeakPolarHBondContact O-CB 3.42Å; A771-L775 PolarHBondContact O-N 3.12Å
772V82.7Confident67.3Low40.6667 Ų40.666751.4 Ų51.425%0.24633%0.327CS..Hα-helixtrans-68.1-38.8175.1174.30000111.6V638 P757 T768 D769 V770 L775 A776V638-V772 HydrophobicContact CG1-CG1 3.91Å; V638-V772 HydrophobicContact CG2-CG1 4.02Å; P757-V772 HydrophobicContact CB-CG2 4.45Å; P757-V772 HydrophobicContact CG-CG2 4.29Å; T768-V772 VanDerWaalsContact O-CG2 3.32Å; T768-V772 WeakPolarHBondContact O-CG2 3.41Å; T768-V772 PolarHBondContact O-N 3.26Å; T768-V772 VanDerWaalsContact O-N 3.12Å; D769-V772 PolarHBondContact O-N 3.12Å; V770-V772 VanDerWaalsContact C-N 3.3Å; V770-V772 PolarHBondContact O-N 3.27Å; V772-L775 PolarHBondContact O-N 2.9Å; V772-A776 VanDerWaalsContact O-CB 3.29Å; V772-A776 WeakPolarHBondContact O-CB 3.23Å; V772-A776 PolarHBondContact O-N 3.33Å
773V85.1Confident70.1Confident1.66667 Ų1.6666747.6 Ų47.61%0.0129%0.291CS..Hα-helixtrans-66-48.3173.5174.20000111.6V638 L639 N642 D769 V770 L775 A776 L777 F801 I812V638-V773 HydrophobicContact CG1-CG2 4.18Å; L639-V773 HydrophobicContact CD2-CG1 4.3Å; N642-V773 HydrophobicContact CB-CG2 3.92Å; N642-V773 WeakPolarHBondContact ND2-CG2 3.43Å; D769-V773 WeakPolarHBondContact O-CG2 3.31Å; D769-V773 PolarHBondContact O-N 3Å; V770-V773 PolarHBondContact O-N 3.26Å; V773-L775 VanDerWaalsContact C-N 3.26Å; V773-L775 PolarHBondContact O-N 3.02Å; V773-A776 WeakPolarHBondContact O-CB 3.49Å; V773-A776 PolarHBondContact O-N 3.01Å; V773-A776 VanDerWaalsContact O-N 3.11Å; V773-L777 HydrophobicContact CG1-CD1 4.16Å; V773-L777 HydrophobicContact CG1-CG 4.41Å; V773-L777 WeakPolarHBondContact O-CG 3.43Å; V773-L777 PolarHBondContact O-N 3.11Å; V773-F801 HydrophobicContact CG1-CD1 4.49Å; V773-F801 HydrophobicContact CG1-CE1 4.2Å; V773-F801 HydrophobicContact CG1-CZ 4.42Å; V773-I812 HydrophobicContact CB-CD1 4.08Å; V773-I812 HydrophobicContact CB-CG1 4.38Å; V773-I812 HydrophobicContact CG1-CD1 3.9Å; V773-I812 HydrophobicContact CG1-CG1 4.11Å; V773-I812 HydrophobicContact CG1-CG2 4Å
774A84.7Confident72.8Confident14.3333 Ų14.333346.1 Ų46.112%0.11828%0.275CS..Hα-helixtrans-58.9-41177.300000111V770 L777 K778 E811V770-A774 WeakPolarHBondContact O-CB 3.44Å; V770-A774 PolarHBondContact O-N 3.1Å; A774-L777 PolarHBondContact O-N 3.03Å; A774-K778 VanDerWaalsContact O-CB 3.29Å; A774-K778 WeakPolarHBondContact O-CB 3.43Å; A774-K778 PolarHBondContact O-N 3.28Å; A774-E811 HydrophobicContact CB-CG 4.44Å
775L84.1Confident75.4Confident26 Ų2643.8 Ų43.814%0.13625%0.249CC..Hα-helixtrans-65.4-41.2174-175.662.5000112.4L605 Q607 I610 A771 V772 V773 L777 K778 T779L605-L775 VanDerWaalsContact O-CD2 3.3Å; L605-L775 WeakPolarHBondContact O-CD2 3.29Å; Q607-L775 HydrophobicContact CB-CD1 4.25Å; Q607-L775 HydrophobicContact CB-CD2 4.49Å; I610-L775 HydrophobicContact CD1-CD1 3.62Å; I610-L775 HydrophobicContact CD1-CD2 3.88Å; I610-L775 HydrophobicContact CD1-CG 3.68Å; A771-L775 WeakPolarHBondContact O-CB 3.42Å; A771-L775 PolarHBondContact O-N 3.12Å; V772-L775 PolarHBondContact O-N 2.9Å; V773-L775 VanDerWaalsContact C-N 3.26Å; V773-L775 PolarHBondContact O-N 3.02Å; L775-L777 VanDerWaalsContact C-N 3.34Å; L775-L777 PolarHBondContact O-N 2.91Å; L775-K778 PolarHBondContact O-N 3.38Å; L775-T779 VanDerWaalsContact O-CB 3.31Å; L775-T779 WeakPolarHBondContact O-CB 3.27Å; L775-T779 VanDerWaalsContact O-CG2 3.24Å; L775-T779 WeakPolarHBondContact O-CG2 3.45Å; L775-T779 PolarHBondContact O-N 3.03Å; L775-T779 PolarHBondContact O-OG1 3.16Å; L775-T779 VanDerWaalsContact O-OG1 3.11Å
776A86.8Confident77.7Confident0 Ų039.9 Ų39.90%023%0.234CC..Hα-helixtrans-63.9-40.3177.100000112.3L605 I635 V638 L639 V772 V773 T779 L780L605-A776 HydrophobicContact CD1-CB 3.99Å; I635-A776 HydrophobicContact CG1-CB 4.42Å; I635-A776 HydrophobicContact CG2-CB 4.41Å; V638-A776 HydrophobicContact CB-CB 4.36Å; V638-A776 HydrophobicContact CG1-CB 3.85Å; L639-A776 HydrophobicContact CD2-CB 4.26Å; V772-A776 VanDerWaalsContact O-CB 3.29Å; V772-A776 WeakPolarHBondContact O-CB 3.23Å; V772-A776 PolarHBondContact O-N 3.33Å; V773-A776 WeakPolarHBondContact O-CB 3.49Å; V773-A776 PolarHBondContact O-N 3.01Å; V773-A776 VanDerWaalsContact O-N 3.11Å; A776-T779 VanDerWaalsContact C-OG1 3.31Å; A776-T779 VanDerWaalsContact CA-OG1 3.32Å; A776-T779 WeakPolarHBondContact CA-OG1 3.44Å; A776-T779 WeakPolarHBondContact O-CB 3.33Å; A776-T779 PolarHBondContact O-N 3.3Å; A776-T779 PolarHBondContact O-OG1 2.72Å; A776-L780 PolarHBondContact O-N 3.28Å
777L87.6Confident79.5Confident0 Ų038.8 Ų38.80%025%0.248CC..Hα-helixtrans-64.5-50.2172.6-68.5172.9000110.9L639 V773 A774 L775 T779 L780 G781 I797 F801 I812 E815 A816 T819L639-L777 HydrophobicContact CD1-CD2 4.38Å; L639-L777 HydrophobicContact CD2-CD2 3.92Å; L639-L777 HydrophobicContact CD2-CG 4.16Å; V773-L777 HydrophobicContact CG1-CD1 4.16Å; V773-L777 HydrophobicContact CG1-CG 4.41Å; V773-L777 WeakPolarHBondContact O-CG 3.43Å; V773-L777 PolarHBondContact O-N 3.11Å; A774-L777 PolarHBondContact O-N 3.03Å; L775-L777 VanDerWaalsContact C-N 3.34Å; L775-L777 PolarHBondContact O-N 2.91Å; L777-T779 VanDerWaalsContact C-N 3.29Å; L777-T779 PolarHBondContact O-N 3.13Å; L777-L780 WeakPolarHBondContact O-CA 3.49Å; L777-L780 WeakPolarHBondContact O-CB 3.31Å; L777-L780 PolarHBondContact O-N 3.08Å; L777-L780 VanDerWaalsContact O-N 3.08Å; L777-G781 PolarHBondContact O-N 3.11Å; L777-I797 HydrophobicContact CD2-CB 4.49Å; L777-I797 HydrophobicContact CD2-CD1 3.75Å; L777-I797 HydrophobicContact CD2-CG1 3.8Å; L777-I797 HydrophobicContact CD2-CG2 3.97Å; L777-F801 HydrophobicContact CD2-CD2 4.29Å; L777-I812 HydrophobicContact CD1-CG2 3.8Å; L777-E815 HydrophobicContact CB-CB 4.41Å; L777-E815 HydrophobicContact CB-CG 4.19Å; L777-A816 HydrophobicContact CD1-CB 4.03Å; L777-T819 VanDerWaalsContact C-CG2 3.41Å; L777-T819 HydrophobicContact CB-CG2 4.2Å; L777-T819 WeakPolarHBondContact O-CG2 3.35Å; L777-T819 PolarHBondContact O-OG1 3.24Å
778K87.2Confident80.7Confident67.6667 Ų67.666738.5 Ų38.529%0.29424%0.24SC..Hα-helixtrans-57.6-38.7177-177.4170.3179.2-177.80112.6D405 S721 A722 A774 L775 G781 S782 E815D405-K778 IonicContact OD2-NZ 2.7Å; S721-K778 VanDerWaalsContact O-CE 3.25Å; S721-K778 WeakPolarHBondContact O-CE 3.24Å; A722-K778 VanDerWaalsContact CB-NZ 3.29Å; A774-K778 VanDerWaalsContact O-CB 3.29Å; A774-K778 WeakPolarHBondContact O-CB 3.43Å; A774-K778 PolarHBondContact O-N 3.28Å; L775-K778 PolarHBondContact O-N 3.38Å; K778-G781 PolarHBondContact O-N 2.88Å; K778-S782 VanDerWaalsContact O-CB 3.25Å; K778-S782 WeakPolarHBondContact O-CB 3.39Å; K778-S782 PolarHBondContact O-N 3.27Å; K778-S782 PolarHBondContact O-OG 3.04Å; K778-E815 WeakPolarHBondContact CA-OE1 3.18Å; K778-E815 HydrophobicContact CB-CG 3.89Å; K778-E815 VanDerWaalsContact CB-OE1 3.25Å; K778-E815 WeakPolarHBondContact CB-OE1 3.35Å; K778-E815 VanDerWaalsContact CG-OE1 3.26Å; K778-E815 WeakPolarHBondContact CG-OE1 3.46Å
779T85.2Confident81.4Confident1.33333 Ų1.3333339.9 Ų39.91%0.00825%0.249CC..Hα-helixtrans-65.4-45.6176.3-26.60000110.7I610 L631 I635 L775 A776 L777 G781 S782 F783I610-T779 HydrophobicContact CB-CG2 4.38Å; I610-T779 HydrophobicContact CD1-CG2 3.81Å; I610-T779 WeakPolarHBondContact CD1-OG1 3.39Å; I610-T779 HydrophobicContact CG1-CG2 3.72Å; I610-T779 VanDerWaalsContact CG1-CG2 3.48Å; I610-T779 HydrophobicContact CG2-CG2 3.84Å; L631-T779 HydrophobicContact CD1-CG2 4.02Å; L631-T779 HydrophobicContact CD2-CG2 4.11Å; L631-T779 HydrophobicContact CG-CG2 4.33Å; I635-T779 HydrophobicContact CD1-CG2 3.93Å; I635-T779 VanDerWaalsContact CD1-OG1 3.31Å; I635-T779 WeakPolarHBondContact CD1-OG1 3.29Å; L775-T779 VanDerWaalsContact O-CB 3.31Å; L775-T779 WeakPolarHBondContact O-CB 3.27Å; L775-T779 VanDerWaalsContact O-CG2 3.24Å; L775-T779 WeakPolarHBondContact O-CG2 3.45Å; L775-T779 PolarHBondContact O-N 3.03Å; L775-T779 PolarHBondContact O-OG1 3.16Å; L775-T779 VanDerWaalsContact O-OG1 3.11Å; A776-T779 VanDerWaalsContact C-OG1 3.31Å; A776-T779 VanDerWaalsContact CA-OG1 3.32Å; A776-T779 WeakPolarHBondContact CA-OG1 3.44Å; A776-T779 WeakPolarHBondContact O-CB 3.33Å; A776-T779 PolarHBondContact O-N 3.3Å; A776-T779 PolarHBondContact O-OG1 2.72Å; L777-T779 VanDerWaalsContact C-N 3.29Å; L777-T779 PolarHBondContact O-N 3.13Å; T779-G781 VanDerWaalsContact C-N 3.29Å; T779-G781 PolarHBondContact O-N 3.22Å; T779-S782 PolarHBondContact O-N 3.02Å; T779-F783 HydrophobicContact CG2-CB 4.33Å; T779-F783 VanDerWaalsContact O-CB 3.26Å; T779-F783 WeakPolarHBondContact O-CB 3.41Å; T779-F783 PolarHBondContact O-N 3.02Å
780L87.5Confident81.8Confident0.666667 Ų0.66666737 Ų370%0.00323%0.233CC..Hα-helixtrans-60.1-38.3177.9-166.770.3000112.1L632 I635 A776 L777 F785 L790 F793 I797 T819 L823L632-L780 HydrophobicContact CD2-CD1 3.87Å; I635-L780 HydrophobicContact CD1-CB 4.33Å; I635-L780 HydrophobicContact CD1-CD1 4.34Å; I635-L780 HydrophobicContact CG2-CB 4.47Å; I635-L780 HydrophobicContact CG2-CD1 4.45Å; A776-L780 PolarHBondContact O-N 3.28Å; L777-L780 WeakPolarHBondContact O-CA 3.49Å; L777-L780 WeakPolarHBondContact O-CB 3.31Å; L777-L780 PolarHBondContact O-N 3.08Å; L777-L780 VanDerWaalsContact O-N 3.08Å; L780-F785 HydrophobicContact CD1-CD2 4.38Å; L780-F785 HydrophobicContact CD1-CE2 4.04Å; L780-F785 HydrophobicContact CD1-CZ 4.27Å; L780-L790 HydrophobicContact CD1-CD2 4.41Å; L780-F793 HydrophobicContact CD2-CB 4Å; L780-F793 HydrophobicContact CD2-CD1 4.36Å; L780-F793 HydrophobicContact CD2-CG 4.37Å; L780-I797 HydrophobicContact CD2-CD1 3.46Å; L780-I797 VanDerWaalsContact CD2-CD1 3.47Å; L780-T819 HydrophobicContact CB-CG2 4.12Å; L780-T819 HydrophobicContact CD2-CG2 4.17Å; L780-T819 HydrophobicContact CG-CG2 4.39Å; L780-L823 HydrophobicContact CD2-CD1 3.7Å; L780-L823 HydrophobicContact CG-CD1 3.91Å; L780-L823 HydrophobicContact CG-CD2 4.46Å
781G83.6Confident81.9Confident11 Ų1137.6 Ų37.611%0.11324%0.24CC..Hα-helixtrans-81.2-21.817800000115.6L777 K778 T779 H822L777-G781 PolarHBondContact O-N 3.11Å; K778-G781 PolarHBondContact O-N 2.88Å; T779-G781 VanDerWaalsContact C-N 3.29Å; T779-G781 PolarHBondContact O-N 3.22Å; G781-H822 PolarHBondContact O-CD2 3.25Å; G781-H822 PolarHBondContact O-NE2 3.39Å
782S83.5Confident82.1Confident59 Ų5942.2 Ų42.241%0.41325%0.253SS..Hα-helixtrans-111.6-16.7-173.567.10000115.2K614 K778 T779K614-S782 PolarHBondContact NZ-O 2.75Å; K614-S782 PolarHBondContact NZ-OG 2.97Å; K778-S782 VanDerWaalsContact O-CB 3.25Å; K778-S782 WeakPolarHBondContact O-CB 3.39Å; K778-S782 PolarHBondContact O-N 3.27Å; K778-S782 PolarHBondContact O-OG 3.04Å; T779-S782 PolarHBondContact O-N 3.02Å
783F82.5Confident82.1Confident19.3333 Ų19.333342.3 Ų42.39%0.08525%0.251CS..SBendtrans-92.8145176-167.4-87.6000110.2F613 K614 A617 I627 Q628 L631 T779 F785F613-F783 HydrophobicContact CB-CE2 4.38Å; K614-F783 HydrophobicContact CB-CE2 4.41Å; K614-F783 HydrophobicContact CD-CD2 4.37Å; K614-F783 HydrophobicContact CG-CD2 3.49Å; K614-F783 VanDerWaalsContact CG-CD2 3.49Å; K614-F783 HydrophobicContact CG-CE2 3.68Å; A617-F783 HydrophobicContact CB-CZ 4.17Å; I627-F783 HydrophobicContact CG2-CZ 4.02Å; Q628-F783 HydrophobicContact CG-CE1 3.85Å; L631-F783 HydrophobicContact CD1-CD1 4.14Å; L631-F783 HydrophobicContact CD1-CD2 3.99Å; L631-F783 HydrophobicContact CD1-CE1 4.06Å; L631-F783 HydrophobicContact CD1-CE2 3.9Å; L631-F783 HydrophobicContact CD1-CG 4.11Å; L631-F783 HydrophobicContact CD1-CZ 3.95Å; T779-F783 HydrophobicContact CG2-CB 4.33Å; T779-F783 VanDerWaalsContact O-CB 3.26Å; T779-F783 WeakPolarHBondContact O-CB 3.41Å; T779-F783 PolarHBondContact O-N 3.02Å; F783-F785 HydrophobicContact CB-CD2 4.33Å; F783-F785 HydrophobicContact CB-CE2 3.66Å; F783-F785 HydrophobicContact CB-CZ 3.82Å; F783-F785 AromaticContact CD1-CD1 3.94Å; F783-F785 HydrophobicContact CD1-CD1 4.01Å; F783-F785 HydrophobicContact CD1-CD2 4.26Å; F783-F785 AromaticContact CD1-CE1 3.63Å; F783-F785 HydrophobicContact CD1-CE1 3.63Å; F783-F785 AromaticContact CD1-CE2 3.88Å; F783-F785 HydrophobicContact CD1-CE2 3.88Å; F783-F785 HydrophobicContact CD1-CG 4.32Å; F783-F785 AromaticContact CD1-CZ 3.57Å; F783-F785 HydrophobicContact CD1-CZ 3.57Å; F783-F785 HydrophobicContact CE1-CD1 4.39Å; F783-F785 HydrophobicContact CE1-CE1 4.2Å; F783-F785 HydrophobicContact CE1-CZ 4.47Å; F783-F785 HydrophobicContact CG-CE1 4.43Å; F783-F785 HydrophobicContact CG-CE2 4.23Å; F783-F785 AromaticContact CG-CZ 3.95Å; F783-F785 HydrophobicContact CG-CZ 4.03Å; F783-F785 VanDerWaalsContact O-CD2 3.22Å; F783-F785 WeakPolarHBondContact O-CD2 3.33Å; F783-F785 WeakPolarHBondContact O-CE2 3.46Å; F783-F785 PolarHBondContact O-N 3.05Å
784N79.8Confident82.1Confident79.3333 Ų79.333342.3 Ų42.342%0.42425%0.251SS..  trans-88110.8-177.3-178.9-19.1000110.9R624 Q628 D786R624-N784 PolarHBondContact NH2-ND2 3.14Å; R624-N784 PolarHBondContact NH2-OD1 2.97Å; R624-N784 VanDerWaalsContact NH2-OD1 3.15Å; Q628-N784 PolarHBondContact NE2-O 3.04Å; N784-D786 VanDerWaalsContact CG-OD2 3.26Å; N784-D786 PolarHBondContact ND2-OD2 3.1Å; N784-D786 WeakPolarHBondContact OD1-CB 3.36Å; N784-D786 PolarHBondContact OD1-N 3.23Å; N784-D786 PolarHBondContact OD1-OD1 3.2Å; N784-D786 PolarHBondContact OD1-OD2 3.15Å
785F81.2Confident82.1Confident9.66667 Ų9.6666746.7 Ų46.74%0.04226%0.264CS..  trans-10535.7176.1-56.6-83.8000113.9Q628 L631 L632 I635 L780 F783 G787 H788 L790Q628-F785 HydrophobicContact CB-CD1 4.23Å; Q628-F785 HydrophobicContact CG-CD1 4.23Å; L631-F785 HydrophobicContact CB-CE1 4.28Å; L631-F785 HydrophobicContact CB-CZ 4.37Å; L631-F785 HydrophobicContact CD1-CZ 4.41Å; L631-F785 HydrophobicContact CD2-CE1 3.83Å; L631-F785 VanDerWaalsContact CD2-CE1 3.43Å; L631-F785 HydrophobicContact CD2-CZ 3.63Å; L632-F785 HydrophobicContact CD1-CD1 3.89Å; L632-F785 HydrophobicContact CD1-CE1 4.41Å; L632-F785 HydrophobicContact CD2-CD1 3.72Å; L632-F785 HydrophobicContact CD2-CE1 3.7Å; L632-F785 HydrophobicContact CD2-CG 4.23Å; L632-F785 HydrophobicContact CD2-CZ 4.19Å; L632-F785 HydrophobicContact CG-CD1 3.63Å; L632-F785 HydrophobicContact CG-CE1 3.65Å; L632-F785 HydrophobicContact CG-CG 4.48Å; L632-F785 HydrophobicContact CG-CZ 4.48Å; I635-F785 HydrophobicContact CD1-CZ 4.19Å; L780-F785 HydrophobicContact CD1-CD2 4.38Å; L780-F785 HydrophobicContact CD1-CE2 4.04Å; L780-F785 HydrophobicContact CD1-CZ 4.27Å; F783-F785 HydrophobicContact CB-CD2 4.33Å; F783-F785 HydrophobicContact CB-CE2 3.66Å; F783-F785 HydrophobicContact CB-CZ 3.82Å; F783-F785 AromaticContact CD1-CD1 3.94Å; F783-F785 HydrophobicContact CD1-CD1 4.01Å; F783-F785 HydrophobicContact CD1-CD2 4.26Å; F783-F785 AromaticContact CD1-CE1 3.63Å; F783-F785 HydrophobicContact CD1-CE1 3.63Å; F783-F785 AromaticContact CD1-CE2 3.88Å; F783-F785 HydrophobicContact CD1-CE2 3.88Å; F783-F785 HydrophobicContact CD1-CG 4.32Å; F783-F785 AromaticContact CD1-CZ 3.57Å; F783-F785 HydrophobicContact CD1-CZ 3.57Å; F783-F785 HydrophobicContact CE1-CD1 4.39Å; F783-F785 HydrophobicContact CE1-CE1 4.2Å; F783-F785 HydrophobicContact CE1-CZ 4.47Å; F783-F785 HydrophobicContact CG-CE1 4.43Å; F783-F785 HydrophobicContact CG-CE2 4.23Å; F783-F785 AromaticContact CG-CZ 3.95Å; F783-F785 HydrophobicContact CG-CZ 4.03Å; F783-F785 VanDerWaalsContact O-CD2 3.22Å; F783-F785 WeakPolarHBondContact O-CD2 3.33Å; F783-F785 WeakPolarHBondContact O-CE2 3.46Å; F783-F785 PolarHBondContact O-N 3.05Å; F785-G787 PolarHBondContact O-N 3.03Å; F785-G787 VanDerWaalsContact O-N 3.11Å; F785-H788 PolarHBondContact O-N 3.14Å; F785-H788 VanDerWaalsContact O-N 3.14Å; F785-L790 HydrophobicContact CB-CD1 4.09Å; F785-L790 HydrophobicContact CB-CD2 4.22Å; F785-L790 HydrophobicContact CD2-CD1 4.5Å
786D74.5Confident82.2Confident102 Ų10247.7 Ų47.755%0.54527%0.268SS..THydrogen-bonded Turntrans-46.3125.7173.8-65.1-38.1000111R624 N784R624-D786 IonicContact CZ-OD2 2.97Å; R624-D786 IonicContact NH1-OD2 3.14Å; R624-D786 IonicContact NH2-OD2 3.41Å; R624-D786 PolarHBondContact NH2-OD2 3.24Å; N784-D786 VanDerWaalsContact CG-OD2 3.26Å; N784-D786 PolarHBondContact ND2-OD2 3.1Å; N784-D786 WeakPolarHBondContact OD1-CB 3.36Å; N784-D786 PolarHBondContact OD1-N 3.23Å; N784-D786 PolarHBondContact OD1-OD1 3.2Å; N784-D786 PolarHBondContact OD1-OD2 3.15Å
787G70Confident82.1Confident84.3333 Ų84.333347.7 Ų47.787%0.86927%0.268SS*.THydrogen-bonded Turntrans102.5-15178.500000115.7F785F785-G787 PolarHBondContact O-N 3.03Å; F785-G787 VanDerWaalsContact O-N 3.11Å
788H75.4Confident82Confident54.6667 Ų54.666748 Ų4825%0.25327%0.27SS..SBendtrans-97.7147.9179.2-61.4-85.8000113Q628 D629 L632 F785 L790Q628-H788 WeakPolarHBondContact CB-NE2 3.35Å; D629-H788 IonicContact OD1-CE1 3.31Å; D629-H788 PolarHBondContact OD1-CE1 3.09Å; D629-H788 IonicContact OD1-ND1 3.83Å; D629-H788 IonicContact OD1-NE2 2.83Å; L632-H788 HydrophobicContact CD1-CB 3.88Å; F785-H788 PolarHBondContact O-N 3.14Å; F785-H788 VanDerWaalsContact O-N 3.14Å; H788-L790 HydrophobicContact CB-CD2 4.35Å; H788-L790 PolarHBondContact O-N 3.2Å; H788-L790 VanDerWaalsContact O-N 3.13Å
789T79Confident81.9Confident119.333 Ų119.33348.2 Ų48.273%0.73228%0.275SS*.  trans-83.583.1-18049.10000111.9A791T789-A791 VanDerWaalsContact C-N 3.26Å; T789-A791 PolarHBondContact O-N 3.22Å; T789-A791 VanDerWaalsContact O-N 3.08Å
790L81.2Confident81.8Confident23.3333 Ų23.333350 Ų5012%0.12228%0.284CS..THydrogen-bonded Turntrans-73.6-0-176.5-55.7176.7000114.9L632 L780 F785 H788 H792 F793 V794 L823L632-L790 HydrophobicContact CD2-CD2 4.1Å; L780-L790 HydrophobicContact CD1-CD2 4.41Å; F785-L790 HydrophobicContact CB-CD1 4.09Å; F785-L790 HydrophobicContact CB-CD2 4.22Å; F785-L790 HydrophobicContact CD2-CD1 4.5Å; H788-L790 HydrophobicContact CB-CD2 4.35Å; H788-L790 PolarHBondContact O-N 3.2Å; H788-L790 VanDerWaalsContact O-N 3.13Å; L790-H792 VanDerWaalsContact C-N 3.29Å; L790-H792 PolarHBondContact O-N 3.14Å; L790-F793 HydrophobicContact CD2-CD2 4.26Å; L790-F793 PolarHBondContact O-N 3.21Å; L790-F793 VanDerWaalsContact O-N 3.15Å; L790-V794 PolarHBondContact O-N 3.24Å; L790-V794 VanDerWaalsContact O-N 3.13Å; L790-L823 HydrophobicContact CD1-CD2 3.61Å
791A79.8Confident81.6Confident31.3333 Ų31.333350.4 Ų50.426%0.25929%0.286SS..Hα-helixtrans-60.9-31.4-175.900000114.5T789 V794 R795 W827T789-A791 VanDerWaalsContact C-N 3.26Å; T789-A791 PolarHBondContact O-N 3.22Å; T789-A791 VanDerWaalsContact O-N 3.08Å; A791-V794 PolarHBondContact O-N 3.32Å; A791-R795 PolarHBondContact O-N 2.91Å; A791-R795 VanDerWaalsContact O-N 3.11Å; A791-R795 PolarHBondContact O-NH1 3.03Å; A791-R795 VanDerWaalsContact O-NH1 3.1Å; A791-W827 VanDerWaalsContact CA-CH2 3.46Å; A791-W827 HydrophobicContact CB-CH2 4.1Å; A791-W827 HydrophobicContact CB-CZ2 3.9Å
792H82.3Confident81.5Confident139.667 Ų139.66750 Ų5065%0.64728%0.281SS*.Hα-helixtrans-74.2-39.7175.7-68.1-80.3000111.9L790 R795 H796L790-H792 VanDerWaalsContact C-N 3.29Å; L790-H792 PolarHBondContact O-N 3.14Å; H792-R795 PolarHBondContact O-N 3.09Å; H792-H796 WeakPolarHBondContact O-CB 3.32Å; H792-H796 PolarHBondContact O-N 3.21Å
793F83.4Confident81.3Confident43.3333 Ų43.333348.5 Ų48.519%0.1927%0.271CS..Hα-helixtrans-62.3-45.6175.6-73.1-82.4000111.8L632 I635 L639 L780 L790 R795 H796 I797L632-F793 HydrophobicContact CD2-CE2 4.16Å; L632-F793 HydrophobicContact CD2-CZ 4.24Å; I635-F793 HydrophobicContact CG2-CE1 4.22Å; L639-F793 HydrophobicContact CD1-CD1 4.32Å; L780-F793 HydrophobicContact CD2-CB 4Å; L780-F793 HydrophobicContact CD2-CD1 4.36Å; L780-F793 HydrophobicContact CD2-CG 4.37Å; L790-F793 HydrophobicContact CD2-CD2 4.26Å; L790-F793 PolarHBondContact O-N 3.21Å; L790-F793 VanDerWaalsContact O-N 3.15Å; F793-R795 VanDerWaalsContact C-N 3.33Å; F793-R795 PolarHBondContact O-N 3.35Å; F793-H796 PolarHBondContact O-N 3.01Å; F793-I797 WeakPolarHBondContact O-CB 3.37Å; F793-I797 WeakPolarHBondContact O-CD1 3.33Å; F793-I797 VanDerWaalsContact O-CG1 3.22Å; F793-I797 WeakPolarHBondContact O-CG1 3.29Å; F793-I797 PolarHBondContact O-N 3.03Å
794V85.1Confident81Confident1 Ų150.6 Ų50.61%0.00628%0.282CS..Hα-helixtrans-62.3-42.3179.9179.60000111.6L790 A791 I797 C798 L823 W827 V848L790-V794 PolarHBondContact O-N 3.24Å; L790-V794 VanDerWaalsContact O-N 3.13Å; A791-V794 PolarHBondContact O-N 3.32Å; V794-I797 PolarHBondContact O-N 3.17Å; V794-C798 VanDerWaalsContact O-CB 3.23Å; V794-C798 WeakPolarHBondContact O-CB 3.25Å; V794-C798 PolarHBondContact O-N 3.26Å; V794-L823 HydrophobicContact CG2-CB 3.57Å; V794-L823 HydrophobicContact CG2-CD1 3.72Å; V794-L823 HydrophobicContact CG2-CG 4.3Å; V794-W827 HydrophobicContact CB-CH2 3.8Å; V794-W827 HydrophobicContact CB-CZ3 4.27Å; V794-W827 HydrophobicContact CG1-CH2 4.27Å; V794-W827 HydrophobicContact CG1-CZ3 4.23Å; V794-W827 HydrophobicContact CG2-CH2 3.56Å; V794-W827 HydrophobicContact CG2-CZ2 4.35Å; V794-W827 HydrophobicContact CG2-CZ3 4.22Å; V794-V848 HydrophobicContact CG1-CG1 4.09Å; V794-V848 HydrophobicContact CG1-CG2 3.98Å
795R84.9Confident80.6Confident106.667 Ų106.66751.6 Ų51.640%0.40330%0.295SS..Hα-helixtrans-61.9-49.4174.8-100.2-176-173.7102.4-15.4111.4A791 H792 F793 I797 C798 D799 D847A791-R795 PolarHBondContact O-N 2.91Å; A791-R795 VanDerWaalsContact O-N 3.11Å; A791-R795 PolarHBondContact O-NH1 3.03Å; A791-R795 VanDerWaalsContact O-NH1 3.1Å; H792-R795 PolarHBondContact O-N 3.09Å; F793-R795 VanDerWaalsContact C-N 3.33Å; F793-R795 PolarHBondContact O-N 3.35Å; R795-I797 VanDerWaalsContact C-N 3.31Å; R795-I797 PolarHBondContact O-N 3.21Å; R795-C798 WeakPolarHBondContact O-CA 3.32Å; R795-C798 WeakPolarHBondContact O-CB 3.38Å; R795-C798 PolarHBondContact O-N 3.25Å; R795-C798 VanDerWaalsContact O-N 3.07Å; R795-D799 WeakPolarHBondContact O-CB 3.45Å; R795-D799 VanDerWaalsContact O-CG 3.32Å; R795-D799 PolarHBondContact O-N 3.12Å; R795-D847 IonicContact NH1-OD2 3.81Å
796H85.5Confident80.3Confident47.3333 Ų47.333354.4 Ų54.422%0.21931%0.313CS..Hα-helixtrans-58.1-42.9178.6179.1-85.2000112.5L639 S643 H792 F793 C798 D799 N800 F801L639-H796 PolarHBondContact O-CE1 3.31Å; S643-H796 VanDerWaalsContact CB-NE2 3.27Å; S643-H796 WeakPolarHBondContact CB-NE2 3.45Å; S643-H796 PolarHBondContact OG-CE1 2.87Å; S643-H796 PolarHBondContact OG-NE2 3.29Å; H792-H796 WeakPolarHBondContact O-CB 3.32Å; H792-H796 PolarHBondContact O-N 3.21Å; F793-H796 PolarHBondContact O-N 3.01Å; H796-C798 VanDerWaalsContact C-N 3.34Å; H796-D799 PolarHBondContact O-N 3.28Å; H796-N800 PolarHBondContact CD2-ND2 3.23Å; H796-N800 VanDerWaalsContact CD2-ND2 3.34Å; H796-N800 PolarHBondContact CE1-ND2 3.05Å; H796-N800 PolarHBondContact NE2-ND2 3Å; H796-N800 VanDerWaalsContact NE2-ND2 3.2Å; H796-N800 WeakPolarHBondContact O-CB 3.39Å; H796-N800 PolarHBondContact O-N 2.94Å; H796-N800 VanDerWaalsContact O-N 3.09Å; H796-N800 PolarHBondContact O-ND2 3.14Å; H796-F801 AromaticContact CE1-CE2 3.92Å
797I86Confident80.5Confident0 Ų050 Ų500%029%0.29CS..Hα-helixtrans-66.2-42.8176.7-65.3163.4000110.5L639 L777 L780 F793 V794 R795 D799 N800 F801 I802 A816 T819 C820L639-I797 HydrophobicContact CD1-CD1 4.43Å; L639-I797 HydrophobicContact CD1-CG1 4.35Å; L777-I797 HydrophobicContact CD2-CB 4.49Å; L777-I797 HydrophobicContact CD2-CD1 3.75Å; L777-I797 HydrophobicContact CD2-CG1 3.8Å; L777-I797 HydrophobicContact CD2-CG2 3.97Å; L780-I797 HydrophobicContact CD2-CD1 3.46Å; L780-I797 VanDerWaalsContact CD2-CD1 3.47Å; F793-I797 WeakPolarHBondContact O-CB 3.37Å; F793-I797 WeakPolarHBondContact O-CD1 3.33Å; F793-I797 VanDerWaalsContact O-CG1 3.22Å; F793-I797 WeakPolarHBondContact O-CG1 3.29Å; F793-I797 PolarHBondContact O-N 3.03Å; V794-I797 PolarHBondContact O-N 3.17Å; R795-I797 VanDerWaalsContact C-N 3.31Å; R795-I797 PolarHBondContact O-N 3.21Å; I797-D799 VanDerWaalsContact C-N 3.28Å; I797-D799 PolarHBondContact O-N 3.23Å; I797-N800 PolarHBondContact O-N 3.17Å; I797-F801 HydrophobicContact CB-CD2 4.36Å; I797-F801 HydrophobicContact CG1-CD2 4.24Å; I797-F801 HydrophobicContact CG2-CB 4.25Å; I797-F801 HydrophobicContact CG2-CD2 4.28Å; I797-F801 PolarHBondContact O-N 3.29Å; I797-I802 PolarHBondContact O-N 3.49Å; I797-A816 HydrophobicContact CG2-CB 3.81Å; I797-T819 HydrophobicContact CD1-CG2 4.2Å; I797-C820 WeakPolarHBondContact CG2-SG 3.16Å
798C85.3Confident81Confident6.66667 Ų6.6666753.4 Ų53.45%0.04528%0.284CS..Hα-helixtrans-61.1-36.8178.5-163.30000113.1V794 R795 H796 I802 V848 K851V794-C798 VanDerWaalsContact O-CB 3.23Å; V794-C798 WeakPolarHBondContact O-CB 3.25Å; V794-C798 PolarHBondContact O-N 3.26Å; R795-C798 WeakPolarHBondContact O-CA 3.32Å; R795-C798 WeakPolarHBondContact O-CB 3.38Å; R795-C798 PolarHBondContact O-N 3.25Å; R795-C798 VanDerWaalsContact O-N 3.07Å; H796-C798 VanDerWaalsContact C-N 3.34Å; C798-I802 HydrophobicContact CB-CD1 4.1Å; C798-V848 HydrophobicContact CB-CG1 4.45Å; C798-V848 HydrophobicContact CB-CG2 4.28Å; C798-K851 VanDerWaalsContact SG-CB 3.52Å; C798-K851 WeakPolarHBondContact SG-CB 3.21Å; C798-K851 WeakPolarHBondContact SG-CD 3.44Å
799D85Confident81.5Confident72 Ų7253 Ų5339%0.38529%0.285SS..Hα-helixtrans-80.1-35.1-179.4-66.1-26.5000112.7R795 H796 I797 T806 K851R795-D799 WeakPolarHBondContact O-CB 3.45Å; R795-D799 VanDerWaalsContact O-CG 3.32Å; R795-D799 PolarHBondContact O-N 3.12Å; H796-D799 PolarHBondContact O-N 3.28Å; I797-D799 VanDerWaalsContact C-N 3.28Å; I797-D799 PolarHBondContact O-N 3.23Å; D799-T806 WeakPolarHBondContact O-CG2 3.11Å; D799-K851 IonicContact OD1-NZ 3.34Å; D799-K851 PolarHBondContact OD1-NZ 2.95Å
800N83.4Confident81.9Confident40.3333 Ų40.333350 Ų5022%0.21626%0.262CS..Hα-helixtrans-106-28.8-170-63.3-55.7000115.1S643 H796 I797 T806S643-N800 VanDerWaalsContact CB-ND2 3.35Å; S643-N800 WeakPolarHBondContact CB-ND2 3.37Å; S643-N800 PolarHBondContact O-OD1 3.14Å; S643-N800 PolarHBondContact OG-ND2 3.32Å; S643-N800 VanDerWaalsContact OG-ND2 3.13Å; H796-N800 PolarHBondContact CD2-ND2 3.23Å; H796-N800 VanDerWaalsContact CD2-ND2 3.34Å; H796-N800 PolarHBondContact CE1-ND2 3.05Å; H796-N800 PolarHBondContact NE2-ND2 3Å; H796-N800 VanDerWaalsContact NE2-ND2 3.2Å; H796-N800 WeakPolarHBondContact O-CB 3.39Å; H796-N800 PolarHBondContact O-N 2.94Å; H796-N800 VanDerWaalsContact O-N 3.09Å; H796-N800 PolarHBondContact O-ND2 3.14Å; I797-N800 PolarHBondContact O-N 3.17Å; N800-T806 VanDerWaalsContact C-OG1 3.25Å; N800-T806 WeakPolarHBondContact O-CB 3.43Å; N800-T806 PolarHBondContact O-OG1 2.94Å
801F82.3Confident82.1Confident8.75 Ų8.7553.4 Ų53.44%0.03828%0.277CS..THydrogen-bonded Turntrans-120.3-8.5-168.6-60.1-57.9000115.4L639 V773 L777 H796 I797 I812 R813 A816L639-F801 HydrophobicContact CB-CE2 4.24Å; L639-F801 HydrophobicContact CB-CZ 4.44Å; L639-F801 HydrophobicContact CD2-CD2 4.34Å; L639-F801 HydrophobicContact CD2-CE2 3.73Å; L639-F801 HydrophobicContact CD2-CZ 4.05Å; L639-F801 HydrophobicContact CG-CE2 4.4Å; V773-F801 HydrophobicContact CG1-CD1 4.49Å; V773-F801 HydrophobicContact CG1-CE1 4.2Å; V773-F801 HydrophobicContact CG1-CZ 4.42Å; L777-F801 HydrophobicContact CD2-CD2 4.29Å; H796-F801 AromaticContact CE1-CE2 3.92Å; I797-F801 HydrophobicContact CB-CD2 4.36Å; I797-F801 HydrophobicContact CG1-CD2 4.24Å; I797-F801 HydrophobicContact CG2-CB 4.25Å; I797-F801 HydrophobicContact CG2-CD2 4.28Å; I797-F801 PolarHBondContact O-N 3.29Å; F801-I812 HydrophobicContact CB-CG2 4.04Å; F801-I812 HydrophobicContact CD1-CG2 3.74Å; F801-I812 HydrophobicContact CE1-CG2 4.44Å; F801-I812 HydrophobicContact CG-CG2 4.13Å; F801-R813 WeakPolarHBondContact O-CA 3.29Å; F801-R813 WeakPolarHBondContact O-CG 3.49Å; F801-A816 HydrophobicContact CB-CB 3.79Å
802I81.6Confident82.5Confident1.5 Ų1.552.3 Ų52.31%0.00827%0.267CS..SBendtrans-94.8-35.4-179-53.9-172.3000112.3I797 C798 R813 A816 V817 C820 L852 V855I797-I802 PolarHBondContact O-N 3.49Å; C798-I802 HydrophobicContact CB-CD1 4.1Å; I802-R813 WeakPolarHBondContact O-CD 3.31Å; I802-A816 HydrophobicContact CG1-CB 4.05Å; I802-V817 HydrophobicContact CG2-CG2 4.05Å; I802-C820 HydrophobicContact CD1-CB 4.2Å; I802-L852 HydrophobicContact CD1-CD2 3.76Å; I802-L852 HydrophobicContact CD1-CG 4.44Å; I802-L852 HydrophobicContact CG2-CD2 4.32Å; I802-V855 HydrophobicContact CB-CG2 4.44Å; I802-V855 HydrophobicContact CG2-CB 4.04Å; I802-V855 HydrophobicContact CG2-CG1 4Å; I802-V855 HydrophobicContact CG2-CG2 3.78Å; I802-V855 VanDerWaalsContact CG2-CG2 3.44Å; I802-V855 WeakPolarHBondContact O-CG1 3.32Å
803S78.9Confident82.8Confident28.25 Ų28.2545.7 Ų45.720%0.19824%0.236CC..SBendtrans-81.4141.5-179980000112.4S805 T806 C807S803-S805 PolarHBondContact O-N 2.91Å; S803-S805 PolarHBondContact OG-N 3.11Å; S803-S805 PolarHBondContact OG-OG 3.43Å; S803-T806 PolarHBondContact O-N 3.26Å; S803-T806 PolarHBondContact O-OG1 3.33Å; S803-T806 VanDerWaalsContact O-OG1 3.09Å; S803-T806 WeakPolarHBondContact OG-CG2 3.33Å; S803-T806 PolarHBondContact OG-N 3.18Å; S803-T806 VanDerWaalsContact OG-N 3.15Å; S803-T806 PolarHBondContact OG-OG1 2.93Å; S803-C807 PolarHBondContact O-N 3.26Å
804I76Confident83.1Confident63.75 Ų63.7545 Ų4533%0.32723%0.234SC..THydrogen-bonded Turntrans-62.7-27.2173.1-168.6145.1000112.9T806 P860I804-T806 VanDerWaalsContact C-N 3.3Å; I804-T806 PolarHBondContact O-N 3.04Å; I804-P860 HydrophobicContact CD1-CG 3.69Å; I804-P860 HydrophobicContact CG1-CG 3.96Å
805S71.8Confident83.2Confident100.25 Ų100.2546.3 Ų46.370%0.70124%0.24SC*.THydrogen-bonded Turntrans-67.5-19.7175.649.10000114S803S803-S805 PolarHBondContact O-N 2.91Å; S803-S805 PolarHBondContact OG-N 3.11Å; S803-S805 PolarHBondContact OG-OG 3.43Å
806T75.2Confident83.5Confident67 Ų6741.2 Ų41.241%0.41122%0.221SC..THydrogen-bonded Turntrans-112.6-27.8179.355.60000112.6D799 N800 S803 I804D799-T806 WeakPolarHBondContact O-CG2 3.11Å; N800-T806 VanDerWaalsContact C-OG1 3.25Å; N800-T806 WeakPolarHBondContact O-CB 3.43Å; N800-T806 PolarHBondContact O-OG1 2.94Å; S803-T806 PolarHBondContact O-N 3.26Å; S803-T806 PolarHBondContact O-OG1 3.33Å; S803-T806 VanDerWaalsContact O-OG1 3.09Å; S803-T806 WeakPolarHBondContact OG-CG2 3.33Å; S803-T806 PolarHBondContact OG-N 3.18Å; S803-T806 VanDerWaalsContact OG-N 3.15Å; S803-T806 PolarHBondContact OG-OG1 2.93Å; I804-T806 VanDerWaalsContact C-N 3.3Å; I804-T806 PolarHBondContact O-N 3.04Å
807C78Confident83.7Confident10 Ų1039 Ų397%0.06821%0.21CC..  trans-139.4105.7176.1-167.50000113.1S803 V809 R813S803-C807 PolarHBondContact O-N 3.26Å; C807-V809 VanDerWaalsContact C-N 3.33Å; C807-V809 PolarHBondContact O-N 3.22Å; C807-R813 HydrophobicContact CB-CG 4.38Å; C807-R813 VanDerWaalsContact O-CD 3.27Å; C807-R813 WeakPolarHBondContact O-CD 3.31Å; C807-R813 WeakPolarHBondContact O-CG 3.41Å; C807-R813 PolarHBondContact O-NH1 3.24Å; C807-R813 VanDerWaalsContact O-NH1 3.12Å
808E81.5Confident83.9Confident156.5 Ų156.542.5 Ų42.573%0.73123%0.226SC*.  trans-69.1-21.5175.8-58.8-168.7157.600113K810 R813E808-K810 PolarHBondContact O-N 3.15Å; E808-K810 VanDerWaalsContact O-N 3.17Å; E808-R813 VanDerWaalsContact C-NH1 3.29Å; E808-R813 PolarHBondContact O-NH1 3.06Å
809V86.1Confident84Confident45.75 Ų45.7542.2 Ų42.228%0.27722%0.224SC..  trans-78.1110.5-173.2-170.60000111.7F727 V770 C807 E811 I812 R813F727-V809 HydrophobicContact CE2-CG1 3.86Å; F727-V809 HydrophobicContact CZ-CG1 4.28Å; V770-V809 HydrophobicContact CG1-CG1 3.77Å; V770-V809 HydrophobicContact CG2-CG1 4.42Å; V770-V809 HydrophobicContact CG2-CG2 4.27Å; C807-V809 VanDerWaalsContact C-N 3.33Å; C807-V809 PolarHBondContact O-N 3.22Å; V809-E811 VanDerWaalsContact C-N 3.33Å; V809-E811 HydrophobicContact CG1-CB 4.28Å; V809-E811 HydrophobicContact CG1-CG 3.93Å; V809-E811 PolarHBondContact O-N 3.24Å; V809-I812 HydrophobicContact CB-CB 4.34Å; V809-I812 HydrophobicContact CB-CD1 4.08Å; V809-I812 HydrophobicContact CB-CG1 4.19Å; V809-I812 HydrophobicContact CG1-CB 4.46Å; V809-I812 HydrophobicContact CG1-CD1 4.14Å; V809-I812 HydrophobicContact CG1-CG1 4.01Å; V809-I812 HydrophobicContact CG2-CD1 4.4Å; V809-I812 PolarHBondContact O-N 3.06Å; V809-I812 VanDerWaalsContact O-N 3.14Å; V809-R813 PolarHBondContact O-N 3.39Å; V809-R813 VanDerWaalsContact O-N 3.14Å
810K87.5Confident84.2Confident57 Ų5738.8 Ų38.825%0.24821%0.206CC..Hα-helixtrans-49-47.4177.2179.6-179.3-178.9162.20113.3F725 V726 F727 E808 I812 R813 L814 D861 D863 V864F725-K810 HydrophobicContact CD1-CB 4.43Å; F725-K810 HydrophobicContact CD1-CG 4.04Å; F725-K810 HydrophobicContact CE1-CG 4.2Å; F725-K810 VanDerWaalsContact CE1-O 3.23Å; F725-K810 WeakPolarHBondContact CE1-O 3.36Å; V726-K810 PolarHBondContact O-NZ 3.46Å; V726-K810 VanDerWaalsContact O-NZ 3.12Å; F727-K810 HydrophobicContact CE2-CB 4.02Å; F727-K810 HydrophobicContact CZ-CB 4.13Å; E808-K810 PolarHBondContact O-N 3.15Å; E808-K810 VanDerWaalsContact O-N 3.17Å; K810-I812 VanDerWaalsContact C-N 3.33Å; K810-I812 PolarHBondContact O-N 3.32Å; K810-I812 VanDerWaalsContact O-N 3.12Å; K810-R813 PolarHBondContact O-N 3.27Å; K810-L814 HydrophobicContact CG-CD1 3.98Å; K810-L814 HydrophobicContact CG-CG 4.4Å; K810-L814 WeakPolarHBondContact O-CB 3.42Å; K810-L814 WeakPolarHBondContact O-CG 3.34Å; K810-L814 PolarHBondContact O-N 3.1Å; K810-L814 VanDerWaalsContact O-N 3.11Å; K810-D861 HydrophobicContact CD-CB 4.49Å; K810-D861 VanDerWaalsContact CD-OD1 3.26Å; K810-D861 WeakPolarHBondContact CD-OD1 3.26Å; K810-D861 VanDerWaalsContact CD-OD2 3.28Å; K810-D861 WeakPolarHBondContact CD-OD2 3.29Å; K810-D861 VanDerWaalsContact CE-OD1 3.26Å; K810-D861 WeakPolarHBondContact CE-OD1 3.45Å; K810-D861 VanDerWaalsContact CE-OD2 3.26Å; K810-D861 WeakPolarHBondContact CE-OD2 3.32Å; K810-D861 VanDerWaalsContact NZ-CG 3.3Å; K810-D861 IonicContact NZ-OD1 2.95Å; K810-D861 PolarHBondContact NZ-OD1 3.2Å; K810-D861 VanDerWaalsContact NZ-OD1 3.08Å; K810-D861 IonicContact NZ-OD2 3.47Å; K810-D861 PolarHBondContact NZ-OD2 3.21Å; K810-D863 VanDerWaalsContact CE-OD2 3.27Å; K810-D863 WeakPolarHBondContact CE-OD2 3.38Å; K810-D863 IonicContact NZ-OD2 3.48Å; K810-D863 PolarHBondContact NZ-OD2 3.16Å; K810-V864 HydrophobicContact CG-CG2 4.38Å
811E84.5Confident84.3Confident94 Ų9437.2 Ų37.244%0.43920%0.198SC..Hα-helixtrans-46.8-50.7173.3-63.1-175.917500113.3F725 F727 L766 V770 A774 V809 L814 E815F725-E811 HydrophobicContact CB-CB 4.31Å; F725-E811 HydrophobicContact CB-CG 3.73Å; F725-E811 VanDerWaalsContact CB-OE1 3.25Å; F725-E811 WeakPolarHBondContact CB-OE1 3.1Å; F725-E811 HydrophobicContact CD1-CB 3.54Å; F725-E811 HydrophobicContact CD1-CG 3.72Å; F725-E811 VanDerWaalsContact CD1-N 3.26Å; F725-E811 HydrophobicContact CD2-CB 3.5Å; F725-E811 HydrophobicContact CD2-CG 3.85Å; F725-E811 VanDerWaalsContact CD2-OE2 3.26Å; F725-E811 WeakPolarHBondContact CD2-OE2 3.36Å; F725-E811 HydrophobicContact CE1-CB 3.6Å; F725-E811 HydrophobicContact CE1-CG 4.3Å; F725-E811 WeakPolarHBondContact CE1-O 3.49Å; F725-E811 HydrophobicContact CE2-CB 3.6Å; F725-E811 HydrophobicContact CE2-CG 4.44Å; F725-E811 HydrophobicContact CG-CB 3.49Å; F725-E811 VanDerWaalsContact CG-CB 3.49Å; F725-E811 VanDerWaalsContact CG-CD 3.43Å; F725-E811 HydrophobicContact CG-CG 3.46Å; F725-E811 VanDerWaalsContact CG-CG 3.46Å; F725-E811 HydrophobicContact CZ-CB 3.65Å; F725-E811 WeakPolarHBondContact CZ-O 3.36Å; F727-E811 HydrophobicContact CE2-CG 4.49Å; L766-E811 WeakPolarHBondContact CD2-OE2 3.34Å; V770-E811 HydrophobicContact CG1-CG 4.45Å; A774-E811 HydrophobicContact CB-CG 4.44Å; V809-E811 VanDerWaalsContact C-N 3.33Å; V809-E811 HydrophobicContact CG1-CB 4.28Å; V809-E811 HydrophobicContact CG1-CG 3.93Å; V809-E811 PolarHBondContact O-N 3.24Å; E811-L814 PolarHBondContact O-N 2.96Å; E811-E815 PolarHBondContact O-N 3.26Å; E811-E815 VanDerWaalsContact O-N 3.09Å
812I87.8Confident84.5Confident8 Ų841.7 Ų41.74%0.04122%0.219CC..Hα-helixtrans-72.7-42.6-178.7-65.1174.5000109.6V770 V773 L777 F801 V809 K810 L814 E815 A816V770-I812 HydrophobicContact CB-CD1 4.47Å; V770-I812 HydrophobicContact CG1-CD1 4.14Å; V770-I812 HydrophobicContact CG1-CG1 4.31Å; V770-I812 HydrophobicContact CG2-CD1 4.36Å; V773-I812 HydrophobicContact CB-CD1 4.08Å; V773-I812 HydrophobicContact CB-CG1 4.38Å; V773-I812 HydrophobicContact CG1-CD1 3.9Å; V773-I812 HydrophobicContact CG1-CG1 4.11Å; V773-I812 HydrophobicContact CG1-CG2 4Å; L777-I812 HydrophobicContact CD1-CG2 3.8Å; F801-I812 HydrophobicContact CB-CG2 4.04Å; F801-I812 HydrophobicContact CD1-CG2 3.74Å; F801-I812 HydrophobicContact CE1-CG2 4.44Å; F801-I812 HydrophobicContact CG-CG2 4.13Å; V809-I812 HydrophobicContact CB-CB 4.34Å; V809-I812 HydrophobicContact CB-CD1 4.08Å; V809-I812 HydrophobicContact CB-CG1 4.19Å; V809-I812 HydrophobicContact CG1-CB 4.46Å; V809-I812 HydrophobicContact CG1-CD1 4.14Å; V809-I812 HydrophobicContact CG1-CG1 4.01Å; V809-I812 HydrophobicContact CG2-CD1 4.4Å; V809-I812 PolarHBondContact O-N 3.06Å; V809-I812 VanDerWaalsContact O-N 3.14Å; K810-I812 VanDerWaalsContact C-N 3.33Å; K810-I812 PolarHBondContact O-N 3.32Å; K810-I812 VanDerWaalsContact O-N 3.12Å; I812-L814 PolarHBondContact O-N 2.98Å; I812-E815 PolarHBondContact O-N 3.24Å; I812-A816 WeakPolarHBondContact O-CB 3.43Å; I812-A816 PolarHBondContact O-N 3.07Å
813R89.5Confident84.7Confident2.25 Ų2.2542.2 Ų42.21%0.00822%0.222CC..Hα-helixtrans-60.4-45177-60.6-155.5-57.8-70.7-1.2112.3F801 I802 C807 E808 V809 K810 E815 A816 V817 D859 D861 V864F801-R813 WeakPolarHBondContact O-CA 3.29Å; F801-R813 WeakPolarHBondContact O-CG 3.49Å; I802-R813 WeakPolarHBondContact O-CD 3.31Å; C807-R813 HydrophobicContact CB-CG 4.38Å; C807-R813 VanDerWaalsContact O-CD 3.27Å; C807-R813 WeakPolarHBondContact O-CD 3.31Å; C807-R813 WeakPolarHBondContact O-CG 3.41Å; C807-R813 PolarHBondContact O-NH1 3.24Å; C807-R813 VanDerWaalsContact O-NH1 3.12Å; E808-R813 VanDerWaalsContact C-NH1 3.29Å; E808-R813 PolarHBondContact O-NH1 3.06Å; V809-R813 PolarHBondContact O-N 3.39Å; V809-R813 VanDerWaalsContact O-N 3.14Å; K810-R813 PolarHBondContact O-N 3.27Å; R813-E815 VanDerWaalsContact C-N 3.34Å; R813-E815 PolarHBondContact O-N 3.36Å; R813-A816 PolarHBondContact O-N 3.26Å; R813-V817 VanDerWaalsContact O-CG2 3.3Å; R813-V817 WeakPolarHBondContact O-CG2 3.28Å; R813-V817 PolarHBondContact O-N 3.27Å; R813-D859 IonicContact CZ-OD1 3.5Å; R813-D859 IonicContact CZ-OD2 3.44Å; R813-D859 IonicContact NE-OD1 3.05Å; R813-D859 IonicContact NE-OD2 3.48Å; R813-D859 PolarHBondContact NE-OD2 3.07Å; R813-D859 IonicContact NH2-OD1 3.48Å; R813-D859 PolarHBondContact NH2-OD1 2.95Å; R813-D859 IonicContact NH2-OD2 3.19Å; R813-D859 PolarHBondContact NH2-OD2 3.19Å; R813-D861 IonicContact CZ-OD2 3.09Å; R813-D861 IonicContact NH2-OD2 3.26Å; R813-D861 PolarHBondContact NH2-OD2 3Å; R813-V864 HydrophobicContact CB-CG1 4.45Å; R813-V864 HydrophobicContact CB-CG2 4.36Å
814L89.1Confident84.8Confident28 Ų2840.9 Ų40.915%0.14721%0.212CC..Hα-helixtrans-60.1-44.3178-80.7174.8000112.4F725 K810 E811 I812 K818 D863 V864 C867F725-L814 HydrophobicContact CD1-CD1 4.13Å; F725-L814 HydrophobicContact CE1-CB 3.57Å; F725-L814 HydrophobicContact CE1-CD1 3.45Å; F725-L814 VanDerWaalsContact CE1-CD1 3.45Å; F725-L814 HydrophobicContact CE1-CG 3.89Å; F725-L814 HydrophobicContact CZ-CB 3.56Å; F725-L814 HydrophobicContact CZ-CD1 4.02Å; F725-L814 HydrophobicContact CZ-CG 4.33Å; K810-L814 HydrophobicContact CG-CD1 3.98Å; K810-L814 HydrophobicContact CG-CG 4.4Å; K810-L814 WeakPolarHBondContact O-CB 3.42Å; K810-L814 WeakPolarHBondContact O-CG 3.34Å; K810-L814 PolarHBondContact O-N 3.1Å; K810-L814 VanDerWaalsContact O-N 3.11Å; E811-L814 PolarHBondContact O-N 2.96Å; I812-L814 PolarHBondContact O-N 2.98Å; L814-K818 WeakPolarHBondContact O-CD 3.46Å; L814-K818 VanDerWaalsContact O-CE 3.25Å; L814-K818 WeakPolarHBondContact O-CE 3.37Å; L814-K818 WeakPolarHBondContact O-CG 3.45Å; L814-K818 PolarHBondContact O-N 3.34Å; L814-D863 HydrophobicContact CD1-CB 4.34Å; L814-D863 HydrophobicContact CD2-CB 4.3Å; L814-D863 WeakPolarHBondContact CD2-O 3.41Å; L814-V864 HydrophobicContact CD2-CB 4.42Å; L814-V864 HydrophobicContact CD2-CG2 4Å; L814-V864 HydrophobicContact CG-CG2 4.01Å; L814-C867 HydrophobicContact CD2-CB 3.6Å
815E87.7Confident85.1Confident27.25 Ų27.2538.7 Ų38.713%0.12720%0.201CC..Hα-helixtrans-77.3-33.4-179.6-154.666-172.500111.9T723 L777 K778 E811 I812 R813 V817 K818 T819T723-E815 VanDerWaalsContact CB-OE2 3.27Å; T723-E815 WeakPolarHBondContact CB-OE2 3.5Å; T723-E815 PolarHBondContact OG1-OE2 3.49Å; L777-E815 HydrophobicContact CB-CB 4.41Å; L777-E815 HydrophobicContact CB-CG 4.19Å; K778-E815 WeakPolarHBondContact CA-OE1 3.18Å; K778-E815 HydrophobicContact CB-CG 3.89Å; K778-E815 VanDerWaalsContact CB-OE1 3.25Å; K778-E815 WeakPolarHBondContact CB-OE1 3.35Å; K778-E815 VanDerWaalsContact CG-OE1 3.26Å; K778-E815 WeakPolarHBondContact CG-OE1 3.46Å; E811-E815 PolarHBondContact O-N 3.26Å; E811-E815 VanDerWaalsContact O-N 3.09Å; I812-E815 PolarHBondContact O-N 3.24Å; R813-E815 VanDerWaalsContact C-N 3.34Å; R813-E815 PolarHBondContact O-N 3.36Å; E815-V817 PolarHBondContact O-N 3.12Å; E815-K818 PolarHBondContact O-N 3.33Å; E815-K818 WeakPolarHBondContact OE2-CD 3.39Å; E815-K818 WeakPolarHBondContact OE2-CE 3.47Å; E815-K818 IonicContact OE2-NZ 3.03Å; E815-K818 PolarHBondContact OE2-NZ 3.24Å; E815-T819 HydrophobicContact CG-CG2 4.3Å; E815-T819 VanDerWaalsContact O-CB 3.3Å; E815-T819 WeakPolarHBondContact O-CB 3.42Å; E815-T819 WeakPolarHBondContact O-CG2 3.47Å; E815-T819 PolarHBondContact O-N 3.13Å; E815-T819 PolarHBondContact O-OG1 3.18Å
816A90.5Very high85.4Confident0 Ų037.4 Ų37.40%019%0.19CC..Hα-helixtrans-59.9-45.1172.700000112L777 I797 F801 I802 I812 R813 K818 T819 C820L777-A816 HydrophobicContact CD1-CB 4.03Å; I797-A816 HydrophobicContact CG2-CB 3.81Å; F801-A816 HydrophobicContact CB-CB 3.79Å; I802-A816 HydrophobicContact CG1-CB 4.05Å; I812-A816 WeakPolarHBondContact O-CB 3.43Å; I812-A816 PolarHBondContact O-N 3.07Å; R813-A816 PolarHBondContact O-N 3.26Å; A816-K818 PolarHBondContact O-N 2.82Å; A816-T819 WeakPolarHBondContact CA-OG1 3.31Å; A816-T819 PolarHBondContact O-N 3.11Å; A816-T819 PolarHBondContact O-OG1 3.33Å; A816-C820 WeakPolarHBondContact O-CB 3.3Å; A816-C820 PolarHBondContact O-N 3.25Å; A816-C820 PolarHBondContact O-SG 3.35Å
817V90.3Very high85.4Confident0.75 Ų0.7536.6 Ų36.61%0.00518%0.18CC..Hα-helixtrans-58.9-49.9175.8166.30000111.4I802 R813 E815 T819 C820 A821 L852 V864 C867 V868I802-V817 HydrophobicContact CG2-CG2 4.05Å; R813-V817 VanDerWaalsContact O-CG2 3.3Å; R813-V817 WeakPolarHBondContact O-CG2 3.28Å; R813-V817 PolarHBondContact O-N 3.27Å; E815-V817 PolarHBondContact O-N 3.12Å; V817-T819 VanDerWaalsContact C-N 3.32Å; V817-T819 PolarHBondContact O-N 3.32Å; V817-C820 PolarHBondContact O-N 3.25Å; V817-A821 WeakPolarHBondContact O-CB 3.35Å; V817-A821 PolarHBondContact O-N 3.03Å; V817-L852 HydrophobicContact CB-CD2 4.45Å; V817-L852 HydrophobicContact CG1-CD2 4.32Å; V817-L852 HydrophobicContact CG2-CD2 4.17Å; V817-V864 HydrophobicContact CG2-CG1 4.4Å; V817-C867 HydrophobicContact CG1-CB 4.45Å; V817-V868 HydrophobicContact CB-CG2 4.47Å; V817-V868 HydrophobicContact CG1-CB 4.34Å; V817-V868 HydrophobicContact CG1-CG2 3.68Å; V817-V868 HydrophobicContact CG2-CG2 3.93Å
818K89.1Confident85.2Confident74 Ų7436.6 Ų36.632%0.32218%0.179SC..Hα-helixtrans-60.7-44178.2-66.6171.4-156.8156.50111.7Y430 T723 L814 E815 A816 A821 H822 C867Y430-K818 WeakPolarHBondContact OH-CE 3.13Å; Y430-K818 PolarHBondContact OH-NZ 3.42Å; T723-K818 PolarHBondContact OG1-NZ 2.96Å; L814-K818 WeakPolarHBondContact O-CD 3.46Å; L814-K818 VanDerWaalsContact O-CE 3.25Å; L814-K818 WeakPolarHBondContact O-CE 3.37Å; L814-K818 WeakPolarHBondContact O-CG 3.45Å; L814-K818 PolarHBondContact O-N 3.34Å; E815-K818 PolarHBondContact O-N 3.33Å; E815-K818 WeakPolarHBondContact OE2-CD 3.39Å; E815-K818 WeakPolarHBondContact OE2-CE 3.47Å; E815-K818 IonicContact OE2-NZ 3.03Å; E815-K818 PolarHBondContact OE2-NZ 3.24Å; A816-K818 PolarHBondContact O-N 2.82Å; K818-A821 PolarHBondContact O-N 3.21Å; K818-H822 WeakPolarHBondContact O-CB 3.43Å; K818-H822 PolarHBondContact O-N 3.11Å; K818-C867 VanDerWaalsContact CE-SG 3.55Å; K818-C867 VanDerWaalsContact CG-SG 3.53Å
819T87.9Confident84.7Confident1.75 Ų1.7534.5 Ų34.51%0.01117%0.168CC..Hα-helixtrans-65.8-47.1-177.9-44.20000110.9L777 L780 I797 E815 A816 V817 A821 H822 L823L777-T819 VanDerWaalsContact C-CG2 3.41Å; L777-T819 HydrophobicContact CB-CG2 4.2Å; L777-T819 WeakPolarHBondContact O-CG2 3.35Å; L777-T819 PolarHBondContact O-OG1 3.24Å; L780-T819 HydrophobicContact CB-CG2 4.12Å; L780-T819 HydrophobicContact CD2-CG2 4.17Å; L780-T819 HydrophobicContact CG-CG2 4.39Å; I797-T819 HydrophobicContact CD1-CG2 4.2Å; E815-T819 HydrophobicContact CG-CG2 4.3Å; E815-T819 VanDerWaalsContact O-CB 3.3Å; E815-T819 WeakPolarHBondContact O-CB 3.42Å; E815-T819 WeakPolarHBondContact O-CG2 3.47Å; E815-T819 PolarHBondContact O-N 3.13Å; E815-T819 PolarHBondContact O-OG1 3.18Å; A816-T819 WeakPolarHBondContact CA-OG1 3.31Å; A816-T819 PolarHBondContact O-N 3.11Å; A816-T819 PolarHBondContact O-OG1 3.33Å; V817-T819 VanDerWaalsContact C-N 3.32Å; V817-T819 PolarHBondContact O-N 3.32Å; T819-A821 PolarHBondContact O-N 3.3Å; T819-H822 PolarHBondContact O-N 3.2Å; T819-L823 HydrophobicContact CG2-CD1 3.63Å; T819-L823 HydrophobicContact CG2-CG 4.28Å; T819-L823 WeakPolarHBondContact O-CB 3.4Å; T819-L823 WeakPolarHBondContact O-CG 3.4Å; T819-L823 PolarHBondContact O-N 3.19Å
820C88.4Confident83.6Confident0 Ų035.7 Ų35.70%018%0.178CC..Hα-helixtrans-60.7-46.9175-74.10000112.1I797 I802 A816 V817 H822 L823 M824 L852I797-C820 WeakPolarHBondContact CG2-SG 3.16Å; I802-C820 HydrophobicContact CD1-CB 4.2Å; A816-C820 WeakPolarHBondContact O-CB 3.3Å; A816-C820 PolarHBondContact O-N 3.25Å; A816-C820 PolarHBondContact O-SG 3.35Å; V817-C820 PolarHBondContact O-N 3.25Å; C820-H822 VanDerWaalsContact C-N 3.32Å; C820-H822 PolarHBondContact O-N 3.2Å; C820-L823 PolarHBondContact O-N 3.04Å; C820-M824 VanDerWaalsContact O-CG 3.25Å; C820-M824 WeakPolarHBondContact O-CG 3.36Å; C820-M824 PolarHBondContact O-N 3.23Å; C820-M824 VanDerWaalsContact O-N 3.14Å; C820-L852 HydrophobicContact CB-CD1 4.49Å; C820-L852 HydrophobicContact CB-CD2 4.46Å
821A86.8Confident82.2Confident5.75 Ų5.7534.7 Ų34.75%0.04818%0.176CC..Hα-helixtrans-60.2-41176.800000112.2V817 K818 T819 M824 F876V817-A821 WeakPolarHBondContact O-CB 3.35Å; V817-A821 PolarHBondContact O-N 3.03Å; K818-A821 PolarHBondContact O-N 3.21Å; T819-A821 PolarHBondContact O-N 3.3Å; A821-M824 PolarHBondContact O-N 2.76Å; A821-F876 HydrophobicContact CB-CZ 4.39Å; A821-F876 WeakPolarHBondContact O-CZ 3.47Å
822H85.9Confident80.9Confident104.75 Ų104.7537.6 Ų37.649%0.48519%0.19SC..Hα-helixtrans-66.9-44.9177.8-164.885.2000112.4G781 K818 T819 C820 M824 I825G781-H822 PolarHBondContact O-CD2 3.25Å; G781-H822 PolarHBondContact O-NE2 3.39Å; K818-H822 WeakPolarHBondContact O-CB 3.43Å; K818-H822 PolarHBondContact O-N 3.11Å; T819-H822 PolarHBondContact O-N 3.2Å; C820-H822 VanDerWaalsContact C-N 3.32Å; C820-H822 PolarHBondContact O-N 3.2Å; H822-M824 VanDerWaalsContact C-N 3.25Å; H822-M824 PolarHBondContact O-N 3.07Å; H822-I825 HydrophobicContact CB-CD1 4.46Å; H822-I825 VanDerWaalsContact O-CB 3.3Å; H822-I825 WeakPolarHBondContact O-CB 3.32Å; H822-I825 WeakPolarHBondContact O-CD1 2.92Å; H822-I825 WeakPolarHBondContact O-CG1 3.42Å; H822-I825 PolarHBondContact O-N 3.17Å; H822-I825 VanDerWaalsContact O-N 3.14Å
823L85.1Confident79.4Confident12 Ų1242.4 Ų42.46%0.06322%0.22CC..Hα-helixtrans-68.2-19.9-178.1-69.1173.6000113.8L780 L790 V794 T819 C820 P826L780-L823 HydrophobicContact CD2-CD1 3.7Å; L780-L823 HydrophobicContact CG-CD1 3.91Å; L780-L823 HydrophobicContact CG-CD2 4.46Å; L790-L823 HydrophobicContact CD1-CD2 3.61Å; V794-L823 HydrophobicContact CG2-CB 3.57Å; V794-L823 HydrophobicContact CG2-CD1 3.72Å; V794-L823 HydrophobicContact CG2-CG 4.3Å; T819-L823 HydrophobicContact CG2-CD1 3.63Å; T819-L823 HydrophobicContact CG2-CG 4.28Å; T819-L823 WeakPolarHBondContact O-CB 3.4Å; T819-L823 WeakPolarHBondContact O-CG 3.4Å; T819-L823 PolarHBondContact O-N 3.19Å; C820-L823 PolarHBondContact O-N 3.04Å; L823-P826 WeakPolarHBondContact O-CD 3.37Å
824M82.9Confident77.4Confident0 Ų048.5 Ų48.50%025%0.248CC..Hα-helixtrans-77.7-21.9173.7-70167.674.900113.3C820 A821 H822 P826 W827 L828 V845 V848 L849 L852 F876C820-M824 VanDerWaalsContact O-CG 3.25Å; C820-M824 WeakPolarHBondContact O-CG 3.36Å; C820-M824 PolarHBondContact O-N 3.23Å; C820-M824 VanDerWaalsContact O-N 3.14Å; A821-M824 PolarHBondContact O-N 2.76Å; H822-M824 VanDerWaalsContact C-N 3.25Å; H822-M824 PolarHBondContact O-N 3.07Å; M824-P826 VanDerWaalsContact C-CD 3.49Å; M824-W827 HydrophobicContact CG-CE3 4.31Å; M824-W827 HydrophobicContact CG-CZ3 4.25Å; M824-W827 WeakPolarHBondContact O-CB 3.25Å; M824-W827 PolarHBondContact O-N 3.23Å; M824-W827 VanDerWaalsContact O-N 3.15Å; M824-L828 HydrophobicContact CB-CD1 4.16Å; M824-L828 WeakPolarHBondContact O-CD1 3.42Å; M824-L828 WeakPolarHBondContact O-CG 3.38Å; M824-L828 PolarHBondContact O-N 3.3Å; M824-L828 VanDerWaalsContact O-N 3.1Å; M824-V845 HydrophobicContact CE-CB 4.26Å; M824-V845 HydrophobicContact CE-CG1 3.77Å; M824-V845 HydrophobicContact CE-CG2 4.3Å; M824-V845 WeakPolarHBondContact CE-O 3.47Å; M824-V848 HydrophobicContact CE-CB 4.29Å; M824-V848 HydrophobicContact CE-CG1 4.16Å; M824-V848 HydrophobicContact CG-CG1 4.42Å; M824-V848 HydrophobicContact SD-CB 4.2Å; M824-V848 HydrophobicContact SD-CG1 3.49Å; M824-V848 VanDerWaalsContact SD-CG1 3.56Å; M824-V848 WeakPolarHBondContact SD-CG1 3.3Å; M824-L849 HydrophobicContact CE-CB 4.31Å; M824-L852 HydrophobicContact SD-CD1 4.12Å; M824-F876 HydrophobicContact CB-CE1 4.34Å; M824-F876 HydrophobicContact CB-CZ 4.49Å; M824-F876 HydrophobicContact CE-CE1 4.27Å; M824-F876 HydrophobicContact SD-CE1 4.38Å
825I81.8Confident75.7Confident18 Ų1854.3 Ų54.39%0.09228%0.275CS..Hα-helixtrans-54.9-44.2-175.4-65.3163.9000113.3H822 W827 L828 K829 R875 F876H822-I825 HydrophobicContact CB-CD1 4.46Å; H822-I825 VanDerWaalsContact O-CB 3.3Å; H822-I825 WeakPolarHBondContact O-CB 3.32Å; H822-I825 WeakPolarHBondContact O-CD1 2.92Å; H822-I825 WeakPolarHBondContact O-CG1 3.42Å; H822-I825 PolarHBondContact O-N 3.17Å; H822-I825 VanDerWaalsContact O-N 3.14Å; I825-W827 VanDerWaalsContact C-N 3.33Å; I825-W827 PolarHBondContact O-N 3.09Å; I825-L828 PolarHBondContact O-N 3.34Å; I825-K829 HydrophobicContact CG2-CD 4.33Å; I825-K829 WeakPolarHBondContact O-CG 3.23Å; I825-K829 PolarHBondContact O-N 3.11Å; I825-K829 VanDerWaalsContact O-N 3.14Å; I825-R875 VanDerWaalsContact CD1-NH1 3.32Å; I825-R875 VanDerWaalsContact CD1-NH2 3.33Å; I825-R875 VanDerWaalsContact CG2-NH1 3.26Å; I825-F876 HydrophobicContact CG1-CE2 4.38Å
826P76.6Confident74Confident72.75 Ų72.7561.4 Ų61.447%0.47230%0.3SS..Hα-helixtrans-63.2-37.2178.9-23.335.8000112.9L823 M824 L828 K829 S830L823-P826 WeakPolarHBondContact O-CD 3.37Å; M824-P826 VanDerWaalsContact C-CD 3.49Å; P826-L828 VanDerWaalsContact C-N 3.34Å; P826-L828 PolarHBondContact O-N 3.25Å; P826-K829 PolarHBondContact O-N 3.2Å; P826-K829 VanDerWaalsContact O-N 3.15Å; P826-S830 PolarHBondContact O-N 3.23Å; P826-S830 VanDerWaalsContact O-N 3.16Å; P826-S830 PolarHBondContact O-OG 3.33Å; P826-S830 VanDerWaalsContact O-OG 3.09Å
827W75.4Confident72.3Confident51 Ų5167.9 Ų67.919%0.19333%0.326CS..Hα-helixtrans-69.1-39.1178.3-53.5-24.6000111.5A791 V794 M824 I825 K829 S830 T831 V845A791-W827 VanDerWaalsContact CA-CH2 3.46Å; A791-W827 HydrophobicContact CB-CH2 4.1Å; A791-W827 HydrophobicContact CB-CZ2 3.9Å; V794-W827 HydrophobicContact CB-CH2 3.8Å; V794-W827 HydrophobicContact CB-CZ3 4.27Å; V794-W827 HydrophobicContact CG1-CH2 4.27Å; V794-W827 HydrophobicContact CG1-CZ3 4.23Å; V794-W827 HydrophobicContact CG2-CH2 3.56Å; V794-W827 HydrophobicContact CG2-CZ2 4.35Å; V794-W827 HydrophobicContact CG2-CZ3 4.22Å; M824-W827 HydrophobicContact CG-CE3 4.31Å; M824-W827 HydrophobicContact CG-CZ3 4.25Å; M824-W827 WeakPolarHBondContact O-CB 3.25Å; M824-W827 PolarHBondContact O-N 3.23Å; M824-W827 VanDerWaalsContact O-N 3.15Å; I825-W827 VanDerWaalsContact C-N 3.33Å; I825-W827 PolarHBondContact O-N 3.09Å; W827-K829 VanDerWaalsContact C-N 3.29Å; W827-K829 PolarHBondContact O-N 3.02Å; W827-S830 PolarHBondContact O-N 3.13Å; W827-T831 WeakPolarHBondContact O-CG2 3.29Å; W827-T831 PolarHBondContact O-N 3.35Å; W827-T831 PolarHBondContact O-OG1 2.92Å; W827-V845 HydrophobicContact CB-CG2 4.2Å; W827-V845 HydrophobicContact CE3-CG2 3.8Å
828L75.2Confident70.9Confident9.5 Ų9.568.8 Ų68.85%0.0533%0.334CS..Hα-helixtrans-67-21.5175.1-68.7163000113.9M824 I825 P826 T831 V845 F876 H879M824-L828 HydrophobicContact CB-CD1 4.16Å; M824-L828 WeakPolarHBondContact O-CD1 3.42Å; M824-L828 WeakPolarHBondContact O-CG 3.38Å; M824-L828 PolarHBondContact O-N 3.3Å; M824-L828 VanDerWaalsContact O-N 3.1Å; I825-L828 PolarHBondContact O-N 3.34Å; P826-L828 VanDerWaalsContact C-N 3.34Å; P826-L828 PolarHBondContact O-N 3.25Å; L828-T831 PolarHBondContact O-OG1 3.3Å; L828-V845 HydrophobicContact CD2-CG1 4.09Å; L828-F876 HydrophobicContact CD1-CD1 3.56Å; L828-F876 VanDerWaalsContact CD1-CD1 3.48Å; L828-F876 HydrophobicContact CD1-CD2 4.36Å; L828-F876 HydrophobicContact CD1-CE1 3.39Å; L828-F876 VanDerWaalsContact CD1-CE1 3.44Å; L828-F876 HydrophobicContact CD1-CE2 4.23Å; L828-F876 HydrophobicContact CD1-CG 4.06Å; L828-F876 HydrophobicContact CD1-CZ 3.75Å; L828-F876 HydrophobicContact CD2-CD1 4.29Å; L828-H879 WeakPolarHBondContact CD2-CD2 3.28Å
829K71.2Confident69.9Low113 Ų11373.8 Ų73.849%0.49135%0.35SS..Hα-helixtrans-83.4-36.9171.8-72.8-178.2174.6-172.20112.2I825 P826 W827 T831 E832 Y1175I825-K829 HydrophobicContact CG2-CD 4.33Å; I825-K829 WeakPolarHBondContact O-CG 3.23Å; I825-K829 PolarHBondContact O-N 3.11Å; I825-K829 VanDerWaalsContact O-N 3.14Å; P826-K829 PolarHBondContact O-N 3.2Å; P826-K829 VanDerWaalsContact O-N 3.15Å; W827-K829 VanDerWaalsContact C-N 3.29Å; W827-K829 PolarHBondContact O-N 3.02Å; K829-T831 PolarHBondContact O-N 3.1Å; K829-T831 VanDerWaalsContact O-N 3.15Å; K829-E832 PolarHBondContact O-N 3.14Å; K829-Y1175 PolarHBondContact NZ-OH 3.25Å
830S63.3Low69.2Low70.5 Ų70.578 Ų7849%0.49338%0.378SS..Hα-helixtrans-64.6-20.4-179.9-57.90000113.1P826 W827 E832 T833P826-S830 PolarHBondContact O-N 3.23Å; P826-S830 VanDerWaalsContact O-N 3.16Å; P826-S830 PolarHBondContact O-OG 3.33Å; P826-S830 VanDerWaalsContact O-OG 3.09Å; W827-S830 PolarHBondContact O-N 3.13Å; S830-E832 VanDerWaalsContact C-N 3.31Å; S830-E832 PolarHBondContact O-N 3.18Å; S830-T833 PolarHBondContact O-N 3.39Å; S830-T833 PolarHBondContact O-OG1 3.16Å; S830-T833 VanDerWaalsContact O-OG1 3.1Å
831T56.9Low68.3Low35.25 Ų35.2579.8 Ų79.822%0.21639%0.393CS..THydrogen-bonded Turntrans-75.4-18.6179.344.90000114.5W827 L828 K829 T833 L842W827-T831 WeakPolarHBondContact O-CG2 3.29Å; W827-T831 PolarHBondContact O-N 3.35Å; W827-T831 PolarHBondContact O-OG1 2.92Å; L828-T831 PolarHBondContact O-OG1 3.3Å; K829-T831 PolarHBondContact O-N 3.1Å; K829-T831 VanDerWaalsContact O-N 3.15Å; T831-T833 VanDerWaalsContact C-N 3.3Å; T831-T833 PolarHBondContact O-N 2.93Å; T831-L842 HydrophobicContact CG2-CD1 4.38Å; T831-L842 HydrophobicContact CG2-CD2 3.42Å; T831-L842 VanDerWaalsContact CG2-CD2 3.45Å; T831-L842 HydrophobicContact CG2-CG 4.13Å
832E57Low67.7Low155.75 Ų155.7581.9 Ų81.973%0.72840%0.403SS*.THydrogen-bonded Turntrans-69.3-25.6175.9-68.9-180169.300112.2K829 S830 L878K829-E832 PolarHBondContact O-N 3.14Å; S830-E832 VanDerWaalsContact C-N 3.31Å; S830-E832 PolarHBondContact O-N 3.18Å; E832-L878 HydrophobicContact CG-CD1 4.39Å
833T55.9Low67.4Low107.75 Ų107.7581.9 Ų81.966%0.66141%0.406SS*.THydrogen-bonded Turntrans-97.3-33.3-173.740.30000114.4S830 T831 Q835S830-T833 PolarHBondContact O-N 3.39Å; S830-T833 PolarHBondContact O-OG1 3.16Å; S830-T833 VanDerWaalsContact O-OG1 3.1Å; T831-T833 VanDerWaalsContact C-N 3.3Å; T831-T833 PolarHBondContact O-N 2.93Å; T833-Q835 PolarHBondContact O-N 3.22Å
834Q48.7Very low67.2Low131 Ų13182.1 Ų82.161%0.61241%0.408SS*.  trans-133.8124.5-177.7-65.9-171-0.600114.2Y837Q834-Y837 HydrophobicContact CB-CE1 4.08Å; Q834-Y837 HydrophobicContact CB-CE2 4.31Å; Q834-Y837 WeakPolarHBondContact CB-OH 3.39Å; Q834-Y837 VanDerWaalsContact OE1-CE1 3.28Å; Q834-Y837 PolarHBondContact OE1-OH 3.18Å
835Q54Low67.3Low150.25 Ų150.2582.2 Ų82.270%0.70241%0.409SS*.  trans-106.11-160.6-68.4180-14.900116.8T833 Y837 A838T833-Q835 PolarHBondContact O-N 3.22Å; Q835-Y837 HydrophobicContact CB-CD2 3.99Å; Q835-Y837 HydrophobicContact CB-CE1 4.3Å; Q835-Y837 HydrophobicContact CB-CE2 3.55Å; Q835-Y837 VanDerWaalsContact CD-OH 3.28Å; Q835-Y837 HydrophobicContact CG-CE2 3.95Å; Q835-Y837 PolarHBondContact NE2-OH 3.44Å; Q835-Y837 PolarHBondContact O-N 3.15Å; Q835-Y837 VanDerWaalsContact O-N 3.16Å; Q835-A838 WeakPolarHBondContact O-CB 3.36Å; Q835-A838 PolarHBondContact O-N 3.11Å
836W51.8Low67.4Low174.75 Ų174.7582.5 Ų82.566%0.66241%0.414SS*.SBendtrans-92.3-38.3-166.262.8-92.9000115.3L703 A838 R839L703-W836 VanDerWaalsContact C-CH2 3.47Å; L703-W836 WeakPolarHBondContact O-CH2 3.3Å; W836-A838 VanDerWaalsContact C-N 3.35Å; W836-A838 PolarHBondContact O-N 3.11Å; W836-R839 WeakPolarHBondContact O-CG 3.28Å; W836-R839 PolarHBondContact O-N 3.47Å
837Y54Low67.9Low137.25 Ų137.2583.1 Ų83.154%0.53841%0.413SS..THydrogen-bonded Turntrans-70.1-19.3177.913.9-87.9000113.5Q834 Q835 R839 P840Q834-Y837 HydrophobicContact CB-CE1 4.08Å; Q834-Y837 HydrophobicContact CB-CE2 4.31Å; Q834-Y837 WeakPolarHBondContact CB-OH 3.39Å; Q834-Y837 VanDerWaalsContact OE1-CE1 3.28Å; Q834-Y837 PolarHBondContact OE1-OH 3.18Å; Q835-Y837 HydrophobicContact CB-CD2 3.99Å; Q835-Y837 HydrophobicContact CB-CE1 4.3Å; Q835-Y837 HydrophobicContact CB-CE2 3.55Å; Q835-Y837 VanDerWaalsContact CD-OH 3.28Å; Q835-Y837 HydrophobicContact CG-CE2 3.95Å; Q835-Y837 PolarHBondContact NE2-OH 3.44Å; Q835-Y837 PolarHBondContact O-N 3.15Å; Q835-Y837 VanDerWaalsContact O-N 3.16Å; Y837-R839 VanDerWaalsContact C-N 3.3Å; Y837-R839 PolarHBondContact O-N 3.29Å; Y837-P840 WeakPolarHBondContact O-CD 3.33Å
838A61.1Low68.5Low20.25 Ų20.2580.9 Ų80.917%0.16741%0.405CS..THydrogen-bonded Turntrans-77.4-7.6-178.700000114.6Q835 W836 A841 L842Q835-A838 WeakPolarHBondContact O-CB 3.36Å; Q835-A838 PolarHBondContact O-N 3.11Å; W836-A838 VanDerWaalsContact C-N 3.35Å; W836-A838 PolarHBondContact O-N 3.11Å; A838-A841 WeakPolarHBondContact O-CA 3.28Å; A838-A841 WeakPolarHBondContact O-CB 3.39Å; A838-A841 PolarHBondContact O-N 3.19Å; A838-A841 VanDerWaalsContact O-N 3.13Å; A838-L842 HydrophobicContact CB-CD1 4.41Å; A838-L842 HydrophobicContact CB-CG 4.38Å; A838-L842 WeakPolarHBondContact O-CG 3.28Å; A838-L842 PolarHBondContact O-N 3.13Å
839R68.3Low69.2Low178.5 Ų178.580.5 Ų80.567%0.67440%0.403SS*.Hα-helixtrans-53-45.2-173.1-75.8-175.7175.8-164.4-0.4115.1W836 Y837 A841 L842 N843W836-R839 WeakPolarHBondContact O-CG 3.28Å; W836-R839 PolarHBondContact O-N 3.47Å; Y837-R839 VanDerWaalsContact C-N 3.3Å; Y837-R839 PolarHBondContact O-N 3.29Å; R839-A841 VanDerWaalsContact C-N 3.32Å; R839-A841 PolarHBondContact O-N 3.29Å; R839-L842 WeakPolarHBondContact O-CB 3.33Å; R839-L842 PolarHBondContact O-N 3.02Å; R839-N843 PolarHBondContact O-N 3.07Å; R839-N843 VanDerWaalsContact O-N 3.09Å; R839-N843 PolarHBondContact O-OD1 2.87Å
840P72.3Confident70.1Confident91 Ų9177.1 Ų77.159%0.59139%0.391SS*.Hα-helixtrans-63.2-37.7177.1-22.534.7000112.7Y837 N843 T844Y837-P840 WeakPolarHBondContact O-CD 3.33Å; P840-N843 PolarHBondContact O-N 3.47Å; P840-T844 WeakPolarHBondContact O-CG2 3.3Å; P840-T844 PolarHBondContact O-N 3.21Å; P840-T844 VanDerWaalsContact O-N 3.08Å; P840-T844 PolarHBondContact O-OG1 2.85Å
841A70.9Confident71.4Confident37 Ų3777.9 Ų77.931%0.30639%0.385SS..Hα-helixtrans-68.1-40.1176.300000111.5A838 R839 N843 T844 V845A838-A841 WeakPolarHBondContact O-CA 3.28Å; A838-A841 WeakPolarHBondContact O-CB 3.39Å; A838-A841 PolarHBondContact O-N 3.19Å; A838-A841 VanDerWaalsContact O-N 3.13Å; R839-A841 VanDerWaalsContact C-N 3.32Å; R839-A841 PolarHBondContact O-N 3.29Å; A841-N843 VanDerWaalsContact C-N 3.35Å; A841-N843 PolarHBondContact O-N 3.33Å; A841-T844 WeakPolarHBondContact CA-OG1 3.32Å; A841-T844 PolarHBondContact O-N 3.16Å; A841-T844 VanDerWaalsContact O-N 3.15Å; A841-T844 PolarHBondContact O-OG1 3.1Å; A841-V845 WeakPolarHBondContact O-CG2 3.34Å; A841-V845 PolarHBondContact O-N 3.16Å
842L73.9Confident73Confident49.75 Ų49.7576.2 Ų76.226%0.2638%0.375SS..Hα-helixtrans-61.2-42175.2-73.8173.4000112.7T831 A838 R839 T844 V845 A846 H879T831-L842 HydrophobicContact CG2-CD1 4.38Å; T831-L842 HydrophobicContact CG2-CD2 3.42Å; T831-L842 VanDerWaalsContact CG2-CD2 3.45Å; T831-L842 HydrophobicContact CG2-CG 4.13Å; A838-L842 HydrophobicContact CB-CD1 4.41Å; A838-L842 HydrophobicContact CB-CG 4.38Å; A838-L842 WeakPolarHBondContact O-CG 3.28Å; A838-L842 PolarHBondContact O-N 3.13Å; R839-L842 WeakPolarHBondContact O-CB 3.33Å; R839-L842 PolarHBondContact O-N 3.02Å; L842-T844 VanDerWaalsContact C-N 3.34Å; L842-T844 PolarHBondContact O-N 3.05Å; L842-V845 WeakPolarHBondContact O-CB 3.42Å; L842-V845 PolarHBondContact O-N 3.12Å; L842-A846 PolarHBondContact O-N 3.06Å; L842-H879 VanDerWaalsContact CD2-CE1 3.47Å; L842-H879 WeakPolarHBondContact CD2-CE1 3.16Å
843N80Confident74.7Confident105.25 Ų105.2568.8 Ų68.856%0.56334%0.34SS*.Hα-helixtrans-61-45.1173.9-693.5000110.6R839 P840 A841 V845 A846 D847R839-N843 PolarHBondContact O-N 3.07Å; R839-N843 VanDerWaalsContact O-N 3.09Å; R839-N843 PolarHBondContact O-OD1 2.87Å; P840-N843 PolarHBondContact O-N 3.47Å; A841-N843 VanDerWaalsContact C-N 3.35Å; A841-N843 PolarHBondContact O-N 3.33Å; N843-V845 VanDerWaalsContact C-N 3.3Å; N843-V845 PolarHBondContact O-N 3.22Å; N843-A846 WeakPolarHBondContact O-CB 3.26Å; N843-A846 PolarHBondContact O-N 3.3Å; N843-A846 VanDerWaalsContact O-N 3.12Å; N843-D847 WeakPolarHBondContact O-CB 3.34Å; N843-D847 PolarHBondContact O-N 3.24Å
844T80.5Confident76.4Confident15.75 Ų15.7566.1 Ų66.110%0.09732%0.323CS..Hα-helixtrans-64.4-32.8176.457.90000113.7P840 A841 L842 D847 V848P840-T844 WeakPolarHBondContact O-CG2 3.3Å; P840-T844 PolarHBondContact O-N 3.21Å; P840-T844 VanDerWaalsContact O-N 3.08Å; P840-T844 PolarHBondContact O-OG1 2.85Å; A841-T844 WeakPolarHBondContact CA-OG1 3.32Å; A841-T844 PolarHBondContact O-N 3.16Å; A841-T844 VanDerWaalsContact O-N 3.15Å; A841-T844 PolarHBondContact O-OG1 3.1Å; L842-T844 VanDerWaalsContact C-N 3.34Å; L842-T844 PolarHBondContact O-N 3.05Å; T844-D847 PolarHBondContact O-N 3.38Å; T844-V848 VanDerWaalsContact O-CB 3.29Å; T844-V848 WeakPolarHBondContact O-CB 3.29Å; T844-V848 VanDerWaalsContact O-CG2 3.22Å; T844-V848 WeakPolarHBondContact O-CG2 3.38Å; T844-V848 PolarHBondContact O-N 3.06Å
845V83.7Confident78.4Confident2 Ų260.5 Ų60.51%0.01230%0.298CS..Hα-helixtrans-64.6-44.5173.81650000110.1M824 W827 L828 A841 L842 N843 V848 L849M824-V845 HydrophobicContact CE-CB 4.26Å; M824-V845 HydrophobicContact CE-CG1 3.77Å; M824-V845 HydrophobicContact CE-CG2 4.3Å; M824-V845 WeakPolarHBondContact CE-O 3.47Å; W827-V845 HydrophobicContact CB-CG2 4.2Å; W827-V845 HydrophobicContact CE3-CG2 3.8Å; L828-V845 HydrophobicContact CD2-CG1 4.09Å; A841-V845 WeakPolarHBondContact O-CG2 3.34Å; A841-V845 PolarHBondContact O-N 3.16Å; L842-V845 WeakPolarHBondContact O-CB 3.42Å; L842-V845 PolarHBondContact O-N 3.12Å; N843-V845 VanDerWaalsContact C-N 3.3Å; N843-V845 PolarHBondContact O-N 3.22Å; V845-V848 PolarHBondContact O-N 3.29Å; V845-L849 WeakPolarHBondContact O-CB 3.41Å; V845-L849 PolarHBondContact O-N 3.2Å
846A84.6Confident80.1Confident24 Ų2453.3 Ų53.320%0.19826%0.264CS..Hα-helixtrans-65.5-42.4176.200000112.4L842 N843 V848 L849 N850L842-A846 PolarHBondContact O-N 3.06Å; N843-A846 WeakPolarHBondContact O-CB 3.26Å; N843-A846 PolarHBondContact O-N 3.3Å; N843-A846 VanDerWaalsContact O-N 3.12Å; A846-V848 VanDerWaalsContact C-N 3.34Å; A846-V848 PolarHBondContact O-N 3.28Å; A846-L849 PolarHBondContact O-N 3.08Å; A846-N850 WeakPolarHBondContact O-CB 3.45Å; A846-N850 PolarHBondContact O-N 3.22Å; A846-N850 PolarHBondContact O-ND2 3.22Å
847D86.5Confident82Confident85 Ų8547 Ų4746%0.45524%0.243SC..Hα-helixtrans-60.2-46.6177.2-65.5-25.3000111.6R795 N843 T844 K851R795-D847 IonicContact NH1-OD2 3.81Å; N843-D847 WeakPolarHBondContact O-CB 3.34Å; N843-D847 PolarHBondContact O-N 3.24Å; T844-D847 PolarHBondContact O-N 3.38Å; D847-K851 WeakPolarHBondContact O-CG 3.36Å; D847-K851 PolarHBondContact O-N 3.15Å; D847-K851 VanDerWaalsContact O-N 3.15Å
848V88.4Confident83.7Confident5 Ų543.4 Ų43.43%0.0324%0.238CC..Hα-helixtrans-69.5-39.9179173.50000110.9V794 C798 M824 T844 V845 A846 K851 L852V794-V848 HydrophobicContact CG1-CG1 4.09Å; V794-V848 HydrophobicContact CG1-CG2 3.98Å; C798-V848 HydrophobicContact CB-CG1 4.45Å; C798-V848 HydrophobicContact CB-CG2 4.28Å; M824-V848 HydrophobicContact CE-CB 4.29Å; M824-V848 HydrophobicContact CE-CG1 4.16Å; M824-V848 HydrophobicContact CG-CG1 4.42Å; M824-V848 HydrophobicContact SD-CB 4.2Å; M824-V848 HydrophobicContact SD-CG1 3.49Å; M824-V848 VanDerWaalsContact SD-CG1 3.56Å; M824-V848 WeakPolarHBondContact SD-CG1 3.3Å; T844-V848 VanDerWaalsContact O-CB 3.29Å; T844-V848 WeakPolarHBondContact O-CB 3.29Å; T844-V848 VanDerWaalsContact O-CG2 3.22Å; T844-V848 WeakPolarHBondContact O-CG2 3.38Å; T844-V848 PolarHBondContact O-N 3.06Å; V845-V848 PolarHBondContact O-N 3.29Å; A846-V848 VanDerWaalsContact C-N 3.34Å; A846-V848 PolarHBondContact O-N 3.28Å; V848-K851 PolarHBondContact O-N 3.17Å; V848-L852 HydrophobicContact CG1-CD1 4Å; V848-L852 HydrophobicContact CG1-CG 4.36Å; V848-L852 WeakPolarHBondContact O-CB 3.35Å; V848-L852 WeakPolarHBondContact O-CG 3.42Å; V848-L852 PolarHBondContact O-N 3.32Å
849L89.7Confident85.1Confident0.5 Ų0.542.5 Ų42.50%0.00323%0.231CC..Hα-helixtrans-64.8-41.2178.3-172.758.6000111.9M824 V845 A846 K851 L852 L853 F872 F876 H879 L880M824-L849 HydrophobicContact CE-CB 4.31Å; V845-L849 WeakPolarHBondContact O-CB 3.41Å; V845-L849 PolarHBondContact O-N 3.2Å; A846-L849 PolarHBondContact O-N 3.08Å; L849-K851 VanDerWaalsContact C-N 3.32Å; L849-K851 PolarHBondContact O-N 3.31Å; L849-L852 PolarHBondContact O-N 3.07Å; L849-L853 HydrophobicContact CD1-CD1 4.42Å; L849-L853 HydrophobicContact CD1-CG 4.45Å; L849-L853 HydrophobicContact CG-CD1 4.07Å; L849-L853 WeakPolarHBondContact O-CB 3.4Å; L849-L853 VanDerWaalsContact O-CG 3.31Å; L849-L853 WeakPolarHBondContact O-CG 3.23Å; L849-L853 PolarHBondContact O-N 3.11Å; L849-F872 HydrophobicContact CD1-CD1 4.29Å; L849-F872 HydrophobicContact CD1-CE1 3.49Å; L849-F872 VanDerWaalsContact CD1-CE1 3.46Å; L849-F872 HydrophobicContact CD1-CZ 3.8Å; L849-F876 HydrophobicContact CD1-CD1 4.45Å; L849-H879 HydrophobicContact CD2-CB 3.91Å; L849-L880 HydrophobicContact CD1-CD2 4.05Å; L849-L880 HydrophobicContact CD2-CD2 4.08Å; L849-L880 HydrophobicContact CD2-CG 4.33Å; L849-L880 HydrophobicContact CG-CD2 4.36Å
850N90.5Very high86.1Confident43.5 Ų43.537.3 Ų37.323%0.23322%0.219CC..Hα-helixtrans-61-42.5173.6-83.6-61.7000112.2A846 L853 T854 H885 Y888A846-N850 WeakPolarHBondContact O-CB 3.45Å; A846-N850 PolarHBondContact O-N 3.22Å; A846-N850 PolarHBondContact O-ND2 3.22Å; N850-L853 PolarHBondContact O-N 3.25Å; N850-T854 WeakPolarHBondContact O-CB 3.23Å; N850-T854 PolarHBondContact O-N 3.03Å; N850-T854 PolarHBondContact O-OG1 3.31Å; N850-H885 PolarHBondContact ND2-NE2 2.95Å; N850-H885 VanDerWaalsContact ND2-NE2 3.18Å; N850-H885 PolarHBondContact OD1-CD2 3.29Å; N850-H885 VanDerWaalsContact OD1-CD2 3.28Å; N850-H885 PolarHBondContact OD1-NE2 3.1Å; N850-Y888 WeakPolarHBondContact OD1-CE2 3.33Å
851K89.7Confident86.9Confident85.75 Ų85.7534.8 Ų34.837%0.37320%0.201SC..Hα-helixtrans-65.6-43.7176-73.2174.1179.3176.30112.1C798 D799 D847 V848 L849 T854 V855C798-K851 VanDerWaalsContact SG-CB 3.52Å; C798-K851 WeakPolarHBondContact SG-CB 3.21Å; C798-K851 WeakPolarHBondContact SG-CD 3.44Å; D799-K851 IonicContact OD1-NZ 3.34Å; D799-K851 PolarHBondContact OD1-NZ 2.95Å; D847-K851 WeakPolarHBondContact O-CG 3.36Å; D847-K851 PolarHBondContact O-N 3.15Å; D847-K851 VanDerWaalsContact O-N 3.15Å; V848-K851 PolarHBondContact O-N 3.17Å; L849-K851 VanDerWaalsContact C-N 3.32Å; L849-K851 PolarHBondContact O-N 3.31Å; K851-T854 WeakPolarHBondContact O-CB 3.42Å; K851-T854 PolarHBondContact O-N 3.29Å; K851-V855 VanDerWaalsContact O-CG2 3.28Å; K851-V855 WeakPolarHBondContact O-CG2 3.3Å; K851-V855 PolarHBondContact O-N 3Å; K851-V855 VanDerWaalsContact O-N 3.08Å
852L91.9Very high87.8Confident1 Ų135.2 Ų35.21%0.00520%0.201CC..Hα-helixtrans-60.1-46.9174.3-75.5171000111.9I802 V817 C820 M824 V848 L849 T854 V855 G856 V868 F872I802-L852 HydrophobicContact CD1-CD2 3.76Å; I802-L852 HydrophobicContact CD1-CG 4.44Å; I802-L852 HydrophobicContact CG2-CD2 4.32Å; V817-L852 HydrophobicContact CB-CD2 4.45Å; V817-L852 HydrophobicContact CG1-CD2 4.32Å; V817-L852 HydrophobicContact CG2-CD2 4.17Å; C820-L852 HydrophobicContact CB-CD1 4.49Å; C820-L852 HydrophobicContact CB-CD2 4.46Å; M824-L852 HydrophobicContact SD-CD1 4.12Å; V848-L852 HydrophobicContact CG1-CD1 4Å; V848-L852 HydrophobicContact CG1-CG 4.36Å; V848-L852 WeakPolarHBondContact O-CB 3.35Å; V848-L852 WeakPolarHBondContact O-CG 3.42Å; V848-L852 PolarHBondContact O-N 3.32Å; L849-L852 PolarHBondContact O-N 3.07Å; L852-T854 VanDerWaalsContact C-N 3.34Å; L852-T854 PolarHBondContact O-N 3.09Å; L852-V855 PolarHBondContact O-N 3.17Å; L852-G856 PolarHBondContact O-N 3.14Å; L852-V868 WeakPolarHBondContact O-CG1 3.3Å; L852-F872 HydrophobicContact CB-CZ 4.24Å; L852-F872 HydrophobicContact CD1-CE1 4.37Å
853L92.2Very high88.6Confident0 Ų036.4 Ų36.40%021%0.208CC..Hα-helixtrans-64-38177.5-75.1168000112.4L849 N850 V855 G856 I857 F869 F872 L880 H885 Y888 L889L849-L853 HydrophobicContact CD1-CD1 4.42Å; L849-L853 HydrophobicContact CD1-CG 4.45Å; L849-L853 HydrophobicContact CG-CD1 4.07Å; L849-L853 WeakPolarHBondContact O-CB 3.4Å; L849-L853 VanDerWaalsContact O-CG 3.31Å; L849-L853 WeakPolarHBondContact O-CG 3.23Å; L849-L853 PolarHBondContact O-N 3.11Å; N850-L853 PolarHBondContact O-N 3.25Å; L853-V855 VanDerWaalsContact C-N 3.31Å; L853-V855 PolarHBondContact O-N 2.88Å; L853-G856 PolarHBondContact O-N 2.95Å; L853-I857 PolarHBondContact O-N 3.35Å; L853-F869 HydrophobicContact CD2-CE1 4.24Å; L853-F872 HydrophobicContact CD2-CE2 3.61Å; L853-F872 HydrophobicContact CD2-CZ 3.99Å; L853-F872 HydrophobicContact CG-CE2 4.33Å; L853-F872 HydrophobicContact CG-CZ 4.21Å; L853-L880 HydrophobicContact CD1-CD2 4.13Å; L853-L880 HydrophobicContact CD2-CD2 4.26Å; L853-H885 HydrophobicContact CD1-CB 3.71Å; L853-Y888 HydrophobicContact CB-CD1 4.09Å; L853-Y888 HydrophobicContact CB-CD2 4.2Å; L853-Y888 HydrophobicContact CB-CE1 4.31Å; L853-Y888 HydrophobicContact CB-CG 3.96Å; L853-Y888 HydrophobicContact CD1-CD2 4.24Å; L853-Y888 HydrophobicContact CD1-CG 4.32Å; L853-L889 HydrophobicContact CD2-CD2 4.19Å; L853-L889 HydrophobicContact CD2-CG 4.48Å
854T91.6Very high89.1Confident50.75 Ų50.7531.4 Ų31.431%0.31118%0.181SC..Hα-helixtrans-59.7-49.1174.1-59.40000110.5N850 K851 L852 G856 I857 S858N850-T854 WeakPolarHBondContact O-CB 3.23Å; N850-T854 PolarHBondContact O-N 3.03Å; N850-T854 PolarHBondContact O-OG1 3.31Å; K851-T854 WeakPolarHBondContact O-CB 3.42Å; K851-T854 PolarHBondContact O-N 3.29Å; L852-T854 VanDerWaalsContact C-N 3.34Å; L852-T854 PolarHBondContact O-N 3.09Å; T854-G856 VanDerWaalsContact C-N 3.28Å; T854-G856 PolarHBondContact O-N 3.11Å; T854-I857 PolarHBondContact O-N 3.03Å; T854-S858 VanDerWaalsContact O-CB 3.31Å; T854-S858 WeakPolarHBondContact O-CB 3.35Å; T854-S858 PolarHBondContact O-N 3.12Å; T854-S858 PolarHBondContact O-OG 3.22Å; T854-S858 VanDerWaalsContact O-OG 3.09Å
855V90.5Very high89.7Confident12.25 Ų12.2531.2 Ų31.27%0.07418%0.178CC..Hα-helixtrans-66.5-33.8177172.50000111.9I802 K851 L852 L853 I857 S858 D859 V864 V868I802-V855 HydrophobicContact CB-CG2 4.44Å; I802-V855 HydrophobicContact CG2-CB 4.04Å; I802-V855 HydrophobicContact CG2-CG1 4Å; I802-V855 HydrophobicContact CG2-CG2 3.78Å; I802-V855 VanDerWaalsContact CG2-CG2 3.44Å; I802-V855 WeakPolarHBondContact O-CG1 3.32Å; K851-V855 VanDerWaalsContact O-CG2 3.28Å; K851-V855 WeakPolarHBondContact O-CG2 3.3Å; K851-V855 PolarHBondContact O-N 3Å; K851-V855 VanDerWaalsContact O-N 3.08Å; L852-V855 PolarHBondContact O-N 3.17Å; L853-V855 VanDerWaalsContact C-N 3.31Å; L853-V855 PolarHBondContact O-N 2.88Å; V855-I857 PolarHBondContact O-N 3.18Å; V855-I857 VanDerWaalsContact O-N 3.12Å; V855-S858 PolarHBondContact O-N 3.04Å; V855-D859 HydrophobicContact CG1-CB 4.04Å; V855-D859 VanDerWaalsContact O-CB 3.31Å; V855-D859 WeakPolarHBondContact O-CB 3.35Å; V855-D859 PolarHBondContact O-N 3.26Å; V855-V864 HydrophobicContact CG1-CG1 4.06Å; V855-V868 HydrophobicContact CG1-CG2 4.29Å
856G89.9Confident90.1Very high0 Ų034.9 Ų34.90%019%0.192CC..Hα-helixtrans-57.9-18.5172.300000114.7L852 L853 T854 R865 F869L852-G856 PolarHBondContact O-N 3.14Å; L853-G856 PolarHBondContact O-N 2.95Å; T854-G856 VanDerWaalsContact C-N 3.28Å; T854-G856 PolarHBondContact O-N 3.11Å; G856-R865 VanDerWaalsContact O-CB 3.31Å; G856-R865 WeakPolarHBondContact O-CB 3.43Å; G856-R865 VanDerWaalsContact O-CD 3.28Å; G856-R865 WeakPolarHBondContact O-CD 3.2Å; G856-R865 VanDerWaalsContact O-CG 3.27Å; G856-R865 WeakPolarHBondContact O-CG 3.31Å; G856-F869 VanDerWaalsContact O-CE2 3.3Å; G856-F869 WeakPolarHBondContact O-CE2 3.45Å; G856-F869 WeakPolarHBondContact O-CZ 3.22Å
857I91.6Very high90.4Very high43.25 Ų43.2534.3 Ų34.322%0.22219%0.186CC..Hα-helixtrans-112.5-35.6178.6-65.4159.7000112.2L853 T854 V855 F869 Y888 L891 A892L853-I857 PolarHBondContact O-N 3.35Å; T854-I857 PolarHBondContact O-N 3.03Å; V855-I857 PolarHBondContact O-N 3.18Å; V855-I857 VanDerWaalsContact O-N 3.12Å; I857-F869 HydrophobicContact CG1-CZ 4.48Å; I857-Y888 HydrophobicContact CD1-CD1 3.69Å; I857-Y888 HydrophobicContact CD1-CG 4.12Å; I857-Y888 VanDerWaalsContact CD1-O 3.28Å; I857-Y888 WeakPolarHBondContact CD1-O 3.37Å; I857-L891 HydrophobicContact CD1-CB 4.26Å; I857-L891 HydrophobicContact CD1-CD2 3.99Å; I857-L891 HydrophobicContact CD1-CG 4.32Å; I857-L891 HydrophobicContact CG2-CD2 3.93Å; I857-L891 HydrophobicContact CG2-CG 4.25Å; I857-A892 HydrophobicContact CD1-CB 4.43Å; I857-A892 HydrophobicContact CG1-CB 4.03Å
858S89.9Confident90.7Very high60 Ų6030.3 Ų30.342%0.4217%0.165SC..Hα-helixtrans-95.8-13.8-171.464.50000115.5T854 V855T854-S858 VanDerWaalsContact O-CB 3.31Å; T854-S858 WeakPolarHBondContact O-CB 3.35Å; T854-S858 PolarHBondContact O-N 3.12Å; T854-S858 PolarHBondContact O-OG 3.22Å; T854-S858 VanDerWaalsContact O-OG 3.09Å; V855-S858 PolarHBondContact O-N 3.04Å
859D90.7Very high90.8Very high3.25 Ų3.2530.1 Ų30.12%0.01716%0.163CC..  trans-70130.3-179-160.2-68.2000111.2R813 V855 D861 V864 R865R813-D859 IonicContact CZ-OD1 3.5Å; R813-D859 IonicContact CZ-OD2 3.44Å; R813-D859 IonicContact NE-OD1 3.05Å; R813-D859 IonicContact NE-OD2 3.48Å; R813-D859 PolarHBondContact NE-OD2 3.07Å; R813-D859 IonicContact NH2-OD1 3.48Å; R813-D859 PolarHBondContact NH2-OD1 2.95Å; R813-D859 IonicContact NH2-OD2 3.19Å; R813-D859 PolarHBondContact NH2-OD2 3.19Å; V855-D859 HydrophobicContact CG1-CB 4.04Å; V855-D859 VanDerWaalsContact O-CB 3.31Å; V855-D859 WeakPolarHBondContact O-CB 3.35Å; V855-D859 PolarHBondContact O-N 3.26Å; D859-D861 VanDerWaalsContact C-N 3.27Å; D859-D861 PolarHBondContact O-N 3.08Å; D859-D861 WeakPolarHBondContact OD1-CB 3.4Å; D859-D861 PolarHBondContact OD1-N 3.07Å; D859-V864 HydrophobicContact CB-CB 4.23Å; D859-V864 HydrophobicContact CB-CG1 4.14Å; D859-V864 WeakPolarHBondContact OD2-CG1 3.45Å; D859-R865 HydrophobicContact CB-CG 4.1Å; D859-R865 VanDerWaalsContact O-CD 3.3Å; D859-R865 WeakPolarHBondContact O-CD 3.37Å; D859-R865 PolarHBondContact O-NE 2.98Å
860P88.9Confident90.9Very high67.25 Ų67.2533 Ų3344%0.43718%0.179SC..SBendtrans-63.4-31.6178.426.2-35.1000112.5I804 P862 R865I804-P860 HydrophobicContact CD1-CG 3.69Å; I804-P860 HydrophobicContact CG1-CG 3.96Å; P860-P862 VanDerWaalsContact O-CD 3.25Å; P860-P862 WeakPolarHBondContact O-CD 3.3Å; P860-R865 PolarHBondContact O-NH2 3.39Å; P860-R865 VanDerWaalsContact O-NH2 3.15Å
861D89.8Confident90.7Very high39.5 Ų39.532 Ų3221%0.21118%0.175CC..  trans-78.1117.9-178.6-101-68.3000111K810 R813 D859 D863 V864 R865K810-D861 HydrophobicContact CD-CB 4.49Å; K810-D861 VanDerWaalsContact CD-OD1 3.26Å; K810-D861 WeakPolarHBondContact CD-OD1 3.26Å; K810-D861 VanDerWaalsContact CD-OD2 3.28Å; K810-D861 WeakPolarHBondContact CD-OD2 3.29Å; K810-D861 VanDerWaalsContact CE-OD1 3.26Å; K810-D861 WeakPolarHBondContact CE-OD1 3.45Å; K810-D861 VanDerWaalsContact CE-OD2 3.26Å; K810-D861 WeakPolarHBondContact CE-OD2 3.32Å; K810-D861 VanDerWaalsContact NZ-CG 3.3Å; K810-D861 IonicContact NZ-OD1 2.95Å; K810-D861 PolarHBondContact NZ-OD1 3.2Å; K810-D861 VanDerWaalsContact NZ-OD1 3.08Å; K810-D861 IonicContact NZ-OD2 3.47Å; K810-D861 PolarHBondContact NZ-OD2 3.21Å; R813-D861 IonicContact CZ-OD2 3.09Å; R813-D861 IonicContact NH2-OD2 3.26Å; R813-D861 PolarHBondContact NH2-OD2 3Å; D859-D861 VanDerWaalsContact C-N 3.27Å; D859-D861 PolarHBondContact O-N 3.08Å; D859-D861 WeakPolarHBondContact OD1-CB 3.4Å; D859-D861 PolarHBondContact OD1-N 3.07Å; D861-D863 VanDerWaalsContact C-N 3.31Å; D861-D863 PolarHBondContact O-N 3.18Å; D861-D863 WeakPolarHBondContact OD1-CA 3.39Å; D861-D863 VanDerWaalsContact OD1-CB 3.26Å; D861-D863 WeakPolarHBondContact OD1-CB 3.44Å; D861-D863 PolarHBondContact OD1-N 3.11Å; D861-V864 HydrophobicContact CB-CB 4.23Å; D861-V864 HydrophobicContact CB-CG2 3.82Å; D861-V864 PolarHBondContact O-N 3.06Å; D861-V864 VanDerWaalsContact O-N 3.08Å; D861-V864 PolarHBondContact OD1-N 3.1Å; D861-R865 PolarHBondContact O-N 3.04Å
862P89.7Confident90.7Very high45.5 Ų45.528 Ų2830%0.29516%0.158SC..Hα-helixtrans-65.7-26.1-179.727.3-35000112.7P860 V864 R865 R866 V897P860-P862 VanDerWaalsContact O-CD 3.25Å; P860-P862 WeakPolarHBondContact O-CD 3.3Å; P862-V864 VanDerWaalsContact C-N 3.33Å; P862-V864 PolarHBondContact O-N 2.73Å; P862-R865 PolarHBondContact O-N 3.42Å; P862-R866 VanDerWaalsContact O-CB 3.25Å; P862-R866 WeakPolarHBondContact O-CB 3.38Å; P862-R866 PolarHBondContact O-N 3Å; P862-V897 HydrophobicContact CB-CG2 3.62Å; P862-V897 VanDerWaalsContact CB-CG2 3.49Å; P862-V897 HydrophobicContact CG-CG2 4.42Å
863D90.7Very high90.3Very high75.25 Ų75.2529.7 Ų29.740%0.40217%0.167SC..Hα-helixtrans-66.3-36175.5-64.9-45.6000111.8K810 L814 D861 C867K810-D863 VanDerWaalsContact CE-OD2 3.27Å; K810-D863 WeakPolarHBondContact CE-OD2 3.38Å; K810-D863 IonicContact NZ-OD2 3.48Å; K810-D863 PolarHBondContact NZ-OD2 3.16Å; L814-D863 HydrophobicContact CD1-CB 4.34Å; L814-D863 HydrophobicContact CD2-CB 4.3Å; L814-D863 WeakPolarHBondContact CD2-O 3.41Å; D861-D863 VanDerWaalsContact C-N 3.31Å; D861-D863 PolarHBondContact O-N 3.18Å; D861-D863 WeakPolarHBondContact OD1-CA 3.39Å; D861-D863 VanDerWaalsContact OD1-CB 3.26Å; D861-D863 WeakPolarHBondContact OD1-CB 3.44Å; D861-D863 PolarHBondContact OD1-N 3.11Å; D863-C867 VanDerWaalsContact O-CB 3.26Å; D863-C867 WeakPolarHBondContact O-CB 3.35Å; D863-C867 PolarHBondContact O-N 3.26Å
864V90.9Very high89.9Confident0 Ų036.1 Ų36.10%020%0.197CC..Hα-helixtrans-69.1-49.4177.1-1790000109.8K810 R813 L814 V817 V855 D859 D861 P862 R866 C867 V868K810-V864 HydrophobicContact CG-CG2 4.38Å; R813-V864 HydrophobicContact CB-CG1 4.45Å; R813-V864 HydrophobicContact CB-CG2 4.36Å; L814-V864 HydrophobicContact CD2-CB 4.42Å; L814-V864 HydrophobicContact CD2-CG2 4Å; L814-V864 HydrophobicContact CG-CG2 4.01Å; V817-V864 HydrophobicContact CG2-CG1 4.4Å; V855-V864 HydrophobicContact CG1-CG1 4.06Å; D859-V864 HydrophobicContact CB-CB 4.23Å; D859-V864 HydrophobicContact CB-CG1 4.14Å; D859-V864 WeakPolarHBondContact OD2-CG1 3.45Å; D861-V864 HydrophobicContact CB-CB 4.23Å; D861-V864 HydrophobicContact CB-CG2 3.82Å; D861-V864 PolarHBondContact O-N 3.06Å; D861-V864 VanDerWaalsContact O-N 3.08Å; D861-V864 PolarHBondContact OD1-N 3.1Å; P862-V864 VanDerWaalsContact C-N 3.33Å; P862-V864 PolarHBondContact O-N 2.73Å; V864-R866 VanDerWaalsContact C-N 3.33Å; V864-R866 PolarHBondContact O-N 3.07Å; V864-C867 WeakPolarHBondContact O-CA 3.47Å; V864-C867 WeakPolarHBondContact O-CB 3.34Å; V864-C867 PolarHBondContact O-N 3.02Å; V864-C867 VanDerWaalsContact O-N 3.1Å; V864-V868 WeakPolarHBondContact O-CG2 3.42Å; V864-V868 PolarHBondContact O-N 3.02Å
865R92.5Very high89.6Confident10.75 Ų10.7537.6 Ų37.64%0.04120%0.197CC..Hα-helixtrans-55.9-46.7174.6-67.6-174-93.1149.6-5.6111.9G856 D859 P860 D861 P862 C867 V868 F869 D895 E896 I900G856-R865 VanDerWaalsContact O-CB 3.31Å; G856-R865 WeakPolarHBondContact O-CB 3.43Å; G856-R865 VanDerWaalsContact O-CD 3.28Å; G856-R865 WeakPolarHBondContact O-CD 3.2Å; G856-R865 VanDerWaalsContact O-CG 3.27Å; G856-R865 WeakPolarHBondContact O-CG 3.31Å; D859-R865 HydrophobicContact CB-CG 4.1Å; D859-R865 VanDerWaalsContact O-CD 3.3Å; D859-R865 WeakPolarHBondContact O-CD 3.37Å; D859-R865 PolarHBondContact O-NE 2.98Å; P860-R865 PolarHBondContact O-NH2 3.39Å; P860-R865 VanDerWaalsContact O-NH2 3.15Å; D861-R865 PolarHBondContact O-N 3.04Å; P862-R865 PolarHBondContact O-N 3.42Å; R865-C867 VanDerWaalsContact C-N 3.34Å; R865-C867 PolarHBondContact O-N 3.14Å; R865-V868 WeakPolarHBondContact O-CB 3.35Å; R865-V868 PolarHBondContact O-N 3.15Å; R865-F869 VanDerWaalsContact O-CD2 3.23Å; R865-F869 WeakPolarHBondContact O-CD2 3.41Å; R865-F869 PolarHBondContact O-N 3.13Å; R865-D895 IonicContact CZ-OD1 3.81Å; R865-D895 IonicContact CZ-OD2 3.19Å; R865-D895 VanDerWaalsContact NH1-CG 3.3Å; R865-D895 IonicContact NH1-OD1 3.14Å; R865-D895 PolarHBondContact NH1-OD1 2.91Å; R865-D895 VanDerWaalsContact NH1-OD1 3.1Å; R865-D895 IonicContact NH1-OD2 3.18Å; R865-D895 PolarHBondContact NH1-OD2 3.1Å; R865-E896 IonicContact CZ-OE1 3.32Å; R865-E896 IonicContact NH1-OE1 3.14Å; R865-E896 PolarHBondContact NH1-OE1 3.45Å; R865-E896 IonicContact NH2-OE1 3.26Å; R865-E896 PolarHBondContact NH2-OE1 3.14Å; R865-I900 HydrophobicContact CB-CD1 3.65Å
866R92Very high89.4Confident81 Ų8137.1 Ų37.131%0.30619%0.193SC..Hα-helixtrans-61.1-41.3175.1-175.3176.1174.8-99.3-1.4112G418 P862 V864 V868 F869 L870 D899 I900 L903G418-R866 PolarHBondContact O-NH2 3.4Å; P862-R866 VanDerWaalsContact O-CB 3.25Å; P862-R866 WeakPolarHBondContact O-CB 3.38Å; P862-R866 PolarHBondContact O-N 3Å; V864-R866 VanDerWaalsContact C-N 3.33Å; V864-R866 PolarHBondContact O-N 3.07Å; R866-V868 VanDerWaalsContact C-N 3.33Å; R866-V868 PolarHBondContact O-N 3.06Å; R866-F869 PolarHBondContact O-N 3.21Å; R866-L870 HydrophobicContact CG-CD1 3.83Å; R866-L870 HydrophobicContact CG-CG 4.21Å; R866-L870 WeakPolarHBondContact O-CB 3.29Å; R866-L870 VanDerWaalsContact O-CG 3.25Å; R866-L870 WeakPolarHBondContact O-CG 3.35Å; R866-L870 PolarHBondContact O-N 3.16Å; R866-D899 IonicContact CZ-OD2 3.15Å; R866-D899 IonicContact NE-OD2 2.8Å; R866-D899 PolarHBondContact NE-OD2 3.35Å; R866-D899 IonicContact NH2-OD2 2.8Å; R866-D899 PolarHBondContact NH2-OD2 2.79Å; R866-I900 HydrophobicContact CB-CD1 4.3Å; R866-I900 HydrophobicContact CB-CG1 4.03Å; R866-I900 HydrophobicContact CG-CG1 4.48Å; R866-L903 HydrophobicContact CG-CD1 3.9Å
867C90.8Very high89.3Confident11.75 Ų11.7537.4 Ų37.48%0.07920%0.195CC..Hα-helixtrans-62.4-39177.7-170.10000112.3L814 V817 K818 D863 V864 R865 L870 S871L814-C867 HydrophobicContact CD2-CB 3.6Å; V817-C867 HydrophobicContact CG1-CB 4.45Å; K818-C867 VanDerWaalsContact CE-SG 3.55Å; K818-C867 VanDerWaalsContact CG-SG 3.53Å; D863-C867 VanDerWaalsContact O-CB 3.26Å; D863-C867 WeakPolarHBondContact O-CB 3.35Å; D863-C867 PolarHBondContact O-N 3.26Å; V864-C867 WeakPolarHBondContact O-CA 3.47Å; V864-C867 WeakPolarHBondContact O-CB 3.34Å; V864-C867 PolarHBondContact O-N 3.02Å; V864-C867 VanDerWaalsContact O-N 3.1Å; R865-C867 VanDerWaalsContact C-N 3.34Å; R865-C867 PolarHBondContact O-N 3.14Å; C867-L870 PolarHBondContact O-N 2.97Å; C867-S871 WeakPolarHBondContact O-CB 3.29Å; C867-S871 PolarHBondContact O-N 3.24Å; C867-S871 VanDerWaalsContact O-N 3.08Å; C867-S871 PolarHBondContact O-OG 3.13Å
868V92.5Very high89Confident0.5 Ų0.541 Ų410%0.00321%0.214CC..Hα-helixtrans-58.6-56.5174.7172.10000110.5V817 L852 V855 V864 R865 R866 L870 S871 F872V817-V868 HydrophobicContact CB-CG2 4.47Å; V817-V868 HydrophobicContact CG1-CB 4.34Å; V817-V868 HydrophobicContact CG1-CG2 3.68Å; V817-V868 HydrophobicContact CG2-CG2 3.93Å; L852-V868 WeakPolarHBondContact O-CG1 3.3Å; V855-V868 HydrophobicContact CG1-CG2 4.29Å; V864-V868 WeakPolarHBondContact O-CG2 3.42Å; V864-V868 PolarHBondContact O-N 3.02Å; R865-V868 WeakPolarHBondContact O-CB 3.35Å; R865-V868 PolarHBondContact O-N 3.15Å; R866-V868 VanDerWaalsContact C-N 3.33Å; R866-V868 PolarHBondContact O-N 3.06Å; V868-L870 VanDerWaalsContact C-N 3.32Å; V868-L870 PolarHBondContact O-N 3.19Å; V868-S871 WeakPolarHBondContact O-CB 3.41Å; V868-S871 PolarHBondContact O-N 3.25Å; V868-S871 VanDerWaalsContact O-N 3.1Å; V868-S871 PolarHBondContact O-OG 3.38Å; V868-F872 HydrophobicContact CG1-CD2 4.44Å; V868-F872 HydrophobicContact CG1-CE1 4.48Å; V868-F872 HydrophobicContact CG1-CE2 3.55Å; V868-F872 VanDerWaalsContact CG1-CE2 3.49Å; V868-F872 HydrophobicContact CG1-CZ 3.59Å; V868-F872 WeakPolarHBondContact O-CD2 3.2Å; V868-F872 PolarHBondContact O-N 3.21Å
869F91.7Very high88.7Confident0 Ų039.4 Ų39.40%020%0.2CC..Hα-helixtrans-70.1-27.4-177.2-61.5-61.8000114.1L853 G856 I857 R865 R866 S871 F872 L889 A892 I900 L903 V904 R907L853-F869 HydrophobicContact CD2-CE1 4.24Å; G856-F869 VanDerWaalsContact O-CE2 3.3Å; G856-F869 WeakPolarHBondContact O-CE2 3.45Å; G856-F869 WeakPolarHBondContact O-CZ 3.22Å; I857-F869 HydrophobicContact CG1-CZ 4.48Å; R865-F869 VanDerWaalsContact O-CD2 3.23Å; R865-F869 WeakPolarHBondContact O-CD2 3.41Å; R865-F869 PolarHBondContact O-N 3.13Å; R866-F869 PolarHBondContact O-N 3.21Å; F869-S871 VanDerWaalsContact C-N 3.31Å; F869-F872 HydrophobicContact CD1-CD2 4.05Å; F869-F872 AromaticContact CD1-CE2 3.98Å; F869-F872 HydrophobicContact CD1-CE2 4.04Å; F869-F872 HydrophobicContact CE1-CE2 4.36Å; F869-L889 HydrophobicContact CD1-CD2 4.09Å; F869-L889 HydrophobicContact CE1-CD2 3.78Å; F869-A892 HydrophobicContact CE1-CB 4.11Å; F869-A892 HydrophobicContact CE2-CB 3.84Å; F869-A892 HydrophobicContact CZ-CB 3.37Å; F869-I900 HydrophobicContact CD2-CG2 3.76Å; F869-I900 HydrophobicContact CE2-CG2 3.89Å; F869-L903 HydrophobicContact CB-CB 4.36Å; F869-V904 HydrophobicContact CB-CG2 4.44Å; F869-V904 HydrophobicContact CD1-CG2 3.93Å; F869-V904 HydrophobicContact CD2-CG2 3.91Å; F869-V904 HydrophobicContact CE1-CG2 4.1Å; F869-V904 HydrophobicContact CE2-CG2 4.05Å; F869-V904 HydrophobicContact CG-CG2 3.85Å; F869-V904 HydrophobicContact CZ-CG2 4.16Å; F869-R907 PolarHBondContact O-NE 2.9Å; F869-R907 PolarHBondContact O-NH2 3.04Å
870L90.4Very high88.7Confident61 Ų6139.2 Ų39.232%0.31920%0.199SC..Hα-helixtrans-64.7-39.9170.2-124.9122.9000111.6D421 R866 C867 V868 F872 L903 R907D421-L870 WeakPolarHBondContact OD2-CB 3.41Å; D421-L870 WeakPolarHBondContact OD2-CD2 3.46Å; R866-L870 HydrophobicContact CG-CD1 3.83Å; R866-L870 HydrophobicContact CG-CG 4.21Å; R866-L870 WeakPolarHBondContact O-CB 3.29Å; R866-L870 VanDerWaalsContact O-CG 3.25Å; R866-L870 WeakPolarHBondContact O-CG 3.35Å; R866-L870 PolarHBondContact O-N 3.16Å; C867-L870 PolarHBondContact O-N 2.97Å; V868-L870 VanDerWaalsContact C-N 3.32Å; V868-L870 PolarHBondContact O-N 3.19Å; L870-F872 VanDerWaalsContact C-N 3.28Å; L870-F872 PolarHBondContact O-N 3.13Å; L870-L903 HydrophobicContact CD1-CD2 4.36Å; L870-L903 HydrophobicContact CD2-CD1 3.74Å; L870-L903 HydrophobicContact CD2-CD2 3.56Å; L870-L903 HydrophobicContact CD2-CG 4.3Å; L870-L903 HydrophobicContact CG-CD1 3.75Å; L870-L903 HydrophobicContact CG-CD2 4.35Å; L870-R907 PolarHBondContact O-NH2 2.82Å
871S87.1Confident88.6Confident23.25 Ų23.2536.5 Ų36.516%0.16318%0.183CC..Hα-helixtrans-70.3-16.6-176.9-40.20000114.1C867 V868 F869 D873 F876C867-S871 WeakPolarHBondContact O-CB 3.29Å; C867-S871 PolarHBondContact O-N 3.24Å; C867-S871 VanDerWaalsContact O-N 3.08Å; C867-S871 PolarHBondContact O-OG 3.13Å; V868-S871 WeakPolarHBondContact O-CB 3.41Å; V868-S871 PolarHBondContact O-N 3.25Å; V868-S871 VanDerWaalsContact O-N 3.1Å; V868-S871 PolarHBondContact O-OG 3.38Å; F869-S871 VanDerWaalsContact C-N 3.31Å; S871-D873 PolarHBondContact O-N 3.16Å; S871-D873 VanDerWaalsContact O-N 3.08Å; S871-F876 WeakPolarHBondContact O-CE2 3.46Å
872F88.7Confident88.5Confident1.5 Ų1.538.9 Ų38.91%0.00719%0.193CC..  trans-80.494.5176.2-61.5-36.4000112L849 L852 L853 V868 F869 L870 F876 L880 R907L849-F872 HydrophobicContact CD1-CD1 4.29Å; L849-F872 HydrophobicContact CD1-CE1 3.49Å; L849-F872 VanDerWaalsContact CD1-CE1 3.46Å; L849-F872 HydrophobicContact CD1-CZ 3.8Å; L852-F872 HydrophobicContact CB-CZ 4.24Å; L852-F872 HydrophobicContact CD1-CE1 4.37Å; L853-F872 HydrophobicContact CD2-CE2 3.61Å; L853-F872 HydrophobicContact CD2-CZ 3.99Å; L853-F872 HydrophobicContact CG-CE2 4.33Å; L853-F872 HydrophobicContact CG-CZ 4.21Å; V868-F872 HydrophobicContact CG1-CD2 4.44Å; V868-F872 HydrophobicContact CG1-CE1 4.48Å; V868-F872 HydrophobicContact CG1-CE2 3.55Å; V868-F872 VanDerWaalsContact CG1-CE2 3.49Å; V868-F872 HydrophobicContact CG1-CZ 3.59Å; V868-F872 WeakPolarHBondContact O-CD2 3.2Å; V868-F872 PolarHBondContact O-N 3.21Å; F869-F872 HydrophobicContact CD1-CD2 4.05Å; F869-F872 AromaticContact CD1-CE2 3.98Å; F869-F872 HydrophobicContact CD1-CE2 4.04Å; F869-F872 HydrophobicContact CE1-CE2 4.36Å; L870-F872 VanDerWaalsContact C-N 3.28Å; L870-F872 PolarHBondContact O-N 3.13Å; F872-F876 HydrophobicContact CD1-CD1 4.28Å; F872-F876 HydrophobicContact CD1-CD2 4.46Å; F872-F876 HydrophobicContact CD1-CE1 4.39Å; F872-F876 HydrophobicContact CD1-CG 4.29Å; F872-L880 HydrophobicContact CB-CD1 4Å; F872-L880 HydrophobicContact CD2-CD1 4.43Å; F872-L880 HydrophobicContact CG-CD1 4.12Å; F872-R907 VanDerWaalsContact O-CZ 3.28Å; F872-R907 PolarHBondContact O-NE 3.13Å; F872-R907 PolarHBondContact O-NH2 3.19Å; F872-R907 VanDerWaalsContact O-NH2 3.08Å
873D83.7Confident88.4Confident37.75 Ų37.7539.9 Ų39.920%0.20220%0.2CC..  trans-80.5173.3170.1-73.1-32.3000113S871 R875 F876 R910S871-D873 PolarHBondContact O-N 3.16Å; S871-D873 VanDerWaalsContact O-N 3.08Å; D873-R875 PolarHBondContact O-N 3.19Å; D873-R875 VanDerWaalsContact O-N 3.13Å; D873-R875 IonicContact OD2-CZ 3.02Å; D873-R875 IonicContact OD2-NE 2.91Å; D873-R875 IonicContact OD2-NH1 2.64Å; D873-R875 PolarHBondContact OD2-NH1 3.04Å; D873-R875 IonicContact OD2-NH2 2.99Å; D873-R875 PolarHBondContact OD2-NH2 3.01Å; D873-F876 HydrophobicContact CB-CD2 4.3Å; D873-F876 HydrophobicContact CB-CE2 4.41Å; D873-F876 WeakPolarHBondContact O-CB 3.46Å; D873-F876 WeakPolarHBondContact O-CD2 3.38Å; D873-F876 PolarHBondContact O-N 3.17Å; D873-R910 VanDerWaalsContact C-NH2 3.28Å; D873-R910 PolarHBondContact O-NH2 2.67Å
874Q84.8Confident88.2Confident134.25 Ų134.2541 Ų4163%0.62721%0.206SC*.G310 helixtrans-55.4-23.3175.5-171.8173.8-5.300114.2F876 D877 R910Q874-F876 PolarHBondContact O-N 3.27Å; Q874-F876 VanDerWaalsContact O-N 3.15Å; Q874-D877 WeakPolarHBondContact CA-OD2 3.37Å; Q874-D877 WeakPolarHBondContact CG-OD2 3.49Å; Q874-D877 VanDerWaalsContact O-CB 3.29Å; Q874-D877 WeakPolarHBondContact O-CB 3.38Å; Q874-D877 VanDerWaalsContact O-CG 3.3Å; Q874-D877 PolarHBondContact O-N 3.22Å; Q874-D877 VanDerWaalsContact O-N 3.1Å; Q874-R910 VanDerWaalsContact N-NH2 3.2Å
875R84.9Confident88.2Confident81 Ų8141.1 Ų41.131%0.30621%0.207SC..G310 helixtrans-64.2-18.8174.8-65.1174.1-79.6175.52.5113.7F401 I825 D873F401-R875 VanDerWaalsContact CD1-NH2 3.28Å; F401-R875 VanDerWaalsContact CG-NH2 3.28Å; F401-R875 VanDerWaalsContact CZ-NE 3.33Å; I825-R875 VanDerWaalsContact CD1-NH1 3.32Å; I825-R875 VanDerWaalsContact CD1-NH2 3.33Å; I825-R875 VanDerWaalsContact CG2-NH1 3.26Å; D873-R875 PolarHBondContact O-N 3.19Å; D873-R875 VanDerWaalsContact O-N 3.13Å; D873-R875 IonicContact OD2-CZ 3.02Å; D873-R875 IonicContact OD2-NE 2.91Å; D873-R875 IonicContact OD2-NH1 2.64Å; D873-R875 PolarHBondContact OD2-NH1 3.04Å; D873-R875 IonicContact OD2-NH2 2.99Å; D873-R875 PolarHBondContact OD2-NH2 3.01Å
876F86.8Confident88.2Confident1.5 Ų1.540.7 Ų40.71%0.00721%0.205CC..G310 helixtrans-94.1-10177.5-65-95.7000113A821 M824 I825 L828 L849 S871 F872 D873 Q874 L878 H879 L880A821-F876 HydrophobicContact CB-CZ 4.39Å; A821-F876 WeakPolarHBondContact O-CZ 3.47Å; M824-F876 HydrophobicContact CB-CE1 4.34Å; M824-F876 HydrophobicContact CB-CZ 4.49Å; M824-F876 HydrophobicContact CE-CE1 4.27Å; M824-F876 HydrophobicContact SD-CE1 4.38Å; I825-F876 HydrophobicContact CG1-CE2 4.38Å; L828-F876 HydrophobicContact CD1-CD1 3.56Å; L828-F876 VanDerWaalsContact CD1-CD1 3.48Å; L828-F876 HydrophobicContact CD1-CD2 4.36Å; L828-F876 HydrophobicContact CD1-CE1 3.39Å; L828-F876 VanDerWaalsContact CD1-CE1 3.44Å; L828-F876 HydrophobicContact CD1-CE2 4.23Å; L828-F876 HydrophobicContact CD1-CG 4.06Å; L828-F876 HydrophobicContact CD1-CZ 3.75Å; L828-F876 HydrophobicContact CD2-CD1 4.29Å; L849-F876 HydrophobicContact CD1-CD1 4.45Å; S871-F876 WeakPolarHBondContact O-CE2 3.46Å; F872-F876 HydrophobicContact CD1-CD1 4.28Å; F872-F876 HydrophobicContact CD1-CD2 4.46Å; F872-F876 HydrophobicContact CD1-CE1 4.39Å; F872-F876 HydrophobicContact CD1-CG 4.29Å; D873-F876 HydrophobicContact CB-CD2 4.3Å; D873-F876 HydrophobicContact CB-CE2 4.41Å; D873-F876 WeakPolarHBondContact O-CB 3.46Å; D873-F876 WeakPolarHBondContact O-CD2 3.38Å; D873-F876 PolarHBondContact O-N 3.17Å; Q874-F876 PolarHBondContact O-N 3.27Å; Q874-F876 VanDerWaalsContact O-N 3.15Å; F876-L878 VanDerWaalsContact C-N 3.31Å; F876-L878 PolarHBondContact O-N 3.07Å; F876-H879 PolarHBondContact O-N 3.26Å; F876-L880 HydrophobicContact CB-CD1 3.67Å; F876-L880 HydrophobicContact CB-CG 4.12Å; F876-L880 WeakPolarHBondContact O-CG 3.38Å; F876-L880 PolarHBondContact O-N 3.21Å
877D87Confident88.1Confident7 Ų741.1 Ų41.14%0.03721%0.214CC..Hα-helixtrans-61.9-35.5-166-71.7-2.5000113.1Q874 H879 L880 A881 R910 L911 I914Q874-D877 WeakPolarHBondContact CA-OD2 3.37Å; Q874-D877 WeakPolarHBondContact CG-OD2 3.49Å; Q874-D877 VanDerWaalsContact O-CB 3.29Å; Q874-D877 WeakPolarHBondContact O-CB 3.38Å; Q874-D877 VanDerWaalsContact O-CG 3.3Å; Q874-D877 PolarHBondContact O-N 3.22Å; Q874-D877 VanDerWaalsContact O-N 3.1Å; D877-H879 VanDerWaalsContact C-N 3.29Å; D877-H879 PolarHBondContact O-N 3.25Å; D877-L880 PolarHBondContact O-N 3.1Å; D877-A881 VanDerWaalsContact O-CB 3.27Å; D877-A881 WeakPolarHBondContact O-CB 3.36Å; D877-A881 PolarHBondContact O-N 2.95Å; D877-R910 IonicContact OD1-CZ 3.43Å; D877-R910 IonicContact OD1-NE 2.87Å; D877-R910 IonicContact OD1-NH2 3.11Å; D877-R910 PolarHBondContact OD1-NH2 3.19Å; D877-R910 IonicContact OD2-CZ 3.05Å; D877-R910 IonicContact OD2-NE 3.19Å; D877-R910 PolarHBondContact OD2-NE 3.23Å; D877-R910 VanDerWaalsContact OD2-NE 3.11Å; D877-R910 IonicContact OD2-NH2 3.22Å; D877-R910 PolarHBondContact OD2-NH2 3.14Å; D877-L911 HydrophobicContact CB-CD2 3.89Å; D877-L911 VanDerWaalsContact O-CD2 3.25Å; D877-L911 WeakPolarHBondContact O-CD2 3.3Å; D877-I914 HydrophobicContact CB-CD1 3.63Å
878L85.5Confident88.2Confident118.5 Ų118.543.4 Ų43.462%0.6222%0.221SC*.Hα-helixtrans-60.9-34176-70.5169.4000113.2E832 F876E832-L878 HydrophobicContact CG-CD1 4.39Å; F876-L878 VanDerWaalsContact C-N 3.31Å; F876-L878 PolarHBondContact O-N 3.07Å
879H84.6Confident88.2Confident26.5 Ų26.543.4 Ų43.412%0.12322%0.221CC..Hα-helixtrans-89.4-37.4178.8-67.6-79.7000111.8L828 L842 L849 F876 D877 A881 Q882 H885L828-H879 WeakPolarHBondContact CD2-CD2 3.28Å; L842-H879 VanDerWaalsContact CD2-CE1 3.47Å; L842-H879 WeakPolarHBondContact CD2-CE1 3.16Å; L849-H879 HydrophobicContact CD2-CB 3.91Å; F876-H879 PolarHBondContact O-N 3.26Å; D877-H879 VanDerWaalsContact C-N 3.29Å; D877-H879 PolarHBondContact O-N 3.25Å; H879-A881 PolarHBondContact O-N 3.11Å; H879-Q882 WeakPolarHBondContact O-CB 3.32Å; H879-Q882 WeakPolarHBondContact O-CG 3.39Å; H879-Q882 PolarHBondContact O-N 3.28Å; H879-Q882 PolarHBondContact O-OE1 3.25Å; H879-H885 PolarHBondContact O-ND1 3.16Å
880L89.2Confident88.3Confident0.25 Ų0.2544.6 Ų44.60%0.00123%0.226CC..Hα-helixtrans-66.1-21.1175.5-71.7170.8000113.1L849 L853 F872 F876 D877 Q882 H885 L886 L889 L911L849-L880 HydrophobicContact CD1-CD2 4.05Å; L849-L880 HydrophobicContact CD2-CD2 4.08Å; L849-L880 HydrophobicContact CD2-CG 4.33Å; L849-L880 HydrophobicContact CG-CD2 4.36Å; L853-L880 HydrophobicContact CD1-CD2 4.13Å; L853-L880 HydrophobicContact CD2-CD2 4.26Å; F872-L880 HydrophobicContact CB-CD1 4Å; F872-L880 HydrophobicContact CD2-CD1 4.43Å; F872-L880 HydrophobicContact CG-CD1 4.12Å; F876-L880 HydrophobicContact CB-CD1 3.67Å; F876-L880 HydrophobicContact CB-CG 4.12Å; F876-L880 WeakPolarHBondContact O-CG 3.38Å; F876-L880 PolarHBondContact O-N 3.21Å; D877-L880 PolarHBondContact O-N 3.1Å; L880-Q882 VanDerWaalsContact C-N 3.26Å; L880-Q882 PolarHBondContact O-N 3.35Å; L880-H885 HydrophobicContact CD2-CB 4.48Å; L880-L886 WeakPolarHBondContact O-CD2 3.39Å; L880-L886 WeakPolarHBondContact O-CG 3.42Å; L880-L889 HydrophobicContact CB-CD1 4.45Å; L880-L889 HydrophobicContact CD2-CD1 4.47Å; L880-L911 HydrophobicContact CB-CD1 4.02Å; L880-L911 HydrophobicContact CB-CD2 4.05Å
881A88.2Confident88.3Confident10.5 Ų10.545.9 Ų45.99%0.08723%0.233CC..THydrogen-bonded Turntrans-72-7.8175.500000114.7D877 H879 L886 L911 I914 N915D877-A881 VanDerWaalsContact O-CB 3.27Å; D877-A881 WeakPolarHBondContact O-CB 3.36Å; D877-A881 PolarHBondContact O-N 2.95Å; H879-A881 PolarHBondContact O-N 3.11Å; A881-L886 WeakPolarHBondContact O-CD1 3.35Å; A881-L911 HydrophobicContact CB-CD2 4.11Å; A881-I914 HydrophobicContact CB-CB 4.42Å; A881-I914 HydrophobicContact CB-CG2 3.87Å; A881-N915 HydrophobicContact CB-CB 4.2Å; A881-N915 PolarHBondContact O-ND2 3.25Å
882Q87.6Confident88.6Confident90 Ų9045 Ų4542%0.42123%0.226SC..SBendtrans-69.5145.1176.1-64.5179.1-51.100111.3H879 L880 D884 H885 L886H879-Q882 WeakPolarHBondContact O-CB 3.32Å; H879-Q882 WeakPolarHBondContact O-CG 3.39Å; H879-Q882 PolarHBondContact O-N 3.28Å; H879-Q882 PolarHBondContact O-OE1 3.25Å; L880-Q882 VanDerWaalsContact C-N 3.26Å; L880-Q882 PolarHBondContact O-N 3.35Å; Q882-D884 PolarHBondContact O-N 3.21Å; Q882-D884 VanDerWaalsContact O-N 3.14Å; Q882-H885 PolarHBondContact O-N 3.12Å; Q882-H885 VanDerWaalsContact O-N 3.15Å; Q882-H885 PolarHBondContact OE1-CE1 2.88Å; Q882-H885 VanDerWaalsContact OE1-CE1 3.25Å; Q882-H885 PolarHBondContact OE1-ND1 3.26Å; Q882-L886 WeakPolarHBondContact O-CG 3.36Å; Q882-L886 PolarHBondContact O-N 3.05Å
883S86.8Confident88.7Confident64.75 Ų64.7545.2 Ų45.245%0.45323%0.228SC..Hα-helixtrans-50.1-42.4-176.145.80000113.6L886 N887S883-L886 PolarHBondContact O-N 3.03Å; S883-N887 PolarHBondContact O-N 3.11Å; S883-N887 VanDerWaalsContact O-N 3.16Å; S883-N887 PolarHBondContact O-ND2 3.24Å
884D87.3Confident89.1Confident99.25 Ų99.2548.5 Ų48.553%0.53124%0.238SC..Hα-helixtrans-72.2-43.2-170.3-52.5-10.7000109.8Q882 N887 Y888Q882-D884 PolarHBondContact O-N 3.21Å; Q882-D884 VanDerWaalsContact O-N 3.14Å; D884-N887 WeakPolarHBondContact O-CB 3.31Å; D884-N887 PolarHBondContact O-N 3.18Å; D884-Y888 WeakPolarHBondContact O-CD2 3.29Å; D884-Y888 WeakPolarHBondContact O-CE2 3.23Å
885H90.4Very high89.5Confident3 Ų342.8 Ų42.81%0.01421%0.212CC..Hα-helixtrans-67.8-36.8174.4-58.1143000112.9N850 L853 H879 L880 Q882 N887 Y888 L889N850-H885 PolarHBondContact ND2-NE2 2.95Å; N850-H885 VanDerWaalsContact ND2-NE2 3.18Å; N850-H885 PolarHBondContact OD1-CD2 3.29Å; N850-H885 VanDerWaalsContact OD1-CD2 3.28Å; N850-H885 PolarHBondContact OD1-NE2 3.1Å; L853-H885 HydrophobicContact CD1-CB 3.71Å; H879-H885 PolarHBondContact O-ND1 3.16Å; L880-H885 HydrophobicContact CD2-CB 4.48Å; Q882-H885 PolarHBondContact O-N 3.12Å; Q882-H885 VanDerWaalsContact O-N 3.15Å; Q882-H885 PolarHBondContact OE1-CE1 2.88Å; Q882-H885 VanDerWaalsContact OE1-CE1 3.25Å; Q882-H885 PolarHBondContact OE1-ND1 3.26Å; H885-N887 VanDerWaalsContact C-N 3.29Å; H885-N887 PolarHBondContact O-N 3.04Å; H885-Y888 WeakPolarHBondContact O-CB 3.4Å; H885-Y888 PolarHBondContact O-N 3.32Å; H885-Y888 VanDerWaalsContact O-N 3.16Å; H885-L889 PolarHBondContact O-N 3.21Å
886L91.9Very high89.7Confident2 Ų244.6 Ų44.61%0.0122%0.224CC..Hα-helixtrans-62-35.2177.6-74.6177.6000112.5L880 A881 Q882 S883 Y888 L889 F890 L908 L911 C918 V919L880-L886 WeakPolarHBondContact O-CD2 3.39Å; L880-L886 WeakPolarHBondContact O-CG 3.42Å; A881-L886 WeakPolarHBondContact O-CD1 3.35Å; Q882-L886 WeakPolarHBondContact O-CG 3.36Å; Q882-L886 PolarHBondContact O-N 3.05Å; S883-L886 PolarHBondContact O-N 3.03Å; L886-Y888 VanDerWaalsContact C-N 3.32Å; L886-Y888 PolarHBondContact O-N 3.03Å; L886-L889 HydrophobicContact CD2-CD1 4.34Å; L886-L889 PolarHBondContact O-N 3.25Å; L886-L889 VanDerWaalsContact O-N 3.14Å; L886-F890 HydrophobicContact CB-CD2 4.45Å; L886-F890 HydrophobicContact CB-CE2 3.98Å; L886-F890 HydrophobicContact CB-CZ 4.3Å; L886-F890 WeakPolarHBondContact O-CD2 3.42Å; L886-F890 WeakPolarHBondContact O-CG 3.39Å; L886-F890 PolarHBondContact O-N 3.05Å; L886-L908 HydrophobicContact CD2-CD2 4.24Å; L886-L911 HydrophobicContact CD2-CD1 3.97Å; L886-C918 HydrophobicContact CD1-CB 3.71Å; L886-V919 HydrophobicContact CD1-CG2 3.8Å; L886-V919 HydrophobicContact CD2-CG2 3.79Å; L886-V919 HydrophobicContact CG-CG2 4.34Å
887N91.2Very high89.9Confident88.75 Ų88.7546.4 Ų46.448%0.47524%0.235SC..Hα-helixtrans-60.6-41.1177.5-70.7-34.5000112.2S883 D884 H885 L889 F890 L891S883-N887 PolarHBondContact O-N 3.11Å; S883-N887 VanDerWaalsContact O-N 3.16Å; S883-N887 PolarHBondContact O-ND2 3.24Å; D884-N887 WeakPolarHBondContact O-CB 3.31Å; D884-N887 PolarHBondContact O-N 3.18Å; H885-N887 VanDerWaalsContact C-N 3.29Å; H885-N887 PolarHBondContact O-N 3.04Å; N887-L889 PolarHBondContact O-N 3.44Å; N887-F890 PolarHBondContact O-N 3.2Å; N887-L891 WeakPolarHBondContact O-CB 3.46Å; N887-L891 WeakPolarHBondContact O-CG 3.41Å; N887-L891 PolarHBondContact O-N 3.12Å; N887-L891 VanDerWaalsContact O-N 3.13Å
888Y92.3Very high90Very high60 Ų6047.5 Ų47.524%0.23524%0.239CC..Hα-helixtrans-61.4-45173.6-65.3-79.2000111.3N850 L853 I857 D884 H885 L886 F890 L891 A892N850-Y888 WeakPolarHBondContact OD1-CE2 3.33Å; L853-Y888 HydrophobicContact CB-CD1 4.09Å; L853-Y888 HydrophobicContact CB-CD2 4.2Å; L853-Y888 HydrophobicContact CB-CE1 4.31Å; L853-Y888 HydrophobicContact CB-CG 3.96Å; L853-Y888 HydrophobicContact CD1-CD2 4.24Å; L853-Y888 HydrophobicContact CD1-CG 4.32Å; I857-Y888 HydrophobicContact CD1-CD1 3.69Å; I857-Y888 HydrophobicContact CD1-CG 4.12Å; I857-Y888 VanDerWaalsContact CD1-O 3.28Å; I857-Y888 WeakPolarHBondContact CD1-O 3.37Å; D884-Y888 WeakPolarHBondContact O-CD2 3.29Å; D884-Y888 WeakPolarHBondContact O-CE2 3.23Å; H885-Y888 WeakPolarHBondContact O-CB 3.4Å; H885-Y888 PolarHBondContact O-N 3.32Å; H885-Y888 VanDerWaalsContact O-N 3.16Å; L886-Y888 VanDerWaalsContact C-N 3.32Å; L886-Y888 PolarHBondContact O-N 3.03Å; Y888-F890 VanDerWaalsContact C-N 3.32Å; Y888-F890 PolarHBondContact O-N 2.89Å; Y888-L891 PolarHBondContact O-N 3.13Å; Y888-L891 VanDerWaalsContact O-N 3.14Å; Y888-A892 WeakPolarHBondContact O-CB 3.4Å; Y888-A892 PolarHBondContact O-N 3.33Å
889L92.6Very high90.1Very high0.25 Ų0.2544.4 Ų44.40%0.00122%0.223CC..Hα-helixtrans-63.3-36.5177.6-65.4175.8000112.8L853 F869 L880 H885 L886 N887 L891 A892 L893 V904 L908 L911L853-L889 HydrophobicContact CD2-CD2 4.19Å; L853-L889 HydrophobicContact CD2-CG 4.48Å; F869-L889 HydrophobicContact CD1-CD2 4.09Å; F869-L889 HydrophobicContact CE1-CD2 3.78Å; L880-L889 HydrophobicContact CB-CD1 4.45Å; L880-L889 HydrophobicContact CD2-CD1 4.47Å; H885-L889 PolarHBondContact O-N 3.21Å; L886-L889 HydrophobicContact CD2-CD1 4.34Å; L886-L889 PolarHBondContact O-N 3.25Å; L886-L889 VanDerWaalsContact O-N 3.14Å; N887-L889 PolarHBondContact O-N 3.44Å; L889-L891 VanDerWaalsContact C-N 3.34Å; L889-L891 PolarHBondContact O-N 3.28Å; L889-A892 PolarHBondContact O-N 3.3Å; L889-L893 PolarHBondContact O-N 3.1Å; L889-V904 HydrophobicContact CB-CG1 4.41Å; L889-V904 HydrophobicContact CD2-CG1 4.36Å; L889-V904 WeakPolarHBondContact O-CG1 3.36Å; L889-L908 HydrophobicContact CB-CD1 4.42Å; L889-L908 HydrophobicContact CB-CD2 3.75Å; L889-L908 HydrophobicContact CB-CG 4.18Å; L889-L908 HydrophobicContact CD1-CD2 4.16Å; L889-L911 HydrophobicContact CD1-CD1 3.51Å; L889-L911 VanDerWaalsContact CD1-CD1 3.47Å
890F92.6Very high90.5Very high26.25 Ų26.2543.1 Ų43.112%0.11522%0.218CC..Hα-helixtrans-69.4-31.6175.3-66.4-52.7000113.2L886 N887 Y888 L893 Y894 L908 V919 N922 L923L886-F890 HydrophobicContact CB-CD2 4.45Å; L886-F890 HydrophobicContact CB-CE2 3.98Å; L886-F890 HydrophobicContact CB-CZ 4.3Å; L886-F890 WeakPolarHBondContact O-CD2 3.42Å; L886-F890 WeakPolarHBondContact O-CG 3.39Å; L886-F890 PolarHBondContact O-N 3.05Å; N887-F890 PolarHBondContact O-N 3.2Å; Y888-F890 VanDerWaalsContact C-N 3.32Å; Y888-F890 PolarHBondContact O-N 2.89Å; F890-L893 WeakPolarHBondContact O-CB 3.18Å; F890-L893 PolarHBondContact O-N 2.89Å; F890-Y894 WeakPolarHBondContact O-CD2 3.41Å; F890-L908 HydrophobicContact CD1-CD1 3.92Å; F890-L908 HydrophobicContact CD1-CD2 4.16Å; F890-L908 HydrophobicContact CE1-CD1 4.04Å; F890-L908 HydrophobicContact CE1-CD2 3.75Å; F890-L908 HydrophobicContact CE1-CG 4.46Å; F890-L908 HydrophobicContact CE2-CD2 4.2Å; F890-L908 HydrophobicContact CZ-CD2 4.15Å; F890-V919 HydrophobicContact CZ-CG1 4.19Å; F890-V919 HydrophobicContact CZ-CG2 4.35Å; F890-N922 HydrophobicContact CD1-CB 3.97Å; F890-N922 HydrophobicContact CD2-CB 4.2Å; F890-N922 WeakPolarHBondContact CD2-ND2 3.4Å; F890-N922 HydrophobicContact CE1-CB 3.57Å; F890-N922 HydrophobicContact CE2-CB 4.09Å; F890-N922 VanDerWaalsContact CE2-ND2 3.28Å; F890-N922 WeakPolarHBondContact CE2-ND2 3.44Å; F890-N922 HydrophobicContact CG-CB 4.25Å; F890-N922 HydrophobicContact CZ-CB 3.78Å; F890-N922 WeakPolarHBondContact CZ-ND2 3.46Å; F890-L923 HydrophobicContact CE1-CD2 4.38Å
891L91.8Very high90.7Very high88.5 Ų88.546.4 Ų46.446%0.46323%0.23SC..Hα-helixtrans-70.1-44.7172.5-88150.7000111.4I857 N887 Y888 L889 L893 Y894I857-L891 HydrophobicContact CD1-CB 4.26Å; I857-L891 HydrophobicContact CD1-CD2 3.99Å; I857-L891 HydrophobicContact CD1-CG 4.32Å; I857-L891 HydrophobicContact CG2-CD2 3.93Å; I857-L891 HydrophobicContact CG2-CG 4.25Å; N887-L891 WeakPolarHBondContact O-CB 3.46Å; N887-L891 WeakPolarHBondContact O-CG 3.41Å; N887-L891 PolarHBondContact O-N 3.12Å; N887-L891 VanDerWaalsContact O-N 3.13Å; Y888-L891 PolarHBondContact O-N 3.13Å; Y888-L891 VanDerWaalsContact O-N 3.14Å; L889-L891 VanDerWaalsContact C-N 3.34Å; L889-L891 PolarHBondContact O-N 3.28Å; L891-L893 PolarHBondContact O-N 3.02Å; L891-L893 VanDerWaalsContact O-N 3.09Å; L891-Y894 PolarHBondContact O-N 3.22Å; L891-Y894 VanDerWaalsContact O-N 3.1Å
892A92.6Very high90.8Very high2.5 Ų2.546.3 Ų46.32%0.02123%0.228CC..Hα-helixtrans-65-16.3178.700000114.1I857 F869 Y888 L889 Y894 D895 V904I857-A892 HydrophobicContact CD1-CB 4.43Å; I857-A892 HydrophobicContact CG1-CB 4.03Å; F869-A892 HydrophobicContact CE1-CB 4.11Å; F869-A892 HydrophobicContact CE2-CB 3.84Å; F869-A892 HydrophobicContact CZ-CB 3.37Å; Y888-A892 WeakPolarHBondContact O-CB 3.4Å; Y888-A892 PolarHBondContact O-N 3.33Å; L889-A892 PolarHBondContact O-N 3.3Å; A892-Y894 PolarHBondContact O-N 2.96Å; A892-D895 WeakPolarHBondContact O-CB 3.39Å; A892-D895 PolarHBondContact O-N 3.25Å; A892-V904 HydrophobicContact CB-CG1 4.26Å; A892-V904 HydrophobicContact CB-CG2 3.78Å
893L91.6Very high91Very high7.25 Ų7.2542.6 Ų42.64%0.03821%0.211CC..THydrogen-bonded Turntrans-67.5-21.9174.6-169.664.4000113L889 F890 L891 R901 V904 M905 L908 V926L889-L893 PolarHBondContact O-N 3.1Å; F890-L893 WeakPolarHBondContact O-CB 3.18Å; F890-L893 PolarHBondContact O-N 2.89Å; L891-L893 PolarHBondContact O-N 3.02Å; L891-L893 VanDerWaalsContact O-N 3.09Å; L893-R901 WeakPolarHBondContact O-CD 3.38Å; L893-R901 VanDerWaalsContact O-CG 3.3Å; L893-R901 WeakPolarHBondContact O-CG 3.25Å; L893-V904 HydrophobicContact CB-CG1 4.18Å; L893-V904 HydrophobicContact CD1-CG1 4.25Å; L893-M905 HydrophobicContact CD1-CB 4.13Å; L893-M905 HydrophobicContact CD1-CE 4.08Å; L893-M905 HydrophobicContact CD1-SD 4.31Å; L893-M905 HydrophobicContact CD2-CE 4.26Å; L893-L908 HydrophobicContact CB-CD1 4.48Å; L893-L908 HydrophobicContact CD1-CD1 4.42Å; L893-L908 HydrophobicContact CD2-CD1 4.09Å; L893-V926 HydrophobicContact CD2-CB 4.3Å; L893-V926 HydrophobicContact CD2-CG1 3.93Å; L893-V926 HydrophobicContact CD2-CG2 3.43Å; L893-V926 VanDerWaalsContact CD2-CG2 3.43Å
894Y91.5Very high91.3Very high107.25 Ų107.2539.5 Ų39.542%0.42119%0.19SC..THydrogen-bonded Turntrans-103.621.4178.8-62.9-83.1000112.9F890 L891 A892 H929F890-Y894 WeakPolarHBondContact O-CD2 3.41Å; L891-Y894 PolarHBondContact O-N 3.22Å; L891-Y894 VanDerWaalsContact O-N 3.1Å; A892-Y894 PolarHBondContact O-N 2.96Å; Y894-H929 AromaticContact CE1-CD2 3.91Å; Y894-H929 PolarHBondContact OH-ND1 3.3Å
895D92.6Very high91.5Very high13.25 Ų13.2534.8 Ų34.87%0.07117%0.165CC..  trans-56.7156.5175.6-164.8-72.7000112.6R865 A892 V897 I900 R901R865-D895 IonicContact CZ-OD1 3.81Å; R865-D895 IonicContact CZ-OD2 3.19Å; R865-D895 VanDerWaalsContact NH1-CG 3.3Å; R865-D895 IonicContact NH1-OD1 3.14Å; R865-D895 PolarHBondContact NH1-OD1 2.91Å; R865-D895 VanDerWaalsContact NH1-OD1 3.1Å; R865-D895 IonicContact NH1-OD2 3.18Å; R865-D895 PolarHBondContact NH1-OD2 3.1Å; A892-D895 WeakPolarHBondContact O-CB 3.39Å; A892-D895 PolarHBondContact O-N 3.25Å; D895-V897 VanDerWaalsContact C-N 3.32Å; D895-V897 PolarHBondContact O-N 3.13Å; D895-V897 PolarHBondContact OD1-N 3.14Å; D895-I900 HydrophobicContact CB-CB 4.21Å; D895-I900 HydrophobicContact CB-CG2 3.89Å; D895-R901 HydrophobicContact CB-CG 4.24Å; D895-R901 WeakPolarHBondContact O-CD 3.26Å; D895-R901 PolarHBondContact O-NE 3.3Å; D895-R901 VanDerWaalsContact O-NE 3.07Å; D895-R901 PolarHBondContact O-NH2 2.98Å
896E89.5Confident91.5Very high118.75 Ų118.7536.5 Ų36.556%0.55517%0.173SC*.SBendtrans-67-31.5174.870.9-169.3151.100112.8R865R865-E896 IonicContact CZ-OE1 3.32Å; R865-E896 IonicContact NH1-OE1 3.14Å; R865-E896 PolarHBondContact NH1-OE1 3.45Å; R865-E896 IonicContact NH2-OE1 3.26Å; R865-E896 PolarHBondContact NH2-OE1 3.14Å
897V90.6Very high91.5Very high39.5 Ų39.537.2 Ų37.224%0.23918%0.175CC..  trans-90.3120.5-175.6-177.40000110.9P862 D895 D899 I900 R901P862-V897 HydrophobicContact CB-CG2 3.62Å; P862-V897 VanDerWaalsContact CB-CG2 3.49Å; P862-V897 HydrophobicContact CG-CG2 4.42Å; D895-V897 VanDerWaalsContact C-N 3.32Å; D895-V897 PolarHBondContact O-N 3.13Å; D895-V897 PolarHBondContact OD1-N 3.14Å; V897-D899 VanDerWaalsContact C-N 3.32Å; V897-D899 HydrophobicContact CG1-CB 4.2Å; V897-D899 PolarHBondContact O-N 3.23Å; V897-I900 HydrophobicContact CB-CB 4.41Å; V897-I900 HydrophobicContact CB-CD1 3.96Å; V897-I900 HydrophobicContact CB-CG1 4.06Å; V897-I900 HydrophobicContact CG1-CD1 4.43Å; V897-I900 HydrophobicContact CG1-CG1 4.21Å; V897-I900 HydrophobicContact CG2-CD1 4.39Å; V897-I900 WeakPolarHBondContact O-CB 3.29Å; V897-I900 PolarHBondContact O-N 3.12Å; V897-I900 VanDerWaalsContact O-N 3.13Å; V897-R901 PolarHBondContact O-N 3.23Å
898F89.3Confident91.6Very high29.5 Ų29.532.9 Ų32.913%0.12915%0.152CC..Hα-helixtrans-58.4-40.2-178.6-179.1-105.4000113.9I900 R901 C902 Q945 L948 L949F898-I900 VanDerWaalsContact C-N 3.27Å; F898-I900 PolarHBondContact O-N 2.93Å; F898-R901 WeakPolarHBondContact O-CB 3.25Å; F898-R901 PolarHBondContact O-N 3.16Å; F898-C902 WeakPolarHBondContact CE1-SG 3.39Å; F898-C902 WeakPolarHBondContact CZ-SG 3.36Å; F898-C902 PolarHBondContact O-N 3.18Å; F898-Q945 HydrophobicContact CB-CG 4.45Å; F898-Q945 HydrophobicContact CD1-CG 4.48Å; F898-Q945 HydrophobicContact CD2-CB 3.74Å; F898-Q945 HydrophobicContact CD2-CG 3.73Å; F898-Q945 VanDerWaalsContact CD2-CG 3.5Å; F898-Q945 HydrophobicContact CE2-CB 3.62Å; F898-Q945 VanDerWaalsContact CE2-CB 3.43Å; F898-Q945 HydrophobicContact CE2-CG 4.01Å; F898-Q945 VanDerWaalsContact CE2-O 3.23Å; F898-Q945 WeakPolarHBondContact CE2-O 3.37Å; F898-Q945 VanDerWaalsContact CE2-OE1 3.3Å; F898-Q945 HydrophobicContact CG-CB 4.47Å; F898-Q945 HydrophobicContact CG-CG 4.16Å; F898-Q945 HydrophobicContact CZ-CB 4.36Å; F898-Q945 HydrophobicContact CZ-CG 4.38Å; F898-Q945 VanDerWaalsContact CZ-OE1 3.3Å; F898-L948 HydrophobicContact CE1-CB 4.13Å; F898-L948 HydrophobicContact CE1-CD1 4.08Å; F898-L948 HydrophobicContact CE2-CB 4.5Å; F898-L948 HydrophobicContact CZ-CB 3.55Å; F898-L948 HydrophobicContact CZ-CD1 4.23Å; F898-L948 HydrophobicContact CZ-CG 4.5Å; F898-L949 HydrophobicContact CE2-CB 4.31Å; F898-L949 HydrophobicContact CE2-CD1 3.85Å; F898-L949 HydrophobicContact CE2-CD2 4.35Å; F898-L949 HydrophobicContact CE2-CG 3.68Å; F898-L949 HydrophobicContact CZ-CG 4.08Å
899D88.2Confident91.5Very high54 Ų5430.1 Ų30.129%0.28914%0.141SC..Hα-helixtrans-60.3-36.6178.8-71-15.6000111.9L412 R866 V897 C902 L903 R1167L412-D899 HydrophobicContact CD2-CB 3.85Å; L412-D899 WeakPolarHBondContact CD2-O 3.43Å; R866-D899 IonicContact CZ-OD2 3.15Å; R866-D899 IonicContact NE-OD2 2.8Å; R866-D899 PolarHBondContact NE-OD2 3.35Å; R866-D899 IonicContact NH2-OD2 2.8Å; R866-D899 PolarHBondContact NH2-OD2 2.79Å; V897-D899 VanDerWaalsContact C-N 3.32Å; V897-D899 HydrophobicContact CG1-CB 4.2Å; V897-D899 PolarHBondContact O-N 3.23Å; D899-C902 PolarHBondContact O-N 2.98Å; D899-L903 VanDerWaalsContact O-CG 3.29Å; D899-L903 WeakPolarHBondContact O-CG 3.28Å; D899-L903 PolarHBondContact O-N 3.29Å; D899-R1167 IonicContact OD1-CZ 2.8Å; D899-R1167 IonicContact OD1-NE 2.69Å; D899-R1167 PolarHBondContact OD1-NE 2.95Å; D899-R1167 IonicContact OD1-NH2 3.67Å; D899-R1167 PolarHBondContact OD1-NH2 3.31Å; D899-R1167 IonicContact OD2-CZ 2.88Å; D899-R1167 IonicContact OD2-NE 3.43Å; D899-R1167 IonicContact OD2-NH2 3.94Å; D899-R1167 PolarHBondContact OD2-NH2 3.05Å
900I92.4Very high91.3Very high0 Ų033.2 Ų33.20%015%0.153CC..Hα-helixtrans-67.3-48176.2-63.3178.8000109.8R865 R866 F869 D895 V897 F898 C902 L903 V904R865-I900 HydrophobicContact CB-CD1 3.65Å; R866-I900 HydrophobicContact CB-CD1 4.3Å; R866-I900 HydrophobicContact CB-CG1 4.03Å; R866-I900 HydrophobicContact CG-CG1 4.48Å; F869-I900 HydrophobicContact CD2-CG2 3.76Å; F869-I900 HydrophobicContact CE2-CG2 3.89Å; D895-I900 HydrophobicContact CB-CB 4.21Å; D895-I900 HydrophobicContact CB-CG2 3.89Å; V897-I900 HydrophobicContact CB-CB 4.41Å; V897-I900 HydrophobicContact CB-CD1 3.96Å; V897-I900 HydrophobicContact CB-CG1 4.06Å; V897-I900 HydrophobicContact CG1-CD1 4.43Å; V897-I900 HydrophobicContact CG1-CG1 4.21Å; V897-I900 HydrophobicContact CG2-CD1 4.39Å; V897-I900 WeakPolarHBondContact O-CB 3.29Å; V897-I900 PolarHBondContact O-N 3.12Å; V897-I900 VanDerWaalsContact O-N 3.13Å; F898-I900 VanDerWaalsContact C-N 3.27Å; F898-I900 PolarHBondContact O-N 2.93Å; I900-C902 VanDerWaalsContact C-N 3.26Å; I900-C902 PolarHBondContact O-N 3.32Å; I900-L903 PolarHBondContact O-N 2.89Å; I900-L903 VanDerWaalsContact O-N 3.12Å; I900-V904 HydrophobicContact CG2-CG2 4.11Å; I900-V904 WeakPolarHBondContact O-CB 3.32Å; I900-V904 VanDerWaalsContact O-CG2 3.29Å; I900-V904 WeakPolarHBondContact O-CG2 3.38Å; I900-V904 PolarHBondContact O-N 3.17Å
901R93Very high91.3Very high68.5 Ų68.531.9 Ų31.926%0.25815%0.147SC..Hα-helixtrans-54.6-42.6175.5-56.6-171.5-154.4174.2-2.5111.9L893 D895 V897 F898 M905 L949L893-R901 WeakPolarHBondContact O-CD 3.38Å; L893-R901 VanDerWaalsContact O-CG 3.3Å; L893-R901 WeakPolarHBondContact O-CG 3.25Å; D895-R901 HydrophobicContact CB-CG 4.24Å; D895-R901 WeakPolarHBondContact O-CD 3.26Å; D895-R901 PolarHBondContact O-NE 3.3Å; D895-R901 VanDerWaalsContact O-NE 3.07Å; D895-R901 PolarHBondContact O-NH2 2.98Å; V897-R901 PolarHBondContact O-N 3.23Å; F898-R901 WeakPolarHBondContact O-CB 3.25Å; F898-R901 PolarHBondContact O-N 3.16Å; R901-M905 VanDerWaalsContact O-CB 3.24Å; R901-M905 WeakPolarHBondContact O-CB 3.35Å; R901-M905 PolarHBondContact O-N 3.17Å; R901-L949 HydrophobicContact CB-CD1 4.45Å; R901-L949 HydrophobicContact CB-CD2 3.95Å
902C91Very high91.3Very high8.5 Ų8.527.8 Ų27.86%0.05713%0.126CC..Hα-helixtrans-64.8-47.2176.5-80.50000112.5L412 L419 F898 D899 I900 V904 M905 Q906 C952L412-C902 HydrophobicContact CD2-CB 3.45Å; L412-C902 VanDerWaalsContact CD2-CB 3.45Å; L419-C902 HydrophobicContact CD1-CB 4.1Å; F898-C902 WeakPolarHBondContact CE1-SG 3.39Å; F898-C902 WeakPolarHBondContact CZ-SG 3.36Å; F898-C902 PolarHBondContact O-N 3.18Å; D899-C902 PolarHBondContact O-N 2.98Å; I900-C902 VanDerWaalsContact C-N 3.26Å; I900-C902 PolarHBondContact O-N 3.32Å; C902-V904 VanDerWaalsContact C-N 3.33Å; C902-V904 PolarHBondContact O-N 3.23Å; C902-M905 WeakPolarHBondContact O-CB 3.26Å; C902-M905 PolarHBondContact O-N 3.25Å; C902-Q906 VanDerWaalsContact O-CG 3.31Å; C902-Q906 WeakPolarHBondContact O-CG 3.34Å; C902-Q906 PolarHBondContact O-N 3.03Å; C902-Q906 VanDerWaalsContact O-N 3.08Å; C902-C952 PolarHBondContact O-SG 3.45Å
903L90.9Very high91.2Very high12.5 Ų12.531.1 Ų31.17%0.06514%0.143CC..Hα-helixtrans-59.4-47.1176.9-74.7168.3000111.6L412 L419 R866 F869 L870 D899 I900 M905 Q906 R907L412-L903 HydrophobicContact CD1-CD2 4.11Å; L412-L903 HydrophobicContact CD1-CG 4.35Å; L419-L903 HydrophobicContact CD2-CB 4.44Å; L419-L903 HydrophobicContact CD2-CD2 3.42Å; L419-L903 VanDerWaalsContact CD2-CD2 3.42Å; L419-L903 HydrophobicContact CD2-CG 3.57Å; R866-L903 HydrophobicContact CG-CD1 3.9Å; F869-L903 HydrophobicContact CB-CB 4.36Å; L870-L903 HydrophobicContact CD1-CD2 4.36Å; L870-L903 HydrophobicContact CD2-CD1 3.74Å; L870-L903 HydrophobicContact CD2-CD2 3.56Å; L870-L903 HydrophobicContact CD2-CG 4.3Å; L870-L903 HydrophobicContact CG-CD1 3.75Å; L870-L903 HydrophobicContact CG-CD2 4.35Å; D899-L903 VanDerWaalsContact O-CG 3.29Å; D899-L903 WeakPolarHBondContact O-CG 3.28Å; D899-L903 PolarHBondContact O-N 3.29Å; I900-L903 PolarHBondContact O-N 2.89Å; I900-L903 VanDerWaalsContact O-N 3.12Å; L903-M905 VanDerWaalsContact C-N 3.34Å; L903-M905 PolarHBondContact O-N 3.13Å; L903-Q906 WeakPolarHBondContact O-CB 3.21Å; L903-Q906 PolarHBondContact O-N 3.23Å; L903-Q906 VanDerWaalsContact O-N 3.13Å; L903-R907 VanDerWaalsContact CD2-NH1 3.34Å; L903-R907 WeakPolarHBondContact O-CD 3.48Å; L903-R907 WeakPolarHBondContact O-CG 3.29Å; L903-R907 PolarHBondContact O-N 3.1Å; L903-R907 VanDerWaalsContact O-N 3.11Å; L903-R907 PolarHBondContact O-NH1 3.38Å
904V93.4Very high91.1Very high0 Ų034.6 Ų34.60%016%0.161CC..Hα-helixtrans-61.7-43.2177.7173.70000110.9F869 L889 A892 L893 I900 C902 Q906 R907 L908F869-V904 HydrophobicContact CB-CG2 4.44Å; F869-V904 HydrophobicContact CD1-CG2 3.93Å; F869-V904 HydrophobicContact CD2-CG2 3.91Å; F869-V904 HydrophobicContact CE1-CG2 4.1Å; F869-V904 HydrophobicContact CE2-CG2 4.05Å; F869-V904 HydrophobicContact CG-CG2 3.85Å; F869-V904 HydrophobicContact CZ-CG2 4.16Å; L889-V904 HydrophobicContact CB-CG1 4.41Å; L889-V904 HydrophobicContact CD2-CG1 4.36Å; L889-V904 WeakPolarHBondContact O-CG1 3.36Å; A892-V904 HydrophobicContact CB-CG1 4.26Å; A892-V904 HydrophobicContact CB-CG2 3.78Å; L893-V904 HydrophobicContact CB-CG1 4.18Å; L893-V904 HydrophobicContact CD1-CG1 4.25Å; I900-V904 HydrophobicContact CG2-CG2 4.11Å; I900-V904 WeakPolarHBondContact O-CB 3.32Å; I900-V904 VanDerWaalsContact O-CG2 3.29Å; I900-V904 WeakPolarHBondContact O-CG2 3.38Å; I900-V904 PolarHBondContact O-N 3.17Å; C902-V904 VanDerWaalsContact C-N 3.33Å; C902-V904 PolarHBondContact O-N 3.23Å; V904-Q906 VanDerWaalsContact C-N 3.31Å; V904-Q906 PolarHBondContact O-N 2.87Å; V904-R907 PolarHBondContact O-N 3.17Å; V904-R907 VanDerWaalsContact O-N 3.13Å; V904-L908 HydrophobicContact CG1-CD1 3.96Å; V904-L908 HydrophobicContact CG1-CG 4.36Å; V904-L908 WeakPolarHBondContact O-CB 3.43Å; V904-L908 WeakPolarHBondContact O-CG 3.26Å; V904-L908 PolarHBondContact O-N 2.96Å
905M92Very high91Very high0.75 Ų0.7531.2 Ų31.20%0.00415%0.15CC..Hα-helixtrans-59-39.8173.8-174.767.28900112.2L893 R901 C902 L903 R907 L908 G909 L923 V926 L949 C952 L953L893-M905 HydrophobicContact CD1-CB 4.13Å; L893-M905 HydrophobicContact CD1-CE 4.08Å; L893-M905 HydrophobicContact CD1-SD 4.31Å; L893-M905 HydrophobicContact CD2-CE 4.26Å; R901-M905 VanDerWaalsContact O-CB 3.24Å; R901-M905 WeakPolarHBondContact O-CB 3.35Å; R901-M905 PolarHBondContact O-N 3.17Å; C902-M905 WeakPolarHBondContact O-CB 3.26Å; C902-M905 PolarHBondContact O-N 3.25Å; L903-M905 VanDerWaalsContact C-N 3.34Å; L903-M905 PolarHBondContact O-N 3.13Å; M905-R907 VanDerWaalsContact C-N 3.32Å; M905-R907 PolarHBondContact O-N 3.41Å; M905-L908 PolarHBondContact O-N 3.44Å; M905-G909 PolarHBondContact O-N 3.23Å; M905-L923 HydrophobicContact SD-CD2 4.11Å; M905-V926 HydrophobicContact CE-CG1 3.63Å; M905-V926 VanDerWaalsContact CE-CG1 3.49Å; M905-L949 HydrophobicContact CB-CD1 3.8Å; M905-L949 HydrophobicContact CB-CD2 4.43Å; M905-L949 HydrophobicContact CE-CB 4.18Å; M905-L949 HydrophobicContact CE-CD1 3.85Å; M905-L949 HydrophobicContact CE-CD2 4.19Å; M905-L949 HydrophobicContact CE-CG 3.81Å; M905-L949 HydrophobicContact CG-CD1 4.01Å; M905-C952 HydrophobicContact CG-CB 4.41Å; M905-L953 HydrophobicContact CE-CB 4.35Å; M905-L953 HydrophobicContact CE-CD2 4.37Å; M905-L953 HydrophobicContact CG-CB 4.15Å; M905-L953 HydrophobicContact CG-CD1 4.46Å; M905-L953 HydrophobicContact SD-CB 4.04Å; M905-L953 HydrophobicContact SD-CD1 3.78Å; M905-L953 HydrophobicContact SD-CD2 4.42Å; M905-L953 HydrophobicContact SD-CG 4.32Å
906Q91.1Very high91Very high37.5 Ų37.533.2 Ų33.218%0.17516%0.164CC..Hα-helixtrans-63.2-40.8175.8-66.6175.22.500112.3C902 L903 V904 G909 R910 C952 T956C902-Q906 VanDerWaalsContact O-CG 3.31Å; C902-Q906 WeakPolarHBondContact O-CG 3.34Å; C902-Q906 PolarHBondContact O-N 3.03Å; C902-Q906 VanDerWaalsContact O-N 3.08Å; L903-Q906 WeakPolarHBondContact O-CB 3.21Å; L903-Q906 PolarHBondContact O-N 3.23Å; L903-Q906 VanDerWaalsContact O-N 3.13Å; V904-Q906 VanDerWaalsContact C-N 3.31Å; V904-Q906 PolarHBondContact O-N 2.87Å; Q906-G909 PolarHBondContact O-N 3.36Å; Q906-R910 WeakPolarHBondContact O-CG 3.35Å; Q906-R910 PolarHBondContact O-N 2.94Å; Q906-R910 VanDerWaalsContact O-N 3.16Å; Q906-C952 WeakPolarHBondContact CG-SG 3.33Å; Q906-T956 HydrophobicContact CB-CG2 3.88Å; Q906-T956 HydrophobicContact CG-CG2 3.75Å
907R91Very high91Very high17 Ų1731.3 Ų31.36%0.06417%0.169CC..Hα-helixtrans-69.9-48178.9-64.3-28.8-175.4-128.85.7110.8F869 L870 F872 L903 V904 M905 G909 R910 L911F869-R907 PolarHBondContact O-NE 2.9Å; F869-R907 PolarHBondContact O-NH2 3.04Å; L870-R907 PolarHBondContact O-NH2 2.82Å; F872-R907 VanDerWaalsContact O-CZ 3.28Å; F872-R907 PolarHBondContact O-NE 3.13Å; F872-R907 PolarHBondContact O-NH2 3.19Å; F872-R907 VanDerWaalsContact O-NH2 3.08Å; L903-R907 VanDerWaalsContact CD2-NH1 3.34Å; L903-R907 WeakPolarHBondContact O-CD 3.48Å; L903-R907 WeakPolarHBondContact O-CG 3.29Å; L903-R907 PolarHBondContact O-N 3.1Å; L903-R907 VanDerWaalsContact O-N 3.11Å; L903-R907 PolarHBondContact O-NH1 3.38Å; V904-R907 PolarHBondContact O-N 3.17Å; V904-R907 VanDerWaalsContact O-N 3.13Å; M905-R907 VanDerWaalsContact C-N 3.32Å; M905-R907 PolarHBondContact O-N 3.41Å; R907-G909 VanDerWaalsContact C-N 3.29Å; R907-G909 PolarHBondContact O-N 3.24Å; R907-R910 VanDerWaalsContact CD-NH2 3.3Å; R907-R910 PolarHBondContact O-N 3.23Å; R907-L911 WeakPolarHBondContact O-CB 3.45Å; R907-L911 VanDerWaalsContact O-CG 3.26Å; R907-L911 WeakPolarHBondContact O-CG 3.35Å; R907-L911 PolarHBondContact O-N 3.02Å
908L92.8Very high91Very high0 Ų032 Ų320%018%0.175CC..Hα-helixtrans-58.4-37.4173.9-73.3174.5000112.5L886 L889 F890 L893 V904 M905 R910 L911 S912 V919 L923L886-L908 HydrophobicContact CD2-CD2 4.24Å; L889-L908 HydrophobicContact CB-CD1 4.42Å; L889-L908 HydrophobicContact CB-CD2 3.75Å; L889-L908 HydrophobicContact CB-CG 4.18Å; L889-L908 HydrophobicContact CD1-CD2 4.16Å; F890-L908 HydrophobicContact CD1-CD1 3.92Å; F890-L908 HydrophobicContact CD1-CD2 4.16Å; F890-L908 HydrophobicContact CE1-CD1 4.04Å; F890-L908 HydrophobicContact CE1-CD2 3.75Å; F890-L908 HydrophobicContact CE1-CG 4.46Å; F890-L908 HydrophobicContact CE2-CD2 4.2Å; F890-L908 HydrophobicContact CZ-CD2 4.15Å; L893-L908 HydrophobicContact CB-CD1 4.48Å; L893-L908 HydrophobicContact CD1-CD1 4.42Å; L893-L908 HydrophobicContact CD2-CD1 4.09Å; V904-L908 HydrophobicContact CG1-CD1 3.96Å; V904-L908 HydrophobicContact CG1-CG 4.36Å; V904-L908 WeakPolarHBondContact O-CB 3.43Å; V904-L908 WeakPolarHBondContact O-CG 3.26Å; V904-L908 PolarHBondContact O-N 2.96Å; M905-L908 PolarHBondContact O-N 3.44Å; L908-R910 VanDerWaalsContact C-N 3.35Å; L908-R910 PolarHBondContact O-N 3.48Å; L908-L911 PolarHBondContact O-N 3.18Å; L908-S912 PolarHBondContact O-N 3.4Å; L908-V919 WeakPolarHBondContact O-CG1 3.44Å; L908-L923 HydrophobicContact CB-CD2 4.26Å
909G90.6Very high91.1Very high0 Ų030.6 Ų30.60%017%0.169CC..Hα-helixtrans-60.4-47.7175.800000112.8M905 Q906 R907 L911 S912 T956M905-G909 PolarHBondContact O-N 3.23Å; Q906-G909 PolarHBondContact O-N 3.36Å; R907-G909 VanDerWaalsContact C-N 3.29Å; R907-G909 PolarHBondContact O-N 3.24Å; G909-L911 VanDerWaalsContact C-N 3.34Å; G909-L911 PolarHBondContact O-N 2.88Å; G909-S912 VanDerWaalsContact O-CB 3.3Å; G909-S912 WeakPolarHBondContact O-CB 3.39Å; G909-S912 PolarHBondContact O-N 3.09Å; G909-S912 PolarHBondContact O-OG 3.02Å; G909-T956 CarbonylContact C-O 3.54Å
910R89.8Confident91.3Very high65 Ų6531.2 Ų31.225%0.24517%0.17CC..Hα-helixtrans-64.1-42.3174.1-73.9173.720-149.9-18112.7D873 Q874 D877 Q906 R907 L908 S912 D913D873-R910 VanDerWaalsContact C-NH2 3.28Å; D873-R910 PolarHBondContact O-NH2 2.67Å; Q874-R910 VanDerWaalsContact N-NH2 3.2Å; D877-R910 IonicContact OD1-CZ 3.43Å; D877-R910 IonicContact OD1-NE 2.87Å; D877-R910 IonicContact OD1-NH2 3.11Å; D877-R910 PolarHBondContact OD1-NH2 3.19Å; D877-R910 IonicContact OD2-CZ 3.05Å; D877-R910 IonicContact OD2-NE 3.19Å; D877-R910 PolarHBondContact OD2-NE 3.23Å; D877-R910 VanDerWaalsContact OD2-NE 3.11Å; D877-R910 IonicContact OD2-NH2 3.22Å; D877-R910 PolarHBondContact OD2-NH2 3.14Å; Q906-R910 WeakPolarHBondContact O-CG 3.35Å; Q906-R910 PolarHBondContact O-N 2.94Å; Q906-R910 VanDerWaalsContact O-N 3.16Å; R907-R910 VanDerWaalsContact CD-NH2 3.3Å; R907-R910 PolarHBondContact O-N 3.23Å; L908-R910 VanDerWaalsContact C-N 3.35Å; L908-R910 PolarHBondContact O-N 3.48Å; R910-S912 PolarHBondContact O-N 3.11Å; R910-D913 PolarHBondContact O-N 3.11Å
911L92Very high91.3Very high0 Ų034.6 Ų34.60%019%0.192CC..Hα-helixtrans-65.1-21.2177.7-66.3169.8000112.8D877 L880 A881 L886 L889 R907 L908 G909 D913 I914 N915 V919D877-L911 HydrophobicContact CB-CD2 3.89Å; D877-L911 VanDerWaalsContact O-CD2 3.25Å; D877-L911 WeakPolarHBondContact O-CD2 3.3Å; L880-L911 HydrophobicContact CB-CD1 4.02Å; L880-L911 HydrophobicContact CB-CD2 4.05Å; A881-L911 HydrophobicContact CB-CD2 4.11Å; L886-L911 HydrophobicContact CD2-CD1 3.97Å; L889-L911 HydrophobicContact CD1-CD1 3.51Å; L889-L911 VanDerWaalsContact CD1-CD1 3.47Å; R907-L911 WeakPolarHBondContact O-CB 3.45Å; R907-L911 VanDerWaalsContact O-CG 3.26Å; R907-L911 WeakPolarHBondContact O-CG 3.35Å; R907-L911 PolarHBondContact O-N 3.02Å; L908-L911 PolarHBondContact O-N 3.18Å; G909-L911 VanDerWaalsContact C-N 3.34Å; G909-L911 PolarHBondContact O-N 2.88Å; L911-D913 PolarHBondContact O-N 3.16Å; L911-I914 HydrophobicContact CD2-CD1 4.4Å; L911-I914 PolarHBondContact O-N 3.07Å; L911-I914 VanDerWaalsContact O-N 3.09Å; L911-N915 PolarHBondContact O-N 3.01Å; L911-V919 HydrophobicContact CB-CG2 4.44Å
912S91.7Very high91.3Very high1.25 Ų1.2533.7 Ų33.71%0.00919%0.192CC..THydrogen-bonded Turntrans-66.3-21.6178.281.50000114.3L908 G909 R910 P916 Q920L908-S912 PolarHBondContact O-N 3.4Å; G909-S912 VanDerWaalsContact O-CB 3.3Å; G909-S912 WeakPolarHBondContact O-CB 3.39Å; G909-S912 PolarHBondContact O-N 3.09Å; G909-S912 PolarHBondContact O-OG 3.02Å; R910-S912 PolarHBondContact O-N 3.11Å; S912-P916 WeakPolarHBondContact O-CA 3.31Å; S912-P916 WeakPolarHBondContact O-CB 3.37Å; S912-Q920 PolarHBondContact O-NE2 3.38Å
913D89.5Confident91.3Very high72.25 Ų72.2533.3 Ų33.339%0.38619%0.19SC..THydrogen-bonded Turntrans-83.2-21.3172.8-82.7-41.9000112.8R910 L911 R959R910-D913 PolarHBondContact O-N 3.11Å; L911-D913 PolarHBondContact O-N 3.16Å; D913-R959 VanDerWaalsContact OD1-CD 3.3Å; D913-R959 WeakPolarHBondContact OD1-CD 3.38Å; D913-R959 IonicContact OD1-CZ 3.24Å; D913-R959 IonicContact OD1-NE 3.15Å; D913-R959 IonicContact OD1-NH1 3.05Å; D913-R959 PolarHBondContact OD1-NH1 3.03Å; D913-R959 IonicContact OD2-NH1 2.74Å
914I89.5Confident91.5Very high81.75 Ų81.7539.2 Ų39.242%0.41921%0.211SC..THydrogen-bonded Turntrans-94.6-48.8-177.4-61.3169.9000111D877 A881 L911 P916D877-I914 HydrophobicContact CB-CD1 3.63Å; A881-I914 HydrophobicContact CB-CB 4.42Å; A881-I914 HydrophobicContact CB-CG2 3.87Å; L911-I914 HydrophobicContact CD2-CD1 4.4Å; L911-I914 PolarHBondContact O-N 3.07Å; L911-I914 VanDerWaalsContact O-N 3.09Å; I914-P916 VanDerWaalsContact C-CD 3.47Å; I914-P916 WeakPolarHBondContact O-CD 3.44Å
915N90.6Very high91.4Very high34.5 Ų34.545 Ų4518%0.18424%0.236CC..  trans-123.873.9177.1-174.7-6.3000110.6A881 L911 A917 C918 V919A881-N915 HydrophobicContact CB-CB 4.2Å; A881-N915 PolarHBondContact O-ND2 3.25Å; L911-N915 PolarHBondContact O-N 3.01Å; N915-A917 VanDerWaalsContact C-N 3.26Å; N915-A917 PolarHBondContact O-N 3.02Å; N915-C918 PolarHBondContact ND2-SG 3.44Å; N915-C918 VanDerWaalsContact ND2-SG 3.39Å; N915-C918 PolarHBondContact OD1-N 3.13Å; N915-C918 VanDerWaalsContact OD1-N 3.08Å; N915-V919 VanDerWaalsContact O-CB 3.29Å; N915-V919 WeakPolarHBondContact O-CB 3.37Å; N915-V919 VanDerWaalsContact O-CG2 3.25Å; N915-V919 WeakPolarHBondContact O-CG2 3.37Å; N915-V919 PolarHBondContact O-N 3.18Å
916P91.3Very high91.4Very high56.25 Ų56.2545.4 Ų45.437%0.36524%0.238SC..Hα-helixtrans-63.3-32.7-178.925.2-34.8000112.6S912 I914 C918 V919 Q920S912-P916 WeakPolarHBondContact O-CA 3.31Å; S912-P916 WeakPolarHBondContact O-CB 3.37Å; I914-P916 VanDerWaalsContact C-CD 3.47Å; I914-P916 WeakPolarHBondContact O-CD 3.44Å; P916-C918 PolarHBondContact O-N 3.02Å; P916-V919 PolarHBondContact O-N 3.29Å; P916-Q920 HydrophobicContact CB-CG 4.04Å; P916-Q920 VanDerWaalsContact CB-NE2 3.34Å; P916-Q920 VanDerWaalsContact O-CB 3.27Å; P916-Q920 WeakPolarHBondContact O-CB 3.3Å; P916-Q920 WeakPolarHBondContact O-CG 3.37Å; P916-Q920 PolarHBondContact O-N 3.17Å
917A90.8Very high91.5Very high78.75 Ų78.7543.8 Ų43.865%0.65123%0.231SC*.Hα-helixtrans-62.9-44.1-174.700000113N915 P921N915-A917 VanDerWaalsContact C-N 3.26Å; N915-A917 PolarHBondContact O-N 3.02Å; A917-P921 VanDerWaalsContact O-CD 3.3Å; A917-P921 WeakPolarHBondContact O-CD 3.44Å; A917-P921 WeakPolarHBondContact O-CG 3.4Å
918C89.1Confident91.5Very high54.75 Ų54.7547.9 Ų47.937%0.3725%0.254SS..Hα-helixtrans-84.1-33.3177.5-61.80000112.5L886 N915 P916L886-C918 HydrophobicContact CD1-CB 3.71Å; N915-C918 PolarHBondContact ND2-SG 3.44Å; N915-C918 VanDerWaalsContact ND2-SG 3.39Å; N915-C918 PolarHBondContact OD1-N 3.13Å; N915-C918 VanDerWaalsContact OD1-N 3.08Å; P916-C918 PolarHBondContact O-N 3.02Å
919V92.8Very high91.4Very high0 Ų051.2 Ų51.20%027%0.269CS..Hα-helixtrans-88.2-46.5-168.6-179.80000113L886 F890 L908 L911 N915 P916 N922 L923L886-V919 HydrophobicContact CD1-CG2 3.8Å; L886-V919 HydrophobicContact CD2-CG2 3.79Å; L886-V919 HydrophobicContact CG-CG2 4.34Å; F890-V919 HydrophobicContact CZ-CG1 4.19Å; F890-V919 HydrophobicContact CZ-CG2 4.35Å; L908-V919 WeakPolarHBondContact O-CG1 3.44Å; L911-V919 HydrophobicContact CB-CG2 4.44Å; N915-V919 VanDerWaalsContact O-CB 3.29Å; N915-V919 WeakPolarHBondContact O-CB 3.37Å; N915-V919 VanDerWaalsContact O-CG2 3.25Å; N915-V919 WeakPolarHBondContact O-CG2 3.37Å; N915-V919 PolarHBondContact O-N 3.18Å; P916-V919 PolarHBondContact O-N 3.29Å; V919-N922 PolarHBondContact O-N 2.99Å; V919-L923 HydrophobicContact CG1-CD1 3.65Å; V919-L923 HydrophobicContact CG1-CG 3.85Å; V919-L923 WeakPolarHBondContact O-CG 3.48Å; V919-L923 PolarHBondContact O-N 2.97Å
920Q92.5Very high91.4Very high66.75 Ų66.7551.6 Ų51.631%0.31227%0.271SS..Hα-helixtrans-63.7-37.7-173.2-65.1-177.91.700114.5S912 P916 N922 L923 R924 F960S912-Q920 PolarHBondContact O-NE2 3.38Å; P916-Q920 HydrophobicContact CB-CG 4.04Å; P916-Q920 VanDerWaalsContact CB-NE2 3.34Å; P916-Q920 VanDerWaalsContact O-CB 3.27Å; P916-Q920 WeakPolarHBondContact O-CB 3.3Å; P916-Q920 WeakPolarHBondContact O-CG 3.37Å; P916-Q920 PolarHBondContact O-N 3.17Å; Q920-N922 VanDerWaalsContact C-N 3.3Å; Q920-N922 PolarHBondContact O-N 3.32Å; Q920-L923 PolarHBondContact O-N 3.18Å; Q920-R924 WeakPolarHBondContact O-CB 3.45Å; Q920-R924 PolarHBondContact O-N 3.24Å; Q920-F960 HydrophobicContact CB-CD2 3.94Å; Q920-F960 HydrophobicContact CB-CE2 3.97Å; Q920-F960 HydrophobicContact CG-CD2 3.79Å; Q920-F960 HydrophobicContact CG-CE2 4.33Å; Q920-F960 WeakPolarHBondContact O-CE2 3.12Å
921P92.7Very high91.4Very high71.5 Ų71.549.3 Ų49.346%0.46426%0.264SS..Hα-helixtrans-61.8-37.1175.7-24.935.8000113A917 R924 K925A917-P921 VanDerWaalsContact O-CD 3.3Å; A917-P921 WeakPolarHBondContact O-CD 3.44Å; A917-P921 WeakPolarHBondContact O-CG 3.4Å; P921-R924 WeakPolarHBondContact O-CB 3.49Å; P921-R924 PolarHBondContact O-N 3.16Å; P921-K925 WeakPolarHBondContact O-CG 3.18Å; P921-K925 PolarHBondContact O-N 3.32Å
922N91.3Very high91.3Very high49.25 Ų49.2553 Ų5326%0.26328%0.284SS..Hα-helixtrans-76.5-40.7177.1-72.7-21.5000111.4F890 V919 Q920 R924 K925 V926F890-N922 HydrophobicContact CD1-CB 3.97Å; F890-N922 HydrophobicContact CD2-CB 4.2Å; F890-N922 WeakPolarHBondContact CD2-ND2 3.4Å; F890-N922 HydrophobicContact CE1-CB 3.57Å; F890-N922 HydrophobicContact CE2-CB 4.09Å; F890-N922 VanDerWaalsContact CE2-ND2 3.28Å; F890-N922 WeakPolarHBondContact CE2-ND2 3.44Å; F890-N922 HydrophobicContact CG-CB 4.25Å; F890-N922 HydrophobicContact CZ-CB 3.78Å; F890-N922 WeakPolarHBondContact CZ-ND2 3.46Å; V919-N922 PolarHBondContact O-N 2.99Å; Q920-N922 VanDerWaalsContact C-N 3.3Å; Q920-N922 PolarHBondContact O-N 3.32Å; N922-R924 PolarHBondContact O-N 3.09Å; N922-K925 WeakPolarHBondContact O-CB 3.29Å; N922-K925 PolarHBondContact O-N 3.28Å; N922-K925 VanDerWaalsContact O-N 3.11Å; N922-K925 PolarHBondContact OD1-NZ 3.06Å; N922-V926 VanDerWaalsContact O-CG2 3.3Å; N922-V926 WeakPolarHBondContact O-CG2 3.34Å; N922-V926 PolarHBondContact O-N 3.12Å; N922-V926 VanDerWaalsContact O-N 3.1Å
923L92.4Very high91.1Very high0.5 Ų0.554.7 Ų54.70%0.00329%0.293CS..Hα-helixtrans-59.1-34.1171.5-71.7-177000112.4F890 M905 L908 V919 Q920 V926 L927 L953 F960F890-L923 HydrophobicContact CE1-CD2 4.38Å; M905-L923 HydrophobicContact SD-CD2 4.11Å; L908-L923 HydrophobicContact CB-CD2 4.26Å; V919-L923 HydrophobicContact CG1-CD1 3.65Å; V919-L923 HydrophobicContact CG1-CG 3.85Å; V919-L923 WeakPolarHBondContact O-CG 3.48Å; V919-L923 PolarHBondContact O-N 2.97Å; Q920-L923 PolarHBondContact O-N 3.18Å; L923-V926 PolarHBondContact O-N 3.18Å; L923-L927 WeakPolarHBondContact O-CB 3.32Å; L923-L927 PolarHBondContact O-N 3.12Å; L923-L953 HydrophobicContact CD1-CD1 4.27Å; L923-L953 HydrophobicContact CD2-CD1 4.16Å; L923-F960 HydrophobicContact CB-CD1 4.43Å; L923-F960 HydrophobicContact CB-CE1 3.89Å; L923-F960 HydrophobicContact CB-CE2 4.42Å; L923-F960 HydrophobicContact CB-CZ 3.91Å; L923-F960 HydrophobicContact CD1-CD1 4.46Å
924R93.6Very high91Very high135.25 Ų135.2551.5 Ų51.551%0.5128%0.275SS..Hα-helixtrans-64.7-40.8174-174.2179.4176.7167.6-2112.5Q920 P921 N922 V926 L927 L928 F960 Y964Q920-R924 WeakPolarHBondContact O-CB 3.45Å; Q920-R924 PolarHBondContact O-N 3.24Å; P921-R924 WeakPolarHBondContact O-CB 3.49Å; P921-R924 PolarHBondContact O-N 3.16Å; N922-R924 PolarHBondContact O-N 3.09Å; R924-V926 VanDerWaalsContact C-N 3.33Å; R924-L927 PolarHBondContact O-N 3.07Å; R924-L928 HydrophobicContact CG-CD1 4.45Å; R924-L928 WeakPolarHBondContact O-CG 3.38Å; R924-L928 PolarHBondContact O-N 3.07Å; R924-L928 VanDerWaalsContact O-N 3.11Å; R924-F960 HydrophobicContact CB-CE2 4.43Å; R924-F960 HydrophobicContact CB-CZ 4.08Å; R924-Y964 WeakPolarHBondContact CD-OH 3.42Å
925K92.5Very high90.7Very high122 Ų12248.5 Ų48.553%0.5326%0.262SS..Hα-helixtrans-61.4-45.1173.9-83.8173.2-172.8170.30110.8P921 N922 L928 H929P921-K925 WeakPolarHBondContact O-CG 3.18Å; P921-K925 PolarHBondContact O-N 3.32Å; N922-K925 WeakPolarHBondContact O-CB 3.29Å; N922-K925 PolarHBondContact O-N 3.28Å; N922-K925 VanDerWaalsContact O-N 3.11Å; N922-K925 PolarHBondContact OD1-NZ 3.06Å; K925-L928 PolarHBondContact O-N 3.05Å; K925-H929 PolarHBondContact O-CD2 2.87Å; K925-H929 PolarHBondContact O-N 3.22Å
926V91.6Very high90.4Very high8.75 Ų8.7552.5 Ų52.55%0.05328%0.279CS..Hα-helixtrans-65.1-41.2179175.60000111.7L893 M905 N922 L923 R924 L928 H929 T930L893-V926 HydrophobicContact CD2-CB 4.3Å; L893-V926 HydrophobicContact CD2-CG1 3.93Å; L893-V926 HydrophobicContact CD2-CG2 3.43Å; L893-V926 VanDerWaalsContact CD2-CG2 3.43Å; M905-V926 HydrophobicContact CE-CG1 3.63Å; M905-V926 VanDerWaalsContact CE-CG1 3.49Å; N922-V926 VanDerWaalsContact O-CG2 3.3Å; N922-V926 WeakPolarHBondContact O-CG2 3.34Å; N922-V926 PolarHBondContact O-N 3.12Å; N922-V926 VanDerWaalsContact O-N 3.1Å; L923-V926 PolarHBondContact O-N 3.18Å; R924-V926 VanDerWaalsContact C-N 3.33Å; V926-L928 VanDerWaalsContact C-N 3.32Å; V926-L928 PolarHBondContact O-N 2.94Å; V926-H929 WeakPolarHBondContact O-CB 3.23Å; V926-H929 PolarHBondContact O-N 3.13Å; V926-H929 VanDerWaalsContact O-N 3.17Å; V926-T930 HydrophobicContact CG1-CG2 4.34Å; V926-T930 WeakPolarHBondContact O-CB 3.44Å; V926-T930 WeakPolarHBondContact O-CG2 3.38Å; V926-T930 PolarHBondContact O-N 3.39Å; V926-T930 PolarHBondContact O-OG1 3.23Å
927L92.4Very high89.9Confident5.25 Ų5.2550.8 Ų50.83%0.02727%0.269CS..Hα-helixtrans-58.6-46.8174.9-178.263000111L923 R924 H929 T930 L931 L950 L953 F960 L961 Y964 L968L923-L927 WeakPolarHBondContact O-CB 3.32Å; L923-L927 PolarHBondContact O-N 3.12Å; R924-L927 PolarHBondContact O-N 3.07Å; L927-H929 PolarHBondContact O-N 3.13Å; L927-T930 PolarHBondContact O-N 2.97Å; L927-T930 PolarHBondContact O-OG1 3.05Å; L927-T930 VanDerWaalsContact O-OG1 3.09Å; L927-L931 HydrophobicContact CD1-CD1 4.26Å; L927-L931 HydrophobicContact CD1-CG 4.44Å; L927-L931 HydrophobicContact CG-CD1 4.11Å; L927-L931 WeakPolarHBondContact O-CB 3.36Å; L927-L931 WeakPolarHBondContact O-CD1 3.27Å; L927-L931 VanDerWaalsContact O-CG 3.29Å; L927-L931 WeakPolarHBondContact O-CG 3.29Å; L927-L931 PolarHBondContact O-N 3.17Å; L927-L950 HydrophobicContact CD1-CD1 3.56Å; L927-L953 HydrophobicContact CB-CD2 4.38Å; L927-L953 HydrophobicContact CD1-CD2 4.05Å; L927-F960 HydrophobicContact CD2-CE1 4.28Å; L927-L961 HydrophobicContact CD1-CD1 4.45Å; L927-L961 HydrophobicContact CD1-CD2 4.07Å; L927-L961 HydrophobicContact CD2-CD2 3.9Å; L927-Y964 HydrophobicContact CD2-CD1 4.34Å; L927-Y964 HydrophobicContact CD2-CD2 4.06Å; L927-Y964 HydrophobicContact CD2-CG 4.03Å; L927-L968 HydrophobicContact CD1-CD2 4.19Å
928L92.1Very high89.2Confident103 Ų10350.2 Ų50.254%0.53927%0.27SS..Hα-helixtrans-64.4-40.8177.1-67.9170.6000112.3R924 K925 V926 L931 N932R924-L928 HydrophobicContact CG-CD1 4.45Å; R924-L928 WeakPolarHBondContact O-CG 3.38Å; R924-L928 PolarHBondContact O-N 3.07Å; R924-L928 VanDerWaalsContact O-N 3.11Å; K925-L928 PolarHBondContact O-N 3.05Å; V926-L928 VanDerWaalsContact C-N 3.32Å; V926-L928 PolarHBondContact O-N 2.94Å; L928-L931 PolarHBondContact O-N 3.34Å; L928-N932 VanDerWaalsContact O-CB 3.31Å; L928-N932 WeakPolarHBondContact O-CB 3.27Å; L928-N932 PolarHBondContact O-N 3.19Å
929H90.9Very high88.9Confident68.5 Ų68.549.4 Ų49.432%0.31727%0.265SS..Hα-helixtrans-63.9-48176.1-161.716.4000112Y894 K925 V926 L927 L931 N932 D933 H1559Y894-H929 AromaticContact CE1-CD2 3.91Å; Y894-H929 PolarHBondContact OH-ND1 3.3Å; K925-H929 PolarHBondContact O-CD2 2.87Å; K925-H929 PolarHBondContact O-N 3.22Å; V926-H929 WeakPolarHBondContact O-CB 3.23Å; V926-H929 PolarHBondContact O-N 3.13Å; V926-H929 VanDerWaalsContact O-N 3.17Å; L927-H929 PolarHBondContact O-N 3.13Å; H929-L931 VanDerWaalsContact C-N 3.3Å; H929-L931 PolarHBondContact O-N 3.36Å; H929-N932 WeakPolarHBondContact O-CB 3.37Å; H929-N932 PolarHBondContact O-N 2.98Å; H929-N932 VanDerWaalsContact O-N 3.12Å; H929-D933 VanDerWaalsContact CE1-CG 3.48Å; H929-D933 IonicContact CE1-OD1 2.94Å; H929-D933 PolarHBondContact CE1-OD1 3.11Å; H929-D933 IonicContact CE1-OD2 3.45Å; H929-D933 PolarHBondContact CE1-OD2 3.16Å; H929-D933 IonicContact ND1-OD1 3.51Å; H929-D933 PolarHBondContact ND1-OD1 3.27Å; H929-D933 VanDerWaalsContact ND1-OD1 3.08Å; H929-D933 IonicContact ND1-OD2 3.1Å; H929-D933 IonicContact NE2-OD2 3.59Å; H929-D933 PolarHBondContact O-N 3.13Å; H929-H1559 PolarHBondContact O-NE2 3.48Å; H929-H1559 VanDerWaalsContact O-NE2 3.12Å
930T90.3Very high88.4Confident8 Ų852.4 Ų52.45%0.04928%0.283CS..Hα-helixtrans-63.6-33.4178.651.20000112.7V926 L927 L934 S946 L949V926-T930 HydrophobicContact CG1-CG2 4.34Å; V926-T930 WeakPolarHBondContact O-CB 3.44Å; V926-T930 WeakPolarHBondContact O-CG2 3.38Å; V926-T930 PolarHBondContact O-N 3.39Å; V926-T930 PolarHBondContact O-OG1 3.23Å; L927-T930 PolarHBondContact O-N 2.97Å; L927-T930 PolarHBondContact O-OG1 3.05Å; L927-T930 VanDerWaalsContact O-OG1 3.09Å; T930-L934 VanDerWaalsContact O-CB 3.27Å; T930-L934 WeakPolarHBondContact O-CB 3.39Å; T930-L934 PolarHBondContact O-N 3.2Å; T930-S946 WeakPolarHBondContact O-CB 3.44Å; T930-L949 HydrophobicContact CG2-CB 4.34Å; T930-L949 HydrophobicContact CG2-CD2 3.76Å; T930-L949 HydrophobicContact CG2-CG 4.27Å
931L90.3Very high88.1Confident16 Ų1656.3 Ų56.38%0.08430%0.295CS..Hα-helixtrans-70.8-39.9172.7-69.2168.7000112.6L927 L928 H929 D933 L934 S935 L950 L968 I971L927-L931 HydrophobicContact CD1-CD1 4.26Å; L927-L931 HydrophobicContact CD1-CG 4.44Å; L927-L931 HydrophobicContact CG-CD1 4.11Å; L927-L931 WeakPolarHBondContact O-CB 3.36Å; L927-L931 WeakPolarHBondContact O-CD1 3.27Å; L927-L931 VanDerWaalsContact O-CG 3.29Å; L927-L931 WeakPolarHBondContact O-CG 3.29Å; L927-L931 PolarHBondContact O-N 3.17Å; L928-L931 PolarHBondContact O-N 3.34Å; H929-L931 VanDerWaalsContact C-N 3.3Å; H929-L931 PolarHBondContact O-N 3.36Å; L931-D933 VanDerWaalsContact C-N 3.34Å; L931-D933 PolarHBondContact O-N 3.41Å; L931-L934 PolarHBondContact O-N 3.2Å; L931-S935 VanDerWaalsContact O-CB 3.29Å; L931-S935 WeakPolarHBondContact O-CB 3.4Å; L931-S935 PolarHBondContact O-N 3.38Å; L931-S935 VanDerWaalsContact O-N 3.08Å; L931-S935 PolarHBondContact O-OG 3.19Å; L931-S935 VanDerWaalsContact O-OG 3.06Å; L931-L950 HydrophobicContact CD2-CD2 4.09Å; L931-L968 HydrophobicContact CD1-CD2 3.7Å; L931-L968 HydrophobicContact CD2-CD2 3.53Å; L931-L968 VanDerWaalsContact CD2-CD2 3.45Å; L931-L968 HydrophobicContact CG-CD2 4.11Å; L931-I971 HydrophobicContact CD1-CD1 4.1Å; L931-I971 HydrophobicContact CD2-CD1 4.39Å; L931-I971 HydrophobicContact CD2-CG2 4.18Å
932N89.2Confident87.8Confident78.25 Ų78.2555.8 Ų55.842%0.41829%0.289SS..Hα-helixtrans-62.5-44.7174.4-153.826000111.2L928 H929 L934 S935 H936L928-N932 VanDerWaalsContact O-CB 3.31Å; L928-N932 WeakPolarHBondContact O-CB 3.27Å; L928-N932 PolarHBondContact O-N 3.19Å; H929-N932 WeakPolarHBondContact O-CB 3.37Å; H929-N932 PolarHBondContact O-N 2.98Å; H929-N932 VanDerWaalsContact O-N 3.12Å; N932-L934 PolarHBondContact O-N 3.27Å; N932-S935 WeakPolarHBondContact CA-OG 3.24Å; N932-S935 PolarHBondContact O-N 3.11Å; N932-S935 PolarHBondContact O-OG 3.3Å; N932-S935 VanDerWaalsContact O-OG 3.09Å; N932-H936 WeakPolarHBondContact O-CB 3.4Å; N932-H936 PolarHBondContact O-N 3.35Å; N932-H936 PolarHBondContact OD1-CD2 3.11Å; N932-H936 VanDerWaalsContact OD1-CD2 3.29Å
933D88Confident87.6Confident37.5 Ų37.554.8 Ų54.820%0.20128%0.282CS..Hα-helixtrans-62.3-43.6175.3-74.18.7000111.4H929 L931 S935 S937 S946 H1559 I1560H929-D933 VanDerWaalsContact CE1-CG 3.48Å; H929-D933 IonicContact CE1-OD1 2.94Å; H929-D933 PolarHBondContact CE1-OD1 3.11Å; H929-D933 IonicContact CE1-OD2 3.45Å; H929-D933 PolarHBondContact CE1-OD2 3.16Å; H929-D933 IonicContact ND1-OD1 3.51Å; H929-D933 PolarHBondContact ND1-OD1 3.27Å; H929-D933 VanDerWaalsContact ND1-OD1 3.08Å; H929-D933 IonicContact ND1-OD2 3.1Å; H929-D933 IonicContact NE2-OD2 3.59Å; H929-D933 PolarHBondContact O-N 3.13Å; L931-D933 VanDerWaalsContact C-N 3.34Å; L931-D933 PolarHBondContact O-N 3.41Å; D933-S935 VanDerWaalsContact C-N 3.28Å; D933-S935 PolarHBondContact O-N 3.14Å; D933-S937 WeakPolarHBondContact O-CA 3.19Å; D933-S937 WeakPolarHBondContact O-CB 3.34Å; D933-S937 PolarHBondContact O-N 2.94Å; D933-S937 VanDerWaalsContact O-N 3.09Å; D933-S937 PolarHBondContact O-OG 3.3Å; D933-S946 WeakPolarHBondContact CB-OG 3.39Å; D933-S946 PolarHBondContact OD2-OG 3.41Å; D933-H1559 IonicContact OD1-CD2 3.62Å; D933-H1559 PolarHBondContact OD1-CD2 3.33Å; D933-H1559 IonicContact OD1-CG 3.58Å; D933-H1559 IonicContact OD1-NE2 3.8Å; D933-H1559 PolarHBondContact OD1-NE2 3.16Å; D933-H1559 IonicContact OD2-CD2 3.8Å; D933-I1560 WeakPolarHBondContact OD1-CG1 3.08Å
934L86.7Confident87.4Confident4 Ų456.8 Ų56.82%0.02129%0.291CS..Hα-helixtrans-65.1-30.7177.8-174.760.6000112.9T930 L931 N932 K943 A947 L950 L972 L1246T930-L934 VanDerWaalsContact O-CB 3.27Å; T930-L934 WeakPolarHBondContact O-CB 3.39Å; T930-L934 PolarHBondContact O-N 3.2Å; L931-L934 PolarHBondContact O-N 3.2Å; N932-L934 PolarHBondContact O-N 3.27Å; L934-K943 HydrophobicContact CD1-CB 4.25Å; L934-K943 WeakPolarHBondContact CD1-O 3.32Å; L934-A947 HydrophobicContact CD1-CB 4.03Å; L934-L950 HydrophobicContact CD2-CD2 4.32Å; L934-L972 HydrophobicContact CD2-CD2 3.77Å; L934-L1246 HydrophobicContact CD1-CD2 4.16Å; L934-L1246 HydrophobicContact CD2-CD2 4.3Å
935S83.8Confident87.2Confident19.5 Ų19.551.9 Ų51.914%0.13627%0.274CS..Hα-helixtrans-93.3-32.1-176.256.90000114.4L931 N932 D933 R975L931-S935 VanDerWaalsContact O-CB 3.29Å; L931-S935 WeakPolarHBondContact O-CB 3.4Å; L931-S935 PolarHBondContact O-N 3.38Å; L931-S935 VanDerWaalsContact O-N 3.08Å; L931-S935 PolarHBondContact O-OG 3.19Å; L931-S935 VanDerWaalsContact O-OG 3.06Å; N932-S935 WeakPolarHBondContact CA-OG 3.24Å; N932-S935 PolarHBondContact O-N 3.11Å; N932-S935 PolarHBondContact O-OG 3.3Å; N932-S935 VanDerWaalsContact O-OG 3.09Å; D933-S935 VanDerWaalsContact C-N 3.28Å; D933-S935 PolarHBondContact O-N 3.14Å; S935-R975 VanDerWaalsContact CA-CZ 3.48Å; S935-R975 VanDerWaalsContact CB-NH2 3.35Å; S935-R975 PolarHBondContact O-NH1 3.22Å; S935-R975 PolarHBondContact O-NH2 3.08Å
936H83.1Confident87.1Confident119.5 Ų119.546.4 Ų46.455%0.55325%0.251SS*.Hα-helixtrans-118.9-6.9-172.8-62.8-72.8000114.8N932 G938 Y1557 I1560N932-H936 WeakPolarHBondContact O-CB 3.4Å; N932-H936 PolarHBondContact O-N 3.35Å; N932-H936 PolarHBondContact OD1-CD2 3.11Å; N932-H936 VanDerWaalsContact OD1-CD2 3.29Å; H936-G938 PolarHBondContact O-N 3.3Å; H936-Y1557 HydrophobicContact CB-CE1 4.43Å; H936-I1560 HydrophobicContact CB-CD1 4.46Å
937S81.7Confident87Confident20.5 Ų20.546 Ų4614%0.14325%0.249CC..  trans-69128.7174.7169.70000112D933 S939 N942 K943D933-S937 WeakPolarHBondContact O-CA 3.19Å; D933-S937 WeakPolarHBondContact O-CB 3.34Å; D933-S937 PolarHBondContact O-N 2.94Å; D933-S937 VanDerWaalsContact O-N 3.09Å; D933-S937 PolarHBondContact O-OG 3.3Å; S937-S939 VanDerWaalsContact C-N 3.29Å; S937-S939 PolarHBondContact OG-N 3.24Å; S937-S939 PolarHBondContact OG-O 2.87Å; S937-N942 WeakPolarHBondContact OG-CB 3.32Å; S937-K943 WeakPolarHBondContact O-CE 3.38Å; S937-K943 WeakPolarHBondContact OG-CG 3.13Å; S937-K943 PolarHBondContact OG-N 3.34Å
938G76.9Confident86.9Confident65.5 Ų65.547 Ų4768%0.67525%0.254SS*.  trans-76-16.4167.500000113.6H936H936-G938 PolarHBondContact O-N 3.3Å
939S82.7Confident86.9Confident38.25 Ų38.2542.7 Ų42.727%0.26723%0.232SC..  trans-85.6122.1179.9173.90000111S937 R941 N942 K943 H1532S937-S939 VanDerWaalsContact C-N 3.29Å; S937-S939 PolarHBondContact OG-N 3.24Å; S937-S939 PolarHBondContact OG-O 2.87Å; S939-R941 VanDerWaalsContact C-N 3.28Å; S939-R941 PolarHBondContact O-N 2.93Å; S939-N942 VanDerWaalsContact CB-OD1 3.22Å; S939-N942 WeakPolarHBondContact CB-OD1 3.48Å; S939-N942 PolarHBondContact O-N 3.18Å; S939-N942 VanDerWaalsContact O-N 3.11Å; S939-N942 PolarHBondContact OG-N 2.93Å; S939-N942 PolarHBondContact OG-OD1 3.15Å; S939-K943 PolarHBondContact O-N 3.22Å; S939-K943 VanDerWaalsContact O-N 3.16Å; S939-H1532 WeakPolarHBondContact CB-NE2 3.46Å; S939-H1532 PolarHBondContact OG-NE2 3.47Å
940T82.4Confident87Confident62.5 Ų62.539.5 Ų39.538%0.38322%0.217SC..Hα-helixtrans-60.7-40.2175.9500000111.9N942 K943 E944 P1239 V1242T940-N942 VanDerWaalsContact C-N 3.32Å; T940-N942 PolarHBondContact O-N 3.16Å; T940-K943 WeakPolarHBondContact O-CB 3.11Å; T940-K943 PolarHBondContact O-N 3.16Å; T940-K943 VanDerWaalsContact O-N 3.12Å; T940-E944 WeakPolarHBondContact O-CB 3.37Å; T940-E944 PolarHBondContact O-N 3.1Å; T940-P1239 HydrophobicContact CG2-CG 3.66Å; T940-V1242 VanDerWaalsContact O-CG2 3.28Å; T940-V1242 WeakPolarHBondContact O-CG2 3.4Å
941R84.7Confident86.9Confident149.75 Ų149.7539.4 Ų39.457%0.56522%0.217SC*.Hα-helixtrans-59.3-42174.5-178.8176.6175.4132.8-4.3111.9S939 E944 Q945S939-R941 VanDerWaalsContact C-N 3.28Å; S939-R941 PolarHBondContact O-N 2.93Å; R941-E944 WeakPolarHBondContact O-CB 3.31Å; R941-E944 PolarHBondContact O-N 3.15Å; R941-Q945 HydrophobicContact CG-CG 4.4Å; R941-Q945 WeakPolarHBondContact O-CB 3.27Å; R941-Q945 VanDerWaalsContact O-CG 3.27Å; R941-Q945 WeakPolarHBondContact O-CG 3.31Å; R941-Q945 PolarHBondContact O-N 3.27Å
942N87.6Confident86.9Confident59.5 Ų59.539.1 Ų39.132%0.31822%0.216SC..Hα-helixtrans-69.9-39.5179.3-67.420.3000111.3S937 S939 T940 E944 Q945 S946S937-N942 WeakPolarHBondContact OG-CB 3.32Å; S939-N942 VanDerWaalsContact CB-OD1 3.22Å; S939-N942 WeakPolarHBondContact CB-OD1 3.48Å; S939-N942 PolarHBondContact O-N 3.18Å; S939-N942 VanDerWaalsContact O-N 3.11Å; S939-N942 PolarHBondContact OG-N 2.93Å; S939-N942 PolarHBondContact OG-OD1 3.15Å; T940-N942 VanDerWaalsContact C-N 3.32Å; T940-N942 PolarHBondContact O-N 3.16Å; N942-E944 VanDerWaalsContact C-N 3.32Å; N942-E944 PolarHBondContact O-N 3.11Å; N942-Q945 PolarHBondContact O-N 3.02Å; N942-S946 VanDerWaalsContact O-CB 3.27Å; N942-S946 WeakPolarHBondContact O-CB 3.35Å; N942-S946 PolarHBondContact O-N 3.11Å; N942-S946 PolarHBondContact O-OG 3.01Å; N942-S946 VanDerWaalsContact O-OG 3.14Å
943K87.4Confident87.1Confident29 Ų2935.4 Ų35.413%0.12620%0.196CC..Hα-helixtrans-58-46.4172.3-65.7179.2-170.9171.40111.7L934 S937 S939 T940 S946 A947 E1238 V1242L934-K943 HydrophobicContact CD1-CB 4.25Å; L934-K943 WeakPolarHBondContact CD1-O 3.32Å; S937-K943 WeakPolarHBondContact O-CE 3.38Å; S937-K943 WeakPolarHBondContact OG-CG 3.13Å; S937-K943 PolarHBondContact OG-N 3.34Å; S939-K943 PolarHBondContact O-N 3.22Å; S939-K943 VanDerWaalsContact O-N 3.16Å; T940-K943 WeakPolarHBondContact O-CB 3.11Å; T940-K943 PolarHBondContact O-N 3.16Å; T940-K943 VanDerWaalsContact O-N 3.12Å; K943-S946 PolarHBondContact O-N 2.93Å; K943-A947 VanDerWaalsContact O-CB 3.3Å; K943-A947 WeakPolarHBondContact O-CB 3.35Å; K943-A947 PolarHBondContact O-N 3.21Å; K943-E1238 VanDerWaalsContact NZ-CD 3.26Å; K943-E1238 IonicContact NZ-OE1 3.26Å; K943-E1238 PolarHBondContact NZ-OE1 3.19Å; K943-E1238 IonicContact NZ-OE2 3.26Å; K943-E1238 PolarHBondContact NZ-OE2 3.01Å; K943-E1238 VanDerWaalsContact NZ-OE2 3.08Å; K943-V1242 HydrophobicContact CB-CG1 4.12Å; K943-V1242 HydrophobicContact CB-CG2 4.25Å; K943-V1242 HydrophobicContact CD-CG1 4.47Å
944E87Confident87.2Confident41.75 Ų41.7533.7 Ų33.720%0.19519%0.187CC..Hα-helixtrans-59-53.4177.1-178.4-169.4170.100111.3T940 R941 N942 S946 A947 L948 P1241 V1242 A1245T940-E944 WeakPolarHBondContact O-CB 3.37Å; T940-E944 PolarHBondContact O-N 3.1Å; R941-E944 WeakPolarHBondContact O-CB 3.31Å; R941-E944 PolarHBondContact O-N 3.15Å; N942-E944 VanDerWaalsContact C-N 3.32Å; N942-E944 PolarHBondContact O-N 3.11Å; E944-S946 VanDerWaalsContact C-N 3.31Å; E944-S946 PolarHBondContact O-N 3.2Å; E944-A947 PolarHBondContact O-N 3.15Å; E944-L948 HydrophobicContact CG-CD1 4.14Å; E944-L948 WeakPolarHBondContact O-CB 3.5Å; E944-L948 WeakPolarHBondContact O-CG 3.17Å; E944-L948 PolarHBondContact O-N 3.17Å; E944-P1241 HydrophobicContact CG-CB 4.2Å; E944-P1241 VanDerWaalsContact OE2-CB 3.24Å; E944-P1241 WeakPolarHBondContact OE2-CB 3.28Å; E944-V1242 HydrophobicContact CB-CG2 4.03Å; E944-A1245 HydrophobicContact CG-CB 4.31Å
945Q89.7Confident87.3Confident32 Ų3235.7 Ų35.715%0.1520%0.204CC..Hα-helixtrans-62.7-40.4-178.9-67.1-105.3-34.700112.1F898 R941 N942 L948 L949F898-Q945 HydrophobicContact CB-CG 4.45Å; F898-Q945 HydrophobicContact CD1-CG 4.48Å; F898-Q945 HydrophobicContact CD2-CB 3.74Å; F898-Q945 HydrophobicContact CD2-CG 3.73Å; F898-Q945 VanDerWaalsContact CD2-CG 3.5Å; F898-Q945 HydrophobicContact CE2-CB 3.62Å; F898-Q945 VanDerWaalsContact CE2-CB 3.43Å; F898-Q945 HydrophobicContact CE2-CG 4.01Å; F898-Q945 VanDerWaalsContact CE2-O 3.23Å; F898-Q945 WeakPolarHBondContact CE2-O 3.37Å; F898-Q945 VanDerWaalsContact CE2-OE1 3.3Å; F898-Q945 HydrophobicContact CG-CB 4.47Å; F898-Q945 HydrophobicContact CG-CG 4.16Å; F898-Q945 HydrophobicContact CZ-CB 4.36Å; F898-Q945 HydrophobicContact CZ-CG 4.38Å; F898-Q945 VanDerWaalsContact CZ-OE1 3.3Å; R941-Q945 HydrophobicContact CG-CG 4.4Å; R941-Q945 WeakPolarHBondContact O-CB 3.27Å; R941-Q945 VanDerWaalsContact O-CG 3.27Å; R941-Q945 WeakPolarHBondContact O-CG 3.31Å; R941-Q945 PolarHBondContact O-N 3.27Å; N942-Q945 PolarHBondContact O-N 3.02Å; Q945-L948 PolarHBondContact O-N 3.12Å; Q945-L949 VanDerWaalsContact O-CB 3.26Å; Q945-L949 WeakPolarHBondContact O-CB 3.3Å; Q945-L949 WeakPolarHBondContact O-CG 3.44Å; Q945-L949 PolarHBondContact O-N 3.28Å
946S91.1Very high87.5Confident7.25 Ų7.2536.1 Ų36.15%0.05121%0.206CC..Hα-helixtrans-68.2-38.2177.5-62.80000112.4T930 D933 N942 K943 E944 L949 L950T930-S946 WeakPolarHBondContact O-CB 3.44Å; D933-S946 WeakPolarHBondContact CB-OG 3.39Å; D933-S946 PolarHBondContact OD2-OG 3.41Å; N942-S946 VanDerWaalsContact O-CB 3.27Å; N942-S946 WeakPolarHBondContact O-CB 3.35Å; N942-S946 PolarHBondContact O-N 3.11Å; N942-S946 PolarHBondContact O-OG 3.01Å; N942-S946 VanDerWaalsContact O-OG 3.14Å; K943-S946 PolarHBondContact O-N 2.93Å; E944-S946 VanDerWaalsContact C-N 3.31Å; E944-S946 PolarHBondContact O-N 3.2Å; S946-L949 PolarHBondContact O-N 3.19Å; S946-L950 VanDerWaalsContact O-CB 3.28Å; S946-L950 WeakPolarHBondContact O-CB 3.38Å; S946-L950 PolarHBondContact O-N 3.25Å
947A90Very high87.9Confident0 Ų030.4 Ų30.40%018%0.179CC..Hα-helixtrans-64.2-46.2171.500000111.4L934 K943 E944 L949 L950 A951 A1245 L1246 T1249L934-A947 HydrophobicContact CD1-CB 4.03Å; K943-A947 VanDerWaalsContact O-CB 3.3Å; K943-A947 WeakPolarHBondContact O-CB 3.35Å; K943-A947 PolarHBondContact O-N 3.21Å; E944-A947 PolarHBondContact O-N 3.15Å; A947-L949 VanDerWaalsContact C-N 3.34Å; A947-L949 PolarHBondContact O-N 2.99Å; A947-L950 WeakPolarHBondContact O-CB 3.22Å; A947-L950 PolarHBondContact O-N 3.22Å; A947-A951 WeakPolarHBondContact O-CB 3.4Å; A947-A951 PolarHBondContact O-N 3.12Å; A947-A1245 HydrophobicContact CB-CB 3.74Å; A947-L1246 HydrophobicContact CB-CD2 4.43Å; A947-T1249 HydrophobicContact CB-CG2 4.07Å; A947-T1249 WeakPolarHBondContact O-CG2 3.3Å
948L90.3Very high88.3Confident27 Ų2731.9 Ų31.914%0.14119%0.189CC..Hα-helixtrans-64.6-38.5177.8-70.5176.3000112.6V416 F898 E944 Q945 L950 A951 C952 A1245V416-L948 HydrophobicContact CG1-CB 4.47Å; V416-L948 HydrophobicContact CG1-CD2 3.75Å; F898-L948 HydrophobicContact CE1-CB 4.13Å; F898-L948 HydrophobicContact CE1-CD1 4.08Å; F898-L948 HydrophobicContact CE2-CB 4.5Å; F898-L948 HydrophobicContact CZ-CB 3.55Å; F898-L948 HydrophobicContact CZ-CD1 4.23Å; F898-L948 HydrophobicContact CZ-CG 4.5Å; E944-L948 HydrophobicContact CG-CD1 4.14Å; E944-L948 WeakPolarHBondContact O-CB 3.5Å; E944-L948 WeakPolarHBondContact O-CG 3.17Å; E944-L948 PolarHBondContact O-N 3.17Å; Q945-L948 PolarHBondContact O-N 3.12Å; L948-L950 VanDerWaalsContact C-N 3.34Å; L948-A951 WeakPolarHBondContact O-CB 3.41Å; L948-A951 PolarHBondContact O-N 3.07Å; L948-C952 WeakPolarHBondContact O-CB 3.38Å; L948-C952 PolarHBondContact O-N 3.19Å; L948-A1245 HydrophobicContact CD2-CB 3.89Å; L948-A1245 HydrophobicContact CG-CB 3.81Å
949L91.1Very high88.8Confident12.75 Ų12.7537 Ų377%0.06719%0.187CC..Hα-helixtrans-66.2-38.3174.9-150.780.3000111.8F898 R901 M905 T930 Q945 S946 A947 C952 L953F898-L949 HydrophobicContact CE2-CB 4.31Å; F898-L949 HydrophobicContact CE2-CD1 3.85Å; F898-L949 HydrophobicContact CE2-CD2 4.35Å; F898-L949 HydrophobicContact CE2-CG 3.68Å; F898-L949 HydrophobicContact CZ-CG 4.08Å; R901-L949 HydrophobicContact CB-CD1 4.45Å; R901-L949 HydrophobicContact CB-CD2 3.95Å; M905-L949 HydrophobicContact CB-CD1 3.8Å; M905-L949 HydrophobicContact CB-CD2 4.43Å; M905-L949 HydrophobicContact CE-CB 4.18Å; M905-L949 HydrophobicContact CE-CD1 3.85Å; M905-L949 HydrophobicContact CE-CD2 4.19Å; M905-L949 HydrophobicContact CE-CG 3.81Å; M905-L949 HydrophobicContact CG-CD1 4.01Å; T930-L949 HydrophobicContact CG2-CB 4.34Å; T930-L949 HydrophobicContact CG2-CD2 3.76Å; T930-L949 HydrophobicContact CG2-CG 4.27Å; Q945-L949 VanDerWaalsContact O-CB 3.26Å; Q945-L949 WeakPolarHBondContact O-CB 3.3Å; Q945-L949 WeakPolarHBondContact O-CG 3.44Å; Q945-L949 PolarHBondContact O-N 3.28Å; S946-L949 PolarHBondContact O-N 3.19Å; A947-L949 VanDerWaalsContact C-N 3.34Å; A947-L949 PolarHBondContact O-N 2.99Å; L949-C952 VanDerWaalsContact O-CB 3.32Å; L949-C952 WeakPolarHBondContact O-CB 3.35Å; L949-C952 PolarHBondContact O-N 3.34Å; L949-L953 PolarHBondContact O-N 3.28Å
950L92.3Very high89.2Confident1.25 Ų1.2535.6 Ų35.61%0.00718%0.177CC..Hα-helixtrans-63.9-44.4171.7-179.463.7000111.3L927 L931 L934 S946 A947 L948 C952 L953 I954 L968 L972 T1249L927-L950 HydrophobicContact CD1-CD1 3.56Å; L931-L950 HydrophobicContact CD2-CD2 4.09Å; L934-L950 HydrophobicContact CD2-CD2 4.32Å; S946-L950 VanDerWaalsContact O-CB 3.28Å; S946-L950 WeakPolarHBondContact O-CB 3.38Å; S946-L950 PolarHBondContact O-N 3.25Å; A947-L950 WeakPolarHBondContact O-CB 3.22Å; A947-L950 PolarHBondContact O-N 3.22Å; L948-L950 VanDerWaalsContact C-N 3.34Å; L950-C952 VanDerWaalsContact C-N 3.28Å; L950-C952 PolarHBondContact O-N 3.1Å; L950-L953 PolarHBondContact O-N 3.19Å; L950-I954 HydrophobicContact CD1-CD1 4.21Å; L950-I954 HydrophobicContact CD1-CG1 4.36Å; L950-I954 HydrophobicContact CG-CD1 3.86Å; L950-I954 HydrophobicContact CG-CG1 4.45Å; L950-I954 WeakPolarHBondContact O-CB 3.42Å; L950-I954 WeakPolarHBondContact O-CD1 3.33Å; L950-I954 WeakPolarHBondContact O-CG1 3.28Å; L950-I954 PolarHBondContact O-N 3.23Å; L950-L968 HydrophobicContact CD1-CD2 4.18Å; L950-L968 HydrophobicContact CD2-CD2 4.35Å; L950-L972 HydrophobicContact CD2-CD1 4.43Å; L950-L972 HydrophobicContact CD2-CD2 4.26Å; L950-T1249 HydrophobicContact CB-CG2 4.32Å; L950-T1249 HydrophobicContact CD2-CG2 4.36Å; L950-T1249 HydrophobicContact CG-CG2 4.4Å
951A89.8Confident89.6Confident5.75 Ų5.7532.7 Ų32.75%0.04816%0.159CC..Hα-helixtrans-60.4-37.5175.500000111.9V416 A947 L948 I954 A955 T1248 T1249 R1252V416-A951 HydrophobicContact CG1-CB 4.43Å; A947-A951 WeakPolarHBondContact O-CB 3.4Å; A947-A951 PolarHBondContact O-N 3.12Å; L948-A951 WeakPolarHBondContact O-CB 3.41Å; L948-A951 PolarHBondContact O-N 3.07Å; A951-I954 PolarHBondContact O-N 3.05Å; A951-A955 WeakPolarHBondContact O-CB 3.37Å; A951-A955 PolarHBondContact O-N 3.05Å; A951-A955 VanDerWaalsContact O-N 3.1Å; A951-T1248 HydrophobicContact CB-CG2 4.26Å; A951-T1249 HydrophobicContact CB-CG2 3.74Å; A951-R1252 HydrophobicContact CB-CG 4.4Å
952C90.1Very high89.8Confident9.5 Ų9.530.1 Ų30.16%0.06416%0.155CC..Hα-helixtrans-63.8-50175.2-168.80000111.4C902 M905 Q906 L948 L949 L950 I954 A955 T956C902-C952 PolarHBondContact O-SG 3.45Å; M905-C952 HydrophobicContact CG-CB 4.41Å; Q906-C952 WeakPolarHBondContact CG-SG 3.33Å; L948-C952 WeakPolarHBondContact O-CB 3.38Å; L948-C952 PolarHBondContact O-N 3.19Å; L949-C952 VanDerWaalsContact O-CB 3.32Å; L949-C952 WeakPolarHBondContact O-CB 3.35Å; L949-C952 PolarHBondContact O-N 3.34Å; L950-C952 VanDerWaalsContact C-N 3.28Å; L950-C952 PolarHBondContact O-N 3.1Å; C952-I954 VanDerWaalsContact C-N 3.32Å; C952-I954 PolarHBondContact O-N 3.07Å; C952-A955 WeakPolarHBondContact O-CB 3.46Å; C952-A955 PolarHBondContact O-N 3.16Å; C952-A955 VanDerWaalsContact O-N 3.11Å; C952-T956 WeakPolarHBondContact O-CB 3.13Å; C952-T956 VanDerWaalsContact O-CG2 3.25Å; C952-T956 WeakPolarHBondContact O-CG2 3.4Å; C952-T956 PolarHBondContact O-N 3.25Å; C952-T956 VanDerWaalsContact O-N 3.12Å; C952-T956 PolarHBondContact O-OG1 3.11Å; C952-T956 VanDerWaalsContact O-OG1 3.09Å
953L91.7Very high89.9Confident0.25 Ų0.2531.6 Ų31.60%0.00117%0.168CC..Hα-helixtrans-60.9-41.3176.8-179.761.7000112.2M905 L923 L927 L949 L950 A955 T956 A957 F960 L961M905-L953 HydrophobicContact CE-CB 4.35Å; M905-L953 HydrophobicContact CE-CD2 4.37Å; M905-L953 HydrophobicContact CG-CB 4.15Å; M905-L953 HydrophobicContact CG-CD1 4.46Å; M905-L953 HydrophobicContact SD-CB 4.04Å; M905-L953 HydrophobicContact SD-CD1 3.78Å; M905-L953 HydrophobicContact SD-CD2 4.42Å; M905-L953 HydrophobicContact SD-CG 4.32Å; L923-L953 HydrophobicContact CD1-CD1 4.27Å; L923-L953 HydrophobicContact CD2-CD1 4.16Å; L927-L953 HydrophobicContact CB-CD2 4.38Å; L927-L953 HydrophobicContact CD1-CD2 4.05Å; L949-L953 PolarHBondContact O-N 3.28Å; L950-L953 PolarHBondContact O-N 3.19Å; L953-A955 VanDerWaalsContact C-N 3.31Å; L953-A955 PolarHBondContact O-N 3.08Å; L953-T956 PolarHBondContact O-N 3.23Å; L953-T956 PolarHBondContact O-OG1 3.14Å; L953-A957 HydrophobicContact CD1-CB 3.93Å; L953-A957 PolarHBondContact O-N 2.93Å; L953-F960 HydrophobicContact CD2-CE1 4.47Å; L953-L961 HydrophobicContact CB-CD1 4.49Å; L953-L961 HydrophobicContact CD2-CD1 4.45Å; L953-L961 HydrophobicContact CD2-CD2 4.47Å; L953-L961 HydrophobicContact CG-CD1 4Å; L953-L961 WeakPolarHBondContact O-CD1 3.28Å
954I90.8Very high90Very high2.25 Ų2.2533.1 Ų33.11%0.01217%0.174CC..Hα-helixtrans-60.3-40.1174.5-65.9162.6000111.6L950 A951 C952 T956 L961 R1252 L1253 V1256L950-I954 HydrophobicContact CD1-CD1 4.21Å; L950-I954 HydrophobicContact CD1-CG1 4.36Å; L950-I954 HydrophobicContact CG-CD1 3.86Å; L950-I954 HydrophobicContact CG-CG1 4.45Å; L950-I954 WeakPolarHBondContact O-CB 3.42Å; L950-I954 WeakPolarHBondContact O-CD1 3.33Å; L950-I954 WeakPolarHBondContact O-CG1 3.28Å; L950-I954 PolarHBondContact O-N 3.23Å; A951-I954 PolarHBondContact O-N 3.05Å; C952-I954 VanDerWaalsContact C-N 3.32Å; C952-I954 PolarHBondContact O-N 3.07Å; I954-T956 VanDerWaalsContact C-N 3.34Å; I954-T956 PolarHBondContact O-N 3.4Å; I954-L961 VanDerWaalsContact CA-CD1 3.42Å; I954-L961 HydrophobicContact CB-CD1 4.04Å; I954-L961 HydrophobicContact CB-CD2 4.19Å; I954-L961 HydrophobicContact CG1-CD1 3.74Å; I954-L961 HydrophobicContact CG1-CD2 3.69Å; I954-L961 HydrophobicContact CG2-CD2 4Å; I954-R1252 HydrophobicContact CB-CB 4.28Å; I954-R1252 VanDerWaalsContact CG2-C 3.49Å; I954-R1252 HydrophobicContact CG2-CB 3.79Å; I954-R1252 WeakPolarHBondContact CG2-O 3.37Å; I954-L1253 HydrophobicContact CD1-CB 4.33Å; I954-L1253 HydrophobicContact CD1-CD1 4.15Å; I954-L1253 HydrophobicContact CG1-CD1 4.41Å; I954-L1253 HydrophobicContact CG2-CB 4.5Å; I954-L1253 HydrophobicContact CG2-CD1 4.45Å; I954-V1256 HydrophobicContact CG2-CB 4.45Å; I954-V1256 HydrophobicContact CG2-CG2 3.76Å
955A88.8Confident90Very high46.5 Ų46.531.7 Ų31.738%0.38417%0.168SC..Hα-helixtrans-72.3-27.3179.200000113.4A951 C952 L953A951-A955 WeakPolarHBondContact O-CB 3.37Å; A951-A955 PolarHBondContact O-N 3.05Å; A951-A955 VanDerWaalsContact O-N 3.1Å; C952-A955 WeakPolarHBondContact O-CB 3.46Å; C952-A955 PolarHBondContact O-N 3.16Å; C952-A955 VanDerWaalsContact O-N 3.11Å; L953-A955 VanDerWaalsContact C-N 3.31Å; L953-A955 PolarHBondContact O-N 3.08Å
956T88.8Confident89.8Confident27.25 Ų27.2535 Ų3517%0.16718%0.184CC..Hα-helixtrans-107.1-24.5-170.157.90000115Q906 G909 C952 L953 I954 P958Q906-T956 HydrophobicContact CB-CG2 3.88Å; Q906-T956 HydrophobicContact CG-CG2 3.75Å; G909-T956 CarbonylContact C-O 3.54Å; C952-T956 WeakPolarHBondContact O-CB 3.13Å; C952-T956 VanDerWaalsContact O-CG2 3.25Å; C952-T956 WeakPolarHBondContact O-CG2 3.4Å; C952-T956 PolarHBondContact O-N 3.25Å; C952-T956 VanDerWaalsContact O-N 3.12Å; C952-T956 PolarHBondContact O-OG1 3.11Å; C952-T956 VanDerWaalsContact O-OG1 3.09Å; L953-T956 PolarHBondContact O-N 3.23Å; L953-T956 PolarHBondContact O-OG1 3.14Å; I954-T956 VanDerWaalsContact C-N 3.34Å; I954-T956 PolarHBondContact O-N 3.4Å; T956-P958 VanDerWaalsContact C-CD 3.44Å; T956-P958 WeakPolarHBondContact O-CD 3.45Å
957A90.3Very high89.5Confident0.25 Ų0.2537.9 Ų37.90%0.00220%0.202CC..  trans-12859.5-179.300000112.1L953 R959 F960 L961L953-A957 HydrophobicContact CD1-CB 3.93Å; L953-A957 PolarHBondContact O-N 2.93Å; A957-R959 VanDerWaalsContact C-N 3.32Å; A957-R959 PolarHBondContact O-N 3.29Å; A957-F960 HydrophobicContact CB-CB 4.18Å; A957-F960 PolarHBondContact O-N 3.23Å; A957-L961 PolarHBondContact O-N 3.19Å
958P89.6Confident89.4Confident52.25 Ų52.2538 Ų3834%0.33920%0.203SC..Hα-helixtrans-61.1-41.9-174.725.2-34.5000112.3T956 F960 L961 I962 V1256T956-P958 VanDerWaalsContact C-CD 3.44Å; T956-P958 WeakPolarHBondContact O-CD 3.45Å; P958-F960 VanDerWaalsContact C-N 3.33Å; P958-F960 PolarHBondContact O-N 3.21Å; P958-L961 PolarHBondContact O-N 3.17Å; P958-L961 VanDerWaalsContact O-N 3.09Å; P958-I962 WeakPolarHBondContact O-CG1 3.36Å; P958-I962 PolarHBondContact O-N 3.31Å; P958-I962 VanDerWaalsContact O-N 3.16Å; P958-V1256 HydrophobicContact CB-CG1 4.27Å; P958-V1256 HydrophobicContact CB-CG2 3.9Å; P958-V1256 WeakPolarHBondContact O-CG1 3.24Å
959R89.1Confident89.2Confident171.75 Ų171.7537 Ų3765%0.64820%0.197SC*.Hα-helixtrans-60.4-41-179.5-73.7175.1171.9178.3-2.1113.1D913 A957 L961D913-R959 VanDerWaalsContact OD1-CD 3.3Å; D913-R959 WeakPolarHBondContact OD1-CD 3.38Å; D913-R959 IonicContact OD1-CZ 3.24Å; D913-R959 IonicContact OD1-NE 3.15Å; D913-R959 IonicContact OD1-NH1 3.05Å; D913-R959 PolarHBondContact OD1-NH1 3.03Å; D913-R959 IonicContact OD2-NH1 2.74Å; A957-R959 VanDerWaalsContact C-N 3.32Å; A957-R959 PolarHBondContact O-N 3.29Å; R959-L961 VanDerWaalsContact C-N 3.28Å; R959-L961 PolarHBondContact O-N 3.17Å
960F90.7Very high88.8Confident10 Ų1041.2 Ų41.24%0.04422%0.216CC..Hα-helixtrans-65-31.6176.5169.9-108.6000112.5Q920 L923 R924 L927 L953 A957 P958 P963 Y964Q920-F960 HydrophobicContact CB-CD2 3.94Å; Q920-F960 HydrophobicContact CB-CE2 3.97Å; Q920-F960 HydrophobicContact CG-CD2 3.79Å; Q920-F960 HydrophobicContact CG-CE2 4.33Å; Q920-F960 WeakPolarHBondContact O-CE2 3.12Å; L923-F960 HydrophobicContact CB-CD1 4.43Å; L923-F960 HydrophobicContact CB-CE1 3.89Å; L923-F960 HydrophobicContact CB-CE2 4.42Å; L923-F960 HydrophobicContact CB-CZ 3.91Å; L923-F960 HydrophobicContact CD1-CD1 4.46Å; R924-F960 HydrophobicContact CB-CE2 4.43Å; R924-F960 HydrophobicContact CB-CZ 4.08Å; L927-F960 HydrophobicContact CD2-CE1 4.28Å; L953-F960 HydrophobicContact CD2-CE1 4.47Å; A957-F960 HydrophobicContact CB-CB 4.18Å; A957-F960 PolarHBondContact O-N 3.23Å; P958-F960 VanDerWaalsContact C-N 3.33Å; P958-F960 PolarHBondContact O-N 3.21Å; F960-P963 WeakPolarHBondContact O-CD 3.49Å; F960-P963 WeakPolarHBondContact O-CG 3.5Å; F960-Y964 HydrophobicContact CD2-CE2 4.4Å; F960-Y964 HydrophobicContact CE1-CE2 4.47Å; F960-Y964 AromaticContact CE2-CE2 3.87Å; F960-Y964 HydrophobicContact CE2-CE2 3.87Å; F960-Y964 HydrophobicContact CZ-CD2 4.39Å; F960-Y964 AromaticContact CZ-CE2 3.91Å; F960-Y964 HydrophobicContact CZ-CE2 3.94Å; F960-Y964 WeakPolarHBondContact O-CD2 3.38Å
961L90.3Very high88.4Confident0.25 Ų0.2544 Ų440%0.00123%0.231CC..Hα-helixtrans-91.1-20.6-171.5-97.6150.8000115.3L927 L953 I954 A957 P958 R959 P963 Y964 S965 L968 V1256L927-L961 HydrophobicContact CD1-CD1 4.45Å; L927-L961 HydrophobicContact CD1-CD2 4.07Å; L927-L961 HydrophobicContact CD2-CD2 3.9Å; L953-L961 HydrophobicContact CB-CD1 4.49Å; L953-L961 HydrophobicContact CD2-CD1 4.45Å; L953-L961 HydrophobicContact CD2-CD2 4.47Å; L953-L961 HydrophobicContact CG-CD1 4Å; L953-L961 WeakPolarHBondContact O-CD1 3.28Å; I954-L961 VanDerWaalsContact CA-CD1 3.42Å; I954-L961 HydrophobicContact CB-CD1 4.04Å; I954-L961 HydrophobicContact CB-CD2 4.19Å; I954-L961 HydrophobicContact CG1-CD1 3.74Å; I954-L961 HydrophobicContact CG1-CD2 3.69Å; I954-L961 HydrophobicContact CG2-CD2 4Å; A957-L961 PolarHBondContact O-N 3.19Å; P958-L961 PolarHBondContact O-N 3.17Å; P958-L961 VanDerWaalsContact O-N 3.09Å; R959-L961 VanDerWaalsContact C-N 3.28Å; R959-L961 PolarHBondContact O-N 3.17Å; L961-P963 VanDerWaalsContact C-CD 3.49Å; L961-P963 VanDerWaalsContact C-N 3.35Å; L961-Y964 CarbonylContact O-C 3.57Å; L961-Y964 WeakPolarHBondContact O-CA 3.35Å; L961-Y964 PolarHBondContact O-N 3.15Å; L961-S965 PolarHBondContact O-N 3.04Å; L961-S965 VanDerWaalsContact O-N 3.12Å; L961-L968 HydrophobicContact CD1-CD1 3.59Å; L961-L968 HydrophobicContact CD2-CD1 3.78Å; L961-L968 HydrophobicContact CG-CD1 3.69Å; L961-V1256 HydrophobicContact CB-CG1 4.37Å
962I89.7Confident88.1Confident95 Ų9543.9 Ų43.949%0.48723%0.229SC..G310 helixtrans-44.7-51.9175.8-70.1164.9000113P958 Y964 S965 V1256P958-I962 WeakPolarHBondContact O-CG1 3.36Å; P958-I962 PolarHBondContact O-N 3.31Å; P958-I962 VanDerWaalsContact O-N 3.16Å; I962-Y964 VanDerWaalsContact C-N 3.27Å; I962-Y964 PolarHBondContact O-N 3.15Å; I962-S965 VanDerWaalsContact O-CB 3.3Å; I962-S965 WeakPolarHBondContact O-CB 3.3Å; I962-S965 PolarHBondContact O-N 3.09Å; I962-S965 PolarHBondContact O-OG 3.38Å; I962-S965 VanDerWaalsContact O-OG 3.06Å; I962-V1256 HydrophobicContact CG1-CG1 3.84Å
963P89.4Confident87.8Confident92.25 Ų92.2543.8 Ų43.860%0.59923%0.228SC*.G310 helixtrans-69.7-17-179.627.7-36.6000114.6F960 L961F960-P963 WeakPolarHBondContact O-CD 3.49Å; F960-P963 WeakPolarHBondContact O-CG 3.5Å; L961-P963 VanDerWaalsContact C-CD 3.49Å; L961-P963 VanDerWaalsContact C-N 3.35Å
964Y89.4Confident87.3Confident60.75 Ų60.7546.4 Ų46.424%0.23825%0.245CC..G310 helixtrans-98.7-1.6178.5-58.1-69.1000113.1R924 L927 F960 L961 I962 E966 P967 L968R924-Y964 WeakPolarHBondContact CD-OH 3.42Å; L927-Y964 HydrophobicContact CD2-CD1 4.34Å; L927-Y964 HydrophobicContact CD2-CD2 4.06Å; L927-Y964 HydrophobicContact CD2-CG 4.03Å; F960-Y964 HydrophobicContact CD2-CE2 4.4Å; F960-Y964 HydrophobicContact CE1-CE2 4.47Å; F960-Y964 AromaticContact CE2-CE2 3.87Å; F960-Y964 HydrophobicContact CE2-CE2 3.87Å; F960-Y964 HydrophobicContact CZ-CD2 4.39Å; F960-Y964 AromaticContact CZ-CE2 3.91Å; F960-Y964 HydrophobicContact CZ-CE2 3.94Å; F960-Y964 WeakPolarHBondContact O-CD2 3.38Å; L961-Y964 CarbonylContact O-C 3.57Å; L961-Y964 WeakPolarHBondContact O-CA 3.35Å; L961-Y964 PolarHBondContact O-N 3.15Å; I962-Y964 VanDerWaalsContact C-N 3.27Å; I962-Y964 PolarHBondContact O-N 3.15Å; Y964-E966 PolarHBondContact O-N 3.11Å; Y964-P967 WeakPolarHBondContact O-CD 3.24Å; Y964-L968 VanDerWaalsContact O-CB 3.3Å; Y964-L968 WeakPolarHBondContact O-CB 3.3Å; Y964-L968 WeakPolarHBondContact O-CD1 3.38Å; Y964-L968 WeakPolarHBondContact O-CG 3.34Å; Y964-L968 PolarHBondContact O-N 3.13Å
965S86.2Confident86.8Confident11.5 Ų11.549.1 Ų49.18%0.0826%0.255CS..Hα-helixtrans-61.7-43.9-17159.50000114.6L961 I962 L968 I969 A1257 S1260L961-S965 PolarHBondContact O-N 3.04Å; L961-S965 VanDerWaalsContact O-N 3.12Å; I962-S965 VanDerWaalsContact O-CB 3.3Å; I962-S965 WeakPolarHBondContact O-CB 3.3Å; I962-S965 PolarHBondContact O-N 3.09Å; I962-S965 PolarHBondContact O-OG 3.38Å; I962-S965 VanDerWaalsContact O-OG 3.06Å; S965-L968 WeakPolarHBondContact O-CB 3.36Å; S965-L968 PolarHBondContact O-N 3.32Å; S965-I969 VanDerWaalsContact O-CG1 3.3Å; S965-I969 WeakPolarHBondContact O-CG1 3.22Å; S965-I969 PolarHBondContact O-N 3.18Å; S965-A1257 WeakPolarHBondContact OG-CB 3.27Å; S965-S1260 PolarHBondContact OG-OG 3.4Å
966E85.4Confident86.5Confident102.25 Ų102.2546.9 Ų46.948%0.47824%0.237SC..Hα-helixtrans-67.5-49.5179.2-178.2150.9-132.500112.1Y964 L968 I969 H970 S1260Y964-E966 PolarHBondContact O-N 3.11Å; E966-L968 VanDerWaalsContact C-N 3.26Å; E966-L968 PolarHBondContact O-N 2.98Å; E966-I969 PolarHBondContact O-N 3.19Å; E966-I969 VanDerWaalsContact O-N 3.14Å; E966-H970 PolarHBondContact O-CD2 3.04Å; E966-H970 VanDerWaalsContact O-CD2 3.22Å; E966-H970 PolarHBondContact O-N 3.13Å; E966-H970 VanDerWaalsContact O-N 3.09Å; E966-S1260 WeakPolarHBondContact OE2-CA 3.49Å; E966-S1260 WeakPolarHBondContact OE2-CB 3.45Å; E966-S1260 PolarHBondContact OE2-OG 2.91Å
967P86.1Confident86.1Confident67.25 Ų67.2550.5 Ų50.544%0.43725%0.247SC..Hα-helixtrans-53.4-39.2168.6-28.234.3000114.1Y964 I969 H970 I971Y964-P967 WeakPolarHBondContact O-CD 3.24Å; P967-I969 PolarHBondContact O-N 3.08Å; P967-H970 PolarHBondContact O-N 3.3Å; P967-I971 WeakPolarHBondContact O-CG1 3.32Å; P967-I971 PolarHBondContact O-N 3.05Å; P967-I971 VanDerWaalsContact O-N 3.11Å
968L87.8Confident85.4Confident2.25 Ų2.2555.1 Ų55.11%0.01227%0.269CS..Hα-helixtrans-63.4-42.6177.2-76.6168000112.2L927 L931 L950 L961 Y964 S965 E966 H970 I971 L972 L1253L927-L968 HydrophobicContact CD1-CD2 4.19Å; L931-L968 HydrophobicContact CD1-CD2 3.7Å; L931-L968 HydrophobicContact CD2-CD2 3.53Å; L931-L968 VanDerWaalsContact CD2-CD2 3.45Å; L931-L968 HydrophobicContact CG-CD2 4.11Å; L950-L968 HydrophobicContact CD1-CD2 4.18Å; L950-L968 HydrophobicContact CD2-CD2 4.35Å; L961-L968 HydrophobicContact CD1-CD1 3.59Å; L961-L968 HydrophobicContact CD2-CD1 3.78Å; L961-L968 HydrophobicContact CG-CD1 3.69Å; Y964-L968 VanDerWaalsContact O-CB 3.3Å; Y964-L968 WeakPolarHBondContact O-CB 3.3Å; Y964-L968 WeakPolarHBondContact O-CD1 3.38Å; Y964-L968 WeakPolarHBondContact O-CG 3.34Å; Y964-L968 PolarHBondContact O-N 3.13Å; S965-L968 WeakPolarHBondContact O-CB 3.36Å; S965-L968 PolarHBondContact O-N 3.32Å; E966-L968 VanDerWaalsContact C-N 3.26Å; E966-L968 PolarHBondContact O-N 2.98Å; L968-H970 VanDerWaalsContact C-N 3.34Å; L968-I971 PolarHBondContact O-N 3.22Å; L968-L972 WeakPolarHBondContact O-CB 3.32Å; L968-L972 VanDerWaalsContact O-CG 3.28Å; L968-L972 WeakPolarHBondContact O-CG 3.4Å; L968-L972 PolarHBondContact O-N 3.24Å; L968-L1253 HydrophobicContact CB-CD2 4.5Å; L968-L1253 HydrophobicContact CD1-CD1 4.47Å
969I86Confident84.6Confident4.75 Ų4.7552.7 Ų52.72%0.02425%0.253CS..Hα-helixtrans-64-42.3175.6-65.8161.2000110.3S965 E966 P967 I971 L972 L973 L1253 S1260 I1261 Y1264S965-I969 VanDerWaalsContact O-CG1 3.3Å; S965-I969 WeakPolarHBondContact O-CG1 3.22Å; S965-I969 PolarHBondContact O-N 3.18Å; E966-I969 PolarHBondContact O-N 3.19Å; E966-I969 VanDerWaalsContact O-N 3.14Å; P967-I969 PolarHBondContact O-N 3.08Å; I969-I971 PolarHBondContact O-N 3.1Å; I969-L972 PolarHBondContact O-N 3.19Å; I969-L973 VanDerWaalsContact O-CB 3.25Å; I969-L973 WeakPolarHBondContact O-CB 3.36Å; I969-L973 PolarHBondContact O-N 2.97Å; I969-L1253 HydrophobicContact CD1-CD2 4.25Å; I969-L1253 HydrophobicContact CG1-CD2 3.67Å; I969-S1260 VanDerWaalsContact CD1-CB 3.46Å; I969-I1261 HydrophobicContact CD1-CD1 4.45Å; I969-I1261 HydrophobicContact CD1-CG1 3.61Å; I969-I1261 HydrophobicContact CG1-CG1 4.33Å; I969-Y1264 HydrophobicContact CG2-CD2 3.81Å; I969-Y1264 HydrophobicContact CG2-CE2 3.66Å; I969-Y1264 HydrophobicContact CG2-CG 4.37Å
970H83.5Confident83.9Confident102 Ų10244.6 Ų44.647%0.47222%0.223SC..Hα-helixtrans-63-24.6176.5-75.6-61.9000114.2E966 P967 L968 P974 Y1264E966-H970 PolarHBondContact O-CD2 3.04Å; E966-H970 VanDerWaalsContact O-CD2 3.22Å; E966-H970 PolarHBondContact O-N 3.13Å; E966-H970 VanDerWaalsContact O-N 3.09Å; P967-H970 PolarHBondContact O-N 3.3Å; L968-H970 VanDerWaalsContact C-N 3.34Å; H970-P974 WeakPolarHBondContact O-CD 3.4Å; H970-P974 VanDerWaalsContact O-CG 3.23Å; H970-P974 WeakPolarHBondContact O-CG 3.41Å; H970-Y1264 PolarHBondContact CE1-OH 3.04Å; H970-Y1264 VanDerWaalsContact CE1-OH 3.31Å
971I82.4Confident82.8Confident60 Ų6044.1 Ų44.131%0.30822%0.221SC..Hα-helixtrans-88.3-40.8174.5-64.2165.9000111.4L931 P967 L968 I969 P974 R975L931-I971 HydrophobicContact CD1-CD1 4.1Å; L931-I971 HydrophobicContact CD2-CD1 4.39Å; L931-I971 HydrophobicContact CD2-CG2 4.18Å; P967-I971 WeakPolarHBondContact O-CG1 3.32Å; P967-I971 PolarHBondContact O-N 3.05Å; P967-I971 VanDerWaalsContact O-N 3.11Å; L968-I971 PolarHBondContact O-N 3.22Å; I969-I971 PolarHBondContact O-N 3.1Å; I971-P974 WeakPolarHBondContact O-CD 3.27Å; I971-R975 WeakPolarHBondContact O-CG 3.36Å
972L84.4Confident81.4Confident3.5 Ų3.546.3 Ų46.32%0.01824%0.239CC..Hα-helixtrans-72-39.8-178.5-72.5169.8000112.7L934 L950 L968 I969 R975 I976 L1246 L1253L934-L972 HydrophobicContact CD2-CD2 3.77Å; L950-L972 HydrophobicContact CD2-CD1 4.43Å; L950-L972 HydrophobicContact CD2-CD2 4.26Å; L968-L972 WeakPolarHBondContact O-CB 3.32Å; L968-L972 VanDerWaalsContact O-CG 3.28Å; L968-L972 WeakPolarHBondContact O-CG 3.4Å; L968-L972 PolarHBondContact O-N 3.24Å; I969-L972 PolarHBondContact O-N 3.19Å; L972-R975 WeakPolarHBondContact O-CB 3.37Å; L972-R975 PolarHBondContact O-N 3.24Å; L972-R975 VanDerWaalsContact O-N 3.07Å; L972-I976 WeakPolarHBondContact O-CG1 3.35Å; L972-I976 PolarHBondContact O-N 3.12Å; L972-L1246 HydrophobicContact CD2-CD2 4.09Å; L972-L1253 HydrophobicContact CD1-CD2 3.93Å
973L83.9Confident79.8Confident8.25 Ų8.2543.6 Ų43.64%0.04323%0.228CC..Hα-helixtrans-62.1-45.4-175.8-178.268.2000112.8I969 R975 I976 R977 Y1264 F1268I969-L973 VanDerWaalsContact O-CB 3.25Å; I969-L973 WeakPolarHBondContact O-CB 3.36Å; I969-L973 PolarHBondContact O-N 2.97Å; L973-R975 VanDerWaalsContact C-N 3.27Å; L973-R975 PolarHBondContact O-N 3.15Å; L973-I976 PolarHBondContact O-N 3.26Å; L973-R977 HydrophobicContact CD1-CG 4.44Å; L973-R977 WeakPolarHBondContact O-CB 3.44Å; L973-R977 VanDerWaalsContact O-CG 3.29Å; L973-R977 WeakPolarHBondContact O-CG 3.3Å; L973-R977 PolarHBondContact O-N 2.91Å; L973-Y1264 HydrophobicContact CD2-CD1 3.58Å; L973-Y1264 HydrophobicContact CD2-CE1 3.63Å; L973-Y1264 HydrophobicContact CD2-CG 4.31Å; L973-F1268 HydrophobicContact CD1-CE1 3.75Å; L973-F1268 HydrophobicContact CD1-CZ 3.94Å
974P81.3Confident78.5Confident54 Ų5439.8 Ų39.835%0.35120%0.203SC..Hα-helixtrans-57.3-35.6170.6-2735.7000113.7H970 I971 R977 Q978H970-P974 WeakPolarHBondContact O-CD 3.4Å; H970-P974 VanDerWaalsContact O-CG 3.23Å; H970-P974 WeakPolarHBondContact O-CG 3.41Å; I971-P974 WeakPolarHBondContact O-CD 3.27Å; P974-R977 PolarHBondContact O-N 3.13Å; P974-Q978 WeakPolarHBondContact O-CB 3.41Å; P974-Q978 WeakPolarHBondContact O-CG 3.43Å; P974-Q978 PolarHBondContact O-N 2.96Å
975R79.7Confident77.2Confident58.5 Ų58.541.5 Ų41.522%0.22121%0.209CC..Hα-helixtrans-72.5-41.9179.6-61.2-67.7153.3166.14.6111.9S935 I971 L972 L973 R977 Q978 A979 L1246S935-R975 VanDerWaalsContact CA-CZ 3.48Å; S935-R975 VanDerWaalsContact CB-NH2 3.35Å; S935-R975 PolarHBondContact O-NH1 3.22Å; S935-R975 PolarHBondContact O-NH2 3.08Å; I971-R975 WeakPolarHBondContact O-CG 3.36Å; L972-R975 WeakPolarHBondContact O-CB 3.37Å; L972-R975 PolarHBondContact O-N 3.24Å; L972-R975 VanDerWaalsContact O-N 3.07Å; L973-R975 VanDerWaalsContact C-N 3.27Å; L973-R975 PolarHBondContact O-N 3.15Å; R975-R977 VanDerWaalsContact C-N 3.34Å; R975-Q978 PolarHBondContact O-N 3.33Å; R975-A979 PolarHBondContact O-N 3.09Å; R975-A979 VanDerWaalsContact O-N 3.08Å; R975-L1246 HydrophobicContact CB-CD2 4.38Å
976I82.3Confident75.7Confident1.5 Ų1.543.2 Ų43.21%0.00822%0.224CC..Hα-helixtrans-60.2-48.4171.3-65.9165.3000109.6L972 L973 Q978 A979 L980 L1246 F1247 L1250 F1268 I1271L972-I976 WeakPolarHBondContact O-CG1 3.35Å; L972-I976 PolarHBondContact O-N 3.12Å; L973-I976 PolarHBondContact O-N 3.26Å; I976-Q978 VanDerWaalsContact C-N 3.33Å; I976-Q978 PolarHBondContact O-N 3.23Å; I976-A979 WeakPolarHBondContact O-CB 3.27Å; I976-A979 PolarHBondContact O-N 3.39Å; I976-A979 VanDerWaalsContact O-N 3.15Å; I976-L980 WeakPolarHBondContact O-CG 3.34Å; I976-L980 PolarHBondContact O-N 2.97Å; I976-L1246 HydrophobicContact CG1-CB 4.45Å; I976-F1247 HydrophobicContact CG2-CE1 4.46Å; I976-F1247 HydrophobicContact CG2-CE2 4.39Å; I976-F1247 HydrophobicContact CG2-CZ 3.82Å; I976-L1250 HydrophobicContact CD1-CD2 4.16Å; I976-F1268 HydrophobicContact CD1-CE1 4.12Å; I976-I1271 HydrophobicContact CG2-CD1 4.35Å
977R79.7Confident74.3Confident102.25 Ų102.2540.6 Ų40.639%0.38622%0.217SC..Hα-helixtrans-59.9-38.7177-72.9176.5179.8176.30.1112.8L973 P974 R975 A979 L980 R985 E1267L973-R977 HydrophobicContact CD1-CG 4.44Å; L973-R977 WeakPolarHBondContact O-CB 3.44Å; L973-R977 VanDerWaalsContact O-CG 3.29Å; L973-R977 WeakPolarHBondContact O-CG 3.3Å; L973-R977 PolarHBondContact O-N 2.91Å; P974-R977 PolarHBondContact O-N 3.13Å; R975-R977 VanDerWaalsContact C-N 3.34Å; R977-A979 VanDerWaalsContact C-N 3.28Å; R977-A979 PolarHBondContact O-N 3.22Å; R977-L980 WeakPolarHBondContact O-CB 3.13Å; R977-L980 PolarHBondContact O-N 3.28Å; R977-R985 WeakPolarHBondContact O-CD 3.26Å; R977-E1267 IonicContact CZ-OE1 3.08Å; R977-E1267 VanDerWaalsContact CZ-OE1 3.24Å; R977-E1267 IonicContact CZ-OE2 2.74Å; R977-E1267 VanDerWaalsContact CZ-OE2 3.26Å; R977-E1267 IonicContact NE-OE1 2.69Å; R977-E1267 PolarHBondContact NE-OE1 3.42Å; R977-E1267 IonicContact NE-OE2 3.4Å; R977-E1267 PolarHBondContact NE-OE2 3.26Å; R977-E1267 IonicContact NH2-OE1 3.66Å; R977-E1267 PolarHBondContact NH2-OE1 3.08Å; R977-E1267 IonicContact NH2-OE2 2.96Å; R977-E1267 PolarHBondContact NH2-OE2 3.13Å
978Q76Confident73Confident97.25 Ų97.2538.8 Ų38.845%0.45420%0.203SC..Hα-helixtrans-67.2-34.2176.1-79.2170.5-0.700112.8P974 R975 I976 L980 T1237P974-Q978 WeakPolarHBondContact O-CB 3.41Å; P974-Q978 WeakPolarHBondContact O-CG 3.43Å; P974-Q978 PolarHBondContact O-N 2.96Å; R975-Q978 PolarHBondContact O-N 3.33Å; I976-Q978 VanDerWaalsContact C-N 3.33Å; I976-Q978 PolarHBondContact O-N 3.23Å; Q978-L980 VanDerWaalsContact C-N 3.27Å; Q978-L980 PolarHBondContact O-N 3.34Å; Q978-T1237 PolarHBondContact O-OG1 3.16Å
979A74.2Confident71.4Confident1.5 Ų1.541.6 Ų41.61%0.01222%0.218CC..Hα-helixtrans-67.4-23.5177.900000113.5R975 I976 R977 W1236 T1237 E1238 I1243R975-A979 PolarHBondContact O-N 3.09Å; R975-A979 VanDerWaalsContact O-N 3.08Å; I976-A979 WeakPolarHBondContact O-CB 3.27Å; I976-A979 PolarHBondContact O-N 3.39Å; I976-A979 VanDerWaalsContact O-N 3.15Å; R977-A979 VanDerWaalsContact C-N 3.28Å; R977-A979 PolarHBondContact O-N 3.22Å; A979-W1236 VanDerWaalsContact O-CE3 3.26Å; A979-T1237 VanDerWaalsContact C-OG1 3.25Å; A979-T1237 WeakPolarHBondContact CA-OG1 3.29Å; A979-T1237 PolarHBondContact O-N 3.05Å; A979-T1237 PolarHBondContact O-OG1 2.96Å; A979-T1237 VanDerWaalsContact O-OG1 3.13Å; A979-E1238 HydrophobicContact CB-CB 4.2Å; A979-E1238 HydrophobicContact CB-CG 4.04Å; A979-I1243 HydrophobicContact CB-CG1 4.48Å
980L72.9Confident69.6Low1.25 Ų1.2545.6 Ų45.61%0.00724%0.242CC..SBendtrans-68.1143.2-174.1-61.5173.9000113.3I976 R977 Q978 L984 R985 L988 W1236 I1271I976-L980 WeakPolarHBondContact O-CG 3.34Å; I976-L980 PolarHBondContact O-N 2.97Å; R977-L980 WeakPolarHBondContact O-CB 3.13Å; R977-L980 PolarHBondContact O-N 3.28Å; Q978-L980 VanDerWaalsContact C-N 3.27Å; Q978-L980 PolarHBondContact O-N 3.34Å; L980-L984 HydrophobicContact CB-CB 4.41Å; L980-L984 HydrophobicContact CB-CD2 4.02Å; L980-L984 HydrophobicContact CD1-CD2 3.68Å; L980-L984 HydrophobicContact CD2-CD1 4.01Å; L980-L984 HydrophobicContact CD2-CD2 3.87Å; L980-L984 HydrophobicContact CG-CD2 4.02Å; L980-R985 HydrophobicContact CB-CG 3.84Å; L980-R985 HydrophobicContact CD1-CG 4.43Å; L980-R985 PolarHBondContact O-NE 3.1Å; L980-L988 HydrophobicContact CD1-CD1 3.58Å; L980-L988 VanDerWaalsContact CD1-CD1 3.49Å; L980-W1236 HydrophobicContact CD2-CH2 4.06Å; L980-W1236 HydrophobicContact CD2-CZ3 3.82Å; L980-I1271 HydrophobicContact CD1-CD1 3.84Å; L980-I1271 HydrophobicContact CD1-CG1 3.99Å; L980-I1271 HydrophobicContact CD2-CB 4.36Å; L980-I1271 HydrophobicContact CD2-CD1 4.23Å; L980-I1271 HydrophobicContact CD2-CG1 3.96Å; L980-I1271 HydrophobicContact CD2-CG2 3.59Å; L980-I1271 VanDerWaalsContact CD2-CG2 3.46Å
981P68.2Low68Low0 Ų042.8 Ų42.80%023%0.233CC..  trans-51.5147.3166.5-25.733.9000112.8S983 L984 R985 A1234 W1236 Y1274P981-S983 VanDerWaalsContact C-N 3.28Å; P981-S983 PolarHBondContact O-N 3.01Å; P981-L984 PolarHBondContact O-N 3.13Å; P981-L984 VanDerWaalsContact O-N 3.13Å; P981-R985 WeakPolarHBondContact O-CG 3.5Å; P981-R985 PolarHBondContact O-N 3.05Å; P981-R985 VanDerWaalsContact O-N 3.15Å; P981-A1234 WeakPolarHBondContact CG-O 3.45Å; P981-W1236 HydrophobicContact CG-CD2 4.2Å; P981-W1236 HydrophobicContact CG-CG 4.16Å; P981-Y1274 HydrophobicContact CG-CE1 3.9Å
982A59.9Low66.4Low46 Ų4642.6 Ų42.638%0.3824%0.236SC..Hα-helixtrans-60.4-36-177.200000112.9L984 R985 A986A982-L984 VanDerWaalsContact C-N 3.34Å; A982-L984 PolarHBondContact O-N 3.32Å; A982-R985 PolarHBondContact O-N 3.09Å; A982-A986 PolarHBondContact O-N 3.32Å; A982-A986 VanDerWaalsContact O-N 3.13Å
983S57.3Low64.2Low38 Ų3845.7 Ų45.727%0.26625%0.25SC..Hα-helixtrans-59.3-45.7174.853.10000112.6P981 A986 S987 T1233P981-S983 VanDerWaalsContact C-N 3.28Å; P981-S983 PolarHBondContact O-N 3.01Å; S983-A986 PolarHBondContact O-N 3.15Å; S983-S987 WeakPolarHBondContact O-CB 3.38Å; S983-S987 PolarHBondContact O-N 3.15Å; S983-T1233 PolarHBondContact OG-O 2.91Å
984L61.9Low62.1Low13 Ų1347.7 Ų47.77%0.06827%0.265CS..Hα-helixtrans-67.4-40176.6-107.3177.1000112.4L980 P981 A982 A986 S987 L988 M1227 I1271 Y1274L980-L984 HydrophobicContact CB-CB 4.41Å; L980-L984 HydrophobicContact CB-CD2 4.02Å; L980-L984 HydrophobicContact CD1-CD2 3.68Å; L980-L984 HydrophobicContact CD2-CD1 4.01Å; L980-L984 HydrophobicContact CD2-CD2 3.87Å; L980-L984 HydrophobicContact CG-CD2 4.02Å; P981-L984 PolarHBondContact O-N 3.13Å; P981-L984 VanDerWaalsContact O-N 3.13Å; A982-L984 VanDerWaalsContact C-N 3.34Å; A982-L984 PolarHBondContact O-N 3.32Å; L984-A986 VanDerWaalsContact C-N 3.29Å; L984-A986 PolarHBondContact O-N 3.15Å; L984-S987 PolarHBondContact O-N 3.09Å; L984-S987 VanDerWaalsContact O-N 3.11Å; L984-L988 HydrophobicContact CD2-CD1 3.45Å; L984-L988 VanDerWaalsContact CD2-CD1 3.45Å; L984-L988 HydrophobicContact CD2-CG 3.81Å; L984-L988 HydrophobicContact CG-CG 4.4Å; L984-L988 WeakPolarHBondContact O-CB 3.38Å; L984-L988 VanDerWaalsContact O-CG 3.31Å; L984-L988 WeakPolarHBondContact O-CG 3.36Å; L984-L988 PolarHBondContact O-N 3.3Å; L984-M1227 HydrophobicContact CD2-CE 4.04Å; L984-M1227 HydrophobicContact CD2-SD 4.46Å; L984-M1227 HydrophobicContact CG-CE 4.49Å; L984-I1271 HydrophobicContact CD2-CG1 4.14Å; L984-Y1274 HydrophobicContact CD1-CD1 3.41Å; L984-Y1274 VanDerWaalsContact CD1-CD1 3.43Å; L984-Y1274 HydrophobicContact CD1-CD2 3.95Å; L984-Y1274 HydrophobicContact CD1-CE1 3.98Å; L984-Y1274 HydrophobicContact CD1-CE2 4.39Å; L984-Y1274 HydrophobicContact CD1-CG 3.38Å; L984-Y1274 VanDerWaalsContact CD1-CG 3.47Å; L984-Y1274 HydrophobicContact CD2-CD2 4.01Å; L984-Y1274 HydrophobicContact CD2-CE2 4.39Å; L984-Y1274 HydrophobicContact CD2-CG 4.1Å; L984-Y1274 HydrophobicContact CG-CD1 4.23Å; L984-Y1274 HydrophobicContact CG-CD2 4.07Å; L984-Y1274 HydrophobicContact CG-CE1 4.47Å; L984-Y1274 HydrophobicContact CG-CE2 4.32Å; L984-Y1274 HydrophobicContact CG-CG 4.02Å
985R62.9Low60.3Low96.5 Ų96.548.5 Ų48.536%0.36426%0.261SS..Hα-helixtrans-58.7-43.2176.1-69.2-172.3-69131.5-0.8111R977 L980 P981 A982 L988 I989 N1038R977-R985 WeakPolarHBondContact O-CD 3.26Å; L980-R985 HydrophobicContact CB-CG 3.84Å; L980-R985 HydrophobicContact CD1-CG 4.43Å; L980-R985 PolarHBondContact O-NE 3.1Å; P981-R985 WeakPolarHBondContact O-CG 3.5Å; P981-R985 PolarHBondContact O-N 3.05Å; P981-R985 VanDerWaalsContact O-N 3.15Å; A982-R985 PolarHBondContact O-N 3.09Å; R985-L988 PolarHBondContact O-N 3.15Å; R985-I989 VanDerWaalsContact O-CD1 3.27Å; R985-I989 WeakPolarHBondContact O-CD1 3.33Å; R985-I989 VanDerWaalsContact O-CG1 3.24Å; R985-I989 WeakPolarHBondContact O-CG1 3.24Å; R985-I989 PolarHBondContact O-N 3.09Å; R985-I989 VanDerWaalsContact O-N 3.13Å; R985-N1038 PolarHBondContact NH1-OD1 3.3Å
986A53.4Low58.1Low47.75 Ų47.7549.8 Ų49.840%0.39527%0.272SS..Hα-helixtrans-63.7-46.3173.700000112.3A982 S983 L984 L988 I989 V990A982-A986 PolarHBondContact O-N 3.32Å; A982-A986 VanDerWaalsContact O-N 3.13Å; S983-A986 PolarHBondContact O-N 3.15Å; L984-A986 VanDerWaalsContact C-N 3.29Å; L984-A986 PolarHBondContact O-N 3.15Å; A986-L988 PolarHBondContact O-N 3.21Å; A986-I989 WeakPolarHBondContact O-CB 3.27Å; A986-I989 PolarHBondContact O-N 3.02Å; A986-V990 WeakPolarHBondContact O-CG2 3.35Å; A986-V990 PolarHBondContact O-N 3.26Å
987S55.8Low55.7Low48 Ų4854.4 Ų54.434%0.33629%0.293SS..Hα-helixtrans-61.1-42.9179.6-175.90000113.1S983 L984 I989 V990 T991 M1227S983-S987 WeakPolarHBondContact O-CB 3.38Å; S983-S987 PolarHBondContact O-N 3.15Å; L984-S987 PolarHBondContact O-N 3.09Å; L984-S987 VanDerWaalsContact O-N 3.11Å; S987-I989 VanDerWaalsContact C-N 3.31Å; S987-I989 PolarHBondContact O-N 3.25Å; S987-V990 CarbonylContact O-C 3.54Å; S987-V990 PolarHBondContact O-N 3.18Å; S987-V990 VanDerWaalsContact O-N 3.12Å; S987-T991 WeakPolarHBondContact O-CB 3.39Å; S987-T991 WeakPolarHBondContact O-CG2 3.35Å; S987-T991 PolarHBondContact O-N 3.35Å; S987-T991 PolarHBondContact O-OG1 3.09Å; S987-M1227 PolarHBondContact OG-SD 3.38Å; S987-M1227 VanDerWaalsContact OG-SD 3.4Å
988L58.9Low53.5Low28 Ų2854.8 Ų54.815%0.14730%0.303CS..Hα-helixtrans-63-38.4176.5-72.2171.5000112.4L980 L984 R985 A986 T991 S992 P1270 I1271L980-L988 HydrophobicContact CD1-CD1 3.58Å; L980-L988 VanDerWaalsContact CD1-CD1 3.49Å; L984-L988 HydrophobicContact CD2-CD1 3.45Å; L984-L988 VanDerWaalsContact CD2-CD1 3.45Å; L984-L988 HydrophobicContact CD2-CG 3.81Å; L984-L988 HydrophobicContact CG-CG 4.4Å; L984-L988 WeakPolarHBondContact O-CB 3.38Å; L984-L988 VanDerWaalsContact O-CG 3.31Å; L984-L988 WeakPolarHBondContact O-CG 3.36Å; L984-L988 PolarHBondContact O-N 3.3Å; R985-L988 PolarHBondContact O-N 3.15Å; A986-L988 PolarHBondContact O-N 3.21Å; L988-T991 WeakPolarHBondContact CA-OG1 3.39Å; L988-T991 PolarHBondContact O-N 3.28Å; L988-T991 PolarHBondContact O-OG1 3.15Å; L988-S992 VanDerWaalsContact O-CB 3.31Å; L988-S992 WeakPolarHBondContact O-CB 3.12Å; L988-S992 PolarHBondContact O-N 3.03Å; L988-S992 VanDerWaalsContact O-N 3.08Å; L988-S992 PolarHBondContact O-OG 3.25Å; L988-P1270 HydrophobicContact CD2-CB 3.92Å; L988-P1270 HydrophobicContact CD2-CG 3.65Å; L988-I1271 HydrophobicContact CD1-CD1 4.03Å; L988-I1271 HydrophobicContact CD1-CG1 3.81Å; L988-I1271 HydrophobicContact CD2-CG1 4.47Å
989I54.7Low51.5Low61.25 Ų61.2553.1 Ų53.131%0.31430%0.302SS..Hα-helixtrans-65-47.9174.9-66.6164.6000110R985 A986 S987 T991 S992 F993 L1031 Q1034 I1035R985-I989 VanDerWaalsContact O-CD1 3.27Å; R985-I989 WeakPolarHBondContact O-CD1 3.33Å; R985-I989 VanDerWaalsContact O-CG1 3.24Å; R985-I989 WeakPolarHBondContact O-CG1 3.24Å; R985-I989 PolarHBondContact O-N 3.09Å; R985-I989 VanDerWaalsContact O-N 3.13Å; A986-I989 WeakPolarHBondContact O-CB 3.27Å; A986-I989 PolarHBondContact O-N 3.02Å; S987-I989 VanDerWaalsContact C-N 3.31Å; S987-I989 PolarHBondContact O-N 3.25Å; I989-T991 PolarHBondContact O-N 3.11Å; I989-S992 WeakPolarHBondContact CA-OG 3.39Å; I989-S992 PolarHBondContact O-N 3.14Å; I989-S992 PolarHBondContact O-OG 3.09Å; I989-F993 HydrophobicContact CG2-CD2 3.67Å; I989-F993 HydrophobicContact CG2-CE2 3.59Å; I989-F993 VanDerWaalsContact CG2-CE2 3.45Å; I989-F993 WeakPolarHBondContact O-CB 3.41Å; I989-F993 VanDerWaalsContact O-CD2 3.27Å; I989-F993 WeakPolarHBondContact O-CD2 3.41Å; I989-F993 PolarHBondContact O-N 3.1Å; I989-F993 VanDerWaalsContact O-N 3.09Å; I989-L1031 HydrophobicContact CD1-CD2 4.35Å; I989-L1031 HydrophobicContact CG2-CD1 3.76Å; I989-L1031 HydrophobicContact CG2-CD2 4.31Å; I989-Q1034 HydrophobicContact CD1-CG 3.78Å; I989-I1035 HydrophobicContact CB-CG2 4.46Å; I989-I1035 HydrophobicContact CD1-CD1 3.84Å; I989-I1035 HydrophobicContact CD1-CG2 3.36Å; I989-I1035 HydrophobicContact CG1-CD1 4.06Å; I989-I1035 HydrophobicContact CG1-CG1 4.41Å; I989-I1035 HydrophobicContact CG1-CG2 3.79Å; I989-I1035 HydrophobicContact CG2-CD1 4.27Å; I989-I1035 HydrophobicContact CG2-CG2 3.83Å
990V49.1Very low49.5Very low89 Ų8957.7 Ų57.754%0.53933%0.329SS..Hα-helixtrans-62.3-42.6178173.20000111.7A986 S987 F993 S994 L1031A986-V990 WeakPolarHBondContact O-CG2 3.35Å; A986-V990 PolarHBondContact O-N 3.26Å; S987-V990 CarbonylContact O-C 3.54Å; S987-V990 PolarHBondContact O-N 3.18Å; S987-V990 VanDerWaalsContact O-N 3.12Å; V990-F993 WeakPolarHBondContact O-CB 3.5Å; V990-F993 PolarHBondContact O-N 3.31Å; V990-S994 WeakPolarHBondContact O-CB 3.2Å; V990-S994 PolarHBondContact O-N 3.26Å; V990-S994 PolarHBondContact O-OG 3.01Å; V990-L1031 HydrophobicContact CG2-CD1 4.33Å
991T49.7Very low47.6Very low44 Ų4465.8 Ų65.827%0.2737%0.365SS..Hα-helixtrans-70.3-33.6179.127.50000113.1S987 L988 I989 F993 S994 R995S987-T991 WeakPolarHBondContact O-CB 3.39Å; S987-T991 WeakPolarHBondContact O-CG2 3.35Å; S987-T991 PolarHBondContact O-N 3.35Å; S987-T991 PolarHBondContact O-OG1 3.09Å; L988-T991 WeakPolarHBondContact CA-OG1 3.39Å; L988-T991 PolarHBondContact O-N 3.28Å; L988-T991 PolarHBondContact O-OG1 3.15Å; I989-T991 PolarHBondContact O-N 3.11Å; T991-F993 VanDerWaalsContact C-N 3.28Å; T991-F993 PolarHBondContact O-N 3.48Å; T991-S994 WeakPolarHBondContact CA-OG 3.44Å; T991-S994 PolarHBondContact O-N 3.35Å; T991-S994 PolarHBondContact O-OG 3.18Å; T991-R995 WeakPolarHBondContact O-CD 3.5Å; T991-R995 VanDerWaalsContact O-CG 3.3Å; T991-R995 WeakPolarHBondContact O-CG 3.31Å; T991-R995 PolarHBondContact O-N 2.97Å; T991-R995 VanDerWaalsContact O-N 3.16Å
992S47.6Very low45.9Very low54.5 Ų54.570.7 Ų70.738%0.38140%0.395SS..Hα-helixtrans-67.9-38.3172.264.70000111.6L988 I989 R995 L996L988-S992 VanDerWaalsContact O-CB 3.31Å; L988-S992 WeakPolarHBondContact O-CB 3.12Å; L988-S992 PolarHBondContact O-N 3.03Å; L988-S992 VanDerWaalsContact O-N 3.08Å; L988-S992 PolarHBondContact O-OG 3.25Å; I989-S992 WeakPolarHBondContact CA-OG 3.39Å; I989-S992 PolarHBondContact O-N 3.14Å; I989-S992 PolarHBondContact O-OG 3.09Å; S992-R995 WeakPolarHBondContact O-CB 3.38Å; S992-R995 PolarHBondContact O-N 3.05Å; S992-L996 WeakPolarHBondContact O-CG 3.35Å; S992-L996 PolarHBondContact O-N 3.25Å
993F39.2Very low44.4Very low69 Ų6974.8 Ų74.830%0.30341%0.411SS..Hα-helixtrans-67-43.9175.5-119.2-74.4000113I989 V990 T991 R995 L996 Q997 Q1027 L1031 T1032 A1110 A1113I989-F993 HydrophobicContact CG2-CD2 3.67Å; I989-F993 HydrophobicContact CG2-CE2 3.59Å; I989-F993 VanDerWaalsContact CG2-CE2 3.45Å; I989-F993 WeakPolarHBondContact O-CB 3.41Å; I989-F993 VanDerWaalsContact O-CD2 3.27Å; I989-F993 WeakPolarHBondContact O-CD2 3.41Å; I989-F993 PolarHBondContact O-N 3.1Å; I989-F993 VanDerWaalsContact O-N 3.09Å; V990-F993 WeakPolarHBondContact O-CB 3.5Å; V990-F993 PolarHBondContact O-N 3.31Å; T991-F993 VanDerWaalsContact C-N 3.28Å; T991-F993 PolarHBondContact O-N 3.48Å; F993-R995 VanDerWaalsContact C-N 3.29Å; F993-R995 PolarHBondContact O-N 3.2Å; F993-L996 HydrophobicContact CD1-CD1 4.37Å; F993-L996 PolarHBondContact O-N 3.07Å; F993-Q997 HydrophobicContact CD1-CG 4.31Å; F993-Q997 HydrophobicContact CE1-CG 3.88Å; F993-Q997 PolarHBondContact O-N 3.07Å; F993-Q997 VanDerWaalsContact O-N 3.14Å; F993-Q1027 HydrophobicContact CD1-CG 4.46Å; F993-Q1027 HydrophobicContact CE1-CG 4.05Å; F993-L1031 HydrophobicContact CD2-CD1 3.71Å; F993-L1031 HydrophobicContact CE2-CD1 3.86Å; F993-T1032 HydrophobicContact CD2-CG2 4Å; F993-T1032 HydrophobicContact CE2-CG2 4.05Å; F993-A1110 HydrophobicContact CZ-CB 4.35Å; F993-A1113 HydrophobicContact CE1-CB 3.64Å; F993-A1113 HydrophobicContact CE2-CB 3.77Å; F993-A1113 VanDerWaalsContact CZ-CA 3.5Å; F993-A1113 HydrophobicContact CZ-CB 3.09Å
994S38.9Very low42.9Very low51.25 Ų51.2580.1 Ų80.136%0.35844%0.436SS..Hα-helixtrans-63.1-3317788.10000112.6V990 T991 L996 Q997 N998V990-S994 WeakPolarHBondContact O-CB 3.2Å; V990-S994 PolarHBondContact O-N 3.26Å; V990-S994 PolarHBondContact O-OG 3.01Å; T991-S994 WeakPolarHBondContact CA-OG 3.44Å; T991-S994 PolarHBondContact O-N 3.35Å; T991-S994 PolarHBondContact O-OG 3.18Å; S994-L996 VanDerWaalsContact C-N 3.35Å; S994-L996 PolarHBondContact O-N 3.29Å; S994-Q997 PolarHBondContact O-N 3.16Å; S994-N998 WeakPolarHBondContact O-CB 3.38Å; S994-N998 PolarHBondContact O-N 3.15Å; S994-N998 VanDerWaalsContact O-N 3.11Å
995R43Very low41.3Very low70.25 Ų70.2588.6 Ų88.627%0.26547%0.472SS..Hα-helixtrans-68.4-40.3173.9-72.7175.1-178.4-152.6-0.2112.5T991 S992 F993 Q997 N998 S999 D1266 R1308 Y1309T991-R995 WeakPolarHBondContact O-CD 3.5Å; T991-R995 VanDerWaalsContact O-CG 3.3Å; T991-R995 WeakPolarHBondContact O-CG 3.31Å; T991-R995 PolarHBondContact O-N 2.97Å; T991-R995 VanDerWaalsContact O-N 3.16Å; S992-R995 WeakPolarHBondContact O-CB 3.38Å; S992-R995 PolarHBondContact O-N 3.05Å; F993-R995 VanDerWaalsContact C-N 3.29Å; F993-R995 PolarHBondContact O-N 3.2Å; R995-Q997 VanDerWaalsContact C-N 3.33Å; R995-N998 PolarHBondContact O-N 3.24Å; R995-S999 WeakPolarHBondContact O-CB 3.33Å; R995-S999 PolarHBondContact O-N 3.08Å; R995-S999 VanDerWaalsContact O-N 3.15Å; R995-S999 PolarHBondContact O-OG 3.07Å; R995-S999 VanDerWaalsContact O-OG 3.12Å; R995-D1266 IonicContact CZ-OD1 2.71Å; R995-D1266 IonicContact CZ-OD2 3.11Å; R995-D1266 VanDerWaalsContact NH1-CG 3.33Å; R995-D1266 PolarHBondContact NH1-O 3.24Å; R995-D1266 IonicContact NH1-OD1 2.78Å; R995-D1266 PolarHBondContact NH1-OD1 3.22Å; R995-D1266 IonicContact NH1-OD2 3.52Å; R995-D1266 PolarHBondContact NH1-OD2 3.07Å; R995-R1308 VanDerWaalsContact CD-CZ 3.48Å; R995-R1308 VanDerWaalsContact CG-NH2 3.25Å; R995-R1308 PolarHBondContact NH2-O 3.19Å; R995-Y1309 VanDerWaalsContact CZ-OH 3.24Å; R995-Y1309 PolarHBondContact NH1-OH 3.43Å; R995-Y1309 VanDerWaalsContact NH2-CE2 3.32Å; R995-Y1309 VanDerWaalsContact NH2-CZ 3.34Å; R995-Y1309 PolarHBondContact NH2-OH 3.09Å; R995-Y1309 VanDerWaalsContact NH2-OH 3.16Å
996L34.1Very low39.6Very low85.75 Ų85.7592.9 Ų92.945%0.44950%0.497SS..Hα-helixtrans-64.6-41.1175-76165000111.7S992 F993 S994 N998 S999 T1000 N1028S992-L996 WeakPolarHBondContact O-CG 3.35Å; S992-L996 PolarHBondContact O-N 3.25Å; F993-L996 HydrophobicContact CD1-CD1 4.37Å; F993-L996 PolarHBondContact O-N 3.07Å; S994-L996 VanDerWaalsContact C-N 3.35Å; S994-L996 PolarHBondContact O-N 3.29Å; L996-N998 VanDerWaalsContact C-N 3.31Å; L996-N998 PolarHBondContact O-N 3.21Å; L996-S999 WeakPolarHBondContact CA-OG 3.31Å; L996-S999 PolarHBondContact O-N 3.17Å; L996-S999 PolarHBondContact O-OG 3.14Å; L996-T1000 WeakPolarHBondContact O-CB 3.32Å; L996-T1000 WeakPolarHBondContact O-CG2 3.31Å; L996-T1000 PolarHBondContact O-N 3.38Å; L996-T1000 VanDerWaalsContact O-N 3.14Å; L996-T1000 PolarHBondContact O-OG1 3.37Å; L996-N1028 HydrophobicContact CD1-CB 3.97Å; L996-N1028 VanDerWaalsContact CD1-ND2 3.3Å; L996-N1028 WeakPolarHBondContact CD1-ND2 3.28Å; L996-N1028 VanDerWaalsContact CD2-ND2 3.34Å; L996-N1028 WeakPolarHBondContact CD2-ND2 3.16Å
997Q32Very low38.4Very low98.25 Ų98.2598 Ų9846%0.45952%0.516SS..Hα-helixtrans-62.3-42.5175.1-149.9175.4-9.200112.2F993 S994 R995 S999 T1000 F1001F993-Q997 HydrophobicContact CD1-CG 4.31Å; F993-Q997 HydrophobicContact CE1-CG 3.88Å; F993-Q997 PolarHBondContact O-N 3.07Å; F993-Q997 VanDerWaalsContact O-N 3.14Å; S994-Q997 PolarHBondContact O-N 3.16Å; R995-Q997 VanDerWaalsContact C-N 3.33Å; Q997-S999 VanDerWaalsContact C-N 3.26Å; Q997-S999 PolarHBondContact O-N 3.28Å; Q997-T1000 WeakPolarHBondContact CA-OG1 3.37Å; Q997-T1000 PolarHBondContact O-N 2.96Å; Q997-T1000 VanDerWaalsContact O-N 3.16Å; Q997-T1000 PolarHBondContact O-OG1 2.99Å; Q997-T1000 VanDerWaalsContact O-OG1 3.07Å; Q997-F1001 HydrophobicContact CG-CD2 4.37Å; Q997-F1001 HydrophobicContact CG-CE2 4.46Å; Q997-F1001 WeakPolarHBondContact O-CD2 3.49Å; Q997-F1001 PolarHBondContact O-N 2.88Å
998N33.4Very low36.9Very low110 Ų110102.9 Ų102.959%0.58854%0.538SS*.Hα-helixtrans-68.9-34177.6-71.8-4.3000112.7S994 R995 L996 T1000 F1001 T1002S994-N998 WeakPolarHBondContact O-CB 3.38Å; S994-N998 PolarHBondContact O-N 3.15Å; S994-N998 VanDerWaalsContact O-N 3.11Å; R995-N998 PolarHBondContact O-N 3.24Å; L996-N998 VanDerWaalsContact C-N 3.31Å; L996-N998 PolarHBondContact O-N 3.21Å; N998-T1000 PolarHBondContact O-N 3.2Å; N998-F1001 PolarHBondContact O-N 3.26Å; N998-T1002 WeakPolarHBondContact O-CG2 3.36Å; N998-T1002 PolarHBondContact O-N 2.95Å; N998-T1002 PolarHBondContact O-OG1 3.28Å
999S34.5Very low35.2Very low62.5 Ų62.5106.8 Ų106.844%0.43757%0.567SS.*Hα-helixtrans-71.5-20.5176.267.90000114.1R995 L996 Q997 T1002R995-S999 WeakPolarHBondContact O-CB 3.33Å; R995-S999 PolarHBondContact O-N 3.08Å; R995-S999 VanDerWaalsContact O-N 3.15Å; R995-S999 PolarHBondContact O-OG 3.07Å; R995-S999 VanDerWaalsContact O-OG 3.12Å; L996-S999 WeakPolarHBondContact CA-OG 3.31Å; L996-S999 PolarHBondContact O-N 3.17Å; L996-S999 PolarHBondContact O-OG 3.14Å; Q997-S999 VanDerWaalsContact C-N 3.26Å; Q997-S999 PolarHBondContact O-N 3.28Å; S999-T1002 PolarHBondContact O-OG1 3.37Å
1000T32.5Very low33.8Very low96.75 Ų96.75109.1 Ų109.159%0.59459%0.588SS**Hα-helixtrans-86.8-15.5176.8430000113.9L996 Q997 N998L996-T1000 WeakPolarHBondContact O-CB 3.32Å; L996-T1000 WeakPolarHBondContact O-CG2 3.31Å; L996-T1000 PolarHBondContact O-N 3.38Å; L996-T1000 VanDerWaalsContact O-N 3.14Å; L996-T1000 PolarHBondContact O-OG1 3.37Å; Q997-T1000 WeakPolarHBondContact CA-OG1 3.37Å; Q997-T1000 PolarHBondContact O-N 2.96Å; Q997-T1000 VanDerWaalsContact O-N 3.16Å; Q997-T1000 PolarHBondContact O-OG1 2.99Å; Q997-T1000 VanDerWaalsContact O-OG1 3.07Å; N998-T1000 PolarHBondContact O-N 3.2Å
1001F32.2Very low32.7Very low171.4 Ų171.4110.5 Ų110.575%0.75260%0.602SS**SBendtrans-92.8-11.7178.9-103.1-87.6000114.6Q997 N998Q997-F1001 HydrophobicContact CG-CD2 4.37Å; Q997-F1001 HydrophobicContact CG-CE2 4.46Å; Q997-F1001 WeakPolarHBondContact O-CD2 3.49Å; Q997-F1001 PolarHBondContact O-N 2.88Å; N998-F1001 PolarHBondContact O-N 3.26Å
1002T33Very low31.6Very low103.8 Ų103.8113.4 Ų113.464%0.63762%0.624SS**SBendtrans-99.42.8-17551.20000114.6N998 S999 N1004N998-T1002 WeakPolarHBondContact O-CG2 3.36Å; N998-T1002 PolarHBondContact O-N 2.95Å; N998-T1002 PolarHBondContact O-OG1 3.28Å; S999-T1002 PolarHBondContact O-OG1 3.37Å; T1002-N1004 VanDerWaalsContact C-N 3.32Å; T1002-N1004 PolarHBondContact O-N 3.14Å; T1002-N1004 VanDerWaalsContact O-N 3.11Å
1003N27.4Very low30.6Very low131.6 Ų131.6118.4 Ų118.470%0.70465%0.646SS**THydrogen-bonded Turntrans-95.922.8-177.7-81.6-3.5000114.8
1004N27.1Very low30Very low149.2 Ų149.2122.6 Ų122.680%0.79867%0.67SS**THydrogen-bonded Turntrans-124.135.4-178.5-79.2-14.5000113.5T1002T1002-N1004 VanDerWaalsContact C-N 3.32Å; T1002-N1004 PolarHBondContact O-N 3.14Å; T1002-N1004 VanDerWaalsContact O-N 3.11Å
1005K28.5Very low29.5Very low190.8 Ų190.8125.9 Ų125.983%0.8369%0.691SS**SBendtrans-149.794.3169.5-90.6-177178.8-1750112.6I1007K1005-I1007 PolarHBondContact O-N 3.01Å
1006E26.4Very low28.7Very low187.6 Ų187.6127.1 Ų127.188%0.87772%0.715SS**  trans169.695.3162.4-78.2165.3-164.400112.1
1007I28.1Very low28.4Very low154.8 Ų154.8131.3 Ų131.379%0.79473%0.732SS**  trans-107.5113.9159.6-63.3170000106.3K1005 C1009K1005-I1007 PolarHBondContact O-N 3.01Å; I1007-C1009 PolarHBondContact O-N 2.89Å; I1007-C1009 VanDerWaalsContact O-N 3.1Å
1008D24.9Very low28.2Very low151.8 Ų151.8137.4 Ų137.481%0.81275%0.751SS**  trans-141.3130.6150.4-94.2-34.8000112.2
1009C23.4Very low27.9Very low110 Ų110139.3 Ų139.374%0.74376%0.761SS**  trans63.498.8155.8-67.10000118.5I1007 S1011I1007-C1009 PolarHBondContact O-N 2.89Å; I1007-C1009 VanDerWaalsContact O-N 3.1Å; C1009-S1011 PolarHBondContact O-N 3.49Å
1010S24.9Very low27.7Very low108.4 Ų108.4141.2 Ų141.276%0.75877%0.771SS**  81.3112.4121.4-21.50000117.5
1011S26.6Very low27.7Very low119.2 Ų119.2140 Ų14083%0.83477%0.772SS**  trans135125139.654.40000114.8C1009C1009-S1011 PolarHBondContact O-N 3.49Å
1012S24.9Very low27.8Very low104.4 Ų104.4135.2 Ų135.273%0.7376%0.759SS**  trans-150.8132.1161.856.30000113.8L1014S1012-L1014 PolarHBondContact O-N 3.35Å
1013L26.8Very low28.1Very low160 Ų160135.6 Ų135.684%0.83876%0.756SS**  trans76.7100147.1-69.7158.5000115.3
1014L27.7Very low28.4Very low157.2 Ų157.2135.8 Ų135.882%0.82375%0.753SS**  157.5147.5116.2-79.3167.8000112.8S1012 A1016S1012-L1014 PolarHBondContact O-N 3.35Å; L1014-A1016 PolarHBondContact O-N 2.84Å
1015P27.8Very low28.8Very low121.2 Ų121.2132.8 Ų132.879%0.78774%0.737SS**  trans-100142.2-138.125.9-16.2000113.7E1017P1015-E1017 PolarHBondContact O-N 3.38Å
1016A26.9Very low29.3Very low93.6 Ų93.6128.3 Ų128.377%0.77472%0.721SS**  trans-84134.7155.200000111.5L1014 R1018L1014-A1016 PolarHBondContact O-N 2.84Å; A1016-R1018 PolarHBondContact O-N 3.15Å
1017E26.6Very low30Very low174 Ų174124.8 Ų124.881%0.81370%0.704SS**  trans-110.4119.5163.1-87-170.6174.400112.6P1015 L1019P1015-E1017 PolarHBondContact O-N 3.38Å; E1017-L1019 PolarHBondContact O-N 3.31Å
1018R27.8Very low30.5Very low226.2 Ų226.2121.2 Ų121.285%0.85469%0.687SS**  trans148.1104155.7-72.9178.4-174.5-169.8-1.9114.9A1016A1016-R1018 PolarHBondContact O-N 3.15Å
1019L27.3Very low31.2Very low150 Ų150116.4 Ų116.479%0.78566%0.663SS**  trans-23.1145142-86.1123.5000114.7E1017 A1021 S1022 I1023E1017-L1019 PolarHBondContact O-N 3.31Å; L1019-A1021 VanDerWaalsContact C-N 3.29Å; L1019-A1021 PolarHBondContact O-N 3.24Å; L1019-S1022 PolarHBondContact O-OG 3.13Å; L1019-I1023 HydrophobicContact CD2-CD1 4.31Å
1020P30.4Very low32.1Very low102.4 Ų102.4115 Ų11567%0.66565%0.647SS**  trans-94.6108.9-146.423.9-16.7000113.1S1022 I1023P1020-S1022 PolarHBondContact O-N 3.18Å; P1020-I1023 PolarHBondContact O-N 3.17Å
1021A32.2Very low33Very low73.4 Ų73.4113.6 Ų113.661%0.60763%0.63SS**THydrogen-bonded Turntrans-96.9-14.1177.700000114.5L1019 I1023 L1025L1019-A1021 VanDerWaalsContact C-N 3.29Å; L1019-A1021 PolarHBondContact O-N 3.24Å; A1021-I1023 VanDerWaalsContact C-N 3.29Å; A1021-I1023 PolarHBondContact O-N 3.22Å; A1021-L1025 PolarHBondContact O-N 3.17Å
1022S35.5Very low33.7Very low69.4 Ų69.4110.6 Ų110.649%0.48561%0.607SS.*Hα-helixtrans-68.5-34.2-176.550.10000113.7L1019 P1020 L1025 I1026L1019-S1022 PolarHBondContact O-OG 3.13Å; P1020-S1022 PolarHBondContact O-N 3.18Å; S1022-L1025 PolarHBondContact O-N 3.19Å; S1022-I1026 WeakPolarHBondContact O-CB 3.42Å; S1022-I1026 VanDerWaalsContact O-CD1 3.31Å; S1022-I1026 WeakPolarHBondContact O-CD1 3.44Å; S1022-I1026 VanDerWaalsContact O-CG1 3.23Å; S1022-I1026 WeakPolarHBondContact O-CG1 3.36Å; S1022-I1026 PolarHBondContact O-N 3.04Å
1023I38.1Very low34.7Very low112.2 Ų112.2108.9 Ų108.958%0.57559%0.593SS**Hα-helixtrans-69-42-175.1-60.7176.2000111.5L1019 P1020 A1021 L1025 I1026 Q1027L1019-I1023 HydrophobicContact CD2-CD1 4.31Å; P1020-I1023 PolarHBondContact O-N 3.17Å; A1021-I1023 VanDerWaalsContact C-N 3.29Å; A1021-I1023 PolarHBondContact O-N 3.22Å; I1023-L1025 VanDerWaalsContact C-N 3.33Å; I1023-L1025 PolarHBondContact O-N 3.22Å; I1023-I1026 PolarHBondContact O-N 3.22Å; I1023-Q1027 HydrophobicContact CG2-CG 4.42Å; I1023-Q1027 VanDerWaalsContact O-CB 3.28Å; I1023-Q1027 WeakPolarHBondContact O-CB 3.33Å; I1023-Q1027 VanDerWaalsContact O-CG 3.29Å; I1023-Q1027 WeakPolarHBondContact O-CG 3.5Å; I1023-Q1027 PolarHBondContact O-N 3.14Å
1024Q35.4Very low35.7Very low135.6 Ų135.6106.5 Ų106.563%0.63458%0.577SS**Hα-helixtrans-68.3-35.7176.2-90.1176.4-12.100112.2I1026 Q1027 N1028Q1024-I1026 PolarHBondContact O-N 2.8Å; Q1024-Q1027 PolarHBondContact O-N 3.06Å; Q1024-N1028 WeakPolarHBondContact O-CB 3.34Å; Q1024-N1028 VanDerWaalsContact O-CG 3.3Å; Q1024-N1028 PolarHBondContact O-N 3.32Å; Q1024-N1028 VanDerWaalsContact O-N 3.15Å; Q1024-N1028 PolarHBondContact O-ND2 3.21Å
1025L35.4Very low36.5Very low87.6 Ų87.6102.8 Ų102.846%0.45956%0.557SS.*Hα-helixtrans-65.6-44.1176.6-138.1158.4000110.9A1021 S1022 I1023 Q1027 N1028 V1029 A1117A1021-L1025 PolarHBondContact O-N 3.17Å; S1022-L1025 PolarHBondContact O-N 3.19Å; I1023-L1025 VanDerWaalsContact C-N 3.33Å; I1023-L1025 PolarHBondContact O-N 3.22Å; L1025-Q1027 VanDerWaalsContact C-N 3.32Å; L1025-Q1027 PolarHBondContact O-N 3.45Å; L1025-N1028 PolarHBondContact O-N 3.08Å; L1025-V1029 HydrophobicContact CD2-CG2 4.09Å; L1025-V1029 VanDerWaalsContact O-CB 3.29Å; L1025-V1029 WeakPolarHBondContact O-CB 3.23Å; L1025-V1029 VanDerWaalsContact O-CG2 3.28Å; L1025-V1029 WeakPolarHBondContact O-CG2 3.27Å; L1025-V1029 PolarHBondContact O-N 3.27Å; L1025-A1117 HydrophobicContact CD1-CB 4.32Å; L1025-A1117 HydrophobicContact CD2-CB 3.45Å; L1025-A1117 VanDerWaalsContact CD2-CB 3.45Å
1026I39.1Very low37.2Very low95.2 Ų95.299 Ų9949%0.48854%0.537SS..Hα-helixtrans-63.7-43.2175.4-67.4164.1000111.2S1022 I1023 Q1024 N1028 V1029 I1030S1022-I1026 WeakPolarHBondContact O-CB 3.42Å; S1022-I1026 VanDerWaalsContact O-CD1 3.31Å; S1022-I1026 WeakPolarHBondContact O-CD1 3.44Å; S1022-I1026 VanDerWaalsContact O-CG1 3.23Å; S1022-I1026 WeakPolarHBondContact O-CG1 3.36Å; S1022-I1026 PolarHBondContact O-N 3.04Å; I1023-I1026 PolarHBondContact O-N 3.22Å; Q1024-I1026 PolarHBondContact O-N 2.8Å; I1026-N1028 VanDerWaalsContact C-N 3.32Å; I1026-N1028 PolarHBondContact O-N 3.09Å; I1026-V1029 WeakPolarHBondContact O-CB 3.49Å; I1026-V1029 PolarHBondContact O-N 3.18Å; I1026-I1030 HydrophobicContact CG2-CD1 3.85Å; I1026-I1030 HydrophobicContact CG2-CG1 4.44Å; I1026-I1030 WeakPolarHBondContact O-CB 3.17Å; I1026-I1030 WeakPolarHBondContact O-CD1 2.89Å; I1026-I1030 VanDerWaalsContact O-CG1 3.28Å; I1026-I1030 WeakPolarHBondContact O-CG1 3.32Å; I1026-I1030 PolarHBondContact O-N 3.03Å; I1026-I1030 VanDerWaalsContact O-N 3.11Å
1027Q40Very low38.1Very low113.8 Ų113.897.3 Ų97.353%0.53252%0.522SS..Hα-helixtrans-63.2-41.3176.5-107.8178-30.800112.5F993 I1023 Q1024 L1025 V1029 I1030 L1031F993-Q1027 HydrophobicContact CD1-CG 4.46Å; F993-Q1027 HydrophobicContact CE1-CG 4.05Å; I1023-Q1027 HydrophobicContact CG2-CG 4.42Å; I1023-Q1027 VanDerWaalsContact O-CB 3.28Å; I1023-Q1027 WeakPolarHBondContact O-CB 3.33Å; I1023-Q1027 VanDerWaalsContact O-CG 3.29Å; I1023-Q1027 WeakPolarHBondContact O-CG 3.5Å; I1023-Q1027 PolarHBondContact O-N 3.14Å; Q1024-Q1027 PolarHBondContact O-N 3.06Å; L1025-Q1027 VanDerWaalsContact C-N 3.32Å; L1025-Q1027 PolarHBondContact O-N 3.45Å; Q1027-V1029 VanDerWaalsContact C-N 3.27Å; Q1027-V1029 PolarHBondContact O-N 3.02Å; Q1027-I1030 PolarHBondContact O-N 3.12Å; Q1027-L1031 VanDerWaalsContact O-CB 3.28Å; Q1027-L1031 WeakPolarHBondContact O-CB 3.33Å; Q1027-L1031 PolarHBondContact O-N 3.34Å
1028N38.9Very low39.1Very low80.6 Ų80.692.8 Ų92.843%0.43150%0.504SS..Hα-helixtrans-68.9-35.8176.9-74-24.8000112.2L996 Q1024 L1025 I1026 L1031 T1032L996-N1028 HydrophobicContact CD1-CB 3.97Å; L996-N1028 VanDerWaalsContact CD1-ND2 3.3Å; L996-N1028 WeakPolarHBondContact CD1-ND2 3.28Å; L996-N1028 VanDerWaalsContact CD2-ND2 3.34Å; L996-N1028 WeakPolarHBondContact CD2-ND2 3.16Å; Q1024-N1028 WeakPolarHBondContact O-CB 3.34Å; Q1024-N1028 VanDerWaalsContact O-CG 3.3Å; Q1024-N1028 PolarHBondContact O-N 3.32Å; Q1024-N1028 VanDerWaalsContact O-N 3.15Å; Q1024-N1028 PolarHBondContact O-ND2 3.21Å; L1025-N1028 PolarHBondContact O-N 3.08Å; I1026-N1028 VanDerWaalsContact C-N 3.32Å; I1026-N1028 PolarHBondContact O-N 3.09Å; N1028-L1031 PolarHBondContact O-N 3.27Å; N1028-T1032 WeakPolarHBondContact O-CB 3.36Å; N1028-T1032 VanDerWaalsContact O-CG2 3.29Å; N1028-T1032 WeakPolarHBondContact O-CG2 3.25Å; N1028-T1032 PolarHBondContact O-N 3.31Å; N1028-T1032 PolarHBondContact O-OG1 2.93Å
1029V38.9Very low39.9Very low49.6 Ų49.684.4 Ų84.430%0.30148%0.482SS..Hα-helixtrans-64.7-42.8172.5165.90000111.3L1025 I1026 Q1027 L1031 T1032 T1033 V1114L1025-V1029 HydrophobicContact CD2-CG2 4.09Å; L1025-V1029 VanDerWaalsContact O-CB 3.29Å; L1025-V1029 WeakPolarHBondContact O-CB 3.23Å; L1025-V1029 VanDerWaalsContact O-CG2 3.28Å; L1025-V1029 WeakPolarHBondContact O-CG2 3.27Å; L1025-V1029 PolarHBondContact O-N 3.27Å; I1026-V1029 WeakPolarHBondContact O-CB 3.49Å; I1026-V1029 PolarHBondContact O-N 3.18Å; Q1027-V1029 VanDerWaalsContact C-N 3.27Å; Q1027-V1029 PolarHBondContact O-N 3.02Å; V1029-L1031 VanDerWaalsContact C-N 3.34Å; V1029-L1031 PolarHBondContact O-N 3.32Å; V1029-T1032 WeakPolarHBondContact CA-OG1 3.39Å; V1029-T1032 PolarHBondContact O-N 2.87Å; V1029-T1032 PolarHBondContact O-OG1 3.08Å; V1029-T1032 VanDerWaalsContact O-OG1 3.1Å; V1029-T1033 HydrophobicContact CG1-CG2 4.38Å; V1029-T1033 WeakPolarHBondContact O-CB 3.24Å; V1029-T1033 VanDerWaalsContact O-CG2 3.31Å; V1029-T1033 WeakPolarHBondContact O-CG2 3.4Å; V1029-T1033 PolarHBondContact O-N 3.16Å; V1029-T1033 PolarHBondContact O-OG1 3.27Å; V1029-V1114 HydrophobicContact CB-CG2 4.1Å; V1029-V1114 HydrophobicContact CG1-CB 4.25Å; V1029-V1114 HydrophobicContact CG1-CG1 3.7Å; V1029-V1114 HydrophobicContact CG1-CG2 3.57Å; V1029-V1114 HydrophobicContact CG2-CB 4.45Å; V1029-V1114 HydrophobicContact CG2-CG2 4Å
1030I43.2Very low40.7Very low81.8 Ų81.879.8 Ų79.842%0.41947%0.466SS..Hα-helixtrans-63.6-44.6175.3-68.5165.3000110.5I1026 Q1027 T1032 T1033 Q1034I1026-I1030 HydrophobicContact CG2-CD1 3.85Å; I1026-I1030 HydrophobicContact CG2-CG1 4.44Å; I1026-I1030 WeakPolarHBondContact O-CB 3.17Å; I1026-I1030 WeakPolarHBondContact O-CD1 2.89Å; I1026-I1030 VanDerWaalsContact O-CG1 3.28Å; I1026-I1030 WeakPolarHBondContact O-CG1 3.32Å; I1026-I1030 PolarHBondContact O-N 3.03Å; I1026-I1030 VanDerWaalsContact O-N 3.11Å; Q1027-I1030 PolarHBondContact O-N 3.12Å; I1030-T1032 PolarHBondContact O-N 3.1Å; I1030-T1033 WeakPolarHBondContact CA-OG1 3.25Å; I1030-T1033 PolarHBondContact O-N 3.04Å; I1030-T1033 PolarHBondContact O-OG1 3.18Å; I1030-T1033 VanDerWaalsContact O-OG1 3.09Å; I1030-Q1034 VanDerWaalsContact O-CB 3.27Å; I1030-Q1034 WeakPolarHBondContact O-CB 3.32Å; I1030-Q1034 PolarHBondContact O-N 2.92Å
1031L44.4Very low41.5Very low77.2 Ų77.277.6 Ų77.640%0.40445%0.453SS..Hα-helixtrans-63.3-45.3179.1-160.187.3000111.6I989 V990 F993 Q1027 N1028 V1029 Q1034 I1035I989-L1031 HydrophobicContact CD1-CD2 4.35Å; I989-L1031 HydrophobicContact CG2-CD1 3.76Å; I989-L1031 HydrophobicContact CG2-CD2 4.31Å; V990-L1031 HydrophobicContact CG2-CD1 4.33Å; F993-L1031 HydrophobicContact CD2-CD1 3.71Å; F993-L1031 HydrophobicContact CE2-CD1 3.86Å; Q1027-L1031 VanDerWaalsContact O-CB 3.28Å; Q1027-L1031 WeakPolarHBondContact O-CB 3.33Å; Q1027-L1031 PolarHBondContact O-N 3.34Å; N1028-L1031 PolarHBondContact O-N 3.27Å; V1029-L1031 VanDerWaalsContact C-N 3.34Å; V1029-L1031 PolarHBondContact O-N 3.32Å; L1031-Q1034 PolarHBondContact O-N 3.16Å; L1031-I1035 HydrophobicContact CD2-CD1 4.16Å; L1031-I1035 HydrophobicContact CG-CD1 4.02Å; L1031-I1035 VanDerWaalsContact O-CB 3.31Å; L1031-I1035 WeakPolarHBondContact O-CB 3.33Å; L1031-I1035 VanDerWaalsContact O-CD1 3.28Å; L1031-I1035 WeakPolarHBondContact O-CD1 3.41Å; L1031-I1035 VanDerWaalsContact O-CG1 3.24Å; L1031-I1035 WeakPolarHBondContact O-CG1 3.35Å; L1031-I1035 PolarHBondContact O-N 3.31Å
1032T40.1Very low42.2Very low57 Ų5776.5 Ų76.535%0.3544%0.444SS..Hα-helixtrans-69.2-38.6179.946.20000112.8F993 N1028 V1029 I1030 Q1034 I1035 A1036F993-T1032 HydrophobicContact CD2-CG2 4Å; F993-T1032 HydrophobicContact CE2-CG2 4.05Å; N1028-T1032 WeakPolarHBondContact O-CB 3.36Å; N1028-T1032 VanDerWaalsContact O-CG2 3.29Å; N1028-T1032 WeakPolarHBondContact O-CG2 3.25Å; N1028-T1032 PolarHBondContact O-N 3.31Å; N1028-T1032 PolarHBondContact O-OG1 2.93Å; V1029-T1032 WeakPolarHBondContact CA-OG1 3.39Å; V1029-T1032 PolarHBondContact O-N 2.87Å; V1029-T1032 PolarHBondContact O-OG1 3.08Å; V1029-T1032 VanDerWaalsContact O-OG1 3.1Å; I1030-T1032 PolarHBondContact O-N 3.1Å; T1032-Q1034 VanDerWaalsContact C-N 3.33Å; T1032-I1035 PolarHBondContact O-N 3.23Å; T1032-A1036 VanDerWaalsContact O-CB 3.32Å; T1032-A1036 WeakPolarHBondContact O-CB 3.36Å; T1032-A1036 PolarHBondContact O-N 3.33Å
1033T45.4Very low42.5Very low69.6 Ų69.675.3 Ų75.343%0.42744%0.435SS..Hα-helixtrans-67.4-37.3173.649.40000112.2V1029 I1030 I1035 A1036 A1037 V1114V1029-T1033 HydrophobicContact CG1-CG2 4.38Å; V1029-T1033 WeakPolarHBondContact O-CB 3.24Å; V1029-T1033 VanDerWaalsContact O-CG2 3.31Å; V1029-T1033 WeakPolarHBondContact O-CG2 3.4Å; V1029-T1033 PolarHBondContact O-N 3.16Å; V1029-T1033 PolarHBondContact O-OG1 3.27Å; I1030-T1033 WeakPolarHBondContact CA-OG1 3.25Å; I1030-T1033 PolarHBondContact O-N 3.04Å; I1030-T1033 PolarHBondContact O-OG1 3.18Å; I1030-T1033 VanDerWaalsContact O-OG1 3.09Å; T1033-I1035 VanDerWaalsContact C-N 3.3Å; T1033-I1035 PolarHBondContact O-N 2.84Å; T1033-A1036 PolarHBondContact O-N 3.07Å; T1033-A1037 VanDerWaalsContact O-CB 3.23Å; T1033-A1037 WeakPolarHBondContact O-CB 3.25Å; T1033-A1037 PolarHBondContact O-N 3.04Å; T1033-V1114 HydrophobicContact CG2-CG2 4.23Å
1034Q48.7Very low42.8Very low109.4 Ų109.472.4 Ų72.451%0.51143%0.428SS..Hα-helixtrans-68.4-39.1175-167.1144.3-300112.3I989 I1030 L1031 T1032 A1036 A1037 N1038I989-Q1034 HydrophobicContact CD1-CG 3.78Å; I1030-Q1034 VanDerWaalsContact O-CB 3.27Å; I1030-Q1034 WeakPolarHBondContact O-CB 3.32Å; I1030-Q1034 PolarHBondContact O-N 2.92Å; L1031-Q1034 PolarHBondContact O-N 3.16Å; T1032-Q1034 VanDerWaalsContact C-N 3.33Å; Q1034-A1036 VanDerWaalsContact C-N 3.34Å; Q1034-A1037 PolarHBondContact O-N 3.21Å; Q1034-N1038 VanDerWaalsContact O-CB 3.26Å; Q1034-N1038 WeakPolarHBondContact O-CB 3.29Å; Q1034-N1038 VanDerWaalsContact O-CG 3.29Å; Q1034-N1038 PolarHBondContact O-N 3.19Å; Q1034-N1038 PolarHBondContact O-ND2 3.2Å
1035I43.9Very low43.4Very low79.2 Ų79.271.1 Ų71.141%0.40643%0.426SS..Hα-helixtrans-65-43.1173.6-70.6163.6000110.6I989 L1031 T1032 T1033 A1037 N1038 A1039I989-I1035 HydrophobicContact CB-CG2 4.46Å; I989-I1035 HydrophobicContact CD1-CD1 3.84Å; I989-I1035 HydrophobicContact CD1-CG2 3.36Å; I989-I1035 HydrophobicContact CG1-CD1 4.06Å; I989-I1035 HydrophobicContact CG1-CG1 4.41Å; I989-I1035 HydrophobicContact CG1-CG2 3.79Å; I989-I1035 HydrophobicContact CG2-CD1 4.27Å; I989-I1035 HydrophobicContact CG2-CG2 3.83Å; L1031-I1035 HydrophobicContact CD2-CD1 4.16Å; L1031-I1035 HydrophobicContact CG-CD1 4.02Å; L1031-I1035 VanDerWaalsContact O-CB 3.31Å; L1031-I1035 WeakPolarHBondContact O-CB 3.33Å; L1031-I1035 VanDerWaalsContact O-CD1 3.28Å; L1031-I1035 WeakPolarHBondContact O-CD1 3.41Å; L1031-I1035 VanDerWaalsContact O-CG1 3.24Å; L1031-I1035 WeakPolarHBondContact O-CG1 3.35Å; L1031-I1035 PolarHBondContact O-N 3.31Å; T1032-I1035 PolarHBondContact O-N 3.23Å; T1033-I1035 VanDerWaalsContact C-N 3.3Å; T1033-I1035 PolarHBondContact O-N 2.84Å; I1035-A1037 VanDerWaalsContact C-N 3.33Å; I1035-A1037 PolarHBondContact O-N 2.83Å; I1035-N1038 PolarHBondContact O-N 3.17Å; I1035-A1039 WeakPolarHBondContact O-CB 3.27Å; I1035-A1039 PolarHBondContact O-N 3.26Å
1036A42.7Very low43.8Very low42 Ų4269 Ų6935%0.34742%0.422SS..Hα-helixtrans-63.4-42.2175.800000112.2T1032 T1033 Q1034 N1038 A1039 A1040 A1107 A1110T1032-A1036 VanDerWaalsContact O-CB 3.32Å; T1032-A1036 WeakPolarHBondContact O-CB 3.36Å; T1032-A1036 PolarHBondContact O-N 3.33Å; T1033-A1036 PolarHBondContact O-N 3.07Å; Q1034-A1036 VanDerWaalsContact C-N 3.34Å; A1036-N1038 VanDerWaalsContact C-N 3.33Å; A1036-N1038 PolarHBondContact O-N 3.14Å; A1036-A1039 PolarHBondContact O-N 3.15Å; A1036-A1040 VanDerWaalsContact O-CB 3.29Å; A1036-A1040 WeakPolarHBondContact O-CB 3.3Å; A1036-A1040 PolarHBondContact O-N 2.97Å; A1036-A1107 HydrophobicContact CB-CB 3.99Å; A1036-A1110 HydrophobicContact CB-CB 4.2Å
1037A45.1Very low44Very low56.4 Ų56.468.7 Ų68.747%0.46642%0.42SS..Hα-helixtrans-64.2-40.9175.400000112.3T1033 Q1034 I1035 A1040 S1041T1033-A1037 VanDerWaalsContact O-CB 3.23Å; T1033-A1037 WeakPolarHBondContact O-CB 3.25Å; T1033-A1037 PolarHBondContact O-N 3.04Å; Q1034-A1037 PolarHBondContact O-N 3.21Å; I1035-A1037 VanDerWaalsContact C-N 3.33Å; I1035-A1037 PolarHBondContact O-N 2.83Å; A1037-A1040 PolarHBondContact O-N 3.15Å; A1037-S1041 WeakPolarHBondContact O-CB 3.43Å; A1037-S1041 PolarHBondContact O-N 3.13Å; A1037-S1041 PolarHBondContact O-OG 3.43Å
1038N48.2Very low44.2Very low80.8 Ų80.866 Ų6643%0.43242%0.417SS..Hα-helixtrans-67.7-40.5176-73.9-17.4000112R985 Q1034 I1035 A1036 A1040 S1041 A1042R985-N1038 PolarHBondContact NH1-OD1 3.3Å; Q1034-N1038 VanDerWaalsContact O-CB 3.26Å; Q1034-N1038 WeakPolarHBondContact O-CB 3.29Å; Q1034-N1038 VanDerWaalsContact O-CG 3.29Å; Q1034-N1038 PolarHBondContact O-N 3.19Å; Q1034-N1038 PolarHBondContact O-ND2 3.2Å; I1035-N1038 PolarHBondContact O-N 3.17Å; A1036-N1038 VanDerWaalsContact C-N 3.33Å; A1036-N1038 PolarHBondContact O-N 3.14Å; N1038-A1040 VanDerWaalsContact C-N 3.34Å; N1038-A1040 PolarHBondContact O-N 3.31Å; N1038-S1041 WeakPolarHBondContact CA-OG 3.44Å; N1038-S1041 PolarHBondContact O-N 3.17Å; N1038-S1041 VanDerWaalsContact O-N 3.13Å; N1038-S1041 PolarHBondContact O-OG 3.07Å; N1038-A1042 VanDerWaalsContact O-CB 3.22Å; N1038-A1042 WeakPolarHBondContact O-CB 3.28Å; N1038-A1042 PolarHBondContact O-N 3.15Å
1039A44.8Very low44.4Very low49 Ų4965.8 Ų65.841%0.40542%0.422SS..Hα-helixtrans-64.7-40.3174.200000112I1035 A1036 S1041 A1042 S1043 A1103 A1106I1035-A1039 WeakPolarHBondContact O-CB 3.27Å; I1035-A1039 PolarHBondContact O-N 3.26Å; A1036-A1039 PolarHBondContact O-N 3.15Å; A1039-S1041 VanDerWaalsContact C-N 3.34Å; A1039-S1041 PolarHBondContact O-N 3Å; A1039-A1042 PolarHBondContact O-N 3.38Å; A1039-S1043 WeakPolarHBondContact O-CB 3.35Å; A1039-S1043 PolarHBondContact O-N 3.14Å; A1039-S1043 PolarHBondContact O-OG 3.3Å; A1039-A1103 HydrophobicContact CB-CB 4.38Å; A1039-A1106 HydrophobicContact CB-CB 4.35Å
1040A43.4Very low44.4Very low54.6 Ų54.666 Ų6645%0.45143%0.428SS..Hα-helixtrans-64.1-40.217400000112.2A1036 A1037 N1038 A1042 S1043 A1044A1036-A1040 VanDerWaalsContact O-CB 3.29Å; A1036-A1040 WeakPolarHBondContact O-CB 3.3Å; A1036-A1040 PolarHBondContact O-N 2.97Å; A1037-A1040 PolarHBondContact O-N 3.15Å; N1038-A1040 VanDerWaalsContact C-N 3.34Å; N1038-A1040 PolarHBondContact O-N 3.31Å; A1040-A1042 VanDerWaalsContact C-N 3.35Å; A1040-A1042 PolarHBondContact O-N 2.84Å; A1040-S1043 VanDerWaalsContact CA-OG 3.32Å; A1040-S1043 WeakPolarHBondContact CA-OG 3.41Å; A1040-S1043 PolarHBondContact O-N 2.94Å; A1040-S1043 PolarHBondContact O-OG 3.05Å; A1040-S1043 VanDerWaalsContact O-OG 3.05Å; A1040-A1044 VanDerWaalsContact O-CB 3.3Å; A1040-A1044 WeakPolarHBondContact O-CB 3.26Å; A1040-A1044 PolarHBondContact O-N 3.04Å
1041S49Very low44.3Very low55 Ų5566.3 Ų66.339%0.38543%0.434SS..Hα-helixtrans-67.4-39.6174.987.90000112.6A1037 N1038 A1039 S1043 A1044 N1045A1037-S1041 WeakPolarHBondContact O-CB 3.43Å; A1037-S1041 PolarHBondContact O-N 3.13Å; A1037-S1041 PolarHBondContact O-OG 3.43Å; N1038-S1041 WeakPolarHBondContact CA-OG 3.44Å; N1038-S1041 PolarHBondContact O-N 3.17Å; N1038-S1041 VanDerWaalsContact O-N 3.13Å; N1038-S1041 PolarHBondContact O-OG 3.07Å; A1039-S1041 VanDerWaalsContact C-N 3.34Å; A1039-S1041 PolarHBondContact O-N 3Å; S1041-S1043 VanDerWaalsContact C-N 3.29Å; S1041-S1043 PolarHBondContact O-N 3.3Å; S1041-A1044 PolarHBondContact O-N 3.1Å; S1041-N1045 WeakPolarHBondContact O-CB 3.21Å; S1041-N1045 PolarHBondContact O-N 3.15Å; S1041-N1045 VanDerWaalsContact O-N 3.09Å
1042A45.5Very low44.2Very low51 Ų5165.9 Ų65.942%0.42144%0.442SS..Hα-helixtrans-66.1-40.8176.600000111.7N1038 A1039 A1040 N1045 A1046N1038-A1042 VanDerWaalsContact O-CB 3.22Å; N1038-A1042 WeakPolarHBondContact O-CB 3.28Å; N1038-A1042 PolarHBondContact O-N 3.15Å; A1039-A1042 PolarHBondContact O-N 3.38Å; A1040-A1042 VanDerWaalsContact C-N 3.35Å; A1040-A1042 PolarHBondContact O-N 2.84Å; A1042-N1045 PolarHBondContact O-N 3.07Å; A1042-A1046 VanDerWaalsContact O-CB 3.3Å; A1042-A1046 WeakPolarHBondContact O-CB 3.42Å; A1042-A1046 PolarHBondContact O-N 3.03Å
1043S42.1Very low44.2Very low42.8 Ų42.867.2 Ų67.230%0.29946%0.458SS..Hα-helixtrans-67.6-39.4174.860.50000112.4A1039 A1040 S1041 N1045 A1046 I1047A1039-S1043 WeakPolarHBondContact O-CB 3.35Å; A1039-S1043 PolarHBondContact O-N 3.14Å; A1039-S1043 PolarHBondContact O-OG 3.3Å; A1040-S1043 VanDerWaalsContact CA-OG 3.32Å; A1040-S1043 WeakPolarHBondContact CA-OG 3.41Å; A1040-S1043 PolarHBondContact O-N 2.94Å; A1040-S1043 PolarHBondContact O-OG 3.05Å; A1040-S1043 VanDerWaalsContact O-OG 3.05Å; S1041-S1043 VanDerWaalsContact C-N 3.29Å; S1041-S1043 PolarHBondContact O-N 3.3Å; S1043-N1045 PolarHBondContact O-N 3.26Å; S1043-A1046 WeakPolarHBondContact O-CB 3.15Å; S1043-A1046 PolarHBondContact O-N 3.2Å; S1043-I1047 WeakPolarHBondContact O-CB 3.24Å; S1043-I1047 WeakPolarHBondContact O-CD1 3.32Å; S1043-I1047 VanDerWaalsContact O-CG1 3.24Å; S1043-I1047 WeakPolarHBondContact O-CG1 3.38Å; S1043-I1047 PolarHBondContact O-N 3.04Å
1044A43.8Very low43.9Very low51.4 Ų51.468.3 Ų68.343%0.42547%0.469SS..Hα-helixtrans-62.7-42.5174.800000112A1040 S1041 A1046 I1047 A1048A1040-A1044 VanDerWaalsContact O-CB 3.3Å; A1040-A1044 WeakPolarHBondContact O-CB 3.26Å; A1040-A1044 PolarHBondContact O-N 3.04Å; S1041-A1044 PolarHBondContact O-N 3.1Å; A1044-A1046 VanDerWaalsContact C-N 3.35Å; A1044-I1047 PolarHBondContact O-N 3.21Å; A1044-A1048 VanDerWaalsContact O-CB 3.31Å; A1044-A1048 WeakPolarHBondContact O-CB 3.37Å; A1044-A1048 PolarHBondContact O-N 3.19Å
1045N48.8Very low43.4Very low108.8 Ų108.866.9 Ų66.958%0.58248%0.476SS*.Hα-helixtrans-68.6-36.5175.8-75.6-11000112.5S1041 A1042 S1043 A1048 S1049S1041-N1045 WeakPolarHBondContact O-CB 3.21Å; S1041-N1045 PolarHBondContact O-N 3.15Å; S1041-N1045 VanDerWaalsContact O-N 3.09Å; A1042-N1045 PolarHBondContact O-N 3.07Å; S1043-N1045 PolarHBondContact O-N 3.26Å; N1045-A1048 PolarHBondContact O-N 3.11Å; N1045-S1049 WeakPolarHBondContact O-CB 3.27Å; N1045-S1049 PolarHBondContact O-N 2.84Å; N1045-S1049 PolarHBondContact O-OG 3.01Å; N1045-S1049 VanDerWaalsContact O-OG 3.08Å
1046A43.9Very low42.8Very low44.8 Ų44.866.4 Ų66.437%0.3749%0.49SS..Hα-helixtrans-64.9-42.5174.100000111.9A1042 S1043 A1044 S1049 A1050 M1099A1042-A1046 VanDerWaalsContact O-CB 3.3Å; A1042-A1046 WeakPolarHBondContact O-CB 3.42Å; A1042-A1046 PolarHBondContact O-N 3.03Å; S1043-A1046 WeakPolarHBondContact O-CB 3.15Å; S1043-A1046 PolarHBondContact O-N 3.2Å; A1044-A1046 VanDerWaalsContact C-N 3.35Å; A1046-S1049 WeakPolarHBondContact CA-OG 3.26Å; A1046-S1049 PolarHBondContact O-N 3.14Å; A1046-S1049 PolarHBondContact O-OG 3.16Å; A1046-S1049 VanDerWaalsContact O-OG 3.09Å; A1046-A1050 VanDerWaalsContact O-CB 3.32Å; A1046-A1050 WeakPolarHBondContact O-CB 3.38Å; A1046-A1050 PolarHBondContact O-N 3.35Å; A1046-A1050 VanDerWaalsContact O-N 3.08Å; A1046-M1099 HydrophobicContact CB-CE 3.35Å
1047I42.7Very low42.3Very low88.4 Ų88.472.6 Ų72.645%0.45352%0.517SS..Hα-helixtrans-63.9-44.9173.9-67.5163.3000110.3S1043 A1044 S1049 A1050 V1051 A1100S1043-I1047 WeakPolarHBondContact O-CB 3.24Å; S1043-I1047 WeakPolarHBondContact O-CD1 3.32Å; S1043-I1047 VanDerWaalsContact O-CG1 3.24Å; S1043-I1047 WeakPolarHBondContact O-CG1 3.38Å; S1043-I1047 PolarHBondContact O-N 3.04Å; A1044-I1047 PolarHBondContact O-N 3.21Å; I1047-S1049 VanDerWaalsContact C-N 3.32Å; I1047-S1049 PolarHBondContact O-N 3.32Å; I1047-A1050 PolarHBondContact O-N 3.22Å; I1047-A1050 VanDerWaalsContact O-N 3.16Å; I1047-V1051 HydrophobicContact CG2-CG2 4.25Å; I1047-V1051 VanDerWaalsContact O-CB 3.27Å; I1047-V1051 WeakPolarHBondContact O-CB 3.35Å; I1047-V1051 VanDerWaalsContact O-CG2 3.27Å; I1047-V1051 WeakPolarHBondContact O-CG2 3.37Å; I1047-V1051 PolarHBondContact O-N 3.03Å; I1047-A1100 HydrophobicContact CD1-CB 4.12Å
1048A43.8Very low41.6Very low57.2 Ų57.273.8 Ų73.847%0.47353%0.534SS..Hα-helixtrans-61-39.9177.200000112.2A1044 N1045 V1051 A1052A1044-A1048 VanDerWaalsContact O-CB 3.31Å; A1044-A1048 WeakPolarHBondContact O-CB 3.37Å; A1044-A1048 PolarHBondContact O-N 3.19Å; N1045-A1048 PolarHBondContact O-N 3.11Å; A1048-V1051 PolarHBondContact O-N 3.47Å; A1048-A1052 VanDerWaalsContact O-CB 3.28Å; A1048-A1052 WeakPolarHBondContact O-CB 3.3Å; A1048-A1052 PolarHBondContact O-N 3.22Å; A1048-A1052 VanDerWaalsContact O-N 3.08Å
1049S43.7Very low40.6Very low75.4 Ų75.473.9 Ų73.953%0.52755%0.554SS.*Hα-helixtrans-69.8-37.2175.770.50000113N1045 A1046 I1047 A1052 A1053N1045-S1049 WeakPolarHBondContact O-CB 3.27Å; N1045-S1049 PolarHBondContact O-N 2.84Å; N1045-S1049 PolarHBondContact O-OG 3.01Å; N1045-S1049 VanDerWaalsContact O-OG 3.08Å; A1046-S1049 WeakPolarHBondContact CA-OG 3.26Å; A1046-S1049 PolarHBondContact O-N 3.14Å; A1046-S1049 PolarHBondContact O-OG 3.16Å; A1046-S1049 VanDerWaalsContact O-OG 3.09Å; I1047-S1049 VanDerWaalsContact C-N 3.32Å; I1047-S1049 PolarHBondContact O-N 3.32Å; S1049-A1052 PolarHBondContact O-N 3.33Å; S1049-A1053 VanDerWaalsContact O-CB 3.27Å; S1049-A1053 WeakPolarHBondContact O-CB 3.36Å; S1049-A1053 PolarHBondContact O-N 3.16Å
1050A39.9Very low39.8Very low53.4 Ų53.475.1 Ų75.144%0.44157%0.571SS.*Hα-helixtrans-69.5-37.2176.200000112.3A1046 I1047 A1053 S1054A1046-A1050 VanDerWaalsContact O-CB 3.32Å; A1046-A1050 WeakPolarHBondContact O-CB 3.38Å; A1046-A1050 PolarHBondContact O-N 3.35Å; A1046-A1050 VanDerWaalsContact O-N 3.08Å; I1047-A1050 PolarHBondContact O-N 3.22Å; I1047-A1050 VanDerWaalsContact O-N 3.16Å; A1050-A1053 PolarHBondContact O-N 3.21Å; A1050-S1054 WeakPolarHBondContact O-CB 3.47Å; A1050-S1054 PolarHBondContact O-N 3.19Å; A1050-S1054 VanDerWaalsContact O-N 3.12Å; A1050-S1054 PolarHBondContact O-OG 3.24Å
1051V40.7Very low39.1Very low88.8 Ų88.880.8 Ų80.854%0.53859%0.594SS.*Hα-helixtrans-69.6-41.2173.9172.90000110.8I1047 A1048 A1053 S1054 A1055I1047-V1051 HydrophobicContact CG2-CG2 4.25Å; I1047-V1051 VanDerWaalsContact O-CB 3.27Å; I1047-V1051 WeakPolarHBondContact O-CB 3.35Å; I1047-V1051 VanDerWaalsContact O-CG2 3.27Å; I1047-V1051 WeakPolarHBondContact O-CG2 3.37Å; I1047-V1051 PolarHBondContact O-N 3.03Å; A1048-V1051 PolarHBondContact O-N 3.47Å; V1051-A1053 VanDerWaalsContact C-N 3.31Å; V1051-A1053 PolarHBondContact O-N 3.14Å; V1051-S1054 WeakPolarHBondContact CA-OG 3.31Å; V1051-S1054 CarbonylContact O-C 3.59Å; V1051-S1054 PolarHBondContact O-N 3.03Å; V1051-S1054 PolarHBondContact O-OG 3.08Å; V1051-S1054 VanDerWaalsContact O-OG 3.1Å; V1051-A1055 WeakPolarHBondContact O-CB 3.44Å; V1051-A1055 PolarHBondContact O-N 3.05Å
1052A42Very low38Very low69.2 Ų69.286.3 Ų86.357%0.57261%0.613SS**Hα-helixtrans-63.6-37.9174.700000112.4A1048 S1049 S1054 A1055A1048-A1052 VanDerWaalsContact O-CB 3.28Å; A1048-A1052 WeakPolarHBondContact O-CB 3.3Å; A1048-A1052 PolarHBondContact O-N 3.22Å; A1048-A1052 VanDerWaalsContact O-N 3.08Å; S1049-A1052 PolarHBondContact O-N 3.33Å; A1052-S1054 VanDerWaalsContact C-N 3.31Å; A1052-S1054 PolarHBondContact O-N 3.24Å; A1052-A1055 PolarHBondContact O-N 3.26Å
1053A40.6Very low37Very low83.2 Ų83.292.5 Ų92.569%0.68863%0.631SS**Hα-helixtrans-69-24176.400000113.6S1049 A1050 V1051S1049-A1053 VanDerWaalsContact O-CB 3.27Å; S1049-A1053 WeakPolarHBondContact O-CB 3.36Å; S1049-A1053 PolarHBondContact O-N 3.16Å; A1050-A1053 PolarHBondContact O-N 3.21Å; V1051-A1053 VanDerWaalsContact C-N 3.31Å; V1051-A1053 PolarHBondContact O-N 3.14Å
1054S39.1Very low36.4Very low94 Ų9495.4 Ų95.466%0.65765%0.649SS**Hα-helixtrans-88.3-14177.959.10000114.4A1050 V1051 A1052 G1056A1050-S1054 WeakPolarHBondContact O-CB 3.47Å; A1050-S1054 PolarHBondContact O-N 3.19Å; A1050-S1054 VanDerWaalsContact O-N 3.12Å; A1050-S1054 PolarHBondContact O-OG 3.24Å; V1051-S1054 WeakPolarHBondContact CA-OG 3.31Å; V1051-S1054 CarbonylContact O-C 3.59Å; V1051-S1054 PolarHBondContact O-N 3.03Å; V1051-S1054 PolarHBondContact O-OG 3.08Å; V1051-S1054 VanDerWaalsContact O-OG 3.1Å; A1052-S1054 VanDerWaalsContact C-N 3.31Å; A1052-S1054 PolarHBondContact O-N 3.24Å; S1054-G1056 VanDerWaalsContact C-N 3.3Å; S1054-G1056 PolarHBondContact O-N 3.15Å
1055A37.9Very low35.4Very low79.8 Ų79.8100.1 Ų100.166%0.6667%0.666SS**SBendtrans-92.85.8-178.700000114.4V1051 A1052 L1057V1051-A1055 WeakPolarHBondContact O-CB 3.44Å; V1051-A1055 PolarHBondContact O-N 3.05Å; A1052-A1055 PolarHBondContact O-N 3.26Å; A1055-L1057 VanDerWaalsContact C-N 3.3Å; A1055-L1057 PolarHBondContact O-N 3.17Å; A1055-L1057 VanDerWaalsContact O-N 3.09Å
1056G32.1Very low34.3Very low68.2 Ų68.2101.5 Ų101.570%0.70368%0.678SS**  trans-85.921.5-170.200000117.4S1054S1054-G1056 VanDerWaalsContact C-N 3.3Å; S1054-G1056 PolarHBondContact O-N 3.15Å
1057L32.4Very low33.5Very low172.6 Ų172.6103.4 Ų103.490%0.90469%0.694SS**  trans-122.4102.5177.5-85.7161.4000110.7A1055A1055-L1057 VanDerWaalsContact C-N 3.3Å; A1055-L1057 PolarHBondContact O-N 3.17Å; A1055-L1057 VanDerWaalsContact O-N 3.09Å
1058G29.3Very low32.7Very low80.8 Ų80.8106.5 Ų106.583%0.83371%0.711SS**  trans-117145.5175.300000113.1
1059G28.1Very low31.9Very low83 Ų83109.7 Ų109.786%0.85673%0.725SS**  trans-164.9135.9176.800000113.4
1060G26.3Very low31.1Very low74 Ų74111.2 Ų111.276%0.76374%0.736SS**  trans92.2114.4162.200000117
1061L28.5Very low30.5Very low175.2 Ų175.2117.2 Ų117.292%0.91776%0.755SS**  169.9134.3127.1-87.2165.7000112.9
1062H25.9Very low29.8Very low170.6 Ų170.6123.5 Ų123.579%0.7977%0.769SS**  trans7.9126.9163.5-117-111.6000119.9
1063F24.7Very low29Very low181.4 Ų181.4126.9 Ų126.980%0.79678%0.777SS**  trans-12.8164.7151.8-83.3-101.7000116.4
1064P29.3Very low28.5Very low104.2 Ų104.2129 Ų12968%0.67778%0.782SS**  cis-142.7173-2.835-14.6000116.7
1065L23.2Very low27.9Very low150 Ų150135.9 Ų135.979%0.78579%0.793SS**  trans25.5132154.8-66.6150.3000118.3
1066T26.8Very low27.4Very low137.4 Ų137.4143.7 Ų143.784%0.84381%0.805SS**  -176.3147.999.729.20000111.6
1067A25.6Very low27.2Very low85.6 Ų85.6144.6 Ų144.671%0.70781%0.806SS**  trans-47.2145.3167.300000117.7
1068N26.3Very low27.4Very low151.6 Ų151.6141.6 Ų141.681%0.81180%0.797SS**  trans109.8140.1141.6-77.5-16.6000116.9
1069T28.4Very low27.5Very low125.2 Ų125.2144.5 Ų144.577%0.76880%0.799SS**  104.612011121.30000117
1070S26Very low27.5Very low107 Ų107144.1 Ų144.175%0.74880%0.795SS**  trans2.2138.1140.7-50.40000118.9
1071Q28.5Very low27.7Very low178.4 Ų178.4149.4 Ų149.483%0.83480%0.8SS**  trans104.2124.2133-71.5-172.6-0.300117
1072R25.5Very low27.7Very low222.2 Ų222.2148.9 Ų148.984%0.83880%0.796SS**  106.1123.8127-101.4179.4166.9-157.8-1.6117.1
1073L25.3Very low27.9Very low139.6 Ų139.6144.2 Ų144.273%0.73179%0.794SS**  50.3122.3108-77.1158.4000114.9
1074T29.5Very low28.1Very low129 Ų129140 Ų14079%0.79179%0.792SS**  135.4127.112651.70000115.9
1075R27Very low28.2Very low238.4 Ų238.4142.4 Ų142.490%0.980%0.799SS**  147.7133.3117-153.8-175.9-172.2-175.33.5114.6
1076R27.7Very low28.7Very low243.2 Ų243.2144 Ų14492%0.91880%0.803SS**  trans154.7130.1156.9-124.4176.3178.5170.6-1.3114.3
1077A27.2Very low29Very low88 Ų88143.7 Ų143.773%0.72780%0.795SS**  trans-88.5176.5161.600000111.9
1078P37.4Very low29.7Very low108.8 Ų108.8142.3 Ų142.371%0.70679%0.788SS**  cis-146.9164.239.538.7-19000117.1
1079T29.5Very low30.3Very low141.4 Ų141.4140 Ų14087%0.86778%0.782SS**  trans67.5119.1142.259.10000121.3
1080G30Very low30.6Very low75.8 Ų75.8137.3 Ų137.378%0.78177%0.772SS**  trans179110.7157.300000113.1I1082G1080-I1082 PolarHBondContact O-N 3.1Å
1081H29.3Very low31.2Very low185.4 Ų185.4137.2 Ų137.286%0.85876%0.763SS**  trans-40.2129173.4-109.5-83000116.7
1082I29.1Very low31.7Very low164.4 Ų164.4131.5 Ų131.584%0.84375%0.746SS**  trans147.2133.1133-67.4157.6000113.4G1080G1080-I1082 PolarHBondContact O-N 3.1Å
1083G29.8Very low32.2Very low72 Ų72123.6 Ų123.674%0.74273%0.728SS**  trans134.6116.6138.900000115.2N1085G1083-N1085 PolarHBondContact O-N 3.15Å
1084A29.2Very low33Very low91.4 Ų91.4119.4 Ų119.476%0.75571%0.714SS**  trans-83.6117.1-178.500000113.2
1085N30.8Very low33.5Very low154.6 Ų154.6117.8 Ų117.883%0.82770%0.701SS**  trans-173.469.5158.2-99.3-15.6000111.8G1083G1083-N1085 PolarHBondContact O-N 3.15Å
1086Q34.4Very low34.2Very low184 Ų184108.8 Ų108.886%0.8668%0.677SS**  trans-16738.5169.8-101.1166.271.100114.9G1088 P1089Q1086-G1088 PolarHBondContact O-N 3.46Å; Q1086-P1089 WeakPolarHBondContact O-CD 3.43Å
1087I32.9Very low34.9Very low131.4 Ų131.4101.6 Ų101.667%0.67466%0.66SS**  trans-105.79.7-175.3-52.2177.9000112.8A1090 L1091I1087-A1090 HydrophobicContact CG2-CB 3.91Å; I1087-L1091 HydrophobicContact CB-CD1 4.45Å; I1087-L1091 HydrophobicContact CG2-CB 4.19Å; I1087-L1091 HydrophobicContact CG2-CD1 3.63Å; I1087-L1091 PolarHBondContact O-N 3.26Å
1088G40.2Very low35.8Very low55.8 Ų55.8100.1 Ų100.158%0.57565%0.648SS**Hα-helixtrans-69.2-54-18000000115.3Q1086 A1090 L1091 A1092Q1086-G1088 PolarHBondContact O-N 3.46Å; G1088-A1090 PolarHBondContact O-N 3.18Å; G1088-L1091 PolarHBondContact O-N 3.08Å; G1088-A1092 PolarHBondContact O-N 3.23Å
1089P38.1Very low36Very low104.8 Ų104.8101.6 Ų101.668%0.68165%0.647SS**Hα-helixtrans-73.5-30.7-172.9-919.3000113.9Q1086 L1091 A1092 A1093Q1086-P1089 WeakPolarHBondContact O-CD 3.43Å; P1089-L1091 VanDerWaalsContact C-N 3.34Å; P1089-L1091 PolarHBondContact O-N 2.94Å; P1089-A1092 PolarHBondContact O-N 3.26Å; P1089-A1093 PolarHBondContact O-N 3.22Å; P1089-A1093 VanDerWaalsContact O-N 3.12Å
1090A36Very low36.5Very low67.6 Ų67.696.7 Ų96.756%0.55962%0.62SS**Hα-helixtrans-71.6-33.5-178.100000112.7I1087 G1088 A1093 A1094I1087-A1090 HydrophobicContact CG2-CB 3.91Å; G1088-A1090 PolarHBondContact O-N 3.18Å; A1090-A1093 PolarHBondContact O-N 3.31Å; A1090-A1094 VanDerWaalsContact O-CB 3.3Å; A1090-A1094 WeakPolarHBondContact O-CB 3.42Å; A1090-A1094 PolarHBondContact O-N 3.21Å
1091L38.3Very low37.1Very low105.6 Ų105.697 Ų9755%0.55361%0.607SS**Hα-helixtrans-73.8-34.7178.1-155.776.6000111.9I1087 G1088 P1089 A1094 N1095I1087-L1091 HydrophobicContact CB-CD1 4.45Å; I1087-L1091 HydrophobicContact CG2-CB 4.19Å; I1087-L1091 HydrophobicContact CG2-CD1 3.63Å; I1087-L1091 PolarHBondContact O-N 3.26Å; G1088-L1091 PolarHBondContact O-N 3.08Å; P1089-L1091 VanDerWaalsContact C-N 3.34Å; P1089-L1091 PolarHBondContact O-N 2.94Å; L1091-A1094 PolarHBondContact O-N 3.31Å; L1091-N1095 WeakPolarHBondContact O-CB 3.27Å; L1091-N1095 PolarHBondContact O-N 3.08Å
1092A37.4Very low37.8Very low59 Ų5989.9 Ų89.949%0.48858%0.584SS.*Hα-helixtrans-65.5-41.8173.200000111.8G1088 P1089 N1095 A1096G1088-A1092 PolarHBondContact O-N 3.23Å; P1089-A1092 PolarHBondContact O-N 3.26Å; A1092-N1095 PolarHBondContact O-N 3.14Å; A1092-A1096 WeakPolarHBondContact O-CB 3.19Å; A1092-A1096 PolarHBondContact O-N 3.07Å; A1092-A1096 VanDerWaalsContact O-N 3.1Å
1093A37.6Very low38.4Very low54.4 Ų54.484.4 Ų84.445%0.4556%0.563SS.*Hα-helixtrans-63.8-42.1173.600000112.1P1089 A1090 N1095 A1096 V1097P1089-A1093 PolarHBondContact O-N 3.22Å; P1089-A1093 VanDerWaalsContact O-N 3.12Å; A1090-A1093 PolarHBondContact O-N 3.31Å; A1093-N1095 PolarHBondContact O-N 3.28Å; A1093-A1096 PolarHBondContact O-N 3.1Å; A1093-V1097 WeakPolarHBondContact O-CB 3.34Å; A1093-V1097 WeakPolarHBondContact O-CG2 3.35Å; A1093-V1097 PolarHBondContact O-N 3.13Å
1094A40.6Very low39Very low53.4 Ų53.483.9 Ų83.944%0.44155%0.552SS.*Hα-helixtrans-62.9-42.4176.300000112.5A1090 L1091 A1096 V1097 A1098A1090-A1094 VanDerWaalsContact O-CB 3.3Å; A1090-A1094 WeakPolarHBondContact O-CB 3.42Å; A1090-A1094 PolarHBondContact O-N 3.21Å; L1091-A1094 PolarHBondContact O-N 3.31Å; A1094-A1096 VanDerWaalsContact C-N 3.35Å; A1094-A1096 PolarHBondContact O-N 2.88Å; A1094-V1097 PolarHBondContact O-N 3.33Å; A1094-A1098 VanDerWaalsContact O-CB 3.31Å; A1094-A1098 WeakPolarHBondContact O-CB 3.4Å; A1094-A1098 PolarHBondContact O-N 3.19Å
1095N40.8Very low39.7Very low95.4 Ų95.483.9 Ų83.951%0.5154%0.543SS..Hα-helixtrans-67.4-36.2176.1-78.1-11.4000112.6L1091 A1092 A1093 A1098 M1099L1091-N1095 WeakPolarHBondContact O-CB 3.27Å; L1091-N1095 PolarHBondContact O-N 3.08Å; A1092-N1095 PolarHBondContact O-N 3.14Å; A1093-N1095 PolarHBondContact O-N 3.28Å; N1095-A1098 PolarHBondContact O-N 3.42Å; N1095-M1099 VanDerWaalsContact O-CB 3.31Å; N1095-M1099 WeakPolarHBondContact O-CB 3.35Å; N1095-M1099 WeakPolarHBondContact O-CG 3.3Å; N1095-M1099 PolarHBondContact O-N 3.02Å
1096A41.5Very low40.3Very low48.4 Ų48.479.1 Ų79.140%0.453%0.525SS..Hα-helixtrans-65.5-41.5174.100000112A1092 A1093 A1094 M1099 A1100A1092-A1096 WeakPolarHBondContact O-CB 3.19Å; A1092-A1096 PolarHBondContact O-N 3.07Å; A1092-A1096 VanDerWaalsContact O-N 3.1Å; A1093-A1096 PolarHBondContact O-N 3.1Å; A1094-A1096 VanDerWaalsContact C-N 3.35Å; A1094-A1096 PolarHBondContact O-N 2.88Å; A1096-M1099 PolarHBondContact O-N 3.25Å; A1096-A1100 VanDerWaalsContact O-CB 3.31Å; A1096-A1100 WeakPolarHBondContact O-CB 3.32Å; A1096-A1100 PolarHBondContact O-N 3.29Å
1097V43.1Very low40.6Very low92.6 Ų92.672.7 Ų72.756%0.56150%0.504SS*.Hα-helixtrans-66.4-40.2174.8172.20000111.5A1093 A1094 A1100 T1101A1093-V1097 WeakPolarHBondContact O-CB 3.34Å; A1093-V1097 WeakPolarHBondContact O-CG2 3.35Å; A1093-V1097 PolarHBondContact O-N 3.13Å; A1094-V1097 PolarHBondContact O-N 3.33Å; V1097-A1100 PolarHBondContact O-N 3.07Å; V1097-T1101 WeakPolarHBondContact O-CB 3.37Å; V1097-T1101 PolarHBondContact O-N 3.25Å; V1097-T1101 PolarHBondContact O-OG1 3.21Å
1098A45.2Very low41Very low56.8 Ų56.869.5 Ų69.547%0.46950%0.497SS..Hα-helixtrans-63.8-42.6175.800000112.1A1094 N1095 A1100 T1101 G1102A1094-A1098 VanDerWaalsContact O-CB 3.31Å; A1094-A1098 WeakPolarHBondContact O-CB 3.4Å; A1094-A1098 PolarHBondContact O-N 3.19Å; N1095-A1098 PolarHBondContact O-N 3.42Å; A1098-A1100 VanDerWaalsContact C-N 3.35Å; A1098-A1100 PolarHBondContact O-N 3.33Å; A1098-T1101 VanDerWaalsContact CA-OG1 3.27Å; A1098-T1101 WeakPolarHBondContact CA-OG1 3.35Å; A1098-T1101 PolarHBondContact O-N 3.02Å; A1098-T1101 PolarHBondContact O-OG1 3.08Å; A1098-T1101 VanDerWaalsContact O-OG1 3.11Å; A1098-G1102 PolarHBondContact O-N 3.17Å
1099M41.2Very low41.1Very low139.2 Ų139.269.9 Ų69.969%0.68650%0.495SS*.Hα-helixtrans-66-38.8174.5-72.9-112.5-96.900112.3A1046 N1095 A1096 T1101 G1102 A1103A1046-M1099 HydrophobicContact CB-CE 3.35Å; N1095-M1099 VanDerWaalsContact O-CB 3.31Å; N1095-M1099 WeakPolarHBondContact O-CB 3.35Å; N1095-M1099 WeakPolarHBondContact O-CG 3.3Å; N1095-M1099 PolarHBondContact O-N 3.02Å; A1096-M1099 PolarHBondContact O-N 3.25Å; M1099-T1101 VanDerWaalsContact C-N 3.34Å; M1099-T1101 PolarHBondContact O-N 3.07Å; M1099-G1102 PolarHBondContact O-N 3.02Å; M1099-A1103 WeakPolarHBondContact O-CB 3.37Å; M1099-A1103 PolarHBondContact O-N 2.96Å
1100A41.2Very low41.1Very low38.2 Ų38.266.7 Ų66.732%0.31648%0.477SS..Hα-helixtrans-66.2-39.4175.200000112.5I1047 A1096 V1097 A1098 A1103 A1104I1047-A1100 HydrophobicContact CD1-CB 4.12Å; A1096-A1100 VanDerWaalsContact O-CB 3.31Å; A1096-A1100 WeakPolarHBondContact O-CB 3.32Å; A1096-A1100 PolarHBondContact O-N 3.29Å; V1097-A1100 PolarHBondContact O-N 3.07Å; A1098-A1100 VanDerWaalsContact C-N 3.35Å; A1098-A1100 PolarHBondContact O-N 3.33Å; A1100-A1103 PolarHBondContact O-N 3.19Å; A1100-A1104 WeakPolarHBondContact O-CB 3.28Å; A1100-A1104 PolarHBondContact O-N 3.2Å
1101T42.9Very low41.3Very low81.6 Ų81.666.1 Ų66.150%0.50147%0.472SS..Hα-helixtrans-68.1-39.2174.43.40000111.7V1097 A1098 M1099 A1104 T1105V1097-T1101 WeakPolarHBondContact O-CB 3.37Å; V1097-T1101 PolarHBondContact O-N 3.25Å; V1097-T1101 PolarHBondContact O-OG1 3.21Å; A1098-T1101 VanDerWaalsContact CA-OG1 3.27Å; A1098-T1101 WeakPolarHBondContact CA-OG1 3.35Å; A1098-T1101 PolarHBondContact O-N 3.02Å; A1098-T1101 PolarHBondContact O-OG1 3.08Å; A1098-T1101 VanDerWaalsContact O-OG1 3.11Å; M1099-T1101 VanDerWaalsContact C-N 3.34Å; M1099-T1101 PolarHBondContact O-N 3.07Å; T1101-A1104 PolarHBondContact O-N 3.15Å; T1101-T1105 WeakPolarHBondContact O-CB 3.35Å; T1101-T1105 WeakPolarHBondContact O-CG2 3.17Å; T1101-T1105 PolarHBondContact O-N 3.02Å; T1101-T1105 PolarHBondContact O-OG1 3.17Å; T1101-T1105 VanDerWaalsContact O-OG1 3.1Å
1102G42.6Very low41.3Very low36.4 Ų36.462.8 Ų62.838%0.37546%0.463SS..Hα-helixtrans-61.7-43.7172.900000112.8A1098 M1099 A1104 T1105 A1106A1098-G1102 PolarHBondContact O-N 3.17Å; M1099-G1102 PolarHBondContact O-N 3.02Å; G1102-A1104 VanDerWaalsContact C-N 3.35Å; G1102-A1104 PolarHBondContact O-N 3.44Å; G1102-T1105 VanDerWaalsContact CA-OG1 3.29Å; G1102-T1105 WeakPolarHBondContact CA-OG1 3.29Å; G1102-T1105 PolarHBondContact O-N 3.14Å; G1102-T1105 PolarHBondContact O-OG1 3.21Å; G1102-T1105 VanDerWaalsContact O-OG1 3.1Å; G1102-A1106 VanDerWaalsContact O-CB 3.31Å; G1102-A1106 WeakPolarHBondContact O-CB 3.38Å; G1102-A1106 PolarHBondContact O-N 3.17Å
1103A43.1Very low41.4Very low49 Ų4962.3 Ų62.341%0.40546%0.459SS..Hα-helixtrans-64.6-40.3175.100000112.3A1039 M1099 A1100 T1105 A1106 A1107A1039-A1103 HydrophobicContact CB-CB 4.38Å; M1099-A1103 WeakPolarHBondContact O-CB 3.37Å; M1099-A1103 PolarHBondContact O-N 2.96Å; A1100-A1103 PolarHBondContact O-N 3.19Å; A1103-T1105 VanDerWaalsContact C-N 3.34Å; A1103-T1105 PolarHBondContact O-N 3.06Å; A1103-A1106 PolarHBondContact O-N 3.04Å; A1103-A1107 WeakPolarHBondContact O-CB 3.42Å; A1103-A1107 PolarHBondContact O-N 3.19Å
1104A42.6Very low41.4Very low61.4 Ų61.462.8 Ų62.851%0.50746%0.457SS..Hα-helixtrans-65.3-39.8175.600000112.5A1100 T1101 G1102 A1107 A1108A1100-A1104 WeakPolarHBondContact O-CB 3.28Å; A1100-A1104 PolarHBondContact O-N 3.2Å; T1101-A1104 PolarHBondContact O-N 3.15Å; G1102-A1104 VanDerWaalsContact C-N 3.35Å; G1102-A1104 PolarHBondContact O-N 3.44Å; A1104-A1107 PolarHBondContact O-N 3.33Å; A1104-A1108 WeakPolarHBondContact O-CB 3.43Å; A1104-A1108 PolarHBondContact O-N 3.06Å
1105T43.8Very low41.2Very low91.6 Ų91.667.4 Ų67.456%0.56247%0.471SS*.Hα-helixtrans-70.1-36.7175.735.10000112.3T1101 G1102 A1103 A1107 A1108 A1109T1101-T1105 WeakPolarHBondContact O-CB 3.35Å; T1101-T1105 WeakPolarHBondContact O-CG2 3.17Å; T1101-T1105 PolarHBondContact O-N 3.02Å; T1101-T1105 PolarHBondContact O-OG1 3.17Å; T1101-T1105 VanDerWaalsContact O-OG1 3.1Å; G1102-T1105 VanDerWaalsContact CA-OG1 3.29Å; G1102-T1105 WeakPolarHBondContact CA-OG1 3.29Å; G1102-T1105 PolarHBondContact O-N 3.14Å; G1102-T1105 PolarHBondContact O-OG1 3.21Å; G1102-T1105 VanDerWaalsContact O-OG1 3.1Å; A1103-T1105 VanDerWaalsContact C-N 3.34Å; A1103-T1105 PolarHBondContact O-N 3.06Å; T1105-A1107 VanDerWaalsContact C-N 3.35Å; T1105-A1107 PolarHBondContact O-N 3.32Å; T1105-A1108 PolarHBondContact O-N 3.08Å; T1105-A1109 WeakPolarHBondContact O-CB 3.45Å; T1105-A1109 PolarHBondContact O-N 3.07Å
1106A42Very low41.1Very low53.6 Ų53.666.5 Ų66.544%0.44348%0.477SS..Hα-helixtrans-65.5-39.817300000112A1039 G1102 A1103 A1109 A1110A1039-A1106 HydrophobicContact CB-CB 4.35Å; G1102-A1106 VanDerWaalsContact O-CB 3.31Å; G1102-A1106 WeakPolarHBondContact O-CB 3.38Å; G1102-A1106 PolarHBondContact O-N 3.17Å; A1103-A1106 PolarHBondContact O-N 3.04Å; A1106-A1109 PolarHBondContact O-N 3.12Å; A1106-A1110 WeakPolarHBondContact O-CB 3.28Å; A1106-A1110 PolarHBondContact O-N 3.22Å
1107A40.9Very low40.9Very low51 Ų5167.6 Ų67.642%0.42149%0.486SS..Hα-helixtrans-65.4-4017400000112.2A1036 A1103 A1104 T1105 A1109 A1110 A1111A1036-A1107 HydrophobicContact CB-CB 3.99Å; A1103-A1107 WeakPolarHBondContact O-CB 3.42Å; A1103-A1107 PolarHBondContact O-N 3.19Å; A1104-A1107 PolarHBondContact O-N 3.33Å; T1105-A1107 VanDerWaalsContact C-N 3.35Å; T1105-A1107 PolarHBondContact O-N 3.32Å; A1107-A1109 PolarHBondContact O-N 2.74Å; A1107-A1110 PolarHBondContact O-N 3.18Å; A1107-A1111 WeakPolarHBondContact O-CB 3.4Å; A1107-A1111 PolarHBondContact O-N 3.27Å
1108A42.8Very low40.6Very low64.6 Ų64.667.4 Ų67.453%0.53449%0.485SS..Hα-helixtrans-66.6-39.6174.800000112.5A1104 T1105 A1111 G1112A1104-A1108 WeakPolarHBondContact O-CB 3.43Å; A1104-A1108 PolarHBondContact O-N 3.06Å; T1105-A1108 PolarHBondContact O-N 3.08Å; A1108-A1111 PolarHBondContact O-N 3.07Å; A1108-G1112 PolarHBondContact O-N 3.18Å
1109A41.1Very low40Very low64 Ų6467.5 Ų67.553%0.52949%0.492SS..Hα-helixtrans-66.5-39.3174.800000112.1T1105 A1106 A1107 G1112 A1113T1105-A1109 WeakPolarHBondContact O-CB 3.45Å; T1105-A1109 PolarHBondContact O-N 3.07Å; A1106-A1109 PolarHBondContact O-N 3.12Å; A1107-A1109 PolarHBondContact O-N 2.74Å; A1109-G1112 PolarHBondContact O-N 3.07Å; A1109-A1113 VanDerWaalsContact O-CB 3.31Å; A1109-A1113 WeakPolarHBondContact O-CB 3.31Å; A1109-A1113 PolarHBondContact O-N 3.28Å; A1109-A1113 VanDerWaalsContact O-N 3.09Å
1110A38.5Very low39.5Very low37.2 Ų37.269.6 Ų69.631%0.30750%0.5SS..Hα-helixtrans-63.8-42.6172.800000111.7F993 A1036 A1106 A1107 G1112 A1113 V1114F993-A1110 HydrophobicContact CZ-CB 4.35Å; A1036-A1110 HydrophobicContact CB-CB 4.2Å; A1106-A1110 WeakPolarHBondContact O-CB 3.28Å; A1106-A1110 PolarHBondContact O-N 3.22Å; A1107-A1110 PolarHBondContact O-N 3.18Å; A1110-G1112 VanDerWaalsContact C-N 3.32Å; A1110-G1112 PolarHBondContact O-N 2.95Å; A1110-A1113 VanDerWaalsContact O-CB 3.32Å; A1110-A1113 WeakPolarHBondContact O-CB 3.29Å; A1110-A1113 PolarHBondContact O-N 3.16Å; A1110-A1113 VanDerWaalsContact O-N 3.13Å; A1110-V1114 WeakPolarHBondContact O-CB 3.38Å; A1110-V1114 VanDerWaalsContact O-CG2 3.24Å; A1110-V1114 WeakPolarHBondContact O-CG2 3.34Å; A1110-V1114 PolarHBondContact O-N 3.15Å
1111A39.8Very low38.8Very low54.2 Ų54.275.1 Ų75.145%0.44852%0.524SS..Hα-helixtrans-62.6-38.6174.400000112.5A1107 A1108 A1113 V1114 M1115A1107-A1111 WeakPolarHBondContact O-CB 3.4Å; A1107-A1111 PolarHBondContact O-N 3.27Å; A1108-A1111 PolarHBondContact O-N 3.07Å; A1111-A1113 VanDerWaalsContact C-N 3.26Å; A1111-A1113 PolarHBondContact O-N 2.87Å; A1111-V1114 WeakPolarHBondContact O-CB 3.45Å; A1111-V1114 PolarHBondContact O-N 3.1Å; A1111-M1115 WeakPolarHBondContact O-CB 3.37Å; A1111-M1115 VanDerWaalsContact O-CG 3.27Å; A1111-M1115 WeakPolarHBondContact O-CG 3.28Å; A1111-M1115 PolarHBondContact O-N 3.13Å; A1111-M1115 VanDerWaalsContact O-N 3.1Å
1112G37.8Very low38.1Very low36.2 Ų36.277.5 Ų77.537%0.37354%0.539SS..Hα-helixtrans-64.1-39.9173.300000113.2A1108 A1109 A1110 V1114 M1115 A1116A1108-G1112 PolarHBondContact O-N 3.18Å; A1109-G1112 PolarHBondContact O-N 3.07Å; A1110-G1112 VanDerWaalsContact C-N 3.32Å; A1110-G1112 PolarHBondContact O-N 2.95Å; G1112-V1114 VanDerWaalsContact C-N 3.31Å; G1112-V1114 PolarHBondContact O-N 3.49Å; G1112-M1115 PolarHBondContact O-N 3.06Å; G1112-A1116 WeakPolarHBondContact O-CB 3.28Å; G1112-A1116 PolarHBondContact O-N 3.15Å; G1112-A1116 VanDerWaalsContact O-N 3.1Å
1113A39.5Very low37.5Very low49 Ų4981.7 Ų81.741%0.40556%0.557SS.*Hα-helixtrans-67.1-36.7175.600000112.5F993 A1109 A1110 A1111 A1116 A1117F993-A1113 HydrophobicContact CE1-CB 3.64Å; F993-A1113 HydrophobicContact CE2-CB 3.77Å; F993-A1113 VanDerWaalsContact CZ-CA 3.5Å; F993-A1113 HydrophobicContact CZ-CB 3.09Å; A1109-A1113 VanDerWaalsContact O-CB 3.31Å; A1109-A1113 WeakPolarHBondContact O-CB 3.31Å; A1109-A1113 PolarHBondContact O-N 3.28Å; A1109-A1113 VanDerWaalsContact O-N 3.09Å; A1110-A1113 VanDerWaalsContact O-CB 3.32Å; A1110-A1113 WeakPolarHBondContact O-CB 3.29Å; A1110-A1113 PolarHBondContact O-N 3.16Å; A1110-A1113 VanDerWaalsContact O-N 3.13Å; A1111-A1113 VanDerWaalsContact C-N 3.26Å; A1111-A1113 PolarHBondContact O-N 2.87Å; A1113-A1116 PolarHBondContact O-N 3.05Å; A1113-A1117 VanDerWaalsContact O-CB 3.27Å; A1113-A1117 WeakPolarHBondContact O-CB 3.32Å; A1113-A1117 PolarHBondContact O-N 2.98Å
1114V37.6Very low36.7Very low65.2 Ų65.285.3 Ų85.340%0.39557%0.574SS.*Hα-helixtrans-65.6-43.4174.4171.90000111.1V1029 T1033 A1110 A1111 G1112 A1116 A1117 T1118V1029-V1114 HydrophobicContact CB-CG2 4.1Å; V1029-V1114 HydrophobicContact CG1-CB 4.25Å; V1029-V1114 HydrophobicContact CG1-CG1 3.7Å; V1029-V1114 HydrophobicContact CG1-CG2 3.57Å; V1029-V1114 HydrophobicContact CG2-CB 4.45Å; V1029-V1114 HydrophobicContact CG2-CG2 4Å; T1033-V1114 HydrophobicContact CG2-CG2 4.23Å; A1110-V1114 WeakPolarHBondContact O-CB 3.38Å; A1110-V1114 VanDerWaalsContact O-CG2 3.24Å; A1110-V1114 WeakPolarHBondContact O-CG2 3.34Å; A1110-V1114 PolarHBondContact O-N 3.15Å; A1111-V1114 WeakPolarHBondContact O-CB 3.45Å; A1111-V1114 PolarHBondContact O-N 3.1Å; G1112-V1114 VanDerWaalsContact C-N 3.31Å; G1112-V1114 PolarHBondContact O-N 3.49Å; V1114-A1116 VanDerWaalsContact C-N 3.31Å; V1114-A1116 PolarHBondContact O-N 2.97Å; V1114-A1117 PolarHBondContact O-N 3.29Å; V1114-A1117 VanDerWaalsContact O-N 3.12Å; V1114-T1118 HydrophobicContact CG1-CG2 4.36Å; V1114-T1118 WeakPolarHBondContact O-CG2 3.42Å; V1114-T1118 PolarHBondContact O-N 3.25Å; V1114-T1118 VanDerWaalsContact O-N 3.16Å; V1114-T1118 PolarHBondContact O-OG1 3.26Å; V1114-T1118 VanDerWaalsContact O-OG1 3.09Å
1115M37.7Very low36Very low148.8 Ų148.889.3 Ų89.373%0.73359%0.587SS**Hα-helixtrans-63.7-36.6176.1-72.1-132.5-68.600112.6A1111 G1112 A1117 T1118A1111-M1115 WeakPolarHBondContact O-CB 3.37Å; A1111-M1115 VanDerWaalsContact O-CG 3.27Å; A1111-M1115 WeakPolarHBondContact O-CG 3.28Å; A1111-M1115 PolarHBondContact O-N 3.13Å; A1111-M1115 VanDerWaalsContact O-N 3.1Å; G1112-M1115 PolarHBondContact O-N 3.06Å; M1115-A1117 VanDerWaalsContact C-N 3.29Å; M1115-A1117 PolarHBondContact O-N 2.91Å; M1115-T1118 WeakPolarHBondContact CA-OG1 3.39Å; M1115-T1118 PolarHBondContact O-N 3.18Å; M1115-T1118 PolarHBondContact O-OG1 3.39Å
1116A39Very low35.2Very low78 Ų7891 Ų9165%0.64560%0.597SS**Hα-helixtrans-69.2-32.4175.500000112.9G1112 A1113 V1114 T1118 G1119G1112-A1116 WeakPolarHBondContact O-CB 3.28Å; G1112-A1116 PolarHBondContact O-N 3.15Å; G1112-A1116 VanDerWaalsContact O-N 3.1Å; A1113-A1116 PolarHBondContact O-N 3.05Å; V1114-A1116 VanDerWaalsContact C-N 3.31Å; V1114-A1116 PolarHBondContact O-N 2.97Å; A1116-T1118 VanDerWaalsContact C-N 3.3Å; A1116-T1118 PolarHBondContact O-N 2.86Å; A1116-G1119 PolarHBondContact O-N 3.08Å
1117A36.4Very low34.5Very low70.6 Ų70.694 Ų9458%0.58362%0.615SS**Hα-helixtrans-79.7-17.1-178.900000114.2L1025 A1113 V1114 M1115 G1119L1025-A1117 HydrophobicContact CD1-CB 4.32Å; L1025-A1117 HydrophobicContact CD2-CB 3.45Å; L1025-A1117 VanDerWaalsContact CD2-CB 3.45Å; A1113-A1117 VanDerWaalsContact O-CB 3.27Å; A1113-A1117 WeakPolarHBondContact O-CB 3.32Å; A1113-A1117 PolarHBondContact O-N 2.98Å; V1114-A1117 PolarHBondContact O-N 3.29Å; V1114-A1117 VanDerWaalsContact O-N 3.12Å; M1115-A1117 VanDerWaalsContact C-N 3.29Å; M1115-A1117 PolarHBondContact O-N 2.91Å; A1117-G1119 VanDerWaalsContact C-N 3.31Å; A1117-G1119 PolarHBondContact O-N 3.34Å
1118T36.9Very low33.8Very low88.8 Ų88.895.5 Ų95.555%0.54564%0.636SS.*SBendtrans-95.86.6-176.845.40000115.2V1114 M1115 A1116 Q1120V1114-T1118 HydrophobicContact CG1-CG2 4.36Å; V1114-T1118 WeakPolarHBondContact O-CG2 3.42Å; V1114-T1118 PolarHBondContact O-N 3.25Å; V1114-T1118 VanDerWaalsContact O-N 3.16Å; V1114-T1118 PolarHBondContact O-OG1 3.26Å; V1114-T1118 VanDerWaalsContact O-OG1 3.09Å; M1115-T1118 WeakPolarHBondContact CA-OG1 3.39Å; M1115-T1118 PolarHBondContact O-N 3.18Å; M1115-T1118 PolarHBondContact O-OG1 3.39Å; A1116-T1118 VanDerWaalsContact C-N 3.3Å; A1116-T1118 PolarHBondContact O-N 2.86Å; T1118-Q1120 VanDerWaalsContact C-N 3.3Å; T1118-Q1120 PolarHBondContact O-N 2.98Å; T1118-Q1120 VanDerWaalsContact O-N 3.12Å
1119G31.7Very low32.9Very low59.4 Ų59.496.6 Ų96.661%0.61265%0.653SS**  trans-20.171.6169.500000116.4A1116 A1117 N1121A1116-G1119 PolarHBondContact O-N 3.08Å; A1117-G1119 VanDerWaalsContact C-N 3.31Å; A1117-G1119 PolarHBondContact O-N 3.34Å; G1119-N1121 PolarHBondContact O-N 3.45Å
1120Q31.8Very low32.2Very low183 Ų18396.6 Ų96.686%0.85566%0.66SS**  trans-98.5113.1171.7-72.8-169.5-9.400111.1T1118 T1122T1118-Q1120 VanDerWaalsContact C-N 3.3Å; T1118-Q1120 PolarHBondContact O-N 2.98Å; T1118-Q1120 VanDerWaalsContact O-N 3.12Å; Q1120-T1122 VanDerWaalsContact C-N 3.32Å; Q1120-T1122 PolarHBondContact O-N 3.15Å
1121N26.7Very low31.4Very low152.8 Ų152.8105.1 Ų105.182%0.81769%0.69SS**  trans-73.698.5166.7-81.5-21.8000111.1G1119 T1123G1119-N1121 PolarHBondContact O-N 3.45Å; N1121-T1123 PolarHBondContact O-N 3.37Å
1122T28.6Very low30.8Very low133.6 Ų133.6105.6 Ų105.682%0.8270%0.7SS**  trans-123.6102.2151.448.10000110.1Q1120 T1124Q1120-T1122 VanDerWaalsContact C-N 3.32Å; Q1120-T1122 PolarHBondContact O-N 3.15Å; T1122-T1124 PolarHBondContact O-N 2.95Å
1123T29.2Very low30.1Very low123 Ų123110.4 Ų110.476%0.75572%0.716SS**  trans-53137.3165.448.70000113.3N1121 N1125N1121-T1123 PolarHBondContact O-N 3.37Å; T1123-N1125 PolarHBondContact O-N 3.3Å
1124T27Very low29.5Very low124.6 Ų124.6116.9 Ų116.976%0.76474%0.736SS**  trans-125138.5141.5480000113.1T1122T1122-T1124 PolarHBondContact O-N 2.95Å
1125N27Very low28.9Very low145.8 Ų145.8120.2 Ų120.278%0.7875%0.751SS**  trans-151.3111.3149.1-86.4-15.6000113.4T1123T1123-N1125 PolarHBondContact O-N 3.3Å
1126T27.3Very low28.3Very low126.6 Ų126.6117.9 Ų117.978%0.77775%0.746SS**  79.9126.6126.938.90000118.4
1127S26.4Very low27.5Very low118 Ų118120.8 Ų120.883%0.82575%0.75SS**  trans40.2123.4147.262.50000119.8
1128G26.1Very low27.2Very low82.8 Ų82.8122.1 Ų122.185%0.85476%0.761SS**  trans133.789.2142.300000117.6
1129G25.3Very low26.6Very low86.2 Ų86.2126.4 Ų126.489%0.88977%0.772SS**  trans115.8153167.800000115.3
1130G25.2Very low26.3Very low65.8 Ų65.8130.4 Ų130.468%0.67878%0.779SS**  156125.3109.300000112.1
1131F23.2Very low26Very low214.6 Ų214.6129.1 Ų129.194%0.94178%0.777SS**  trans64.9129.4138.9-80.2-89.8000116.6I1133F1131-I1133 HydrophobicContact CD1-CD1 3.85Å; F1131-I1133 HydrophobicContact CE1-CD1 4.25Å
1132G25.6Very low25.8Very low63.8 Ų63.8130.8 Ų130.866%0.65878%0.778SS**  137.2120.9101.900000113.9
1133I24.8Very low25.6Very low137.4 Ų137.4127.1 Ų127.171%0.70577%0.766SS**  trans73.1142.9143.6-53.3167.8000114.4F1131F1131-I1133 HydrophobicContact CD1-CD1 3.85Å; F1131-I1133 HydrophobicContact CE1-CD1 4.25Å
1134F25.4Very low25.4Very low187 Ų187127.7 Ų127.782%0.8277%0.77SS**  trans123.8120170.4-72.5-84.5000111.4
1135N24.8Very low25.2Very low134 Ų134125.1 Ų125.172%0.71777%0.768SS**  108.9143.751.8-140.721.8000112.2
1136T25.2Very low25.1Very low101 Ų101126.1 Ų126.162%0.6277%0.772SS**  trans82.2133.1143.945.90000117.2
1137D23.7Very low24.9Very low138.8 Ų138.8125.9 Ų125.974%0.74277%0.771SS**  109.7143.595.2-80.5-33.8000118.2K1139D1137-K1139 HydrophobicContact CB-CD 4.47Å; D1137-K1139 IonicContact OD1-NZ 2.7Å; D1137-K1139 PolarHBondContact OD1-NZ 2.89Å; D1137-K1139 IonicContact OD2-NZ 2.83Å; D1137-K1139 PolarHBondContact OD2-NZ 3.46Å
1138A28.8Very low24.9Very low97 Ų97125.4 Ų125.480%0.80276%0.764SS**  trans159.295.5150.700000112.2
1139K24.7Very low24.8Very low179.6 Ų179.6128.2 Ų128.278%0.78176%0.76SS**  22.6137.894.4-71.8-179.3174.3158.60112.1D1137D1137-K1139 HydrophobicContact CB-CD 4.47Å; D1137-K1139 IonicContact OD1-NZ 2.7Å; D1137-K1139 PolarHBondContact OD1-NZ 2.89Å; D1137-K1139 IonicContact OD2-NZ 2.83Å; D1137-K1139 PolarHBondContact OD2-NZ 3.46Å
1140N24.9Very low24.8Very low142.8 Ų142.8135.2 Ų135.276%0.76476%0.761SS**  trans80.9100.8167.8-56.5-16.5000117.8F1142N1140-F1142 HydrophobicContact CB-CD2 4.4Å; N1140-F1142 HydrophobicContact CB-CE2 4.44Å
1141L25.3Very low24.7Very low156.2 Ų156.2135.2 Ų135.282%0.81876%0.762SS**  -159.8116.9111.2-141.669.3000109.6L1208L1141-L1208 CarbonylContact C-O 3.6Å
1142F22.9Very low24.8Very low187.8 Ų187.8134.7 Ų134.782%0.82476%0.76SS**  trans-48.1126.5165-94.5-86.7000112.2N1140 M1207 L1208N1140-F1142 HydrophobicContact CB-CD2 4.4Å; N1140-F1142 HydrophobicContact CB-CE2 4.44Å; F1142-M1207 CarbonylContact O-C 3.55Å; F1142-M1207 VanDerWaalsContact O-CA 3.26Å; F1142-M1207 WeakPolarHBondContact O-CA 3.34Å; F1142-M1207 PolarHBondContact O-N 3.31Å; F1142-L1208 CarbonylContact C-O 3.18Å; F1142-L1208 PolarHBondContact N-O 2.99Å; F1142-L1208 PolarHBondContact O-N 2.95Å
1143G24.2Very low24.7Very low56.2 Ų56.2140.9 Ų140.958%0.57977%0.769SS**  125.1155.1108.100000115.6L1208 G1209G1143-L1208 VanDerWaalsContact N-C 3.27Å; G1143-L1208 PolarHBondContact N-O 3Å; G1143-L1208 CarbonylContact O-C 3.55Å; G1143-G1209 CarbonylContact O-C 3.5Å; G1143-G1209 PolarHBondContact O-N 3.18Å
1144T24.6Very low24.7Very low134.8 Ų134.8138.4 Ų138.483%0.82776%0.764SS**  trans77.5115.8157.752.70000116.5M1207 L1208T1144-M1207 HydrophobicContact CG2-CB 3.85Å; T1144-M1207 HydrophobicContact CG2-CE 3.59Å; T1144-M1207 HydrophobicContact CG2-CG 3.4Å; T1144-M1207 HydrophobicContact CG2-SD 3.34Å; T1144-M1207 WeakPolarHBondContact CG2-SD 3.29Å; T1144-L1208 PolarHBondContact OG1-N 3.23Å
1145G23.7Very low24.7Very low70.4 Ų70.4136.6 Ų136.673%0.72676%0.762SS**  trans111.8139.4161.500000113.9
1146L24.9Very low24.7Very low166.8 Ų166.8135.6 Ų135.687%0.87376%0.761SS**  trans-133.5125.6130.8-82.2170.8000107.9P1148L1146-P1148 VanDerWaalsContact O-CD 3.31Å; L1146-P1148 WeakPolarHBondContact O-CD 3.39Å
1147V23.9Very low24.8Very low122.2 Ų122.2135.8 Ų135.874%0.74176%0.764SS**  trans-69.5133.9152.6-177.20000109N1149V1147-N1149 HydrophobicContact CG1-CB 4.07Å; V1147-N1149 PolarHBondContact O-N 3.28Å; V1147-N1149 VanDerWaalsContact O-N 3.17Å
1148P26.6Very low24.8Very low107.4 Ų107.4137.5 Ų137.570%0.69777%0.769SS**  trans-107.6121.8145.420.7-5.5000109.7L1146 Y1150L1146-P1148 VanDerWaalsContact O-CD 3.31Å; L1146-P1148 WeakPolarHBondContact O-CD 3.39Å; P1148-Y1150 HydrophobicContact CB-CD2 4.23Å; P1148-Y1150 HydrophobicContact CB-CE2 4.27Å; P1148-Y1150 PolarHBondContact O-N 3.07Å
1149N23.2Very low24.7Very low143.2 Ų143.2140.5 Ų140.577%0.76677%0.766SS**  trans18.786.5138.7-111.17000113.1V1147 G1151V1147-N1149 HydrophobicContact CG1-CB 4.07Å; V1147-N1149 PolarHBondContact O-N 3.28Å; V1147-N1149 VanDerWaalsContact O-N 3.17Å; N1149-G1151 PolarHBondContact O-N 3.32Å
1150Y25.7Very low24.8Very low231.6 Ų231.6137.2 Ų137.291%0.90876%0.758SS**  trans-104.1110.4139.7-84.1-83.9000108.5P1148 F1152P1148-Y1150 HydrophobicContact CB-CD2 4.23Å; P1148-Y1150 HydrophobicContact CB-CE2 4.27Å; P1148-Y1150 PolarHBondContact O-N 3.07Å; Y1150-F1152 PolarHBondContact O-N 3.47Å
1151G23.4Very low25Very low67.4 Ų67.4136.6 Ų136.670%0.69575%0.753SS**  trans-110.8105.3176.700000111.9N1149 K1153N1149-G1151 PolarHBondContact O-N 3.32Å; G1151-K1153 VanDerWaalsContact C-N 3.29Å; G1151-K1153 PolarHBondContact O-N 2.8Å
1152F23.8Very low25.1Very low203.6 Ų203.6132.3 Ų132.389%0.89374%0.74SS**  trans-73.2117.5166.7-120.5-95.7000111.5Y1150 S1154Y1150-F1152 PolarHBondContact O-N 3.47Å; F1152-S1154 VanDerWaalsContact C-N 3.29Å; F1152-S1154 PolarHBondContact O-N 3.43Å
1153K23.5Very low25.4Very low194 Ų194126.1 Ų126.184%0.84372%0.724SS**  trans-108.8116.8156.8-94.3173.7176.7-177.80109.6G1151 D1155G1151-K1153 VanDerWaalsContact C-N 3.29Å; G1151-K1153 PolarHBondContact O-N 2.8Å; K1153-D1155 PolarHBondContact O-N 2.93Å
1154S26Very low25.6Very low85.6 Ų85.6127.9 Ų127.960%0.59972%0.719SS**  trans14.3100.1134.462.20000112.6F1152 V1156F1152-S1154 VanDerWaalsContact C-N 3.29Å; F1152-S1154 PolarHBondContact O-N 3.43Å; S1154-V1156 VanDerWaalsContact C-N 3.28Å; S1154-V1156 PolarHBondContact O-N 2.9Å
1155D24Very low25.8Very low148.2 Ų148.2126.4 Ų126.479%0.79371%0.71SS**  trans-34.8122.6147.8-60.5-36.9000113K1153 P1157 P1187K1153-D1155 PolarHBondContact O-N 2.93Å; D1155-P1157 WeakPolarHBondContact O-CD 3.41Å; D1155-P1187 HydrophobicContact CB-CB 3.95Å
1156V26.5Very low26Very low113.2 Ų113.2129.6 Ų129.669%0.68671%0.706SS**  trans-130.4133.7156.51660000108.2S1154 M1158 P1187S1154-V1156 VanDerWaalsContact C-N 3.28Å; S1154-V1156 PolarHBondContact O-N 2.9Å; V1156-M1158 PolarHBondContact O-N 3.06Å; V1156-M1158 VanDerWaalsContact O-N 3.12Å; V1156-P1187 HydrophobicContact CB-CB 3.68Å; V1156-P1187 HydrophobicContact CB-CG 3.54Å; V1156-P1187 HydrophobicContact CG1-CB 3.67Å; V1156-P1187 HydrophobicContact CG1-CG 3.29Å; V1156-P1187 HydrophobicContact CG2-CB 4.33Å; V1156-P1187 HydrophobicContact CG2-CG 3.8Å
1157P25.7Very low26.2Very low105.6 Ų105.6130.4 Ų130.469%0.68670%0.697SS**  trans-89.9146.3-158.622.1-13.8000112.8D1155 H1159 D1160D1155-P1157 WeakPolarHBondContact O-CD 3.41Å; P1157-H1159 PolarHBondContact O-N 2.93Å; P1157-D1160 PolarHBondContact O-N 3.44Å
1158M24.5Very low26.4Very low173.6 Ų173.6131.8 Ų131.886%0.85569%0.694SS**  trans-47.674.5168.2-126.4-170.9-173.600114.6V1156V1156-M1158 PolarHBondContact O-N 3.06Å; V1156-M1158 VanDerWaalsContact O-N 3.12Å
1159H26.6Very low26.4Very low159.8 Ų159.8129.2 Ų129.274%0.7469%0.686SS**  trans-124.1121147.6-127.4-72.8000111.5P1157 L1161P1157-H1159 PolarHBondContact O-N 2.93Å; H1159-L1161 PolarHBondContact O-N 3.37Å; H1159-L1161 VanDerWaalsContact O-N 3.13Å
1160D27.6Very low26.5Very low111.8 Ų111.8128.1 Ų128.160%0.59868%0.68SS**SBendtrans32.4-1.9163.2-65.6-15.2000117.7P1157 A1162 A1163 I1164P1157-D1160 PolarHBondContact O-N 3.44Å; D1160-A1162 HydrophobicContact CB-CB 3.61Å; D1160-A1162 VanDerWaalsContact CB-N 3.32Å; D1160-A1162 PolarHBondContact O-N 3.27Å; D1160-A1162 VanDerWaalsContact O-N 3.11Å; D1160-A1163 PolarHBondContact O-N 3.13Å; D1160-I1164 WeakPolarHBondContact O-CG1 3.45Å; D1160-I1164 PolarHBondContact O-N 2.84Å
1161L27.4Very low26.6Very low128.8 Ų128.8122.6 Ų122.667%0.67467%0.666SS**SBendtrans-69.4-8.9161-79.2169.3000114.6H1159 A1163 I1164 V1165 L1283H1159-L1161 PolarHBondContact O-N 3.37Å; H1159-L1161 VanDerWaalsContact O-N 3.13Å; L1161-A1163 VanDerWaalsContact C-N 3.32Å; L1161-I1164 HydrophobicContact CD2-CD1 4.27Å; L1161-I1164 PolarHBondContact O-N 3.11Å; L1161-V1165 WeakPolarHBondContact O-CG2 3.34Å; L1161-V1165 PolarHBondContact O-N 3.44Å; L1161-V1165 VanDerWaalsContact O-N 3.17Å; L1161-L1283 HydrophobicContact CD2-CD1 3.53Å
1162A28Very low26.7Very low65.6 Ų65.6124.5 Ų124.554%0.54266%0.66SS.*Hα-helixtrans-83.8-19.2171.700000111.3D1160 I1164 V1165 E1166D1160-A1162 HydrophobicContact CB-CB 3.61Å; D1160-A1162 VanDerWaalsContact CB-N 3.32Å; D1160-A1162 PolarHBondContact O-N 3.27Å; D1160-A1162 VanDerWaalsContact O-N 3.11Å; A1162-I1164 VanDerWaalsContact C-N 3.29Å; A1162-I1164 PolarHBondContact O-N 3.27Å; A1162-I1164 VanDerWaalsContact O-N 3.07Å; A1162-V1165 PolarHBondContact O-N 2.98Å; A1162-E1166 PolarHBondContact O-N 3.24Å
1163A28.5Very low26.8Very low57.6 Ų57.6122.5 Ų122.548%0.47665%0.651SS.*Hα-helixtrans-86.4-11.3169.200000113.1D1160 L1161 E1166 R1167D1160-A1163 PolarHBondContact O-N 3.13Å; L1161-A1163 VanDerWaalsContact C-N 3.32Å; A1163-E1166 HydrophobicContact CB-CB 4.37Å; A1163-R1167 VanDerWaalsContact O-CB 3.25Å; A1163-R1167 WeakPolarHBondContact O-CB 3.25Å; A1163-R1167 VanDerWaalsContact O-CG 3.32Å; A1163-R1167 WeakPolarHBondContact O-CG 3.3Å; A1163-R1167 PolarHBondContact O-N 3.2Å
1164I28.8Very low26.8Very low93.8 Ų93.8118.6 Ų118.648%0.48164%0.64SS.*Hα-helixtrans-74.6-21.1165.8-62.4174.1000110.9D1160 L1161 A1162 E1166 R1167 F1168 L1283D1160-I1164 WeakPolarHBondContact O-CG1 3.45Å; D1160-I1164 PolarHBondContact O-N 2.84Å; L1161-I1164 HydrophobicContact CD2-CD1 4.27Å; L1161-I1164 PolarHBondContact O-N 3.11Å; A1162-I1164 VanDerWaalsContact C-N 3.29Å; A1162-I1164 PolarHBondContact O-N 3.27Å; A1162-I1164 VanDerWaalsContact O-N 3.07Å; I1164-E1166 VanDerWaalsContact C-N 3.3Å; I1164-E1166 PolarHBondContact O-N 3.33Å; I1164-R1167 PolarHBondContact O-N 3.01Å; I1164-R1167 VanDerWaalsContact O-N 3.07Å; I1164-F1168 HydrophobicContact CG2-CD2 3.85Å; I1164-F1168 HydrophobicContact CG2-CE2 3.62Å; I1164-F1168 HydrophobicContact CG2-CZ 4.45Å; I1164-F1168 WeakPolarHBondContact O-CD2 3.44Å; I1164-F1168 PolarHBondContact O-N 3.28Å; I1164-L1283 HydrophobicContact CG2-CD1 3.92Å
1165V29.4Very low26.8Very low104.4 Ų104.4123.5 Ų123.563%0.63365%0.647SS**Hα-helixtrans-61-25.8170.81800000112.8L1161 A1162 R1167 F1168 G1169 F1282 L1283L1161-V1165 WeakPolarHBondContact O-CG2 3.34Å; L1161-V1165 PolarHBondContact O-N 3.44Å; L1161-V1165 VanDerWaalsContact O-N 3.17Å; A1162-V1165 PolarHBondContact O-N 2.98Å; V1165-R1167 VanDerWaalsContact C-N 3.33Å; V1165-R1167 PolarHBondContact O-N 3.26Å; V1165-R1167 VanDerWaalsContact O-N 3.13Å; V1165-F1168 WeakPolarHBondContact O-CB 3.32Å; V1165-F1168 PolarHBondContact O-N 3.32Å; V1165-G1169 PolarHBondContact O-N 3.45Å; V1165-F1282 HydrophobicContact CG2-CE2 4.33Å; V1165-F1282 HydrophobicContact CG2-CZ 4.43Å; V1165-L1283 HydrophobicContact CG2-CD2 4.04Å
1166E27.8Very low26.8Very low138 Ų138123.2 Ų123.265%0.64565%0.645SS**Hα-helixtrans-82.2-8.6173.5-90.5-171.5158.200113.4A1162 A1163 I1164 F1168 G1169 N1170A1162-E1166 PolarHBondContact O-N 3.24Å; A1163-E1166 HydrophobicContact CB-CB 4.37Å; I1164-E1166 VanDerWaalsContact C-N 3.3Å; I1164-E1166 PolarHBondContact O-N 3.33Å; E1166-F1168 VanDerWaalsContact C-N 3.28Å; E1166-F1168 PolarHBondContact O-N 3.27Å; E1166-G1169 PolarHBondContact O-N 3.1Å; E1166-G1169 VanDerWaalsContact O-N 3.15Å; E1166-N1170 PolarHBondContact O-N 3.39Å
1167R28.9Very low26.7Very low183.2 Ų183.2122.1 Ų122.169%0.69164%0.643SS**Hα-helixtrans-94.2-5.7-179.1-82.4-176.6177.6-172.62.6112.1D899 A1163 I1164 V1165 N1170 L1171D899-R1167 IonicContact OD1-CZ 2.8Å; D899-R1167 IonicContact OD1-NE 2.69Å; D899-R1167 PolarHBondContact OD1-NE 2.95Å; D899-R1167 IonicContact OD1-NH2 3.67Å; D899-R1167 PolarHBondContact OD1-NH2 3.31Å; D899-R1167 IonicContact OD2-CZ 2.88Å; D899-R1167 IonicContact OD2-NE 3.43Å; D899-R1167 IonicContact OD2-NH2 3.94Å; D899-R1167 PolarHBondContact OD2-NH2 3.05Å; A1163-R1167 VanDerWaalsContact O-CB 3.25Å; A1163-R1167 WeakPolarHBondContact O-CB 3.25Å; A1163-R1167 VanDerWaalsContact O-CG 3.32Å; A1163-R1167 WeakPolarHBondContact O-CG 3.3Å; A1163-R1167 PolarHBondContact O-N 3.2Å; I1164-R1167 PolarHBondContact O-N 3.01Å; I1164-R1167 VanDerWaalsContact O-N 3.07Å; V1165-R1167 VanDerWaalsContact C-N 3.33Å; V1165-R1167 PolarHBondContact O-N 3.26Å; V1165-R1167 VanDerWaalsContact O-N 3.13Å; R1167-N1170 PolarHBondContact O-N 3.33Å; R1167-L1171 WeakPolarHBondContact O-CB 3.28Å; R1167-L1171 VanDerWaalsContact O-CG 3.29Å; R1167-L1171 WeakPolarHBondContact O-CG 3.44Å; R1167-L1171 PolarHBondContact O-N 3.2Å
1168F28.3Very low26.6Very low151.4 Ų151.4124 Ų12466%0.66465%0.647SS**Hα-helixtrans-77.44.6159.2-82.6-73.6000113.7I1164 V1165 E1166 N1170 L1171 N1172 V1244 T1248I1164-F1168 HydrophobicContact CG2-CD2 3.85Å; I1164-F1168 HydrophobicContact CG2-CE2 3.62Å; I1164-F1168 HydrophobicContact CG2-CZ 4.45Å; I1164-F1168 WeakPolarHBondContact O-CD2 3.44Å; I1164-F1168 PolarHBondContact O-N 3.28Å; V1165-F1168 WeakPolarHBondContact O-CB 3.32Å; V1165-F1168 PolarHBondContact O-N 3.32Å; E1166-F1168 VanDerWaalsContact C-N 3.28Å; E1166-F1168 PolarHBondContact O-N 3.27Å; F1168-N1170 VanDerWaalsContact C-N 3.32Å; F1168-N1170 PolarHBondContact O-N 3.05Å; F1168-L1171 HydrophobicContact CD1-CD1 3.88Å; F1168-L1171 HydrophobicContact CE1-CD1 4.13Å; F1168-L1171 CarbonylContact O-C 3.57Å; F1168-L1171 PolarHBondContact O-N 3.46Å; F1168-N1172 VanDerWaalsContact O-CB 3.28Å; F1168-N1172 WeakPolarHBondContact O-CB 3.3Å; F1168-N1172 PolarHBondContact O-N 2.94Å; F1168-V1244 HydrophobicContact CE1-CG1 4.09Å; F1168-V1244 HydrophobicContact CE2-CG1 3.77Å; F1168-V1244 HydrophobicContact CZ-CB 4.48Å; F1168-V1244 HydrophobicContact CZ-CG1 3.23Å; F1168-T1248 HydrophobicContact CE1-CG2 3.51Å; F1168-T1248 HydrophobicContact CZ-CG2 4.06Å
1169G26.6Very low26.6Very low52.4 Ų52.4121.5 Ų121.554%0.5464%0.641SS.*  trans-69.418.3175.500000113.6V1165 E1166 N1172V1165-G1169 PolarHBondContact O-N 3.45Å; E1166-G1169 PolarHBondContact O-N 3.1Å; E1166-G1169 VanDerWaalsContact O-N 3.15Å; G1169-N1172 PolarHBondContact O-N 2.95Å
1170N26.3Very low26.4Very low121 Ų121123.4 Ų123.465%0.64764%0.644SS**  trans-128.750.3173.6-84.9-23.4000112.9E1166 R1167 F1168 N1172 F1173E1166-N1170 PolarHBondContact O-N 3.39Å; R1167-N1170 PolarHBondContact O-N 3.33Å; F1168-N1170 VanDerWaalsContact C-N 3.32Å; F1168-N1170 PolarHBondContact O-N 3.05Å; N1170-N1172 PolarHBondContact O-N 3.24Å; N1170-F1173 WeakPolarHBondContact O-CE2 3.4Å
1171L26.2Very low26.2Very low115.6 Ų115.6126.9 Ų126.961%0.60565%0.654SS**  trans-109.377.5153.6-76171.6000111R1167 F1168 F1173 R1252R1167-L1171 WeakPolarHBondContact O-CB 3.28Å; R1167-L1171 VanDerWaalsContact O-CG 3.29Å; R1167-L1171 WeakPolarHBondContact O-CG 3.44Å; R1167-L1171 PolarHBondContact O-N 3.2Å; F1168-L1171 HydrophobicContact CD1-CD1 3.88Å; F1168-L1171 HydrophobicContact CE1-CD1 4.13Å; F1168-L1171 CarbonylContact O-C 3.57Å; F1168-L1171 PolarHBondContact O-N 3.46Å; L1171-F1173 HydrophobicContact CD2-CE2 4.2Å; L1171-F1173 PolarHBondContact O-N 3.19Å; L1171-R1252 PolarHBondContact O-NH2 3.3Å
1172N25.1Very low26Very low108 Ų108126.9 Ų126.958%0.57865%0.654SS**  trans-93.1121.8155.3-99.7-1.8000110F1168 G1169 N1170 D1174F1168-N1172 VanDerWaalsContact O-CB 3.28Å; F1168-N1172 WeakPolarHBondContact O-CB 3.3Å; F1168-N1172 PolarHBondContact O-N 2.94Å; G1169-N1172 PolarHBondContact O-N 2.95Å; N1170-N1172 PolarHBondContact O-N 3.24Å; N1172-D1174 VanDerWaalsContact C-N 3.35Å; N1172-D1174 WeakPolarHBondContact CB-OD1 3.33Å; N1172-D1174 PolarHBondContact ND2-OD1 2.78Å; N1172-D1174 PolarHBondContact O-N 3.21Å
1173F26.2Very low25.8Very low160 Ų160132.7 Ų132.770%0.70267%0.668SS**  trans-39126.6136.7-74.8-85.6000110.1N1170 L1171 Y1175 R1252N1170-F1173 WeakPolarHBondContact O-CE2 3.4Å; L1171-F1173 HydrophobicContact CD2-CE2 4.2Å; L1171-F1173 PolarHBondContact O-N 3.19Å; F1173-Y1175 PolarHBondContact O-N 3.27Å; F1173-R1252 PolarHBondContact O-NH1 3.28Å; F1173-R1252 PolarHBondContact O-NH2 3.34Å
1174D24Very low25.6Very low112.8 Ų112.8136.5 Ų136.560%0.60368%0.676SS**  trans-112.1125.1-137.7-70.9-39.3000111N1172 N1176 S1177N1172-D1174 VanDerWaalsContact C-N 3.35Å; N1172-D1174 WeakPolarHBondContact CB-OD1 3.33Å; N1172-D1174 PolarHBondContact ND2-OD1 2.78Å; N1172-D1174 PolarHBondContact O-N 3.21Å; D1174-N1176 PolarHBondContact O-N 3.39Å; D1174-S1177 WeakPolarHBondContact OD1-CB 3.01Å; D1174-S1177 PolarHBondContact OD1-OG 3.3Å
1175Y25.9Very low25.4Very low188.8 Ų188.8139.7 Ų139.774%0.7469%0.687SS**  -122.1104.6122.7-117-90.3000112.2K829 F1173K829-Y1175 PolarHBondContact NZ-OH 3.25Å; F1173-Y1175 PolarHBondContact O-N 3.27Å
1176N23.7Very low25.3Very low141.6 Ų141.6139.7 Ų139.776%0.75769%0.689SS**  trans-133.4109.5168.9-70.9-37.9000114.4D1174D1174-N1176 PolarHBondContact O-N 3.39Å
1177S24.5Very low25.3Very low91 Ų91137.8 Ų137.864%0.63669%0.688SS**  trans-164.2117.413258.60000112.4D1174 T1179D1174-S1177 WeakPolarHBondContact OD1-CB 3.01Å; D1174-S1177 PolarHBondContact OD1-OG 3.3Å; S1177-T1179 PolarHBondContact O-N 2.66Å
1178D23.1Very low25.2Very low145 Ų145132.3 Ų132.378%0.77569%0.688SS**  trans-21.9125150.7-56.8-46.8000113.1Y1180D1178-Y1180 HydrophobicContact CB-CD2 3.86Å; D1178-Y1180 HydrophobicContact CB-CE2 3.82Å; D1178-Y1180 PolarHBondContact O-N 3.31Å
1179T24.6Very low25.1Very low121 Ų121129.4 Ų129.474%0.74269%0.692SS**  trans-166.5117.9134.623.20000111S1177 F1181S1177-T1179 PolarHBondContact O-N 2.66Å; T1179-F1181 VanDerWaalsContact C-N 3.3Å; T1179-F1181 PolarHBondContact O-N 2.93Å
1180Y22.8Very low25Very low200.6 Ų200.6136.9 Ų136.979%0.78771%0.706SS**  trans2.2124.2164.3-72.9-91.8000116D1178 N1182D1178-Y1180 HydrophobicContact CB-CD2 3.86Å; D1178-Y1180 HydrophobicContact CB-CE2 3.82Å; D1178-Y1180 PolarHBondContact O-N 3.31Å; Y1180-N1182 PolarHBondContact O-N 3.31Å
1181F24.3Very low25.1Very low183.4 Ų183.4136.6 Ų136.680%0.80471%0.71SS**  trans-140.7102.8146.1-87.6-79.9000112T1179 F1183T1179-F1181 VanDerWaalsContact C-N 3.3Å; T1179-F1181 PolarHBondContact O-N 2.93Å; F1181-F1183 PolarHBondContact O-N 2.62Å
1182N21.7Very low25.3Very low129.6 Ų129.6136.4 Ų136.469%0.69372%0.716SS**  trans-85.9129.2167.4-76.6-23.9000109.4Y1180 E1184Y1180-N1182 PolarHBondContact O-N 3.31Å; N1182-E1184 PolarHBondContact ND2-OE2 2.84Å; N1182-E1184 VanDerWaalsContact ND2-OE2 3.1Å; N1182-E1184 PolarHBondContact O-N 3.27Å
1183F25.2Very low25.3Very low186.6 Ų186.6136.7 Ų136.782%0.81873%0.726SS**  trans-134.8104.4142.2-108.9-80.8000109.5F1181 F1185 C1327F1181-F1183 PolarHBondContact O-N 2.62Å; F1183-F1185 HydrophobicContact CB-CD2 4.12Å; F1183-F1185 HydrophobicContact CB-CE2 3.96Å; F1183-F1185 HydrophobicContact CD1-CD2 4.17Å; F1183-F1185 HydrophobicContact CD1-CE1 4.44Å; F1183-F1185 AromaticContact CD1-CE2 3.65Å; F1183-F1185 HydrophobicContact CD1-CE2 3.65Å; F1183-F1185 AromaticContact CD1-CZ 3.81Å; F1183-F1185 HydrophobicContact CD1-CZ 3.81Å; F1183-F1185 HydrophobicContact CE1-CZ 4.24Å; F1183-F1185 HydrophobicContact CG-CE2 4.11Å; F1183-F1185 PolarHBondContact O-N 2.93Å; F1183-C1327 HydrophobicContact CD2-CB 3.94Å; F1183-C1327 HydrophobicContact CE1-CB 4.38Å; F1183-C1327 HydrophobicContact CE2-CB 3.6Å; F1183-C1327 HydrophobicContact CG-CB 4.48Å; F1183-C1327 HydrophobicContact CZ-CB 3.85Å; F1183-C1327 WeakPolarHBondContact CZ-SG 3.46Å
1184E23.2Very low25.1Very low139.2 Ų139.2132.6 Ų132.665%0.6572%0.723SS**  trans-85.9140170.4-79.6166126.300109.5N1182 P1186 R1252N1182-E1184 PolarHBondContact ND2-OE2 2.84Å; N1182-E1184 VanDerWaalsContact ND2-OE2 3.1Å; N1182-E1184 PolarHBondContact O-N 3.27Å; E1184-P1186 WeakPolarHBondContact O-CD 3.43Å; E1184-R1252 IonicContact OE1-CZ 2.73Å; E1184-R1252 IonicContact OE1-NH1 3.22Å; E1184-R1252 PolarHBondContact OE1-NH1 3.16Å; E1184-R1252 IonicContact OE1-NH2 2.86Å; E1184-R1252 PolarHBondContact OE1-NH2 3Å
1185F24.6Very low25.2Very low160.8 Ų160.8137.6 Ų137.671%0.70573%0.734SS**  trans-87.1152.3136.9-90.6-73.8000111.2F1183 L1283F1183-F1185 HydrophobicContact CB-CD2 4.12Å; F1183-F1185 HydrophobicContact CB-CE2 3.96Å; F1183-F1185 HydrophobicContact CD1-CD2 4.17Å; F1183-F1185 HydrophobicContact CD1-CE1 4.44Å; F1183-F1185 AromaticContact CD1-CE2 3.65Å; F1183-F1185 HydrophobicContact CD1-CE2 3.65Å; F1183-F1185 AromaticContact CD1-CZ 3.81Å; F1183-F1185 HydrophobicContact CD1-CZ 3.81Å; F1183-F1185 HydrophobicContact CE1-CZ 4.24Å; F1183-F1185 HydrophobicContact CG-CE2 4.11Å; F1183-F1185 PolarHBondContact O-N 2.93Å; F1185-L1283 HydrophobicContact CE1-CD2 3.85Å; F1185-L1283 HydrophobicContact CZ-CD2 4.29Å
1186P27.1Very low25.1Very low104.2 Ų104.2135.7 Ų135.768%0.67774%0.736SS**  -101.1169.7-126.226.1-11.1000110E1184 G1188 A1189E1184-P1186 WeakPolarHBondContact O-CD 3.43Å; P1186-G1188 PolarHBondContact O-N 3.19Å; P1186-A1189 HydrophobicContact CG-CB 4.48Å
1187P29Very low25.1Very low98.6 Ų98.6135.5 Ų135.564%0.6473%0.734SS**  trans-95.3150.3-165.635.9-30.5000111.7D1155 V1156D1155-P1187 HydrophobicContact CB-CB 3.95Å; V1156-P1187 HydrophobicContact CB-CB 3.68Å; V1156-P1187 HydrophobicContact CB-CG 3.54Å; V1156-P1187 HydrophobicContact CG1-CB 3.67Å; V1156-P1187 HydrophobicContact CG1-CG 3.29Å; V1156-P1187 HydrophobicContact CG2-CB 4.33Å; V1156-P1187 HydrophobicContact CG2-CG 3.8Å
1188G26.9Very low25.1Very low66 Ų66137.8 Ų137.868%0.6874%0.739SS**  trans156.288.2164.800000118.4P1186 Y1190P1186-G1188 PolarHBondContact O-N 3.19Å; G1188-Y1190 PolarHBondContact O-N 3.45Å
1189A25.7Very low25.3Very low91.8 Ų91.8135.6 Ų135.676%0.75974%0.735SS**  trans50.3104.5150.900000118.1P1186P1186-A1189 HydrophobicContact CG-CB 4.48Å
1190Y25.8Very low25.3Very low210.2 Ų210.2136.2 Ų136.282%0.82474%0.739SS**  trans-83.7154.2136.3-80.8-71.8000112.1G1188G1188-Y1190 PolarHBondContact O-N 3.45Å
1191P28.5Very low25.7Very low113.2 Ų113.2131.8 Ų131.874%0.73574%0.735SS**  trans-104-160.2-17031.1-16.6000112.6S1193P1191-S1193 PolarHBondContact O-N 3.16Å
1192P29.2Very low25.8Very low113 Ų113130.8 Ų130.873%0.73474%0.737SS**  -108.4152.3-12336.5-26.9000114.7A1194P1192-A1194 PolarHBondContact O-N 2.9Å
1193S24.9Very low26Very low112.8 Ų112.8131.2 Ų131.279%0.78974%0.738SS**  trans-45.6130.6154.216.80000115.2P1191 Y1195P1191-S1193 PolarHBondContact O-N 3.16Å; S1193-Y1195 PolarHBondContact O-N 3.17Å
1194A23.4Very low25.9Very low75.2 Ų75.2128.8 Ų128.862%0.62173%0.734SS**  trans-163.9141.2-167.200000110.1P1192P1192-A1194 PolarHBondContact O-N 2.9Å
1195Y26.1Very low25.9Very low217 Ų217126.6 Ų126.685%0.85173%0.734SS**  trans87.2123.3154-57.8-64.9000115.1S1193S1193-Y1195 PolarHBondContact O-N 3.17Å
1196L23.5Very low25.9Very low148.2 Ų148.2128.5 Ų128.578%0.77674%0.738SS**  -137.3138.2116.4-92.7162.8000114.1N1198L1196-N1198 PolarHBondContact O-N 3.48Å
1197L24Very low25.7Very low138.2 Ų138.2131.3 Ų131.372%0.72474%0.744SS**  trans69.6128.2143.6-107.188.7000120.4
1198N24.3Very low25.5Very low139 Ų139133.9 Ų133.974%0.74375%0.752SS**  trans93.2126140.7-90.97.7000119L1196L1196-N1198 PolarHBondContact O-N 3.48Å
1199S25.8Very low25.3Very low98 Ų98133.6 Ų133.669%0.68575%0.748SS**  -178.7127.396.9-16.70000116.2
1200T25.9Very low25.2Very low134.2 Ų134.2135.9 Ų135.982%0.82375%0.747SS**  trans-80.7172.2145.153.20000115.4
1201P31.2Very low25Very low108.6 Ų108.6133.2 Ų133.271%0.70574%0.742SS**  trans-114.4168.6-131.138.7-25.9000114.5
1202L25.5Very low24.8Very low161.4 Ų161.4137.9 Ų137.985%0.84575%0.747SS**  trans-167.8119.8154.5-81.5163.1000114.4
1203I25.6Very low24.5Very low139.8 Ų139.8137.9 Ų137.972%0.71775%0.75SS**  trans54.8124.1142.3-65.6173.4000118.4
1204D23.9Very low24.4Very low136.2 Ų136.2137.6 Ų137.673%0.72875%0.748SS**  32.5142.8129.6-71.5-26.7000121
1205S22.7Very low24.4Very low93 Ų93144.8 Ų144.865%0.6576%0.759SS**  trans159128.3137.4-103.30000114.8
1206Y25.1Very low24.3Very low200.4 Ų200.4141.3 Ų141.379%0.78676%0.755SS**  124.7122.9116.2-72.2-69.9000115.9L1208Y1206-L1208 PolarHBondContact O-N 3.27Å
1207M22.5Very low24.4Very low162.6 Ų162.6142.6 Ų142.680%0.80176%0.757SS**  trans-92142.6138.2-78.6-85.5173.300111.7F1142 T1144F1142-M1207 CarbonylContact O-C 3.55Å; F1142-M1207 VanDerWaalsContact O-CA 3.26Å; F1142-M1207 WeakPolarHBondContact O-CA 3.34Å; F1142-M1207 PolarHBondContact O-N 3.31Å; T1144-M1207 HydrophobicContact CG2-CB 3.85Å; T1144-M1207 HydrophobicContact CG2-CE 3.59Å; T1144-M1207 HydrophobicContact CG2-CG 3.4Å; T1144-M1207 HydrophobicContact CG2-SD 3.34Å; T1144-M1207 WeakPolarHBondContact CG2-SD 3.29Å
1208L25.1Very low24.3Very low153.8 Ų153.8140.1 Ų140.181%0.80575%0.751SS**  trans162.9127.1158.1-84.2153.1000110.5L1141 F1142 G1143 T1144 Y1206L1141-L1208 CarbonylContact C-O 3.6Å; F1142-L1208 CarbonylContact C-O 3.18Å; F1142-L1208 PolarHBondContact N-O 2.99Å; F1142-L1208 PolarHBondContact O-N 2.95Å; G1143-L1208 VanDerWaalsContact N-C 3.27Å; G1143-L1208 PolarHBondContact N-O 3Å; G1143-L1208 CarbonylContact O-C 3.55Å; T1144-L1208 PolarHBondContact OG1-N 3.23Å; Y1206-L1208 PolarHBondContact O-N 3.27Å
1209G23.3Very low24.3Very low58.2 Ų58.2143.8 Ų143.860%0.676%0.755SS**  149.3148.271.200000112.9G1143 Q1211G1143-G1209 CarbonylContact O-C 3.5Å; G1143-G1209 PolarHBondContact O-N 3.18Å; G1209-Q1211 PolarHBondContact O-N 2.44Å
1210D22.7Very low24.2Very low140.4 Ų140.4143.4 Ų143.475%0.75175%0.752SS**  trans74.6108.8146.8-78.4-21000119.6
1211Q22Very low24Very low153.4 Ų153.4145.2 Ų145.272%0.71775%0.751SS**  trans70.8130133.9-66.1-175.329.600115.8G1209G1209-Q1211 PolarHBondContact O-N 2.44Å
1212Y23.3Very low23.7Very low212 Ų212149.4 Ų149.483%0.83175%0.754SS**  trans100.684.5164.1-70.5-76.6000115.4R1896 E1934Y1212-R1896 PolarHBondContact OH-NH2 3.41Å; Y1212-E1934 PolarHBondContact OH-OE2 2.67Å
1213S22.8Very low23.6Very low113.8 Ų113.8146 Ų14680%0.79674%0.744SS**  trans-109.2115.7163.2-1200000112.2
1214S24.2Very low23.6Very low106.8 Ų106.8145.8 Ų145.875%0.74774%0.742SS**  trans151.6108.2138.579.60000113.3N1216S1214-N1216 VanDerWaalsContact C-N 3.27Å; S1214-N1216 PolarHBondContact O-N 2.66Å; S1214-N1216 VanDerWaalsContact O-N 3.07Å
1215R23.1Very low23.6Very low225.2 Ų225.2143.8 Ų143.885%0.8574%0.738SS**  trans165.489.4138-150.4-179.4176.2163.5-0.4113.7Q1217R1215-Q1217 PolarHBondContact O-N 3.06Å; R1215-Q1217 VanDerWaalsContact O-N 3.08Å
1216N23.7Very low23.7Very low144.6 Ų144.6149.6 Ų149.677%0.77375%0.746SS**  trans-171.281.3148-86.5-13000113.3S1214S1214-N1216 VanDerWaalsContact C-N 3.27Å; S1214-N1216 PolarHBondContact O-N 2.66Å; S1214-N1216 VanDerWaalsContact O-N 3.07Å
1217Q24.7Very low23.7Very low174.6 Ų174.6145.9 Ų145.982%0.81674%0.737SS**  trans-106.4116.4151.7-78.4175.12.200110.7R1215 W1219R1215-Q1217 PolarHBondContact O-N 3.06Å; R1215-Q1217 VanDerWaalsContact O-N 3.08Å; Q1217-W1219 PolarHBondContact O-N 2.96Å; Q1217-W1219 VanDerWaalsContact O-N 3.17Å
1218S23.2Very low23.9Very low86.2 Ų86.2142.5 Ų142.560%0.60373%0.73SS**  trans-141.570.6158.652.80000113.6S1220S1218-S1220 PolarHBondContact O-N 3.26Å; S1218-S1220 VanDerWaalsContact O-N 3.16Å
1219W23.3Very low24Very low215.8 Ų215.8141.3 Ų141.382%0.81772%0.72SS**  trans-76.560.4171.5-7566.8000115.1Q1217 E1221 Y1222 H1366 V1370Q1217-W1219 PolarHBondContact O-N 2.96Å; Q1217-W1219 VanDerWaalsContact O-N 3.17Å; W1219-E1221 PolarHBondContact O-N 2.8Å; W1219-Y1222 HydrophobicContact CE3-CE2 4.02Å; W1219-Y1222 VanDerWaalsContact CH2-OH 3.25Å; W1219-Y1222 WeakPolarHBondContact CH2-OH 3.39Å; W1219-Y1222 AromaticContact CZ3-CE2 3.92Å; W1219-Y1222 HydrophobicContact CZ3-CE2 3.92Å; W1219-Y1222 VanDerWaalsContact CZ3-OH 3.28Å; W1219-Y1222 WeakPolarHBondContact CZ3-OH 3.32Å; W1219-H1366 PolarHBondContact O-NE2 3.2Å; W1219-V1370 HydrophobicContact CB-CG2 4.18Å; W1219-V1370 HydrophobicContact CD2-CG1 3.9Å; W1219-V1370 HydrophobicContact CG-CG1 4Å; W1219-V1370 HydrophobicContact CG-CG2 4.14Å; W1219-V1370 HydrophobicContact CZ2-CG1 4.25Å
1220S23.6Very low24.2Very low90.8 Ų90.8143.2 Ų143.264%0.63572%0.717SS**SBendtrans-114.657.2167.850.30000112.8S1218 Y1222S1218-S1220 PolarHBondContact O-N 3.26Å; S1218-S1220 VanDerWaalsContact O-N 3.16Å; S1220-Y1222 PolarHBondContact O-N 3.16Å
1221E23Very low24.7Very low172.2 Ų172.2141.5 Ų141.581%0.80572%0.716SS**SBendtrans-91.231.6173.1-77.6-177.914400114.2W1219 S1223W1219-E1221 PolarHBondContact O-N 2.8Å; E1221-S1223 VanDerWaalsContact C-N 3.35Å; E1221-S1223 PolarHBondContact O-N 3.17Å; E1221-S1223 VanDerWaalsContact O-N 3.08Å
1222Y24.6Very low25.3Very low196.6 Ų196.6137.6 Ų137.677%0.77171%0.705SS**  trans-88.245.6174.3-94.7-89.4000112.8W1219 S1220 M1224W1219-Y1222 HydrophobicContact CE3-CE2 4.02Å; W1219-Y1222 VanDerWaalsContact CH2-OH 3.25Å; W1219-Y1222 WeakPolarHBondContact CH2-OH 3.39Å; W1219-Y1222 AromaticContact CZ3-CE2 3.92Å; W1219-Y1222 HydrophobicContact CZ3-CE2 3.92Å; W1219-Y1222 VanDerWaalsContact CZ3-OH 3.28Å; W1219-Y1222 WeakPolarHBondContact CZ3-OH 3.32Å; S1220-Y1222 PolarHBondContact O-N 3.16Å; Y1222-M1224 PolarHBondContact O-N 3.32Å
1223S23.6Very low26Very low89.8 Ų89.8130.6 Ų130.663%0.62869%0.685SS**  trans-11834.5175.121.90000113.3E1221 S1225E1221-S1223 VanDerWaalsContact C-N 3.35Å; E1221-S1223 PolarHBondContact O-N 3.17Å; E1221-S1223 VanDerWaalsContact O-N 3.08Å; S1223-S1225 PolarHBondContact O-N 2.97Å; S1223-S1225 PolarHBondContact OG-OG 2.72Å
1224M24.2Very low27.3Very low135.6 Ų135.6127 Ų12767%0.66866%0.662SS**SBendtrans-107.11.8173-137.1-178.8-20.500113.1Y1222Y1222-M1224 PolarHBondContact O-N 3.32Å
1225S25.7Very low28.9Very low93.8 Ų93.8128.5 Ų128.566%0.65666%0.657SS**SBendtrans-103.18.4-174.59.60000113.6S1223 M1227S1223-S1225 PolarHBondContact O-N 2.97Å; S1223-S1225 PolarHBondContact OG-OG 2.72Å; S1225-M1227 PolarHBondContact O-N 3.29Å
1226R24.2Very low30.9Very low214.2 Ų214.2119.1 Ų119.181%0.80862%0.622SS**  trans-102.563.6170.7-69.8-170.7-170.8-169.83.3112.5S1228R1226-S1228 VanDerWaalsContact C-N 3.26Å; R1226-S1228 PolarHBondContact O-N 3.09Å
1227M24.1Very low33Very low123.2 Ų123.2116.2 Ų116.261%0.60761%0.609SS**  trans-92.560.5155.6-65.2-168.17800109.5L984 S987 S1225 E1229L984-M1227 HydrophobicContact CD2-CE 4.04Å; L984-M1227 HydrophobicContact CD2-SD 4.46Å; L984-M1227 HydrophobicContact CG-CE 4.49Å; S987-M1227 PolarHBondContact OG-SD 3.38Å; S987-M1227 VanDerWaalsContact OG-SD 3.4Å; S1225-M1227 PolarHBondContact O-N 3.29Å; M1227-E1229 HydrophobicContact CB-CG 4.22Å; M1227-E1229 PolarHBondContact O-N 3.3Å
1228S26.8Very low35.2Very low92 Ų92110.7 Ų110.764%0.64358%0.583SS**  trans-79.9104.1167.6167.80000108.5R1226 N1230R1226-S1228 VanDerWaalsContact C-N 3.26Å; R1226-S1228 PolarHBondContact O-N 3.09Å; S1228-N1230 VanDerWaalsContact C-N 3.26Å; S1228-N1230 WeakPolarHBondContact O-CA 3.4Å; S1228-N1230 PolarHBondContact O-N 3.36Å; S1228-N1230 PolarHBondContact O-OD1 3.3Å
1229E27Very low37.8Very low128.6 Ų128.6109.3 Ų109.360%0.60157%0.572SS**  trans-14.269.3173.5-67169.1179.600114.2M1227 S1231 P1410 N1451M1227-E1229 HydrophobicContact CB-CG 4.22Å; M1227-E1229 PolarHBondContact O-N 3.3Å; E1229-S1231 VanDerWaalsContact C-N 3.3Å; E1229-S1231 PolarHBondContact O-N 2.97Å; E1229-S1231 PolarHBondContact O-OG 3.14Å; E1229-P1410 HydrophobicContact CB-CG 4.07Å; E1229-P1410 HydrophobicContact CG-CG 3.78Å; E1229-P1410 WeakPolarHBondContact OE2-CD 3.24Å; E1229-P1410 WeakPolarHBondContact OE2-CG 3.38Å; E1229-N1451 PolarHBondContact OE2-ND2 3.48Å; E1229-N1451 VanDerWaalsContact OE2-ND2 3.17Å
1230N28.3Very low40.6Very low98 Ų98101 Ų10152%0.52455%0.546SS..  trans-92.794.9163.6-85.3-29.2000108.4S1228 S1232 T1233 A1234S1228-N1230 VanDerWaalsContact C-N 3.26Å; S1228-N1230 WeakPolarHBondContact O-CA 3.4Å; S1228-N1230 PolarHBondContact O-N 3.36Å; S1228-N1230 PolarHBondContact O-OD1 3.3Å; N1230-S1232 PolarHBondContact O-N 3.27Å; N1230-T1233 HydrophobicContact CB-CG2 4.41Å; N1230-T1233 WeakPolarHBondContact CB-OG1 3.37Å; N1230-T1233 PolarHBondContact O-N 3.29Å; N1230-T1233 VanDerWaalsContact O-N 3.12Å; N1230-T1233 PolarHBondContact O-OG1 2.94Å; N1230-A1234 WeakPolarHBondContact O-CB 3.45Å; N1230-A1234 PolarHBondContact O-N 3.21Å
1231S33.4Very low43.3Very low105.2 Ų105.299.3 Ų99.374%0.73653%0.532SS*.THydrogen-bonded Turntrans-59.6-3.5-172.312.30000115E1229 R1453E1229-S1231 VanDerWaalsContact C-N 3.3Å; E1229-S1231 PolarHBondContact O-N 2.97Å; E1229-S1231 PolarHBondContact O-OG 3.14Å; S1231-R1453 PolarHBondContact O-NH1 3.06Å; S1231-R1453 PolarHBondContact O-NH2 2.89Å
1232S35Very low46.3Very low70.4 Ų70.491.9 Ų91.949%0.49250%0.499SS..THydrogen-bonded Turntrans-98.4-2417454.10000114.6N1230 A1234 R1453N1230-S1232 PolarHBondContact O-N 3.27Å; S1232-A1234 VanDerWaalsContact C-N 3.32Å; S1232-R1453 PolarHBondContact OG-NH2 3.43Å
1233T38.5Very low49.1Very low65 Ų6582.7 Ų82.740%0.39946%0.463SS..THydrogen-bonded Turntrans-90.9-15.3-178.857.90000113.6S983 N1230 Q1235 W1236S983-T1233 PolarHBondContact OG-O 2.91Å; N1230-T1233 HydrophobicContact CB-CG2 4.41Å; N1230-T1233 WeakPolarHBondContact CB-OG1 3.37Å; N1230-T1233 PolarHBondContact O-N 3.29Å; N1230-T1233 VanDerWaalsContact O-N 3.12Å; N1230-T1233 PolarHBondContact O-OG1 2.94Å; T1233-Q1235 VanDerWaalsContact C-N 3.33Å; T1233-Q1235 PolarHBondContact O-N 2.96Å; T1233-Q1235 VanDerWaalsContact O-N 3.16Å; T1233-W1236 PolarHBondContact O-N 3.46Å
1234A48.9Very low52.1Low38.6 Ų38.679.1 Ų79.132%0.31944%0.437SS..THydrogen-bonded Turntrans-84.9-1.7177.100000114P981 N1230 S1232 W1236 T1237 Y1274P981-A1234 WeakPolarHBondContact CG-O 3.45Å; N1230-A1234 WeakPolarHBondContact O-CB 3.45Å; N1230-A1234 PolarHBondContact O-N 3.21Å; S1232-A1234 VanDerWaalsContact C-N 3.32Å; A1234-W1236 PolarHBondContact O-N 3.39Å; A1234-T1237 WeakPolarHBondContact O-CB 3.37Å; A1234-T1237 WeakPolarHBondContact O-CG2 3.4Å; A1234-T1237 PolarHBondContact O-N 3.37Å; A1234-T1237 PolarHBondContact O-OG1 2.83Å; A1234-Y1274 WeakPolarHBondContact CB-OH 3.45Å; A1234-Y1274 PolarHBondContact O-OH 2.98Å
1235Q57Low55Low138.4 Ų138.473.1 Ų73.165%0.64741%0.409SS*.  trans-75.3124.1-178.2-143.1172.1-6.300112.1T1233 T1237T1233-Q1235 VanDerWaalsContact C-N 3.33Å; T1233-Q1235 PolarHBondContact O-N 2.96Å; T1233-Q1235 VanDerWaalsContact O-N 3.16Å; Q1235-T1237 PolarHBondContact O-N 3.37Å; Q1235-T1237 VanDerWaalsContact O-N 3.13Å
1236W66.6Low58Low28.4 Ų28.469.4 Ų69.411%0.10838%0.382CS..  trans-69.5126.6170.6-66.280.9000110.6A979 L980 P981 T1233 A1234 E1238 I1243 F1247 I1271 Y1274 M1275 D1278A979-W1236 VanDerWaalsContact O-CE3 3.26Å; L980-W1236 HydrophobicContact CD2-CH2 4.06Å; L980-W1236 HydrophobicContact CD2-CZ3 3.82Å; P981-W1236 HydrophobicContact CG-CD2 4.2Å; P981-W1236 HydrophobicContact CG-CG 4.16Å; T1233-W1236 PolarHBondContact O-N 3.46Å; A1234-W1236 PolarHBondContact O-N 3.39Å; W1236-E1238 VanDerWaalsContact C-N 3.34Å; W1236-I1243 HydrophobicContact CB-CD1 3.82Å; W1236-I1243 HydrophobicContact CD2-CD1 3.68Å; W1236-I1243 HydrophobicContact CE3-CD1 3.68Å; W1236-I1243 VanDerWaalsContact CE3-CD1 3.44Å; W1236-I1243 HydrophobicContact CE3-CG1 4.17Å; W1236-I1243 HydrophobicContact CE3-CG2 4.39Å; W1236-I1243 HydrophobicContact CG-CD1 3.78Å; W1236-I1243 HydrophobicContact CZ3-CD1 4.38Å; W1236-I1243 HydrophobicContact CZ3-CG2 4.27Å; W1236-I1243 WeakPolarHBondContact O-CD1 3.49Å; W1236-F1247 HydrophobicContact CH2-CE2 4.48Å; W1236-F1247 HydrophobicContact CZ3-CE2 4.34Å; W1236-I1271 HydrophobicContact CZ2-CD1 4.3Å; W1236-Y1274 AromaticContact CZ2-CD1 3.85Å; W1236-Y1274 HydrophobicContact CZ2-CD1 3.89Å; W1236-Y1274 AromaticContact CZ2-CE1 4Å; W1236-Y1274 HydrophobicContact CZ2-CE1 4.1Å; W1236-Y1274 AromaticContact NE1-CE1 3.97Å; W1236-M1275 HydrophobicContact CH2-CB 4.07Å; W1236-M1275 HydrophobicContact CH2-CG 3.5Å; W1236-M1275 HydrophobicContact CH2-SD 3.85Å; W1236-M1275 HydrophobicContact CZ2-CB 4.27Å; W1236-M1275 HydrophobicContact CZ2-CG 3.46Å; W1236-M1275 HydrophobicContact CZ2-SD 4.35Å; W1236-M1275 HydrophobicContact CZ3-CG 4.47Å; W1236-D1278 PolarHBondContact NE1-OD2 3.15Å; W1236-D1278 VanDerWaalsContact NE1-OD2 3.07Å
1237T68.2Low61.1Low82.6 Ų82.659.3 Ų59.351%0.50734%0.344SS..SBendtrans-81.4-19.3-177.955.10000111.8Q978 A979 A1234 Q1235Q978-T1237 PolarHBondContact O-OG1 3.16Å; A979-T1237 VanDerWaalsContact C-OG1 3.25Å; A979-T1237 WeakPolarHBondContact CA-OG1 3.29Å; A979-T1237 PolarHBondContact O-N 3.05Å; A979-T1237 PolarHBondContact O-OG1 2.96Å; A979-T1237 VanDerWaalsContact O-OG1 3.13Å; A1234-T1237 WeakPolarHBondContact O-CB 3.37Å; A1234-T1237 WeakPolarHBondContact O-CG2 3.4Å; A1234-T1237 PolarHBondContact O-N 3.37Å; A1234-T1237 PolarHBondContact O-OG1 2.83Å; Q1235-T1237 PolarHBondContact O-N 3.37Å; Q1235-T1237 VanDerWaalsContact O-N 3.13Å
1238E70.5Confident64.2Low58.6 Ų58.654.4 Ų54.427%0.27432%0.321SS..SBendtrans-100151.2172.7-64.1-89.8177.100112.2K943 A979 W1236 V1242 I1243K943-E1238 VanDerWaalsContact NZ-CD 3.26Å; K943-E1238 IonicContact NZ-OE1 3.26Å; K943-E1238 PolarHBondContact NZ-OE1 3.19Å; K943-E1238 IonicContact NZ-OE2 3.26Å; K943-E1238 PolarHBondContact NZ-OE2 3.01Å; K943-E1238 VanDerWaalsContact NZ-OE2 3.08Å; A979-E1238 HydrophobicContact CB-CB 4.2Å; A979-E1238 HydrophobicContact CB-CG 4.04Å; W1236-E1238 VanDerWaalsContact C-N 3.34Å; E1238-V1242 HydrophobicContact CB-CB 4.48Å; E1238-V1242 HydrophobicContact CB-CG1 4.37Å; E1238-I1243 HydrophobicContact CB-CG1 4.36Å; E1238-I1243 VanDerWaalsContact O-CD1 3.25Å; E1238-I1243 WeakPolarHBondContact O-CD1 3.38Å
1239P78.4Confident67.1Low56.8 Ų56.850.2 Ų50.237%0.36929%0.291SS..  trans-72146.8-17830.6-35.2000111.8T940 P1241 V1242 I1243T940-P1239 HydrophobicContact CG2-CG 3.66Å; P1239-P1241 VanDerWaalsContact C-CD 3.45Å; P1239-P1241 VanDerWaalsContact C-N 3.32Å; P1239-P1241 HydrophobicContact CB-CG 4.43Å; P1239-P1241 VanDerWaalsContact O-N 3.16Å; P1239-V1242 HydrophobicContact CG-CB 4.33Å; P1239-V1242 HydrophobicContact CG-CG2 3.82Å; P1239-V1242 WeakPolarHBondContact O-CB 3.29Å; P1239-V1242 PolarHBondContact O-N 3.15Å; P1239-V1242 VanDerWaalsContact O-N 3.11Å; P1239-I1243 PolarHBondContact O-N 3.23Å
1240T81Confident70.1Confident42.6 Ų42.644.4 Ų44.426%0.26126%0.264SS..Hα-helixtrans-44.9-45.6-178.2-55.80000115.5V1242 I1243 V1244 C1281 K1284T1240-V1242 VanDerWaalsContact C-N 3.31Å; T1240-V1242 PolarHBondContact O-N 2.92Å; T1240-I1243 WeakPolarHBondContact O-CB 3.4Å; T1240-I1243 PolarHBondContact O-N 3.2Å; T1240-V1244 HydrophobicContact CG2-CG2 4.24Å; T1240-V1244 WeakPolarHBondContact O-CB 3.44Å; T1240-V1244 VanDerWaalsContact O-CG2 3.29Å; T1240-V1244 WeakPolarHBondContact O-CG2 3.38Å; T1240-V1244 PolarHBondContact O-N 3.02Å; T1240-C1281 HydrophobicContact CG2-CB 4.44Å; T1240-K1284 HydrophobicContact CG2-CD 4.31Å; T1240-K1284 HydrophobicContact CG2-CG 3.86Å; T1240-K1284 VanDerWaalsContact OG1-CE 3.29Å; T1240-K1284 WeakPolarHBondContact OG1-CE 3.39Å
1241P81.6Confident72.9Confident55.4 Ų55.439.7 Ų39.736%0.3624%0.239SC..Hα-helixtrans-61.6-37.5179.74.3-8000113.8E944 P1239 I1243 V1244 A1245E944-P1241 HydrophobicContact CG-CB 4.2Å; E944-P1241 VanDerWaalsContact OE2-CB 3.24Å; E944-P1241 WeakPolarHBondContact OE2-CB 3.28Å; P1239-P1241 VanDerWaalsContact C-CD 3.45Å; P1239-P1241 VanDerWaalsContact C-N 3.32Å; P1239-P1241 HydrophobicContact CB-CG 4.43Å; P1239-P1241 VanDerWaalsContact O-N 3.16Å; P1241-I1243 VanDerWaalsContact C-N 3.33Å; P1241-I1243 PolarHBondContact O-N 3.19Å; P1241-V1244 PolarHBondContact O-N 3.13Å; P1241-A1245 WeakPolarHBondContact O-CB 3.36Å; P1241-A1245 PolarHBondContact O-N 3.31Å
1242V84Confident75.6Confident16.4 Ų16.438.4 Ų38.410%0.09922%0.218CC..Hα-helixtrans-65.8-41.8176.8176.80000110.4T940 K943 E944 E1238 P1239 T1240 V1244 A1245 L1246T940-V1242 VanDerWaalsContact O-CG2 3.28Å; T940-V1242 WeakPolarHBondContact O-CG2 3.4Å; K943-V1242 HydrophobicContact CB-CG1 4.12Å; K943-V1242 HydrophobicContact CB-CG2 4.25Å; K943-V1242 HydrophobicContact CD-CG1 4.47Å; E944-V1242 HydrophobicContact CB-CG2 4.03Å; E1238-V1242 HydrophobicContact CB-CB 4.48Å; E1238-V1242 HydrophobicContact CB-CG1 4.37Å; P1239-V1242 HydrophobicContact CG-CB 4.33Å; P1239-V1242 HydrophobicContact CG-CG2 3.82Å; P1239-V1242 WeakPolarHBondContact O-CB 3.29Å; P1239-V1242 PolarHBondContact O-N 3.15Å; P1239-V1242 VanDerWaalsContact O-N 3.11Å; T1240-V1242 VanDerWaalsContact C-N 3.31Å; T1240-V1242 PolarHBondContact O-N 2.92Å; V1242-V1244 VanDerWaalsContact C-N 3.34Å; V1242-A1245 PolarHBondContact O-N 3.27Å; V1242-L1246 HydrophobicContact CG1-CD1 4.02Å; V1242-L1246 HydrophobicContact CG1-CG 4.39Å; V1242-L1246 VanDerWaalsContact O-CB 3.32Å; V1242-L1246 WeakPolarHBondContact O-CB 3.36Å; V1242-L1246 VanDerWaalsContact O-CG 3.3Å; V1242-L1246 WeakPolarHBondContact O-CG 3.3Å; V1242-L1246 PolarHBondContact O-N 3.27Å
1243I85.2Confident78.1Confident2.4 Ų2.435.2 Ų35.21%0.01220%0.195CC..Hα-helixtrans-61.5-49.3176-63.3165.9000110A979 W1236 E1238 P1239 T1240 P1241 A1245 L1246 F1247 M1275A979-I1243 HydrophobicContact CB-CG1 4.48Å; W1236-I1243 HydrophobicContact CB-CD1 3.82Å; W1236-I1243 HydrophobicContact CD2-CD1 3.68Å; W1236-I1243 HydrophobicContact CE3-CD1 3.68Å; W1236-I1243 VanDerWaalsContact CE3-CD1 3.44Å; W1236-I1243 HydrophobicContact CE3-CG1 4.17Å; W1236-I1243 HydrophobicContact CE3-CG2 4.39Å; W1236-I1243 HydrophobicContact CG-CD1 3.78Å; W1236-I1243 HydrophobicContact CZ3-CD1 4.38Å; W1236-I1243 HydrophobicContact CZ3-CG2 4.27Å; W1236-I1243 WeakPolarHBondContact O-CD1 3.49Å; E1238-I1243 HydrophobicContact CB-CG1 4.36Å; E1238-I1243 VanDerWaalsContact O-CD1 3.25Å; E1238-I1243 WeakPolarHBondContact O-CD1 3.38Å; P1239-I1243 PolarHBondContact O-N 3.23Å; T1240-I1243 WeakPolarHBondContact O-CB 3.4Å; T1240-I1243 PolarHBondContact O-N 3.2Å; P1241-I1243 VanDerWaalsContact C-N 3.33Å; P1241-I1243 PolarHBondContact O-N 3.19Å; I1243-A1245 VanDerWaalsContact C-N 3.3Å; I1243-A1245 PolarHBondContact O-N 3.04Å; I1243-L1246 PolarHBondContact O-N 3.17Å; I1243-F1247 HydrophobicContact CG2-CD2 3.7Å; I1243-F1247 HydrophobicContact CG2-CE2 3.9Å; I1243-F1247 VanDerWaalsContact O-CD2 3.28Å; I1243-F1247 WeakPolarHBondContact O-CD2 3.34Å; I1243-F1247 PolarHBondContact O-N 3.25Å; I1243-M1275 HydrophobicContact CG2-CE 3.74Å; I1243-M1275 HydrophobicContact CG2-SD 4.16Å
1244V84.8Confident80.5Confident15.6 Ų15.632.1 Ų32.110%0.09518%0.176CC..Hα-helixtrans-58.1-44.4177.6170.50000110.7L417 F1168 T1240 P1241 V1242 L1246 F1247 T1248 L1283 I1287L417-V1244 HydrophobicContact CD2-CG1 3.23Å; F1168-V1244 HydrophobicContact CE1-CG1 4.09Å; F1168-V1244 HydrophobicContact CE2-CG1 3.77Å; F1168-V1244 HydrophobicContact CZ-CB 4.48Å; F1168-V1244 HydrophobicContact CZ-CG1 3.23Å; T1240-V1244 HydrophobicContact CG2-CG2 4.24Å; T1240-V1244 WeakPolarHBondContact O-CB 3.44Å; T1240-V1244 VanDerWaalsContact O-CG2 3.29Å; T1240-V1244 WeakPolarHBondContact O-CG2 3.38Å; T1240-V1244 PolarHBondContact O-N 3.02Å; P1241-V1244 PolarHBondContact O-N 3.13Å; V1242-V1244 VanDerWaalsContact C-N 3.34Å; V1244-L1246 PolarHBondContact O-N 3.32Å; V1244-F1247 PolarHBondContact O-N 3.22Å; V1244-T1248 HydrophobicContact CG1-CG2 4.15Å; V1244-T1248 VanDerWaalsContact O-CB 3.3Å; V1244-T1248 WeakPolarHBondContact O-CB 3.48Å; V1244-T1248 WeakPolarHBondContact O-CG2 3.27Å; V1244-T1248 PolarHBondContact O-N 3.38Å; V1244-T1248 PolarHBondContact O-OG1 3.05Å; V1244-L1283 HydrophobicContact CG2-CB 4.33Å; V1244-I1287 HydrophobicContact CB-CD1 3.72Å; V1244-I1287 HydrophobicContact CG1-CB 4.32Å; V1244-I1287 HydrophobicContact CG1-CD1 3.76Å; V1244-I1287 HydrophobicContact CG1-CG1 4.25Å; V1244-I1287 HydrophobicContact CG1-CG2 4.35Å; V1244-I1287 HydrophobicContact CG2-CD1 3.52Å; V1244-I1287 HydrophobicContact CG2-CG2 4.2Å
1245A85.5Confident82.3Confident8.8 Ų8.832.2 Ų32.27%0.07318%0.178CC..Hα-helixtrans-62.7-44.8176.300000112.7E944 A947 L948 P1241 V1242 I1243 F1247 T1248 T1249E944-A1245 HydrophobicContact CG-CB 4.31Å; A947-A1245 HydrophobicContact CB-CB 3.74Å; L948-A1245 HydrophobicContact CD2-CB 3.89Å; L948-A1245 HydrophobicContact CG-CB 3.81Å; P1241-A1245 WeakPolarHBondContact O-CB 3.36Å; P1241-A1245 PolarHBondContact O-N 3.31Å; V1242-A1245 PolarHBondContact O-N 3.27Å; I1243-A1245 VanDerWaalsContact C-N 3.3Å; I1243-A1245 PolarHBondContact O-N 3.04Å; A1245-F1247 PolarHBondContact O-N 2.74Å; A1245-T1248 VanDerWaalsContact CA-OG1 3.27Å; A1245-T1248 WeakPolarHBondContact CA-OG1 3.42Å; A1245-T1248 CarbonylContact O-C 3.39Å; A1245-T1248 WeakPolarHBondContact O-CB 3.39Å; A1245-T1248 PolarHBondContact O-N 3.06Å; A1245-T1248 PolarHBondContact O-OG1 2.92Å; A1245-T1249 WeakPolarHBondContact O-CB 3.43Å; A1245-T1249 VanDerWaalsContact O-CG2 3.25Å; A1245-T1249 WeakPolarHBondContact O-CG2 3.3Å; A1245-T1249 PolarHBondContact O-N 3.14Å; A1245-T1249 PolarHBondContact O-OG1 3.1Å
1246L89.2Confident83.6Confident16 Ų1626.8 Ų26.88%0.08415%0.154CC..Hα-helixtrans-63.1-44.3177.9-89.4165.7000112.3L934 A947 L972 R975 I976 V1242 I1243 V1244 T1248 T1249 L1250L934-L1246 HydrophobicContact CD1-CD2 4.16Å; L934-L1246 HydrophobicContact CD2-CD2 4.3Å; A947-L1246 HydrophobicContact CB-CD2 4.43Å; L972-L1246 HydrophobicContact CD2-CD2 4.09Å; R975-L1246 HydrophobicContact CB-CD2 4.38Å; I976-L1246 HydrophobicContact CG1-CB 4.45Å; V1242-L1246 HydrophobicContact CG1-CD1 4.02Å; V1242-L1246 HydrophobicContact CG1-CG 4.39Å; V1242-L1246 VanDerWaalsContact O-CB 3.32Å; V1242-L1246 WeakPolarHBondContact O-CB 3.36Å; V1242-L1246 VanDerWaalsContact O-CG 3.3Å; V1242-L1246 WeakPolarHBondContact O-CG 3.3Å; V1242-L1246 PolarHBondContact O-N 3.27Å; I1243-L1246 PolarHBondContact O-N 3.17Å; V1244-L1246 PolarHBondContact O-N 3.32Å; L1246-T1248 VanDerWaalsContact C-N 3.32Å; L1246-T1248 PolarHBondContact O-N 3.16Å; L1246-T1249 WeakPolarHBondContact CA-OG1 3.24Å; L1246-T1249 PolarHBondContact O-N 2.88Å; L1246-T1249 PolarHBondContact O-OG1 2.98Å; L1246-L1250 WeakPolarHBondContact O-CB 3.38Å; L1246-L1250 PolarHBondContact O-N 3.05Å; L1246-L1250 VanDerWaalsContact O-N 3.14Å
1247F89.3Confident84.4Confident2.8 Ų2.825.8 Ų25.81%0.01215%0.152CC..Hα-helixtrans-70.7-32.7176.4-80.2-77.6000111.9I976 W1236 I1243 V1244 A1245 T1249 L1250 G1251 I1271 L1272 M1275 I1287 T1291I976-F1247 HydrophobicContact CG2-CE1 4.46Å; I976-F1247 HydrophobicContact CG2-CE2 4.39Å; I976-F1247 HydrophobicContact CG2-CZ 3.82Å; W1236-F1247 HydrophobicContact CH2-CE2 4.48Å; W1236-F1247 HydrophobicContact CZ3-CE2 4.34Å; I1243-F1247 HydrophobicContact CG2-CD2 3.7Å; I1243-F1247 HydrophobicContact CG2-CE2 3.9Å; I1243-F1247 VanDerWaalsContact O-CD2 3.28Å; I1243-F1247 WeakPolarHBondContact O-CD2 3.34Å; I1243-F1247 PolarHBondContact O-N 3.25Å; V1244-F1247 PolarHBondContact O-N 3.22Å; A1245-F1247 PolarHBondContact O-N 2.74Å; F1247-T1249 VanDerWaalsContact C-N 3.33Å; F1247-T1249 PolarHBondContact O-N 3.2Å; F1247-L1250 HydrophobicContact CD1-CD2 4.09Å; F1247-L1250 HydrophobicContact CE1-CD2 4.17Å; F1247-L1250 WeakPolarHBondContact O-CB 3.29Å; F1247-L1250 PolarHBondContact O-N 3.2Å; F1247-L1250 VanDerWaalsContact O-N 3.15Å; F1247-G1251 PolarHBondContact O-N 3.03Å; F1247-I1271 HydrophobicContact CE1-CG2 4.12Å; F1247-I1271 HydrophobicContact CE2-CG2 4.39Å; F1247-I1271 HydrophobicContact CZ-CG2 3.6Å; F1247-L1272 HydrophobicContact CD1-CD2 3.63Å; F1247-L1272 HydrophobicContact CE1-CD2 3.63Å; F1247-L1272 HydrophobicContact CE1-CG 4.37Å; F1247-L1272 HydrophobicContact CG-CD2 4.44Å; F1247-L1272 HydrophobicContact CZ-CD2 4.5Å; F1247-M1275 HydrophobicContact CB-CE 4.19Å; F1247-M1275 HydrophobicContact CD1-SD 4.2Å; F1247-M1275 HydrophobicContact CD2-CE 3.67Å; F1247-M1275 HydrophobicContact CD2-SD 3.62Å; F1247-M1275 VanDerWaalsContact CD2-SD 3.51Å; F1247-M1275 HydrophobicContact CE1-SD 4.02Å; F1247-M1275 HydrophobicContact CE2-CE 4.03Å; F1247-M1275 HydrophobicContact CE2-SD 3.37Å; F1247-M1275 VanDerWaalsContact CE2-SD 3.57Å; F1247-M1275 WeakPolarHBondContact CE2-SD 3.33Å; F1247-M1275 HydrophobicContact CG-CE 4.1Å; F1247-M1275 HydrophobicContact CG-SD 4.12Å; F1247-M1275 HydrophobicContact CZ-CE 4.46Å; F1247-M1275 HydrophobicContact CZ-SD 3.66Å; F1247-M1275 VanDerWaalsContact CZ-SD 3.51Å; F1247-M1275 WeakPolarHBondContact CZ-SD 3.37Å; F1247-I1287 HydrophobicContact CB-CG1 4Å; F1247-I1287 HydrophobicContact CB-CG2 4.06Å; F1247-I1287 VanDerWaalsContact CB-CG2 3.49Å; F1247-T1291 VanDerWaalsContact C-CG2 3.5Å; F1247-T1291 HydrophobicContact CB-CG2 3.95Å; F1247-T1291 HydrophobicContact CD1-CG2 4.37Å; F1247-T1291 WeakPolarHBondContact O-CG2 3.39Å; F1247-T1291 PolarHBondContact O-OG1 2.68Å
1248T88.2Confident85.2Confident19.4 Ų19.423.7 Ų23.712%0.11914%0.14CC..Hα-helixtrans-62.8-42.5171.1-16.30000111.8V416 A951 F1168 V1244 A1245 L1246 L1250 G1251 R1252 I1287V416-T1248 HydrophobicContact CG1-CG2 4.38Å; V416-T1248 VanDerWaalsContact O-CG2 3.26Å; V416-T1248 WeakPolarHBondContact O-CG2 3Å; A951-T1248 HydrophobicContact CB-CG2 4.26Å; F1168-T1248 HydrophobicContact CE1-CG2 3.51Å; F1168-T1248 HydrophobicContact CZ-CG2 4.06Å; V1244-T1248 HydrophobicContact CG1-CG2 4.15Å; V1244-T1248 VanDerWaalsContact O-CB 3.3Å; V1244-T1248 WeakPolarHBondContact O-CB 3.48Å; V1244-T1248 WeakPolarHBondContact O-CG2 3.27Å; V1244-T1248 PolarHBondContact O-N 3.38Å; V1244-T1248 PolarHBondContact O-OG1 3.05Å; A1245-T1248 VanDerWaalsContact CA-OG1 3.27Å; A1245-T1248 WeakPolarHBondContact CA-OG1 3.42Å; A1245-T1248 CarbonylContact O-C 3.39Å; A1245-T1248 WeakPolarHBondContact O-CB 3.39Å; A1245-T1248 PolarHBondContact O-N 3.06Å; A1245-T1248 PolarHBondContact O-OG1 2.92Å; L1246-T1248 VanDerWaalsContact C-N 3.32Å; L1246-T1248 PolarHBondContact O-N 3.16Å; T1248-L1250 VanDerWaalsContact C-N 3.34Å; T1248-L1250 PolarHBondContact O-N 3.3Å; T1248-G1251 PolarHBondContact O-N 3.12Å; T1248-R1252 WeakPolarHBondContact O-CB 3.07Å; T1248-R1252 VanDerWaalsContact O-CG 3.31Å; T1248-R1252 WeakPolarHBondContact O-CG 3.33Å; T1248-R1252 PolarHBondContact O-N 3.2Å; T1248-R1252 VanDerWaalsContact O-N 3.09Å; T1248-I1287 HydrophobicContact CG2-CD1 3.7Å; T1248-I1287 HydrophobicContact CG2-CG1 3.97Å; T1248-I1287 HydrophobicContact CG2-CG2 3.9Å; T1248-I1287 VanDerWaalsContact OG1-CD1 3.3Å; T1248-I1287 WeakPolarHBondContact OG1-CD1 3.36Å
1249T88.4Confident85.8Confident4.6 Ų4.631.3 Ų31.33%0.02817%0.166CC..Hα-helixtrans-61.3-44.5173.558.90000111.6A947 L950 A951 A1245 L1246 F1247 G1251 R1252 L1253A947-T1249 HydrophobicContact CB-CG2 4.07Å; A947-T1249 WeakPolarHBondContact O-CG2 3.3Å; L950-T1249 HydrophobicContact CB-CG2 4.32Å; L950-T1249 HydrophobicContact CD2-CG2 4.36Å; L950-T1249 HydrophobicContact CG-CG2 4.4Å; A951-T1249 HydrophobicContact CB-CG2 3.74Å; A1245-T1249 WeakPolarHBondContact O-CB 3.43Å; A1245-T1249 VanDerWaalsContact O-CG2 3.25Å; A1245-T1249 WeakPolarHBondContact O-CG2 3.3Å; A1245-T1249 PolarHBondContact O-N 3.14Å; A1245-T1249 PolarHBondContact O-OG1 3.1Å; L1246-T1249 WeakPolarHBondContact CA-OG1 3.24Å; L1246-T1249 PolarHBondContact O-N 2.88Å; L1246-T1249 PolarHBondContact O-OG1 2.98Å; F1247-T1249 VanDerWaalsContact C-N 3.33Å; F1247-T1249 PolarHBondContact O-N 3.2Å; T1249-G1251 PolarHBondContact O-N 3.2Å; T1249-R1252 PolarHBondContact O-N 3.2Å; T1249-R1252 VanDerWaalsContact O-N 3.15Å; T1249-L1253 VanDerWaalsContact O-CB 3.25Å; T1249-L1253 WeakPolarHBondContact O-CB 3.38Å; T1249-L1253 VanDerWaalsContact O-CG 3.28Å; T1249-L1253 WeakPolarHBondContact O-CG 3.37Å; T1249-L1253 PolarHBondContact O-N 3.31Å
1250L90.6Very high86Confident6 Ų630.1 Ų30.13%0.03116%0.159CC..Hα-helixtrans-60.9-46.1178.5-178.764.6000112I976 L1246 F1247 T1248 R1252 L1253 A1254 I1261 F1268 T1291 L1295I976-L1250 HydrophobicContact CD1-CD2 4.16Å; L1246-L1250 WeakPolarHBondContact O-CB 3.38Å; L1246-L1250 PolarHBondContact O-N 3.05Å; L1246-L1250 VanDerWaalsContact O-N 3.14Å; F1247-L1250 HydrophobicContact CD1-CD2 4.09Å; F1247-L1250 HydrophobicContact CE1-CD2 4.17Å; F1247-L1250 WeakPolarHBondContact O-CB 3.29Å; F1247-L1250 PolarHBondContact O-N 3.2Å; F1247-L1250 VanDerWaalsContact O-N 3.15Å; T1248-L1250 VanDerWaalsContact C-N 3.34Å; T1248-L1250 PolarHBondContact O-N 3.3Å; L1250-R1252 VanDerWaalsContact C-N 3.29Å; L1250-R1252 PolarHBondContact O-N 3.34Å; L1250-L1253 WeakPolarHBondContact O-CB 3.41Å; L1250-L1253 PolarHBondContact O-N 3.22Å; L1250-A1254 PolarHBondContact O-N 3.22Å; L1250-I1261 HydrophobicContact CD1-CD1 4.27Å; L1250-F1268 HydrophobicContact CD1-CD2 4.5Å; L1250-F1268 HydrophobicContact CD1-CE1 4.22Å; L1250-F1268 HydrophobicContact CD1-CE2 3.99Å; L1250-F1268 HydrophobicContact CD1-CZ 3.75Å; L1250-F1268 HydrophobicContact CD2-CD1 3.78Å; L1250-F1268 HydrophobicContact CD2-CD2 4.32Å; L1250-F1268 HydrophobicContact CD2-CE1 3.75Å; L1250-F1268 HydrophobicContact CD2-CE2 4.3Å; L1250-F1268 HydrophobicContact CD2-CG 4.17Å; L1250-F1268 HydrophobicContact CD2-CZ 4.09Å; L1250-T1291 HydrophobicContact CB-CG2 4.39Å; L1250-T1291 HydrophobicContact CD2-CG2 4.14Å; L1250-T1291 HydrophobicContact CG-CG2 4.23Å; L1250-L1295 HydrophobicContact CD1-CD2 4.44Å; L1250-L1295 HydrophobicContact CD2-CD1 4.26Å; L1250-L1295 HydrophobicContact CG-CD1 4.47Å; L1250-L1295 HydrophobicContact CG-CD2 4.33Å
1251G87.7Confident86.3Confident0 Ų028.2 Ų28.20%015%0.147CC..Hα-helixtrans-65.4-34.3177.400000113.2F1247 T1248 T1249 A1254 R1294F1247-G1251 PolarHBondContact O-N 3.03Å; T1248-G1251 PolarHBondContact O-N 3.12Å; T1249-G1251 PolarHBondContact O-N 3.2Å; G1251-A1254 WeakPolarHBondContact O-CB 3.44Å; G1251-A1254 PolarHBondContact O-N 3.19Å; G1251-R1294 WeakPolarHBondContact O-CG 3.41Å
1252R88.2Confident86.5Confident77.4 Ų77.430.6 Ų30.629%0.29215%0.149SC..Hα-helixtrans-70.7-40.6171.9-68-81.6-177.5169.1-2.5111.7E415 V416 D421 A951 I954 L1171 F1173 E1184 T1248 T1249 L1250 A1254 A1255 W1290E415-R1252 PolarHBondContact O-NH2 2.94Å; E415-R1252 VanDerWaalsContact O-NH2 3.16Å; V416-R1252 PolarHBondContact O-NH2 3.35Å; D421-R1252 IonicContact OD2-CZ 2.74Å; D421-R1252 IonicContact OD2-NH1 3.54Å; D421-R1252 PolarHBondContact OD2-NH1 2.95Å; D421-R1252 IonicContact OD2-NH2 3.4Å; A951-R1252 HydrophobicContact CB-CG 4.4Å; I954-R1252 HydrophobicContact CB-CB 4.28Å; I954-R1252 VanDerWaalsContact CG2-C 3.49Å; I954-R1252 HydrophobicContact CG2-CB 3.79Å; I954-R1252 WeakPolarHBondContact CG2-O 3.37Å; L1171-R1252 PolarHBondContact O-NH2 3.3Å; F1173-R1252 PolarHBondContact O-NH1 3.28Å; F1173-R1252 PolarHBondContact O-NH2 3.34Å; E1184-R1252 IonicContact OE1-CZ 2.73Å; E1184-R1252 IonicContact OE1-NH1 3.22Å; E1184-R1252 PolarHBondContact OE1-NH1 3.16Å; E1184-R1252 IonicContact OE1-NH2 2.86Å; E1184-R1252 PolarHBondContact OE1-NH2 3Å; T1248-R1252 WeakPolarHBondContact O-CB 3.07Å; T1248-R1252 VanDerWaalsContact O-CG 3.31Å; T1248-R1252 WeakPolarHBondContact O-CG 3.33Å; T1248-R1252 PolarHBondContact O-N 3.2Å; T1248-R1252 VanDerWaalsContact O-N 3.09Å; T1249-R1252 PolarHBondContact O-N 3.2Å; T1249-R1252 VanDerWaalsContact O-N 3.15Å; L1250-R1252 VanDerWaalsContact C-N 3.29Å; L1250-R1252 PolarHBondContact O-N 3.34Å; R1252-A1254 VanDerWaalsContact C-N 3.26Å; R1252-A1254 PolarHBondContact O-N 3.27Å; R1252-A1255 WeakPolarHBondContact O-CB 3.18Å; R1252-A1255 PolarHBondContact O-N 3.03Å; R1252-A1255 VanDerWaalsContact O-N 3.09Å; R1252-W1290 HydrophobicContact CG-CH2 4.32Å
1253L89.3Confident86.6Confident2.4 Ų2.436.8 Ų36.81%0.01318%0.177CC..Hα-helixtrans-63.4-31.8178.8-155.276.7000112.3I954 L968 I969 L972 T1249 L1250 A1255 V1256 A1257 I1261I954-L1253 HydrophobicContact CD1-CB 4.33Å; I954-L1253 HydrophobicContact CD1-CD1 4.15Å; I954-L1253 HydrophobicContact CG1-CD1 4.41Å; I954-L1253 HydrophobicContact CG2-CB 4.5Å; I954-L1253 HydrophobicContact CG2-CD1 4.45Å; L968-L1253 HydrophobicContact CB-CD2 4.5Å; L968-L1253 HydrophobicContact CD1-CD1 4.47Å; I969-L1253 HydrophobicContact CD1-CD2 4.25Å; I969-L1253 HydrophobicContact CG1-CD2 3.67Å; L972-L1253 HydrophobicContact CD1-CD2 3.93Å; T1249-L1253 VanDerWaalsContact O-CB 3.25Å; T1249-L1253 WeakPolarHBondContact O-CB 3.38Å; T1249-L1253 VanDerWaalsContact O-CG 3.28Å; T1249-L1253 WeakPolarHBondContact O-CG 3.37Å; T1249-L1253 PolarHBondContact O-N 3.31Å; L1250-L1253 WeakPolarHBondContact O-CB 3.41Å; L1250-L1253 PolarHBondContact O-N 3.22Å; L1253-A1255 PolarHBondContact O-N 3.29Å; L1253-A1255 VanDerWaalsContact O-N 3.13Å; L1253-V1256 PolarHBondContact O-N 3.13Å; L1253-A1257 PolarHBondContact O-N 3.11Å; L1253-I1261 HydrophobicContact CB-CD1 4.29Å; L1253-I1261 HydrophobicContact CG-CD1 4.19Å
1254A88.1Confident86.6Confident0 Ų039.5 Ų39.50%019%0.188CC..THydrogen-bonded Turntrans-53.4-33.8172.800000113.6L1250 G1251 R1252 V1256 I1261 L1295 H1298L1250-A1254 PolarHBondContact O-N 3.22Å; G1251-A1254 WeakPolarHBondContact O-CB 3.44Å; G1251-A1254 PolarHBondContact O-N 3.19Å; R1252-A1254 VanDerWaalsContact C-N 3.26Å; R1252-A1254 PolarHBondContact O-N 3.27Å; A1254-V1256 VanDerWaalsContact C-N 3.33Å; A1254-V1256 PolarHBondContact O-N 3.12Å; A1254-I1261 VanDerWaalsContact CA-CD1 3.46Å; A1254-I1261 HydrophobicContact CB-CD1 4.12Å; A1254-L1295 HydrophobicContact CB-CD2 3.73Å; A1254-L1295 HydrophobicContact CB-CG 4.34Å; A1254-H1298 HydrophobicContact CB-CB 4.15Å; A1254-H1298 VanDerWaalsContact O-CB 3.26Å; A1254-H1298 WeakPolarHBondContact O-CB 3.41Å
1255A85.6Confident86.6Confident42 Ų4238.9 Ų38.935%0.34718%0.184SC..THydrogen-bonded Turntrans-74.3-22.6178.500000113.8R1252 L1253 R1294 H1298R1252-A1255 WeakPolarHBondContact O-CB 3.18Å; R1252-A1255 PolarHBondContact O-N 3.03Å; R1252-A1255 VanDerWaalsContact O-N 3.09Å; L1253-A1255 PolarHBondContact O-N 3.29Å; L1253-A1255 VanDerWaalsContact O-N 3.13Å; A1255-R1294 VanDerWaalsContact CB-NH2 3.32Å; A1255-H1298 VanDerWaalsContact CA-CD2 3.46Å; A1255-H1298 WeakPolarHBondContact CA-CD2 3.27Å; A1255-H1298 WeakPolarHBondContact CA-NE2 3.41Å; A1255-H1298 VanDerWaalsContact CB-NE2 3.25Å; A1255-H1298 WeakPolarHBondContact CB-NE2 3.39Å
1256V85.2Confident86.4Confident24.8 Ų24.840.6 Ų40.615%0.1519%0.192CC..THydrogen-bonded Turntrans-99.5-37.7-175.4-173.70000111.7I954 P958 L961 I962 L1253 A1254 P1258I954-V1256 HydrophobicContact CG2-CB 4.45Å; I954-V1256 HydrophobicContact CG2-CG2 3.76Å; P958-V1256 HydrophobicContact CB-CG1 4.27Å; P958-V1256 HydrophobicContact CB-CG2 3.9Å; P958-V1256 WeakPolarHBondContact O-CG1 3.24Å; L961-V1256 HydrophobicContact CB-CG1 4.37Å; I962-V1256 HydrophobicContact CG1-CG1 3.84Å; L1253-V1256 PolarHBondContact O-N 3.13Å; A1254-V1256 VanDerWaalsContact C-N 3.33Å; A1254-V1256 PolarHBondContact O-N 3.12Å; V1256-P1258 VanDerWaalsContact C-CD 3.46Å
1257A83.5Confident86.2Confident6.8 Ų6.842.9 Ų42.96%0.05620%0.202CC..  trans-133.463.3-171.700000113.6S965 L1253 R1259 S1260 I1261S965-A1257 WeakPolarHBondContact OG-CB 3.27Å; L1253-A1257 PolarHBondContact O-N 3.11Å; A1257-R1259 VanDerWaalsContact C-N 3.31Å; A1257-R1259 PolarHBondContact O-N 2.96Å; A1257-S1260 PolarHBondContact O-N 3.1Å; A1257-I1261 HydrophobicContact CB-CD1 4.48Å; A1257-I1261 WeakPolarHBondContact O-CD1 3.46Å; A1257-I1261 WeakPolarHBondContact O-CG1 3.28Å; A1257-I1261 PolarHBondContact O-N 3.22Å
1258P84.3Confident86Confident39.4 Ų39.443.1 Ų43.126%0.25620%0.203SC..Hα-helixtrans-64-34.5-176.424.9-34.1000113.4V1256 I1261 Y1262 H1298 T1299V1256-P1258 VanDerWaalsContact C-CD 3.46Å; P1258-I1261 PolarHBondContact O-N 3.13Å; P1258-Y1262 PolarHBondContact O-N 3.06Å; P1258-Y1262 VanDerWaalsContact O-N 3.09Å; P1258-H1298 HydrophobicContact CB-CB 4.26Å; P1258-H1298 VanDerWaalsContact CB-O 3.25Å; P1258-H1298 WeakPolarHBondContact CB-O 3.36Å; P1258-T1299 HydrophobicContact CB-CG2 4.16Å; P1258-T1299 VanDerWaalsContact O-CG2 3.3Å; P1258-T1299 WeakPolarHBondContact O-CG2 3.1Å
1259R84.1Confident86Confident218.4 Ų218.442.3 Ų42.382%0.82420%0.198SC*.Hα-helixtrans-64.2-47.7-178.4-66.1-177.1-179.1169.40.3112.5A1257 I1261 Y1262 H1263A1257-R1259 VanDerWaalsContact C-N 3.31Å; A1257-R1259 PolarHBondContact O-N 2.96Å; R1259-I1261 VanDerWaalsContact C-N 3.3Å; R1259-I1261 PolarHBondContact O-N 3.28Å; R1259-Y1262 WeakPolarHBondContact O-CB 3.37Å; R1259-Y1262 PolarHBondContact O-N 3.25Å; R1259-H1263 PolarHBondContact O-CD2 3.06Å
1260S82.8Confident85.8Confident31.6 Ų31.643.3 Ų43.322%0.22120%0.204CC..Hα-helixtrans-65.3-36.4179.7-53.50000111.9S965 E966 I969 A1257 Y1262 Y1264S965-S1260 PolarHBondContact OG-OG 3.4Å; E966-S1260 WeakPolarHBondContact OE2-CA 3.49Å; E966-S1260 WeakPolarHBondContact OE2-CB 3.45Å; E966-S1260 PolarHBondContact OE2-OG 2.91Å; I969-S1260 VanDerWaalsContact CD1-CB 3.46Å; A1257-S1260 PolarHBondContact O-N 3.1Å; S1260-Y1262 VanDerWaalsContact C-N 3.35Å; S1260-Y1262 PolarHBondContact O-N 2.98Å; S1260-Y1264 VanDerWaalsContact O-CD2 3.26Å; S1260-Y1264 WeakPolarHBondContact O-CD2 3.34Å; S1260-Y1264 WeakPolarHBondContact O-CE2 3.43Å
1261I86Confident85.6Confident2.2 Ų2.243.4 Ų43.41%0.01121%0.205CC..Hα-helixtrans-74.1-30.1-179.1-66.7174.9000112.3I969 L1250 L1253 A1254 A1257 P1258 R1259 H1263 Y1264 M1265 F1268 L1295 T1299I969-I1261 HydrophobicContact CD1-CD1 4.45Å; I969-I1261 HydrophobicContact CD1-CG1 3.61Å; I969-I1261 HydrophobicContact CG1-CG1 4.33Å; L1250-I1261 HydrophobicContact CD1-CD1 4.27Å; L1253-I1261 HydrophobicContact CB-CD1 4.29Å; L1253-I1261 HydrophobicContact CG-CD1 4.19Å; A1254-I1261 VanDerWaalsContact CA-CD1 3.46Å; A1254-I1261 HydrophobicContact CB-CD1 4.12Å; A1257-I1261 HydrophobicContact CB-CD1 4.48Å; A1257-I1261 WeakPolarHBondContact O-CD1 3.46Å; A1257-I1261 WeakPolarHBondContact O-CG1 3.28Å; A1257-I1261 PolarHBondContact O-N 3.22Å; P1258-I1261 PolarHBondContact O-N 3.13Å; R1259-I1261 VanDerWaalsContact C-N 3.3Å; R1259-I1261 PolarHBondContact O-N 3.28Å; I1261-H1263 VanDerWaalsContact C-N 3.26Å; I1261-H1263 PolarHBondContact O-N 3.14Å; I1261-H1263 VanDerWaalsContact O-N 3.11Å; I1261-Y1264 PolarHBondContact O-N 3.25Å; I1261-M1265 HydrophobicContact CG2-CE 3.61Å; I1261-M1265 HydrophobicContact CG2-CG 4.45Å; I1261-M1265 HydrophobicContact CG2-SD 4.14Å; I1261-M1265 PolarHBondContact O-N 3.31Å; I1261-F1268 HydrophobicContact CG2-CD2 4.41Å; I1261-F1268 HydrophobicContact CG2-CE2 4.22Å; I1261-L1295 HydrophobicContact CD1-CD2 4.22Å; I1261-L1295 HydrophobicContact CG2-CD2 3.56Å; I1261-L1295 VanDerWaalsContact CG2-CD2 3.48Å; I1261-T1299 HydrophobicContact CB-CG2 4.44Å; I1261-T1299 HydrophobicContact CG2-CG2 4.28Å
1262Y86.3Confident85.6Confident105 Ų10543.4 Ų43.441%0.41221%0.205SC..Hα-helixtrans-49.8-42.4-178.9-176.2-87.9000112.8P1258 R1259 S1260 Y1264 M1265 Y1301P1258-Y1262 PolarHBondContact O-N 3.06Å; P1258-Y1262 VanDerWaalsContact O-N 3.09Å; R1259-Y1262 WeakPolarHBondContact O-CB 3.37Å; R1259-Y1262 PolarHBondContact O-N 3.25Å; S1260-Y1262 VanDerWaalsContact C-N 3.35Å; S1260-Y1262 PolarHBondContact O-N 2.98Å; Y1262-Y1264 VanDerWaalsContact C-N 3.28Å; Y1262-Y1264 PolarHBondContact O-N 3.18Å; Y1262-M1265 WeakPolarHBondContact O-CB 3.41Å; Y1262-M1265 WeakPolarHBondContact O-CG 3.46Å; Y1262-M1265 PolarHBondContact O-N 3.29Å; Y1262-Y1301 HydrophobicContact CD2-CD2 4.19Å; Y1262-Y1301 HydrophobicContact CE1-CD2 4.47Å; Y1262-Y1301 HydrophobicContact CE1-CE2 4.43Å; Y1262-Y1301 AromaticContact CE2-CD2 3.61Å; Y1262-Y1301 HydrophobicContact CE2-CD2 3.61Å; Y1262-Y1301 VanDerWaalsContact CE2-CD2 3.48Å; Y1262-Y1301 HydrophobicContact CE2-CE2 4.16Å; Y1262-Y1301 HydrophobicContact CE2-CG 4.38Å; Y1262-Y1301 AromaticContact CZ-CD2 3.64Å; Y1262-Y1301 AromaticContact CZ-CE2 3.87Å
1263H85.8Confident85.6Confident148.2 Ų148.240.2 Ų40.269%0.68620%0.195SC*.THydrogen-bonded Turntrans-65.9-24.2-179.7-62.3-68.4000114.2R1259 I1261R1259-H1263 PolarHBondContact O-CD2 3.06Å; I1261-H1263 VanDerWaalsContact C-N 3.26Å; I1261-H1263 PolarHBondContact O-N 3.14Å; I1261-H1263 VanDerWaalsContact O-N 3.11Å
1264Y85.1Confident85.3Confident59 Ų5942.7 Ų42.723%0.23121%0.205CC..THydrogen-bonded Turntrans-99.8-0.3-177.9-59.1-76.4000113.3I969 H970 L973 S1260 I1261 Y1262 D1266 E1267 F1268I969-Y1264 HydrophobicContact CG2-CD2 3.81Å; I969-Y1264 HydrophobicContact CG2-CE2 3.66Å; I969-Y1264 HydrophobicContact CG2-CG 4.37Å; H970-Y1264 PolarHBondContact CE1-OH 3.04Å; H970-Y1264 VanDerWaalsContact CE1-OH 3.31Å; L973-Y1264 HydrophobicContact CD2-CD1 3.58Å; L973-Y1264 HydrophobicContact CD2-CE1 3.63Å; L973-Y1264 HydrophobicContact CD2-CG 4.31Å; S1260-Y1264 VanDerWaalsContact O-CD2 3.26Å; S1260-Y1264 WeakPolarHBondContact O-CD2 3.34Å; S1260-Y1264 WeakPolarHBondContact O-CE2 3.43Å; I1261-Y1264 PolarHBondContact O-N 3.25Å; Y1262-Y1264 VanDerWaalsContact C-N 3.28Å; Y1262-Y1264 PolarHBondContact O-N 3.18Å; Y1264-D1266 VanDerWaalsContact C-N 3.26Å; Y1264-D1266 PolarHBondContact O-N 3.12Å; Y1264-E1267 WeakPolarHBondContact O-CB 3.29Å; Y1264-E1267 PolarHBondContact O-N 3.17Å; Y1264-F1268 VanDerWaalsContact CB-CE2 3.45Å; Y1264-F1268 HydrophobicContact CG-CE2 4.47Å; Y1264-F1268 VanDerWaalsContact O-CD2 3.27Å; Y1264-F1268 WeakPolarHBondContact O-CD2 3.35Å; Y1264-F1268 PolarHBondContact O-N 3.29Å; Y1264-F1268 VanDerWaalsContact O-N 3.12Å
1265M84.7Confident85.1Confident2 Ų242.8 Ų42.81%0.0121%0.205CC..Hα-helixtrans-58.2-35.2-178.4-74.7-61.6-118.600113.3I1261 Y1262 E1267 F1268 I1269 L1295 V1296 T1299 Y1301I1261-M1265 HydrophobicContact CG2-CE 3.61Å; I1261-M1265 HydrophobicContact CG2-CG 4.45Å; I1261-M1265 HydrophobicContact CG2-SD 4.14Å; I1261-M1265 PolarHBondContact O-N 3.31Å; Y1262-M1265 WeakPolarHBondContact O-CB 3.41Å; Y1262-M1265 WeakPolarHBondContact O-CG 3.46Å; Y1262-M1265 PolarHBondContact O-N 3.29Å; M1265-E1267 VanDerWaalsContact C-N 3.26Å; M1265-E1267 PolarHBondContact O-N 3.08Å; M1265-F1268 PolarHBondContact O-N 2.93Å; M1265-F1268 HydrophobicContact SD-CD2 4.41Å; M1265-I1269 HydrophobicContact CB-CD1 4.47Å; M1265-I1269 HydrophobicContact CE-CD1 4.38Å; M1265-I1269 HydrophobicContact CE-CG1 4.33Å; M1265-I1269 WeakPolarHBondContact O-CD1 3.47Å; M1265-I1269 VanDerWaalsContact O-CG1 3.28Å; M1265-I1269 WeakPolarHBondContact O-CG1 3.3Å; M1265-I1269 PolarHBondContact O-N 3.3Å; M1265-L1295 HydrophobicContact CE-CB 3.77Å; M1265-L1295 HydrophobicContact CE-CD2 3.8Å; M1265-L1295 HydrophobicContact CE-CG 4.25Å; M1265-L1295 WeakPolarHBondContact CE-O 3.39Å; M1265-L1295 HydrophobicContact SD-CB 4.09Å; M1265-L1295 HydrophobicContact SD-CD2 4.31Å; M1265-L1295 HydrophobicContact SD-CG 4.48Å; M1265-V1296 HydrophobicContact CE-CG2 4.29Å; M1265-T1299 HydrophobicContact CE-CG2 3.47Å; M1265-T1299 WeakPolarHBondContact CE-OG1 3.36Å; M1265-T1299 HydrophobicContact CG-CG2 4.48Å; M1265-T1299 HydrophobicContact SD-CG2 4.29Å; M1265-Y1301 HydrophobicContact CB-CD1 4.2Å; M1265-Y1301 HydrophobicContact CB-CE1 4.14Å; M1265-Y1301 HydrophobicContact CB-CG 4.32Å; M1265-Y1301 HydrophobicContact CE-CD1 3.98Å; M1265-Y1301 HydrophobicContact CE-CG 4.35Å; M1265-Y1301 HydrophobicContact CG-CD1 4.34Å; M1265-Y1301 HydrophobicContact CG-CG 4.39Å
1266D82.5Confident85.1Confident45.6 Ų45.640.8 Ų40.824%0.24419%0.188CC..Hα-helixtrans-63.5-26.9177.1-87.5-4.1000113.3R995 Y1264 P1270 Y1301 R1308 Y1309R995-D1266 IonicContact CZ-OD1 2.71Å; R995-D1266 IonicContact CZ-OD2 3.11Å; R995-D1266 VanDerWaalsContact NH1-CG 3.33Å; R995-D1266 PolarHBondContact NH1-O 3.24Å; R995-D1266 IonicContact NH1-OD1 2.78Å; R995-D1266 PolarHBondContact NH1-OD1 3.22Å; R995-D1266 IonicContact NH1-OD2 3.52Å; R995-D1266 PolarHBondContact NH1-OD2 3.07Å; Y1264-D1266 VanDerWaalsContact C-N 3.26Å; Y1264-D1266 PolarHBondContact O-N 3.12Å; D1266-P1270 WeakPolarHBondContact O-CD 3.45Å; D1266-P1270 WeakPolarHBondContact O-CG 3.45Å; D1266-Y1301 PolarHBondContact OD1-OH 2.98Å; D1266-R1308 WeakPolarHBondContact OD1-CD 3.35Å; D1266-R1308 IonicContact OD1-CZ 2.93Å; D1266-R1308 IonicContact OD1-NE 3.05Å; D1266-R1308 IonicContact OD1-NH1 2.95Å; D1266-R1308 PolarHBondContact OD1-NH1 3.17Å; D1266-R1308 IonicContact OD2-CZ 3.49Å; D1266-R1308 IonicContact OD2-NE 3.07Å; D1266-R1308 PolarHBondContact OD2-NE 3.31Å; D1266-R1308 IonicContact OD2-NH1 3.17Å; D1266-R1308 PolarHBondContact OD2-NH1 3.18Å; D1266-R1308 IonicContact OD2-NH2 3.04Å; D1266-R1308 PolarHBondContact OD2-NH2 3.43Å; D1266-Y1309 PolarHBondContact O-OH 3.24Å
1267E83.6Confident85.1Confident63.4 Ų63.443.8 Ų43.830%0.29620%0.201SC..Hα-helixtrans-86.5-36.6174.9-78.1-176.2-164.800112R977 Y1264 M1265 P1270 I1271R977-E1267 IonicContact CZ-OE1 3.08Å; R977-E1267 VanDerWaalsContact CZ-OE1 3.24Å; R977-E1267 IonicContact CZ-OE2 2.74Å; R977-E1267 VanDerWaalsContact CZ-OE2 3.26Å; R977-E1267 IonicContact NE-OE1 2.69Å; R977-E1267 PolarHBondContact NE-OE1 3.42Å; R977-E1267 IonicContact NE-OE2 3.4Å; R977-E1267 PolarHBondContact NE-OE2 3.26Å; R977-E1267 IonicContact NH2-OE1 3.66Å; R977-E1267 PolarHBondContact NH2-OE1 3.08Å; R977-E1267 IonicContact NH2-OE2 2.96Å; R977-E1267 PolarHBondContact NH2-OE2 3.13Å; Y1264-E1267 WeakPolarHBondContact O-CB 3.29Å; Y1264-E1267 PolarHBondContact O-N 3.17Å; M1265-E1267 VanDerWaalsContact C-N 3.26Å; M1265-E1267 PolarHBondContact O-N 3.08Å; E1267-P1270 VanDerWaalsContact O-CD 3.23Å; E1267-P1270 WeakPolarHBondContact O-CD 3.3Å; E1267-P1270 VanDerWaalsContact O-CG 3.23Å; E1267-P1270 WeakPolarHBondContact O-CG 3.45Å; E1267-I1271 HydrophobicContact CG-CD1 4.35Å; E1267-I1271 VanDerWaalsContact O-CD1 3.25Å; E1267-I1271 WeakPolarHBondContact O-CD1 3.41Å; E1267-I1271 VanDerWaalsContact O-CG1 3.28Å; E1267-I1271 WeakPolarHBondContact O-CG1 3.46Å
1268F87Confident84.9Confident7.8 Ų7.844.7 Ų44.73%0.03421%0.205CC..Hα-helixtrans-72.7-39.8-178-66.1-48.5000113.5L973 I976 L1250 I1261 Y1264 M1265 P1270 I1271 L1272 L1295L973-F1268 HydrophobicContact CD1-CE1 3.75Å; L973-F1268 HydrophobicContact CD1-CZ 3.94Å; I976-F1268 HydrophobicContact CD1-CE1 4.12Å; L1250-F1268 HydrophobicContact CD1-CD2 4.5Å; L1250-F1268 HydrophobicContact CD1-CE1 4.22Å; L1250-F1268 HydrophobicContact CD1-CE2 3.99Å; L1250-F1268 HydrophobicContact CD1-CZ 3.75Å; L1250-F1268 HydrophobicContact CD2-CD1 3.78Å; L1250-F1268 HydrophobicContact CD2-CD2 4.32Å; L1250-F1268 HydrophobicContact CD2-CE1 3.75Å; L1250-F1268 HydrophobicContact CD2-CE2 4.3Å; L1250-F1268 HydrophobicContact CD2-CG 4.17Å; L1250-F1268 HydrophobicContact CD2-CZ 4.09Å; I1261-F1268 HydrophobicContact CG2-CD2 4.41Å; I1261-F1268 HydrophobicContact CG2-CE2 4.22Å; Y1264-F1268 VanDerWaalsContact CB-CE2 3.45Å; Y1264-F1268 HydrophobicContact CG-CE2 4.47Å; Y1264-F1268 VanDerWaalsContact O-CD2 3.27Å; Y1264-F1268 WeakPolarHBondContact O-CD2 3.35Å; Y1264-F1268 PolarHBondContact O-N 3.29Å; Y1264-F1268 VanDerWaalsContact O-N 3.12Å; M1265-F1268 PolarHBondContact O-N 2.93Å; M1265-F1268 HydrophobicContact SD-CD2 4.41Å; F1268-P1270 VanDerWaalsContact C-CD 3.46Å; F1268-I1271 WeakPolarHBondContact O-CB 3.4Å; F1268-I1271 PolarHBondContact O-N 3.24Å; F1268-I1271 VanDerWaalsContact O-N 3.14Å; F1268-L1272 HydrophobicContact CB-CD1 4.4Å; F1268-L1272 WeakPolarHBondContact O-CB 3.38Å; F1268-L1272 VanDerWaalsContact O-CG 3.27Å; F1268-L1272 WeakPolarHBondContact O-CG 3.44Å; F1268-L1272 PolarHBondContact O-N 3.31Å; F1268-L1295 HydrophobicContact CB-CD1 4.45Å
1269I87.5Confident84.7Confident2.4 Ų2.448.6 Ų48.61%0.01223%0.228CC..Hα-helixtrans-57.1-48.2-177.5-67163.5000113.2M1265 I1271 L1272 A1273 L1292 Y1301 P1305 Y1309 L1312M1265-I1269 HydrophobicContact CB-CD1 4.47Å; M1265-I1269 HydrophobicContact CE-CD1 4.38Å; M1265-I1269 HydrophobicContact CE-CG1 4.33Å; M1265-I1269 WeakPolarHBondContact O-CD1 3.47Å; M1265-I1269 VanDerWaalsContact O-CG1 3.28Å; M1265-I1269 WeakPolarHBondContact O-CG1 3.3Å; M1265-I1269 PolarHBondContact O-N 3.3Å; I1269-I1271 VanDerWaalsContact C-N 3.33Å; I1269-I1271 PolarHBondContact O-N 3.12Å; I1269-L1272 PolarHBondContact O-N 3.2Å; I1269-A1273 VanDerWaalsContact O-CB 3.28Å; I1269-A1273 WeakPolarHBondContact O-CB 3.35Å; I1269-A1273 PolarHBondContact O-N 3.22Å; I1269-L1292 HydrophobicContact CG1-CD1 4.38Å; I1269-Y1301 HydrophobicContact CD1-CD1 3.99Å; I1269-Y1301 HydrophobicContact CD1-CE1 3.65Å; I1269-P1305 HydrophobicContact CD1-CB 4.06Å; I1269-P1305 HydrophobicContact CD1-CG 4.01Å; I1269-Y1309 HydrophobicContact CB-CD2 3.89Å; I1269-Y1309 HydrophobicContact CB-CE2 3.89Å; I1269-Y1309 HydrophobicContact CD1-CD2 4.46Å; I1269-Y1309 HydrophobicContact CG2-CD1 4.45Å; I1269-Y1309 HydrophobicContact CG2-CD2 3.37Å; I1269-Y1309 VanDerWaalsContact CG2-CD2 3.43Å; I1269-Y1309 HydrophobicContact CG2-CE2 3.9Å; I1269-Y1309 HydrophobicContact CG2-CG 3.88Å; I1269-L1312 HydrophobicContact CG2-CD2 4.46Å
1270P85Confident84.4Confident25.6 Ų25.642.4 Ų42.417%0.16622%0.218CC..Hα-helixtrans-63.5-37.3177.35-7.3000113L988 D1266 E1267 F1268 L1272 A1273 Y1274 Y1309L988-P1270 HydrophobicContact CD2-CB 3.92Å; L988-P1270 HydrophobicContact CD2-CG 3.65Å; D1266-P1270 WeakPolarHBondContact O-CD 3.45Å; D1266-P1270 WeakPolarHBondContact O-CG 3.45Å; E1267-P1270 VanDerWaalsContact O-CD 3.23Å; E1267-P1270 WeakPolarHBondContact O-CD 3.3Å; E1267-P1270 VanDerWaalsContact O-CG 3.23Å; E1267-P1270 WeakPolarHBondContact O-CG 3.45Å; F1268-P1270 VanDerWaalsContact C-CD 3.46Å; P1270-L1272 VanDerWaalsContact C-N 3.35Å; P1270-A1273 PolarHBondContact O-N 3.01Å; P1270-Y1274 PolarHBondContact O-N 3.13Å; P1270-Y1309 HydrophobicContact CB-CD1 4.43Å; P1270-Y1309 HydrophobicContact CB-CD2 4.49Å; P1270-Y1309 HydrophobicContact CB-CE1 3.66Å; P1270-Y1309 HydrophobicContact CB-CE2 4.27Å; P1270-Y1309 WeakPolarHBondContact CB-OH 3.29Å; P1270-Y1309 WeakPolarHBondContact CD-OH 3.33Å; P1270-Y1309 HydrophobicContact CG-CD2 4.27Å; P1270-Y1309 HydrophobicContact CG-CE1 3.87Å; P1270-Y1309 HydrophobicContact CG-CE2 4.29Å; P1270-Y1309 WeakPolarHBondContact CG-OH 3.38Å
1271I85.4Confident84.2Confident7.2 Ų7.242 Ų424%0.03722%0.215CC..Hα-helixtrans-63.3-47.4177.6-64.7168.8000110.1I976 L980 L984 L988 W1236 F1247 E1267 F1268 I1269 A1273 Y1274 M1275I976-I1271 HydrophobicContact CG2-CD1 4.35Å; L980-I1271 HydrophobicContact CD1-CD1 3.84Å; L980-I1271 HydrophobicContact CD1-CG1 3.99Å; L980-I1271 HydrophobicContact CD2-CB 4.36Å; L980-I1271 HydrophobicContact CD2-CD1 4.23Å; L980-I1271 HydrophobicContact CD2-CG1 3.96Å; L980-I1271 HydrophobicContact CD2-CG2 3.59Å; L980-I1271 VanDerWaalsContact CD2-CG2 3.46Å; L984-I1271 HydrophobicContact CD2-CG1 4.14Å; L988-I1271 HydrophobicContact CD1-CD1 4.03Å; L988-I1271 HydrophobicContact CD1-CG1 3.81Å; L988-I1271 HydrophobicContact CD2-CG1 4.47Å; W1236-I1271 HydrophobicContact CZ2-CD1 4.3Å; F1247-I1271 HydrophobicContact CE1-CG2 4.12Å; F1247-I1271 HydrophobicContact CE2-CG2 4.39Å; F1247-I1271 HydrophobicContact CZ-CG2 3.6Å; E1267-I1271 HydrophobicContact CG-CD1 4.35Å; E1267-I1271 VanDerWaalsContact O-CD1 3.25Å; E1267-I1271 WeakPolarHBondContact O-CD1 3.41Å; E1267-I1271 VanDerWaalsContact O-CG1 3.28Å; E1267-I1271 WeakPolarHBondContact O-CG1 3.46Å; F1268-I1271 WeakPolarHBondContact O-CB 3.4Å; F1268-I1271 PolarHBondContact O-N 3.24Å; F1268-I1271 VanDerWaalsContact O-N 3.14Å; I1269-I1271 VanDerWaalsContact C-N 3.33Å; I1269-I1271 PolarHBondContact O-N 3.12Å; I1271-A1273 VanDerWaalsContact C-N 3.34Å; I1271-A1273 PolarHBondContact O-N 3.28Å; I1271-Y1274 WeakPolarHBondContact O-CB 3.43Å; I1271-Y1274 PolarHBondContact O-N 3.16Å; I1271-M1275 HydrophobicContact CG2-SD 4.41Å; I1271-M1275 WeakPolarHBondContact O-CB 3.22Å; I1271-M1275 WeakPolarHBondContact O-CG 3.38Å; I1271-M1275 PolarHBondContact O-N 3.22Å
1272L88.6Confident84.1Confident0.8 Ų0.846.4 Ų46.40%0.00423%0.234CC..Hα-helixtrans-65.5-40.2177.3-66.2172.9000111.5F1247 F1268 I1269 P1270 Y1274 M1275 M1276 A1288 T1291 L1292 L1295F1247-L1272 HydrophobicContact CD1-CD2 3.63Å; F1247-L1272 HydrophobicContact CE1-CD2 3.63Å; F1247-L1272 HydrophobicContact CE1-CG 4.37Å; F1247-L1272 HydrophobicContact CG-CD2 4.44Å; F1247-L1272 HydrophobicContact CZ-CD2 4.5Å; F1268-L1272 HydrophobicContact CB-CD1 4.4Å; F1268-L1272 WeakPolarHBondContact O-CB 3.38Å; F1268-L1272 VanDerWaalsContact O-CG 3.27Å; F1268-L1272 WeakPolarHBondContact O-CG 3.44Å; F1268-L1272 PolarHBondContact O-N 3.31Å; I1269-L1272 PolarHBondContact O-N 3.2Å; P1270-L1272 VanDerWaalsContact C-N 3.35Å; L1272-Y1274 VanDerWaalsContact C-N 3.3Å; L1272-Y1274 PolarHBondContact O-N 3.08Å; L1272-M1275 HydrophobicContact CD2-SD 4.36Å; L1272-M1275 CarbonylContact O-C 3.58Å; L1272-M1275 PolarHBondContact O-N 3.16Å; L1272-M1275 VanDerWaalsContact O-N 3.14Å; L1272-M1276 WeakPolarHBondContact O-CB 3.26Å; L1272-M1276 VanDerWaalsContact O-CG 3.28Å; L1272-M1276 WeakPolarHBondContact O-CG 3.32Å; L1272-M1276 PolarHBondContact O-N 3.15Å; L1272-A1288 HydrophobicContact CD2-CB 4.22Å; L1272-T1291 HydrophobicContact CD1-CG2 4.48Å; L1272-T1291 HydrophobicContact CD2-CG2 4.23Å; L1272-T1291 WeakPolarHBondContact CD2-OG1 3.36Å; L1272-L1292 HydrophobicContact CD1-CB 4.06Å; L1272-L1292 HydrophobicContact CD1-CD1 4.23Å; L1272-L1295 HydrophobicContact CD1-CD1 3.74Å
1273A86.9Confident83.8Confident9.8 Ų9.843.8 Ų43.88%0.08123%0.227CC..Hα-helixtrans-60.5-37.7175.900000112.7I1269 P1270 I1271 M1276 Q1277 Y1309 I1315I1269-A1273 VanDerWaalsContact O-CB 3.28Å; I1269-A1273 WeakPolarHBondContact O-CB 3.35Å; I1269-A1273 PolarHBondContact O-N 3.22Å; P1270-A1273 PolarHBondContact O-N 3.01Å; I1271-A1273 VanDerWaalsContact C-N 3.34Å; I1271-A1273 PolarHBondContact O-N 3.28Å; A1273-M1276 HydrophobicContact CB-CE 4.31Å; A1273-M1276 PolarHBondContact O-N 2.84Å; A1273-Q1277 WeakPolarHBondContact O-CG 3.35Å; A1273-Q1277 PolarHBondContact O-N 3.21Å; A1273-Q1277 PolarHBondContact O-NE2 3.29Å; A1273-Q1277 VanDerWaalsContact O-NE2 3.08Å; A1273-Y1309 HydrophobicContact CB-CD1 4.12Å; A1273-Y1309 HydrophobicContact CB-CE1 3.41Å; A1273-Y1309 VanDerWaalsContact CB-CE1 3.41Å; A1273-I1315 HydrophobicContact CB-CD1 4.11Å
1274Y83.9Confident83.7Confident55.2 Ų55.237.2 Ų37.222%0.21620%0.196CC..Hα-helixtrans-70.3-44.7172.9-178.4-94.8000112.1P981 L984 A1234 W1236 P1270 I1271 L1272 M1276 Q1277 D1278P981-Y1274 HydrophobicContact CG-CE1 3.9Å; L984-Y1274 HydrophobicContact CD1-CD1 3.41Å; L984-Y1274 VanDerWaalsContact CD1-CD1 3.43Å; L984-Y1274 HydrophobicContact CD1-CD2 3.95Å; L984-Y1274 HydrophobicContact CD1-CE1 3.98Å; L984-Y1274 HydrophobicContact CD1-CE2 4.39Å; L984-Y1274 HydrophobicContact CD1-CG 3.38Å; L984-Y1274 VanDerWaalsContact CD1-CG 3.47Å; L984-Y1274 HydrophobicContact CD2-CD2 4.01Å; L984-Y1274 HydrophobicContact CD2-CE2 4.39Å; L984-Y1274 HydrophobicContact CD2-CG 4.1Å; L984-Y1274 HydrophobicContact CG-CD1 4.23Å; L984-Y1274 HydrophobicContact CG-CD2 4.07Å; L984-Y1274 HydrophobicContact CG-CE1 4.47Å; L984-Y1274 HydrophobicContact CG-CE2 4.32Å; L984-Y1274 HydrophobicContact CG-CG 4.02Å; A1234-Y1274 WeakPolarHBondContact CB-OH 3.45Å; A1234-Y1274 PolarHBondContact O-OH 2.98Å; W1236-Y1274 AromaticContact CZ2-CD1 3.85Å; W1236-Y1274 HydrophobicContact CZ2-CD1 3.89Å; W1236-Y1274 AromaticContact CZ2-CE1 4Å; W1236-Y1274 HydrophobicContact CZ2-CE1 4.1Å; W1236-Y1274 AromaticContact NE1-CE1 3.97Å; P1270-Y1274 PolarHBondContact O-N 3.13Å; I1271-Y1274 WeakPolarHBondContact O-CB 3.43Å; I1271-Y1274 PolarHBondContact O-N 3.16Å; L1272-Y1274 VanDerWaalsContact C-N 3.3Å; L1272-Y1274 PolarHBondContact O-N 3.08Å; Y1274-M1276 PolarHBondContact O-N 3.18Å; Y1274-Q1277 WeakPolarHBondContact O-CB 3.28Å; Y1274-Q1277 PolarHBondContact O-N 3.08Å; Y1274-Q1277 VanDerWaalsContact O-N 3.09Å; Y1274-D1278 PolarHBondContact O-N 3.23Å; Y1274-D1278 VanDerWaalsContact O-N 3.14Å
1275M84.2Confident83.9Confident0.8 Ų0.836.2 Ų36.20%0.00419%0.192CC..Hα-helixtrans-60.8-31175.9-86.6177.381.300113.1W1236 I1243 F1247 I1271 L1272 Q1277 D1278 K1284 R1285 I1287 A1288W1236-M1275 HydrophobicContact CH2-CB 4.07Å; W1236-M1275 HydrophobicContact CH2-CG 3.5Å; W1236-M1275 HydrophobicContact CH2-SD 3.85Å; W1236-M1275 HydrophobicContact CZ2-CB 4.27Å; W1236-M1275 HydrophobicContact CZ2-CG 3.46Å; W1236-M1275 HydrophobicContact CZ2-SD 4.35Å; W1236-M1275 HydrophobicContact CZ3-CG 4.47Å; I1243-M1275 HydrophobicContact CG2-CE 3.74Å; I1243-M1275 HydrophobicContact CG2-SD 4.16Å; F1247-M1275 HydrophobicContact CB-CE 4.19Å; F1247-M1275 HydrophobicContact CD1-SD 4.2Å; F1247-M1275 HydrophobicContact CD2-CE 3.67Å; F1247-M1275 HydrophobicContact CD2-SD 3.62Å; F1247-M1275 VanDerWaalsContact CD2-SD 3.51Å; F1247-M1275 HydrophobicContact CE1-SD 4.02Å; F1247-M1275 HydrophobicContact CE2-CE 4.03Å; F1247-M1275 HydrophobicContact CE2-SD 3.37Å; F1247-M1275 VanDerWaalsContact CE2-SD 3.57Å; F1247-M1275 WeakPolarHBondContact CE2-SD 3.33Å; F1247-M1275 HydrophobicContact CG-CE 4.1Å; F1247-M1275 HydrophobicContact CG-SD 4.12Å; F1247-M1275 HydrophobicContact CZ-CE 4.46Å; F1247-M1275 HydrophobicContact CZ-SD 3.66Å; F1247-M1275 VanDerWaalsContact CZ-SD 3.51Å; F1247-M1275 WeakPolarHBondContact CZ-SD 3.37Å; I1271-M1275 HydrophobicContact CG2-SD 4.41Å; I1271-M1275 WeakPolarHBondContact O-CB 3.22Å; I1271-M1275 WeakPolarHBondContact O-CG 3.38Å; I1271-M1275 PolarHBondContact O-N 3.22Å; L1272-M1275 HydrophobicContact CD2-SD 4.36Å; L1272-M1275 CarbonylContact O-C 3.58Å; L1272-M1275 PolarHBondContact O-N 3.16Å; L1272-M1275 VanDerWaalsContact O-N 3.14Å; M1275-Q1277 VanDerWaalsContact C-N 3.31Å; M1275-Q1277 PolarHBondContact O-N 3.24Å; M1275-D1278 WeakPolarHBondContact O-CB 3.36Å; M1275-D1278 PolarHBondContact O-N 3.19Å; M1275-K1284 HydrophobicContact CE-CB 4.29Å; M1275-K1284 VanDerWaalsContact CE-O 3.22Å; M1275-K1284 WeakPolarHBondContact CE-O 3.35Å; M1275-K1284 HydrophobicContact CG-CB 4Å; M1275-R1285 WeakPolarHBondContact O-CG 3.09Å; M1275-I1287 HydrophobicContact CE-CB 4.37Å; M1275-I1287 HydrophobicContact CE-CG2 3.99Å; M1275-A1288 HydrophobicContact CB-CB 3.61Å; M1275-A1288 VanDerWaalsContact CB-CB 3.43Å; M1275-A1288 HydrophobicContact CE-CB 4.3Å; M1275-A1288 HydrophobicContact CG-CB 4.14Å; M1275-A1288 HydrophobicContact SD-CB 4.31Å
1276M85.7Confident83.9Confident1 Ų137.1 Ų37.11%0.00520%0.199CC..Hα-helixtrans-70.1-26.7173.7-77.9-175.5-49.100113.4L1272 A1273 Y1274 R1285 A1288 V1289 L1292 L1312 I1315 L1316 M1319L1272-M1276 WeakPolarHBondContact O-CB 3.26Å; L1272-M1276 VanDerWaalsContact O-CG 3.28Å; L1272-M1276 WeakPolarHBondContact O-CG 3.32Å; L1272-M1276 PolarHBondContact O-N 3.15Å; A1273-M1276 HydrophobicContact CB-CE 4.31Å; A1273-M1276 PolarHBondContact O-N 2.84Å; Y1274-M1276 PolarHBondContact O-N 3.18Å; M1276-R1285 VanDerWaalsContact O-CD 3.27Å; M1276-R1285 WeakPolarHBondContact O-CD 3.38Å; M1276-A1288 HydrophobicContact CG-CB 3.74Å; M1276-V1289 HydrophobicContact CE-CG2 4.14Å; M1276-V1289 HydrophobicContact CG-CG2 3.86Å; M1276-V1289 HydrophobicContact SD-CB 4.37Å; M1276-V1289 HydrophobicContact SD-CG2 3.75Å; M1276-L1292 HydrophobicContact CE-CD2 3.99Å; M1276-L1292 HydrophobicContact SD-CD2 4.19Å; M1276-L1312 HydrophobicContact CE-CD1 3.78Å; M1276-I1315 HydrophobicContact CB-CG2 4.04Å; M1276-I1315 HydrophobicContact CE-CG2 4.36Å; M1276-L1316 HydrophobicContact CE-CD2 4.19Å; M1276-L1316 VanDerWaalsContact CE-CD2 3.45Å; M1276-L1316 HydrophobicContact CE-CG 3.82Å; M1276-L1316 HydrophobicContact SD-CD2 3.76Å; M1276-M1319 HydrophobicContact CB-CE 4.47Å; M1276-M1319 HydrophobicContact CB-SD 3.62Å; M1276-M1319 VanDerWaalsContact CB-SD 3.53Å; M1276-M1319 HydrophobicContact CE-SD 3.73Å; M1276-M1319 HydrophobicContact CG-CE 4.47Å; M1276-M1319 HydrophobicContact CG-SD 3.86Å; M1276-M1319 HydrophobicContact SD-SD 4.01Å
1277Q84.9Confident84.2Confident88.4 Ų88.435.5 Ų35.541%0.41319%0.19SC..Hα-helixtrans-87-14.3177.1-68.8176.244.400113.3A1273 Y1274 M1275 T1279 I1315A1273-Q1277 WeakPolarHBondContact O-CG 3.35Å; A1273-Q1277 PolarHBondContact O-N 3.21Å; A1273-Q1277 PolarHBondContact O-NE2 3.29Å; A1273-Q1277 VanDerWaalsContact O-NE2 3.08Å; Y1274-Q1277 WeakPolarHBondContact O-CB 3.28Å; Y1274-Q1277 PolarHBondContact O-N 3.08Å; Y1274-Q1277 VanDerWaalsContact O-N 3.09Å; M1275-Q1277 VanDerWaalsContact C-N 3.31Å; M1275-Q1277 PolarHBondContact O-N 3.24Å; Q1277-T1279 PolarHBondContact O-N 3.21Å; Q1277-T1279 VanDerWaalsContact O-N 3.12Å; Q1277-I1315 HydrophobicContact CG-CD1 4.43Å; Q1277-I1315 HydrophobicContact CG-CG1 4.22Å; Q1277-I1315 HydrophobicContact CG-CG2 4.03Å; Q1277-I1315 VanDerWaalsContact NE2-CD1 3.26Å
1278D79.7Confident84.6Confident25.2 Ų25.232.5 Ų32.514%0.13518%0.176CC..  trans-63108-178-170.3-11.4000111.5W1236 Y1274 M1275 S1280 K1284 R1285W1236-D1278 PolarHBondContact NE1-OD2 3.15Å; W1236-D1278 VanDerWaalsContact NE1-OD2 3.07Å; Y1274-D1278 PolarHBondContact O-N 3.23Å; Y1274-D1278 VanDerWaalsContact O-N 3.14Å; M1275-D1278 WeakPolarHBondContact O-CB 3.36Å; M1275-D1278 PolarHBondContact O-N 3.19Å; D1278-S1280 VanDerWaalsContact C-N 3.28Å; D1278-S1280 VanDerWaalsContact CG-OG 3.3Å; D1278-S1280 PolarHBondContact O-N 3.01Å; D1278-S1280 VanDerWaalsContact OD1-CB 3.25Å; D1278-S1280 WeakPolarHBondContact OD1-CB 3.4Å; D1278-S1280 PolarHBondContact OD1-N 3.17Å; D1278-S1280 PolarHBondContact OD1-OG 3.24Å; D1278-S1280 PolarHBondContact OD2-OG 3.09Å; D1278-S1280 VanDerWaalsContact OD2-OG 3.12Å; D1278-K1284 VanDerWaalsContact OD2-CD 3.27Å; D1278-K1284 WeakPolarHBondContact OD2-CD 3.34Å; D1278-K1284 WeakPolarHBondContact OD2-CE 2.96Å; D1278-K1284 IonicContact OD2-NZ 3.14Å; D1278-K1284 PolarHBondContact OD2-NZ 3.08Å; D1278-R1285 VanDerWaalsContact O-CD 3.26Å; D1278-R1285 WeakPolarHBondContact O-CD 3.42Å; D1278-R1285 VanDerWaalsContact O-CG 3.3Å; D1278-R1285 WeakPolarHBondContact O-CG 3.35Å; D1278-R1285 PolarHBondContact O-NE 3.25Å; D1278-R1285 PolarHBondContact O-NH1 3.19Å; D1278-R1285 VanDerWaalsContact O-NH1 3.15Å
1279T79.4Confident84.8Confident120.6 Ų120.632.1 Ų32.174%0.7417%0.174SC*.THydrogen-bonded Turntrans-74.6-17.8179.452.60000112.9Q1277 C1281 R1285Q1277-T1279 PolarHBondContact O-N 3.21Å; Q1277-T1279 VanDerWaalsContact O-N 3.12Å; T1279-C1281 VanDerWaalsContact C-N 3.29Å; T1279-C1281 PolarHBondContact O-N 3.23Å; T1279-R1285 PolarHBondContact O-NH1 2.88Å; T1279-R1285 PolarHBondContact O-NH2 3.16Å; T1279-R1285 VanDerWaalsContact O-NH2 3.12Å
1280S76.7Confident85Confident88.6 Ų88.634.1 Ų34.162%0.6218%0.182SC*.THydrogen-bonded Turntrans-69.7-30.1-172.270.10000114.1D1278D1278-S1280 VanDerWaalsContact C-N 3.28Å; D1278-S1280 VanDerWaalsContact CG-OG 3.3Å; D1278-S1280 PolarHBondContact O-N 3.01Å; D1278-S1280 VanDerWaalsContact OD1-CB 3.25Å; D1278-S1280 WeakPolarHBondContact OD1-CB 3.4Å; D1278-S1280 PolarHBondContact OD1-N 3.17Å; D1278-S1280 PolarHBondContact OD1-OG 3.24Å; D1278-S1280 PolarHBondContact OD2-OG 3.09Å; D1278-S1280 VanDerWaalsContact OD2-OG 3.12Å
1281C79Confident85.3Confident23.2 Ų23.232.9 Ų32.916%0.15717%0.174CC..  trans-148.8117.2-173.2-173.40000113T1240 T1279 L1283 K1284 R1285T1240-C1281 HydrophobicContact CG2-CB 4.44Å; T1279-C1281 VanDerWaalsContact C-N 3.29Å; T1279-C1281 PolarHBondContact O-N 3.23Å; C1281-L1283 VanDerWaalsContact C-N 3.29Å; C1281-L1283 PolarHBondContact O-N 3.11Å; C1281-K1284 HydrophobicContact CB-CB 4.4Å; C1281-K1284 HydrophobicContact CB-CD 4.22Å; C1281-K1284 HydrophobicContact CB-CG 4.09Å; C1281-K1284 PolarHBondContact O-N 2.99Å; C1281-R1285 PolarHBondContact O-N 3.01Å
1282F83.9Confident85.6Confident94.2 Ų94.232.6 Ų32.641%0.41317%0.173SC..Hα-helixtrans-64.3-30.2177.775.2-90.1000113.2V1165 K1284 R1285 S1286 I1325 I1328V1165-F1282 HydrophobicContact CG2-CE2 4.33Å; V1165-F1282 HydrophobicContact CG2-CZ 4.43Å; F1282-K1284 VanDerWaalsContact C-N 3.32Å; F1282-K1284 PolarHBondContact O-N 2.99Å; F1282-R1285 PolarHBondContact O-N 2.96Å; F1282-R1285 VanDerWaalsContact O-N 3.14Å; F1282-S1286 WeakPolarHBondContact O-CB 3.43Å; F1282-S1286 PolarHBondContact O-N 3.28Å; F1282-S1286 PolarHBondContact O-OG 2.98Å; F1282-I1325 HydrophobicContact CB-CD1 4.13Å; F1282-I1325 HydrophobicContact CD1-CD1 4.37Å; F1282-I1325 HydrophobicContact CD2-CD1 3.82Å; F1282-I1325 HydrophobicContact CE2-CD1 4.31Å; F1282-I1325 HydrophobicContact CG-CD1 3.97Å; F1282-I1328 HydrophobicContact CB-CD1 4.28Å; F1282-I1328 HydrophobicContact CD2-CD1 4.38Å
1283L80.9Confident85.8Confident50.4 Ų50.432.8 Ų32.826%0.26417%0.174SC..Hα-helixtrans-62.9-38.7177.9-69.4172.7000111.9L1161 I1164 V1165 F1185 V1244 C1281 R1285 S1286 I1287L1161-L1283 HydrophobicContact CD2-CD1 3.53Å; I1164-L1283 HydrophobicContact CG2-CD1 3.92Å; V1165-L1283 HydrophobicContact CG2-CD2 4.04Å; F1185-L1283 HydrophobicContact CE1-CD2 3.85Å; F1185-L1283 HydrophobicContact CZ-CD2 4.29Å; V1244-L1283 HydrophobicContact CG2-CB 4.33Å; C1281-L1283 VanDerWaalsContact C-N 3.29Å; C1281-L1283 PolarHBondContact O-N 3.11Å; L1283-R1285 PolarHBondContact O-N 3.27Å; L1283-S1286 WeakPolarHBondContact CA-OG 3.42Å; L1283-S1286 PolarHBondContact O-N 3.45Å; L1283-S1286 PolarHBondContact O-OG 3.23Å; L1283-S1286 VanDerWaalsContact O-OG 3.11Å; L1283-I1287 WeakPolarHBondContact O-CB 3.4Å; L1283-I1287 WeakPolarHBondContact O-CD1 3.38Å; L1283-I1287 WeakPolarHBondContact O-CG1 3.34Å; L1283-I1287 VanDerWaalsContact O-CG2 3.32Å; L1283-I1287 WeakPolarHBondContact O-CG2 3.39Å; L1283-I1287 PolarHBondContact O-N 3.36Å; L1283-I1287 VanDerWaalsContact O-N 3.09Å
1284K83.9Confident86Confident9.6 Ų9.635.6 Ų35.64%0.04218%0.182CC..Hα-helixtrans-63.7-44.1174.9-66-176.4-171.51750111.1T1240 M1275 D1278 C1281 F1282 S1286 I1287 A1288T1240-K1284 HydrophobicContact CG2-CD 4.31Å; T1240-K1284 HydrophobicContact CG2-CG 3.86Å; T1240-K1284 VanDerWaalsContact OG1-CE 3.29Å; T1240-K1284 WeakPolarHBondContact OG1-CE 3.39Å; M1275-K1284 HydrophobicContact CE-CB 4.29Å; M1275-K1284 VanDerWaalsContact CE-O 3.22Å; M1275-K1284 WeakPolarHBondContact CE-O 3.35Å; M1275-K1284 HydrophobicContact CG-CB 4Å; D1278-K1284 VanDerWaalsContact OD2-CD 3.27Å; D1278-K1284 WeakPolarHBondContact OD2-CD 3.34Å; D1278-K1284 WeakPolarHBondContact OD2-CE 2.96Å; D1278-K1284 IonicContact OD2-NZ 3.14Å; D1278-K1284 PolarHBondContact OD2-NZ 3.08Å; C1281-K1284 HydrophobicContact CB-CB 4.4Å; C1281-K1284 HydrophobicContact CB-CD 4.22Å; C1281-K1284 HydrophobicContact CB-CG 4.09Å; C1281-K1284 PolarHBondContact O-N 2.99Å; F1282-K1284 VanDerWaalsContact C-N 3.32Å; F1282-K1284 PolarHBondContact O-N 2.99Å; K1284-S1286 PolarHBondContact O-N 3.42Å; K1284-I1287 WeakPolarHBondContact O-CG2 3.36Å; K1284-I1287 PolarHBondContact O-N 3.18Å; K1284-A1288 VanDerWaalsContact O-CB 3.3Å; K1284-A1288 WeakPolarHBondContact O-CB 3.37Å; K1284-A1288 PolarHBondContact O-N 3.03Å
1285R87.9Confident86.3Confident39.2 Ų39.233 Ų3315%0.14817%0.172CC..Hα-helixtrans-62.4-47176.8-65.8-167.1-68.9-139.64.6111.5M1275 M1276 D1278 T1279 C1281 F1282 L1283 I1287 A1288 V1289 M1319 E1323M1275-R1285 WeakPolarHBondContact O-CG 3.09Å; M1276-R1285 VanDerWaalsContact O-CD 3.27Å; M1276-R1285 WeakPolarHBondContact O-CD 3.38Å; D1278-R1285 VanDerWaalsContact O-CD 3.26Å; D1278-R1285 WeakPolarHBondContact O-CD 3.42Å; D1278-R1285 VanDerWaalsContact O-CG 3.3Å; D1278-R1285 WeakPolarHBondContact O-CG 3.35Å; D1278-R1285 PolarHBondContact O-NE 3.25Å; D1278-R1285 PolarHBondContact O-NH1 3.19Å; D1278-R1285 VanDerWaalsContact O-NH1 3.15Å; T1279-R1285 PolarHBondContact O-NH1 2.88Å; T1279-R1285 PolarHBondContact O-NH2 3.16Å; T1279-R1285 VanDerWaalsContact O-NH2 3.12Å; C1281-R1285 PolarHBondContact O-N 3.01Å; F1282-R1285 PolarHBondContact O-N 2.96Å; F1282-R1285 VanDerWaalsContact O-N 3.14Å; L1283-R1285 PolarHBondContact O-N 3.27Å; R1285-I1287 PolarHBondContact O-N 3.2Å; R1285-A1288 PolarHBondContact O-N 3.23Å; R1285-V1289 WeakPolarHBondContact O-CG2 3.3Å; R1285-V1289 PolarHBondContact O-N 3.26Å; R1285-M1319 HydrophobicContact CB-CE 3.93Å; R1285-M1319 HydrophobicContact CG-CE 4.41Å; R1285-E1323 VanDerWaalsContact CD-OE1 3.29Å; R1285-E1323 WeakPolarHBondContact CD-OE1 3.31Å; R1285-E1323 IonicContact CZ-OE1 3.01Å; R1285-E1323 VanDerWaalsContact CZ-OE1 3.27Å; R1285-E1323 IonicContact CZ-OE2 3.45Å; R1285-E1323 VanDerWaalsContact CZ-OE2 3.25Å; R1285-E1323 IonicContact NE-OE1 3.08Å; R1285-E1323 PolarHBondContact NE-OE1 3.31Å; R1285-E1323 VanDerWaalsContact NE-OE1 3.08Å; R1285-E1323 IonicContact NE-OE2 3.31Å; R1285-E1323 PolarHBondContact NE-OE2 3.21Å; R1285-E1323 IonicContact NH1-OE1 3.18Å; R1285-E1323 PolarHBondContact NH1-OE1 3.35Å; R1285-E1323 IonicContact NH1-OE2 3.74Å; R1285-E1323 PolarHBondContact NH1-OE2 3.24Å; R1285-E1323 VanDerWaalsContact NH2-CD 3.33Å; R1285-E1323 IonicContact NH2-OE1 2.86Å; R1285-E1323 PolarHBondContact NH2-OE1 3.13Å; R1285-E1323 IonicContact NH2-OE2 3.55Å; R1285-E1323 PolarHBondContact NH2-OE2 3.34Å; R1285-E1323 VanDerWaalsContact NH2-OE2 3.11Å
1286S86.3Confident86.7Confident21 Ų2133 Ų3315%0.14717%0.172CC..Hα-helixtrans-62.1-45.8-179.869.60000112.4F1282 L1283 K1284 A1288 V1289 W1290F1282-S1286 WeakPolarHBondContact O-CB 3.43Å; F1282-S1286 PolarHBondContact O-N 3.28Å; F1282-S1286 PolarHBondContact O-OG 2.98Å; L1283-S1286 WeakPolarHBondContact CA-OG 3.42Å; L1283-S1286 PolarHBondContact O-N 3.45Å; L1283-S1286 PolarHBondContact O-OG 3.23Å; L1283-S1286 VanDerWaalsContact O-OG 3.11Å; K1284-S1286 PolarHBondContact O-N 3.42Å; S1286-A1288 VanDerWaalsContact C-N 3.33Å; S1286-A1288 PolarHBondContact O-N 3.28Å; S1286-V1289 PolarHBondContact O-N 3.23Å; S1286-W1290 VanDerWaalsContact O-CB 3.3Å; S1286-W1290 WeakPolarHBondContact O-CB 3.31Å; S1286-W1290 PolarHBondContact O-N 3.1Å
1287I88.3Confident86.8Confident10.8 Ų10.835.1 Ų35.16%0.05519%0.187CC..Hα-helixtrans-70.5-33.3178.3-130.579.7000111.4L417 V1244 F1247 T1248 M1275 L1283 K1284 R1285 W1290 T1291L417-I1287 HydrophobicContact CD2-CD1 4.39Å; V1244-I1287 HydrophobicContact CB-CD1 3.72Å; V1244-I1287 HydrophobicContact CG1-CB 4.32Å; V1244-I1287 HydrophobicContact CG1-CD1 3.76Å; V1244-I1287 HydrophobicContact CG1-CG1 4.25Å; V1244-I1287 HydrophobicContact CG1-CG2 4.35Å; V1244-I1287 HydrophobicContact CG2-CD1 3.52Å; V1244-I1287 HydrophobicContact CG2-CG2 4.2Å; F1247-I1287 HydrophobicContact CB-CG1 4Å; F1247-I1287 HydrophobicContact CB-CG2 4.06Å; F1247-I1287 VanDerWaalsContact CB-CG2 3.49Å; T1248-I1287 HydrophobicContact CG2-CD1 3.7Å; T1248-I1287 HydrophobicContact CG2-CG1 3.97Å; T1248-I1287 HydrophobicContact CG2-CG2 3.9Å; T1248-I1287 VanDerWaalsContact OG1-CD1 3.3Å; T1248-I1287 WeakPolarHBondContact OG1-CD1 3.36Å; M1275-I1287 HydrophobicContact CE-CB 4.37Å; M1275-I1287 HydrophobicContact CE-CG2 3.99Å; L1283-I1287 WeakPolarHBondContact O-CB 3.4Å; L1283-I1287 WeakPolarHBondContact O-CD1 3.38Å; L1283-I1287 WeakPolarHBondContact O-CG1 3.34Å; L1283-I1287 VanDerWaalsContact O-CG2 3.32Å; L1283-I1287 WeakPolarHBondContact O-CG2 3.39Å; L1283-I1287 PolarHBondContact O-N 3.36Å; L1283-I1287 VanDerWaalsContact O-N 3.09Å; K1284-I1287 WeakPolarHBondContact O-CG2 3.36Å; K1284-I1287 PolarHBondContact O-N 3.18Å; R1285-I1287 PolarHBondContact O-N 3.2Å; I1287-W1290 HydrophobicContact CD1-CD2 4.32Å; I1287-W1290 HydrophobicContact CD1-CE3 3.58Å; I1287-W1290 HydrophobicContact CD1-CZ3 4.11Å; I1287-W1290 PolarHBondContact O-N 3.39Å; I1287-T1291 HydrophobicContact CD1-CG2 4.38Å; I1287-T1291 HydrophobicContact CG1-CG2 4.22Å; I1287-T1291 HydrophobicContact CG2-CG2 3.95Å; I1287-T1291 VanDerWaalsContact O-CB 3.3Å; I1287-T1291 WeakPolarHBondContact O-CB 3.23Å; I1287-T1291 VanDerWaalsContact O-CG2 3.26Å; I1287-T1291 WeakPolarHBondContact O-CG2 3.39Å; I1287-T1291 PolarHBondContact O-N 3.19Å; I1287-T1291 PolarHBondContact O-OG1 2.93Å
1288A90.6Very high87Confident0 Ų033.2 Ų33.20%018%0.178CC..Hα-helixtrans-65.4-44.4177.200000112.2L1272 M1275 M1276 K1284 R1285 S1286 W1290 T1291 L1292L1272-A1288 HydrophobicContact CD2-CB 4.22Å; M1275-A1288 HydrophobicContact CB-CB 3.61Å; M1275-A1288 VanDerWaalsContact CB-CB 3.43Å; M1275-A1288 HydrophobicContact CE-CB 4.3Å; M1275-A1288 HydrophobicContact CG-CB 4.14Å; M1275-A1288 HydrophobicContact SD-CB 4.31Å; M1276-A1288 HydrophobicContact CG-CB 3.74Å; K1284-A1288 VanDerWaalsContact O-CB 3.3Å; K1284-A1288 WeakPolarHBondContact O-CB 3.37Å; K1284-A1288 PolarHBondContact O-N 3.03Å; R1285-A1288 PolarHBondContact O-N 3.23Å; S1286-A1288 VanDerWaalsContact C-N 3.33Å; S1286-A1288 PolarHBondContact O-N 3.28Å; A1288-W1290 VanDerWaalsContact C-N 3.35Å; A1288-T1291 WeakPolarHBondContact CA-OG1 3.32Å; A1288-T1291 PolarHBondContact O-OG1 3.16Å; A1288-T1291 VanDerWaalsContact O-OG1 3.12Å; A1288-L1292 VanDerWaalsContact O-CB 3.29Å; A1288-L1292 WeakPolarHBondContact O-CB 3.3Å; A1288-L1292 PolarHBondContact O-N 2.96Å
1289V91.7Very high87.4Confident0 Ų032.9 Ų32.90%018%0.177CC..Hα-helixtrans-65.5-45.6174.5-1770000110.4M1276 R1285 S1286 T1291 L1292 T1293 L1316 M1319 E1331 V1332 A1335M1276-V1289 HydrophobicContact CE-CG2 4.14Å; M1276-V1289 HydrophobicContact CG-CG2 3.86Å; M1276-V1289 HydrophobicContact SD-CB 4.37Å; M1276-V1289 HydrophobicContact SD-CG2 3.75Å; R1285-V1289 WeakPolarHBondContact O-CG2 3.3Å; R1285-V1289 PolarHBondContact O-N 3.26Å; S1286-V1289 PolarHBondContact O-N 3.23Å; V1289-T1291 VanDerWaalsContact C-N 3.34Å; V1289-T1291 PolarHBondContact O-N 3.07Å; V1289-L1292 WeakPolarHBondContact O-CB 3.45Å; V1289-L1292 PolarHBondContact O-N 3.26Å; V1289-L1292 VanDerWaalsContact O-N 3.15Å; V1289-T1293 WeakPolarHBondContact O-CB 3.44Å; V1289-T1293 PolarHBondContact O-N 3.13Å; V1289-T1293 PolarHBondContact O-OG1 3.26Å; V1289-L1316 HydrophobicContact CG1-CD2 4.48Å; V1289-M1319 HydrophobicContact CG2-CE 3.51Å; V1289-M1319 VanDerWaalsContact CG2-CE 3.48Å; V1289-M1319 HydrophobicContact CG2-SD 3.86Å; V1289-E1331 HydrophobicContact CB-CG 4.18Å; V1289-E1331 HydrophobicContact CG1-CB 4.15Å; V1289-E1331 HydrophobicContact CG1-CG 3.86Å; V1289-E1331 WeakPolarHBondContact CG1-O 3.38Å; V1289-V1332 HydrophobicContact CB-CG2 4.44Å; V1289-V1332 HydrophobicContact CG1-CB 4.42Å; V1289-V1332 HydrophobicContact CG1-CG2 3.85Å; V1289-V1332 HydrophobicContact CG2-CG2 3.87Å; V1289-A1335 HydrophobicContact CG1-CB 3.95Å
1290W92.5Very high87.6Confident44.4 Ų44.429.3 Ų29.317%0.16816%0.164CC..Hα-helixtrans-60.9-45.3179.3178.785.5000112.6G418 L419 R1252 S1286 I1287 A1288 T1293 R1294 E1331 R1334G418-W1290 VanDerWaalsContact C-NE1 3.27Å; G418-W1290 PolarHBondContact O-NE1 3.07Å; L419-W1290 HydrophobicContact CD2-CB 3.98Å; L419-W1290 HydrophobicContact CD2-CG 4.12Å; R1252-W1290 HydrophobicContact CG-CH2 4.32Å; S1286-W1290 VanDerWaalsContact O-CB 3.3Å; S1286-W1290 WeakPolarHBondContact O-CB 3.31Å; S1286-W1290 PolarHBondContact O-N 3.1Å; I1287-W1290 HydrophobicContact CD1-CD2 4.32Å; I1287-W1290 HydrophobicContact CD1-CE3 3.58Å; I1287-W1290 HydrophobicContact CD1-CZ3 4.11Å; I1287-W1290 PolarHBondContact O-N 3.39Å; A1288-W1290 VanDerWaalsContact C-N 3.35Å; W1290-T1293 PolarHBondContact O-N 3.25Å; W1290-R1294 HydrophobicContact CH2-CG 4.48Å; W1290-R1294 HydrophobicContact CZ2-CG 4.42Å; W1290-R1294 VanDerWaalsContact O-CB 3.3Å; W1290-R1294 WeakPolarHBondContact O-CB 3.37Å; W1290-R1294 PolarHBondContact O-N 3.11Å; W1290-E1331 VanDerWaalsContact CA-OE1 3.27Å; W1290-E1331 WeakPolarHBondContact CA-OE1 3.49Å; W1290-E1331 HydrophobicContact CB-CG 4.11Å; W1290-R1334 VanDerWaalsContact CD1-NH2 3.35Å
1291T90.7Very high88.1Confident0 Ų025.5 Ų25.50%014%0.136CC..Hα-helixtrans-66.6-41.1177.332.40000111.8F1247 L1250 L1272 I1287 A1288 V1289 T1293 R1294 L1295F1247-T1291 VanDerWaalsContact C-CG2 3.5Å; F1247-T1291 HydrophobicContact CB-CG2 3.95Å; F1247-T1291 HydrophobicContact CD1-CG2 4.37Å; F1247-T1291 WeakPolarHBondContact O-CG2 3.39Å; F1247-T1291 PolarHBondContact O-OG1 2.68Å; L1250-T1291 HydrophobicContact CB-CG2 4.39Å; L1250-T1291 HydrophobicContact CD2-CG2 4.14Å; L1250-T1291 HydrophobicContact CG-CG2 4.23Å; L1272-T1291 HydrophobicContact CD1-CG2 4.48Å; L1272-T1291 HydrophobicContact CD2-CG2 4.23Å; L1272-T1291 WeakPolarHBondContact CD2-OG1 3.36Å; I1287-T1291 HydrophobicContact CD1-CG2 4.38Å; I1287-T1291 HydrophobicContact CG1-CG2 4.22Å; I1287-T1291 HydrophobicContact CG2-CG2 3.95Å; I1287-T1291 VanDerWaalsContact O-CB 3.3Å; I1287-T1291 WeakPolarHBondContact O-CB 3.23Å; I1287-T1291 VanDerWaalsContact O-CG2 3.26Å; I1287-T1291 WeakPolarHBondContact O-CG2 3.39Å; I1287-T1291 PolarHBondContact O-N 3.19Å; I1287-T1291 PolarHBondContact O-OG1 2.93Å; A1288-T1291 WeakPolarHBondContact CA-OG1 3.32Å; A1288-T1291 PolarHBondContact O-OG1 3.16Å; A1288-T1291 VanDerWaalsContact O-OG1 3.12Å; V1289-T1291 VanDerWaalsContact C-N 3.34Å; V1289-T1291 PolarHBondContact O-N 3.07Å; T1291-T1293 VanDerWaalsContact C-N 3.33Å; T1291-T1293 PolarHBondContact O-N 3.28Å; T1291-R1294 PolarHBondContact O-N 3.19Å; T1291-L1295 HydrophobicContact CG2-CD1 3.68Å; T1291-L1295 HydrophobicContact CG2-CG 4.14Å; T1291-L1295 VanDerWaalsContact O-CB 3.27Å; T1291-L1295 WeakPolarHBondContact O-CB 3.44Å; T1291-L1295 WeakPolarHBondContact O-CD1 3.31Å; T1291-L1295 WeakPolarHBondContact O-CG 3.41Å; T1291-L1295 PolarHBondContact O-N 3.01Å
1292L92.5Very high88.4Confident2.2 Ų2.226.7 Ų26.71%0.01214%0.142CC..Hα-helixtrans-57.6-50.2173.3179.766.4000110.9I1269 L1272 M1276 A1288 V1289 R1294 L1295 V1296 L1312I1269-L1292 HydrophobicContact CG1-CD1 4.38Å; L1272-L1292 HydrophobicContact CD1-CB 4.06Å; L1272-L1292 HydrophobicContact CD1-CD1 4.23Å; M1276-L1292 HydrophobicContact CE-CD2 3.99Å; M1276-L1292 HydrophobicContact SD-CD2 4.19Å; A1288-L1292 VanDerWaalsContact O-CB 3.29Å; A1288-L1292 WeakPolarHBondContact O-CB 3.3Å; A1288-L1292 PolarHBondContact O-N 2.96Å; V1289-L1292 WeakPolarHBondContact O-CB 3.45Å; V1289-L1292 PolarHBondContact O-N 3.26Å; V1289-L1292 VanDerWaalsContact O-N 3.15Å; L1292-R1294 VanDerWaalsContact C-N 3.32Å; L1292-R1294 PolarHBondContact O-N 3.31Å; L1292-L1295 PolarHBondContact O-N 3.05Å; L1292-V1296 HydrophobicContact CD1-CG2 4.16Å; L1292-V1296 HydrophobicContact CG-CG2 4.49Å; L1292-V1296 WeakPolarHBondContact O-CB 3.13Å; L1292-V1296 VanDerWaalsContact O-CG2 3.29Å; L1292-V1296 WeakPolarHBondContact O-CG2 3.22Å; L1292-V1296 PolarHBondContact O-N 3.18Å; L1292-L1312 HydrophobicContact CD2-CD1 3.99Å; L1292-L1312 HydrophobicContact CD2-CD2 4.4Å
1293T91.8Very high88.4Confident4.6 Ų4.624.4 Ų24.43%0.02814%0.136CC..Hα-helixtrans-58.2-44.9178-53.30000111.2V1289 W1290 T1291 V1296 S1297 E1331 R1334 A1335 V1338V1289-T1293 WeakPolarHBondContact O-CB 3.44Å; V1289-T1293 PolarHBondContact O-N 3.13Å; V1289-T1293 PolarHBondContact O-OG1 3.26Å; W1290-T1293 PolarHBondContact O-N 3.25Å; T1291-T1293 VanDerWaalsContact C-N 3.33Å; T1291-T1293 PolarHBondContact O-N 3.28Å; T1293-V1296 PolarHBondContact O-N 3.03Å; T1293-S1297 VanDerWaalsContact O-CB 3.24Å; T1293-S1297 WeakPolarHBondContact O-CB 3.38Å; T1293-S1297 PolarHBondContact O-N 3.24Å; T1293-S1297 PolarHBondContact O-OG 2.86Å; T1293-S1297 VanDerWaalsContact O-OG 3.14Å; T1293-E1331 WeakPolarHBondContact CB-OE1 3.42Å; T1293-E1331 WeakPolarHBondContact CG2-OE1 3.17Å; T1293-E1331 PolarHBondContact OG1-OE1 2.98Å; T1293-R1334 HydrophobicContact CG2-CB 4.38Å; T1293-R1334 HydrophobicContact CG2-CG 3.98Å; T1293-A1335 VanDerWaalsContact OG1-CA 3.26Å; T1293-A1335 WeakPolarHBondContact OG1-CA 3.42Å; T1293-A1335 VanDerWaalsContact OG1-CB 3.26Å; T1293-A1335 WeakPolarHBondContact OG1-CB 3.3Å; T1293-V1338 HydrophobicContact CG2-CB 4.26Å; T1293-V1338 HydrophobicContact CG2-CG1 4.41Å; T1293-V1338 HydrophobicContact CG2-CG2 4Å
1294R91.7Very high88.6Confident67.8 Ų67.825 Ų2526%0.25614%0.139SC..Hα-helixtrans-70-39.2-178.3-164.761.9174.61780.8112.5D421 G1251 A1255 W1290 T1291 L1292 S1297 H1298D421-R1294 PolarHBondContact O-NH1 3.28Å; G1251-R1294 WeakPolarHBondContact O-CG 3.41Å; A1255-R1294 VanDerWaalsContact CB-NH2 3.32Å; W1290-R1294 HydrophobicContact CH2-CG 4.48Å; W1290-R1294 HydrophobicContact CZ2-CG 4.42Å; W1290-R1294 VanDerWaalsContact O-CB 3.3Å; W1290-R1294 WeakPolarHBondContact O-CB 3.37Å; W1290-R1294 PolarHBondContact O-N 3.11Å; T1291-R1294 PolarHBondContact O-N 3.19Å; L1292-R1294 VanDerWaalsContact C-N 3.32Å; L1292-R1294 PolarHBondContact O-N 3.31Å; R1294-S1297 WeakPolarHBondContact CA-OG 3.39Å; R1294-S1297 PolarHBondContact O-N 3.08Å; R1294-S1297 PolarHBondContact O-OG 3.08Å; R1294-H1298 VanDerWaalsContact CD-CD2 3.48Å; R1294-H1298 WeakPolarHBondContact CD-CD2 3.43Å; R1294-H1298 WeakPolarHBondContact CD-CE1 3.48Å; R1294-H1298 PolarHBondContact NE-CD2 3.17Å; R1294-H1298 VanDerWaalsContact NE-CD2 3.32Å; R1294-H1298 PolarHBondContact NE-CE1 2.84Å; R1294-H1298 PolarHBondContact NE-ND1 2.99Å; R1294-H1298 PolarHBondContact NE-NE2 3.17Å; R1294-H1298 VanDerWaalsContact NE-NE2 3.17Å; R1294-H1298 PolarHBondContact NH1-CE1 3.29Å; R1294-H1298 PolarHBondContact NH1-NE2 3.11Å; R1294-H1298 VanDerWaalsContact NH1-NE2 3.15Å; R1294-H1298 PolarHBondContact NH2-CE1 3.35Å; R1294-H1298 PolarHBondContact NH2-NE2 3.18Å; R1294-H1298 VanDerWaalsContact NH2-NE2 3.18Å; R1294-H1298 PolarHBondContact O-CD2 3.25Å; R1294-H1298 VanDerWaalsContact O-CD2 3.28Å; R1294-H1298 PolarHBondContact O-N 3.3Å; R1294-H1298 VanDerWaalsContact O-N 3.16Å; R1294-H1298 PolarHBondContact O-ND1 3.47Å
1295L91.3Very high88.6Confident1.2 Ų1.224.5 Ų24.51%0.00614%0.137CC..Hα-helixtrans-62.4-51.7175-75.5166000111L1250 A1254 I1261 M1265 F1268 L1272 T1291 L1292 S1297 H1298 T1299L1250-L1295 HydrophobicContact CD1-CD2 4.44Å; L1250-L1295 HydrophobicContact CD2-CD1 4.26Å; L1250-L1295 HydrophobicContact CG-CD1 4.47Å; L1250-L1295 HydrophobicContact CG-CD2 4.33Å; A1254-L1295 HydrophobicContact CB-CD2 3.73Å; A1254-L1295 HydrophobicContact CB-CG 4.34Å; I1261-L1295 HydrophobicContact CD1-CD2 4.22Å; I1261-L1295 HydrophobicContact CG2-CD2 3.56Å; I1261-L1295 VanDerWaalsContact CG2-CD2 3.48Å; M1265-L1295 HydrophobicContact CE-CB 3.77Å; M1265-L1295 HydrophobicContact CE-CD2 3.8Å; M1265-L1295 HydrophobicContact CE-CG 4.25Å; M1265-L1295 WeakPolarHBondContact CE-O 3.39Å; M1265-L1295 HydrophobicContact SD-CB 4.09Å; M1265-L1295 HydrophobicContact SD-CD2 4.31Å; M1265-L1295 HydrophobicContact SD-CG 4.48Å; F1268-L1295 HydrophobicContact CB-CD1 4.45Å; L1272-L1295 HydrophobicContact CD1-CD1 3.74Å; T1291-L1295 HydrophobicContact CG2-CD1 3.68Å; T1291-L1295 HydrophobicContact CG2-CG 4.14Å; T1291-L1295 VanDerWaalsContact O-CB 3.27Å; T1291-L1295 WeakPolarHBondContact O-CB 3.44Å; T1291-L1295 WeakPolarHBondContact O-CD1 3.31Å; T1291-L1295 WeakPolarHBondContact O-CG 3.41Å; T1291-L1295 PolarHBondContact O-N 3.01Å; L1292-L1295 PolarHBondContact O-N 3.05Å; L1295-S1297 VanDerWaalsContact C-N 3.33Å; L1295-S1297 PolarHBondContact O-N 3Å; L1295-H1298 PolarHBondContact O-N 3.15Å; L1295-H1298 VanDerWaalsContact O-N 3.15Å; L1295-T1299 VanDerWaalsContact O-CB 3.32Å; L1295-T1299 WeakPolarHBondContact O-CB 3.39Å; L1295-T1299 VanDerWaalsContact O-CG2 3.26Å; L1295-T1299 WeakPolarHBondContact O-CG2 3.32Å; L1295-T1299 PolarHBondContact O-N 3.04Å; L1295-T1299 VanDerWaalsContact O-N 3.09Å; L1295-T1299 PolarHBondContact O-OG1 3.16Å
1296V91.1Very high88.5Confident1.6 Ų1.622.8 Ų22.81%0.0113%0.13CC..Hα-helixtrans-63.8-43.8-179.8176.70000111.2M1265 L1292 T1293 H1298 T1299 G1300 V1302 P1305 V1338 L1339M1265-V1296 HydrophobicContact CE-CG2 4.29Å; L1292-V1296 HydrophobicContact CD1-CG2 4.16Å; L1292-V1296 HydrophobicContact CG-CG2 4.49Å; L1292-V1296 WeakPolarHBondContact O-CB 3.13Å; L1292-V1296 VanDerWaalsContact O-CG2 3.29Å; L1292-V1296 WeakPolarHBondContact O-CG2 3.22Å; L1292-V1296 PolarHBondContact O-N 3.18Å; T1293-V1296 PolarHBondContact O-N 3.03Å; V1296-H1298 VanDerWaalsContact C-N 3.31Å; V1296-H1298 PolarHBondContact O-N 3.31Å; V1296-H1298 VanDerWaalsContact O-N 3.13Å; V1296-T1299 PolarHBondContact O-N 3.01Å; V1296-G1300 PolarHBondContact O-N 3.07Å; V1296-G1300 VanDerWaalsContact O-N 3.16Å; V1296-V1302 HydrophobicContact CG1-CG2 4.25Å; V1296-P1305 HydrophobicContact CG2-CG 4.29Å; V1296-V1338 HydrophobicContact CB-CG1 4.05Å; V1296-V1338 HydrophobicContact CG1-CG1 3.76Å; V1296-L1339 HydrophobicContact CB-CD2 4.5Å; V1296-L1339 HydrophobicContact CG1-CD2 4.11Å; V1296-L1339 HydrophobicContact CG1-CG 4.48Å; V1296-L1339 HydrophobicContact CG2-CD2 3.93Å
1297S89.3Confident88.3Confident43.8 Ų43.828.5 Ų28.531%0.30615%0.153SC..Hα-helixtrans-60.8-31.7-179.7163.20000113.8T1293 R1294 L1295T1293-S1297 VanDerWaalsContact O-CB 3.24Å; T1293-S1297 WeakPolarHBondContact O-CB 3.38Å; T1293-S1297 PolarHBondContact O-N 3.24Å; T1293-S1297 PolarHBondContact O-OG 2.86Å; T1293-S1297 VanDerWaalsContact O-OG 3.14Å; R1294-S1297 WeakPolarHBondContact CA-OG 3.39Å; R1294-S1297 PolarHBondContact O-N 3.08Å; R1294-S1297 PolarHBondContact O-OG 3.08Å; L1295-S1297 VanDerWaalsContact C-N 3.33Å; L1295-S1297 PolarHBondContact O-N 3Å
1298H88.2Confident88Confident49 Ų4933.6 Ų33.623%0.22717%0.171CC..Hα-helixtrans-97.2-28.7-177.7-75.7-56.5000114A1254 A1255 P1258 R1294 L1295 V1296 G1300A1254-H1298 HydrophobicContact CB-CB 4.15Å; A1254-H1298 VanDerWaalsContact O-CB 3.26Å; A1254-H1298 WeakPolarHBondContact O-CB 3.41Å; A1255-H1298 VanDerWaalsContact CA-CD2 3.46Å; A1255-H1298 WeakPolarHBondContact CA-CD2 3.27Å; A1255-H1298 WeakPolarHBondContact CA-NE2 3.41Å; A1255-H1298 VanDerWaalsContact CB-NE2 3.25Å; A1255-H1298 WeakPolarHBondContact CB-NE2 3.39Å; P1258-H1298 HydrophobicContact CB-CB 4.26Å; P1258-H1298 VanDerWaalsContact CB-O 3.25Å; P1258-H1298 WeakPolarHBondContact CB-O 3.36Å; R1294-H1298 VanDerWaalsContact CD-CD2 3.48Å; R1294-H1298 WeakPolarHBondContact CD-CD2 3.43Å; R1294-H1298 WeakPolarHBondContact CD-CE1 3.48Å; R1294-H1298 PolarHBondContact NE-CD2 3.17Å; R1294-H1298 VanDerWaalsContact NE-CD2 3.32Å; R1294-H1298 PolarHBondContact NE-CE1 2.84Å; R1294-H1298 PolarHBondContact NE-ND1 2.99Å; R1294-H1298 PolarHBondContact NE-NE2 3.17Å; R1294-H1298 VanDerWaalsContact NE-NE2 3.17Å; R1294-H1298 PolarHBondContact NH1-CE1 3.29Å; R1294-H1298 PolarHBondContact NH1-NE2 3.11Å; R1294-H1298 VanDerWaalsContact NH1-NE2 3.15Å; R1294-H1298 PolarHBondContact NH2-CE1 3.35Å; R1294-H1298 PolarHBondContact NH2-NE2 3.18Å; R1294-H1298 VanDerWaalsContact NH2-NE2 3.18Å; R1294-H1298 PolarHBondContact O-CD2 3.25Å; R1294-H1298 VanDerWaalsContact O-CD2 3.28Å; R1294-H1298 PolarHBondContact O-N 3.3Å; R1294-H1298 VanDerWaalsContact O-N 3.16Å; R1294-H1298 PolarHBondContact O-ND1 3.47Å; L1295-H1298 PolarHBondContact O-N 3.15Å; L1295-H1298 VanDerWaalsContact O-N 3.15Å; V1296-H1298 VanDerWaalsContact C-N 3.31Å; V1296-H1298 PolarHBondContact O-N 3.31Å; V1296-H1298 VanDerWaalsContact O-N 3.13Å; H1298-G1300 VanDerWaalsContact C-N 3.34Å
1299T87.2Confident87.6Confident18.2 Ų18.235.1 Ų35.111%0.11218%0.177CC..Hα-helixtrans-88.4-13.7178.560.20000113.3P1258 I1261 M1265 L1295 V1296 Y1301P1258-T1299 HydrophobicContact CB-CG2 4.16Å; P1258-T1299 VanDerWaalsContact O-CG2 3.3Å; P1258-T1299 WeakPolarHBondContact O-CG2 3.1Å; I1261-T1299 HydrophobicContact CB-CG2 4.44Å; I1261-T1299 HydrophobicContact CG2-CG2 4.28Å; M1265-T1299 HydrophobicContact CE-CG2 3.47Å; M1265-T1299 WeakPolarHBondContact CE-OG1 3.36Å; M1265-T1299 HydrophobicContact CG-CG2 4.48Å; M1265-T1299 HydrophobicContact SD-CG2 4.29Å; L1295-T1299 VanDerWaalsContact O-CB 3.32Å; L1295-T1299 WeakPolarHBondContact O-CB 3.39Å; L1295-T1299 VanDerWaalsContact O-CG2 3.26Å; L1295-T1299 WeakPolarHBondContact O-CG2 3.32Å; L1295-T1299 PolarHBondContact O-N 3.04Å; L1295-T1299 VanDerWaalsContact O-N 3.09Å; L1295-T1299 PolarHBondContact O-OG1 3.16Å; V1296-T1299 PolarHBondContact O-N 3.01Å; T1299-Y1301 VanDerWaalsContact C-N 3.26Å; T1299-Y1301 PolarHBondContact O-N 3.13Å; T1299-Y1301 WeakPolarHBondContact OG1-CB 3.26Å; T1299-Y1301 PolarHBondContact OG1-N 3.25Å
1300G85.2Confident87.1Confident45.8 Ų45.837.1 Ų37.147%0.47219%0.19SC..THydrogen-bonded Turntrans69.319.6-174.800000113.4V1296 H1298 V1302V1296-G1300 PolarHBondContact O-N 3.07Å; V1296-G1300 VanDerWaalsContact O-N 3.16Å; H1298-G1300 VanDerWaalsContact C-N 3.34Å; G1300-V1302 PolarHBondContact O-N 3.13Å
1301Y85.9Confident86.6Confident8.8 Ų8.839.9 Ų39.94%0.03521%0.205CC..  trans-80.157.5-176.4-158.4-109.8000112.1Y1262 M1265 D1266 I1269 T1299 I1304 P1305 R1308Y1262-Y1301 HydrophobicContact CD2-CD2 4.19Å; Y1262-Y1301 HydrophobicContact CE1-CD2 4.47Å; Y1262-Y1301 HydrophobicContact CE1-CE2 4.43Å; Y1262-Y1301 AromaticContact CE2-CD2 3.61Å; Y1262-Y1301 HydrophobicContact CE2-CD2 3.61Å; Y1262-Y1301 VanDerWaalsContact CE2-CD2 3.48Å; Y1262-Y1301 HydrophobicContact CE2-CE2 4.16Å; Y1262-Y1301 HydrophobicContact CE2-CG 4.38Å; Y1262-Y1301 AromaticContact CZ-CD2 3.64Å; Y1262-Y1301 AromaticContact CZ-CE2 3.87Å; M1265-Y1301 HydrophobicContact CB-CD1 4.2Å; M1265-Y1301 HydrophobicContact CB-CE1 4.14Å; M1265-Y1301 HydrophobicContact CB-CG 4.32Å; M1265-Y1301 HydrophobicContact CE-CD1 3.98Å; M1265-Y1301 HydrophobicContact CE-CG 4.35Å; M1265-Y1301 HydrophobicContact CG-CD1 4.34Å; M1265-Y1301 HydrophobicContact CG-CG 4.39Å; D1266-Y1301 PolarHBondContact OD1-OH 2.98Å; I1269-Y1301 HydrophobicContact CD1-CD1 3.99Å; I1269-Y1301 HydrophobicContact CD1-CE1 3.65Å; T1299-Y1301 VanDerWaalsContact C-N 3.26Å; T1299-Y1301 PolarHBondContact O-N 3.13Å; T1299-Y1301 WeakPolarHBondContact OG1-CB 3.26Å; T1299-Y1301 PolarHBondContact OG1-N 3.25Å; Y1301-I1304 HydrophobicContact CD1-CB 4.03Å; Y1301-I1304 HydrophobicContact CD1-CG2 4.35Å; Y1301-I1304 HydrophobicContact CD2-CB 4.39Å; Y1301-I1304 HydrophobicContact CD2-CD1 3.99Å; Y1301-I1304 HydrophobicContact CE1-CB 4.09Å; Y1301-I1304 HydrophobicContact CE1-CG2 3.96Å; Y1301-I1304 HydrophobicContact CE2-CB 4.1Å; Y1301-I1304 HydrophobicContact CE2-CD1 3.86Å; Y1301-I1304 HydrophobicContact CE2-CG1 4.46Å; Y1301-I1304 HydrophobicContact CE2-CG2 3.84Å; Y1301-I1304 HydrophobicContact CG-CB 4.32Å; Y1301-I1304 HydrophobicContact CG-CD1 4.22Å; Y1301-I1304 VanDerWaalsContact CZ-CG2 3.48Å; Y1301-I1304 VanDerWaalsContact OH-CG2 3.24Å; Y1301-I1304 WeakPolarHBondContact OH-CG2 3.3Å; Y1301-P1305 HydrophobicContact CD1-CG 3.6Å; Y1301-P1305 VanDerWaalsContact CD1-CG 3.45Å; Y1301-P1305 HydrophobicContact CE1-CG 3.96Å; Y1301-P1305 WeakPolarHBondContact O-CD 3.31Å; Y1301-P1305 VanDerWaalsContact O-CG 3.26Å; Y1301-P1305 WeakPolarHBondContact O-CG 3.37Å; Y1301-R1308 VanDerWaalsContact OH-CD 3.28Å; Y1301-R1308 WeakPolarHBondContact OH-CD 3.38Å; Y1301-R1308 PolarHBondContact OH-NE 3.18Å; Y1301-R1308 PolarHBondContact OH-NH1 3.14Å
1302V86.1Confident86.5Confident48 Ų4840 Ų4029%0.29121%0.205SC..  trans-89147.2-173.4-1700000110.3V1296 G1300 I1304 V1338 L1339V1296-V1302 HydrophobicContact CG1-CG2 4.25Å; G1300-V1302 PolarHBondContact O-N 3.13Å; V1302-I1304 PolarHBondContact O-N 3.21Å; V1302-V1338 VanDerWaalsContact CG1-O 3.27Å; V1302-V1338 WeakPolarHBondContact CG1-O 3.37Å; V1302-L1339 VanDerWaalsContact CG1-C 3.45Å; V1302-L1339 WeakPolarHBondContact CG1-O 3.25Å
1303V83Confident86.3Confident46.6 Ų46.640.8 Ų40.828%0.28221%0.209SC..SBendtrans62-41.3-176.2-171.10000116P1305 Y1306 K1307 L1339 L1342V1303-P1305 VanDerWaalsContact C-CD 3.41Å; V1303-P1305 VanDerWaalsContact C-N 3.32Å; V1303-Y1306 WeakPolarHBondContact O-CB 3.34Å; V1303-Y1306 PolarHBondContact O-N 3.2Å; V1303-Y1306 VanDerWaalsContact O-N 3.09Å; V1303-K1307 PolarHBondContact O-N 3.34Å; V1303-L1339 PolarHBondContact N-O 3.05Å; V1303-L1339 VanDerWaalsContact N-O 3.08Å; V1303-L1342 HydrophobicContact CG1-CD1 4.14Å
1304I85.1Confident86.1Confident61.4 Ų61.444.9 Ų44.932%0.31523%0.231SC..Hα-helixtrans-54.4-38.3-179.7-54.2168.4000112.8Y1301 V1302 Y1306 K1307 R1308Y1301-I1304 HydrophobicContact CD1-CB 4.03Å; Y1301-I1304 HydrophobicContact CD1-CG2 4.35Å; Y1301-I1304 HydrophobicContact CD2-CB 4.39Å; Y1301-I1304 HydrophobicContact CD2-CD1 3.99Å; Y1301-I1304 HydrophobicContact CE1-CB 4.09Å; Y1301-I1304 HydrophobicContact CE1-CG2 3.96Å; Y1301-I1304 HydrophobicContact CE2-CB 4.1Å; Y1301-I1304 HydrophobicContact CE2-CD1 3.86Å; Y1301-I1304 HydrophobicContact CE2-CG1 4.46Å; Y1301-I1304 HydrophobicContact CE2-CG2 3.84Å; Y1301-I1304 HydrophobicContact CG-CB 4.32Å; Y1301-I1304 HydrophobicContact CG-CD1 4.22Å; Y1301-I1304 VanDerWaalsContact CZ-CG2 3.48Å; Y1301-I1304 VanDerWaalsContact OH-CG2 3.24Å; Y1301-I1304 WeakPolarHBondContact OH-CG2 3.3Å; V1302-I1304 PolarHBondContact O-N 3.21Å; I1304-Y1306 VanDerWaalsContact C-N 3.28Å; I1304-Y1306 PolarHBondContact O-N 3.21Å; I1304-K1307 WeakPolarHBondContact O-CA 3.46Å; I1304-K1307 WeakPolarHBondContact O-CB 3.38Å; I1304-K1307 PolarHBondContact O-N 2.97Å; I1304-K1307 VanDerWaalsContact O-N 3.09Å; I1304-R1308 HydrophobicContact CG2-CG 4.1Å; I1304-R1308 WeakPolarHBondContact O-CB 3.44Å; I1304-R1308 PolarHBondContact O-N 3.1Å
1305P84.7Confident85.9Confident0 Ų042.3 Ų42.30%022%0.222CC..Hα-helixtrans-53.5-38.9172.9-30.837.9000113.8I1269 V1296 Y1301 V1303 K1307 R1308 Y1309 L1312 L1339I1269-P1305 HydrophobicContact CD1-CB 4.06Å; I1269-P1305 HydrophobicContact CD1-CG 4.01Å; V1296-P1305 HydrophobicContact CG2-CG 4.29Å; Y1301-P1305 HydrophobicContact CD1-CG 3.6Å; Y1301-P1305 VanDerWaalsContact CD1-CG 3.45Å; Y1301-P1305 HydrophobicContact CE1-CG 3.96Å; Y1301-P1305 WeakPolarHBondContact O-CD 3.31Å; Y1301-P1305 VanDerWaalsContact O-CG 3.26Å; Y1301-P1305 WeakPolarHBondContact O-CG 3.37Å; V1303-P1305 VanDerWaalsContact C-CD 3.41Å; V1303-P1305 VanDerWaalsContact C-N 3.32Å; P1305-K1307 VanDerWaalsContact C-N 3.32Å; P1305-K1307 PolarHBondContact O-N 3.15Å; P1305-R1308 PolarHBondContact O-N 3.04Å; P1305-Y1309 CarbonylContact O-C 3.56Å; P1305-Y1309 WeakPolarHBondContact O-CA 3.35Å; P1305-Y1309 WeakPolarHBondContact O-CB 3.38Å; P1305-Y1309 PolarHBondContact O-N 3.22Å; P1305-L1312 HydrophobicContact CB-CD2 3.64Å; P1305-L1339 HydrophobicContact CB-CD2 3.85Å; P1305-L1339 HydrophobicContact CG-CD2 3.7Å
1306Y84.9Confident85.9Confident4.2 Ų4.242.3 Ų42.32%0.01622%0.222CC..Hα-helixtrans-70.4-31.7177.7-61.7-50.6000112.7V1303 I1304 P1310 L1312 L1313 L1339 G1340 L1342V1303-Y1306 WeakPolarHBondContact O-CB 3.34Å; V1303-Y1306 PolarHBondContact O-N 3.2Å; V1303-Y1306 VanDerWaalsContact O-N 3.09Å; I1304-Y1306 VanDerWaalsContact C-N 3.28Å; I1304-Y1306 PolarHBondContact O-N 3.21Å; Y1306-P1310 WeakPolarHBondContact O-CA 3.42Å; Y1306-L1312 HydrophobicContact CD1-CB 4.39Å; Y1306-L1312 HydrophobicContact CD1-CD2 4.39Å; Y1306-L1312 HydrophobicContact CD1-CG 4.47Å; Y1306-L1312 HydrophobicContact CE1-CB 4.49Å; Y1306-L1312 HydrophobicContact CE1-CD2 4.39Å; Y1306-L1312 HydrophobicContact CE1-CG 4.4Å; Y1306-L1313 HydrophobicContact CD1-CB 3.99Å; Y1306-L1313 HydrophobicContact CE1-CB 3.73Å; Y1306-L1313 HydrophobicContact CE1-CD1 3.99Å; Y1306-L1313 HydrophobicContact CE1-CG 4.37Å; Y1306-L1339 HydrophobicContact CE1-CD1 4.22Å; Y1306-L1339 HydrophobicContact CE2-CB 3.82Å; Y1306-L1339 VanDerWaalsContact OH-CB 3.29Å; Y1306-L1339 WeakPolarHBondContact OH-CB 3.3Å; Y1306-L1339 WeakPolarHBondContact OH-CD1 3.36Å; Y1306-G1340 WeakPolarHBondContact CE2-O 3.27Å; Y1306-L1342 HydrophobicContact CD1-CD2 4.3Å; Y1306-L1342 HydrophobicContact CD2-CB 4.22Å; Y1306-L1342 HydrophobicContact CD2-CD1 4.03Å; Y1306-L1342 HydrophobicContact CD2-CD2 4.08Å; Y1306-L1342 HydrophobicContact CD2-CG 4.39Å; Y1306-L1342 HydrophobicContact CE2-CB 4.37Å; Y1306-L1342 HydrophobicContact CE2-CD2 4.36Å; Y1306-L1342 HydrophobicContact CG-CD1 4.34Å; Y1306-L1342 HydrophobicContact CG-CD2 4.09Å
1307K82.1Confident85.8Confident141 Ų14144.6 Ų44.661%0.61323%0.234SC*.Hα-helixtrans-72.3-39.4174.5-175.9177.9178.5-1790112V1303 I1304 P1305 Y1350V1303-K1307 PolarHBondContact O-N 3.34Å; I1304-K1307 WeakPolarHBondContact O-CA 3.46Å; I1304-K1307 WeakPolarHBondContact O-CB 3.38Å; I1304-K1307 PolarHBondContact O-N 2.97Å; I1304-K1307 VanDerWaalsContact O-N 3.09Å; P1305-K1307 VanDerWaalsContact C-N 3.32Å; P1305-K1307 PolarHBondContact O-N 3.15Å; K1307-Y1350 HydrophobicContact CB-CD1 4.48Å; K1307-Y1350 HydrophobicContact CB-CD2 4.23Å; K1307-Y1350 HydrophobicContact CB-CE1 4.32Å; K1307-Y1350 HydrophobicContact CB-CE2 4.07Å; K1307-Y1350 HydrophobicContact CB-CG 4.42Å; K1307-Y1350 HydrophobicContact CD-CE1 4.3Å; K1307-Y1350 HydrophobicContact CG-CD1 4.25Å; K1307-Y1350 HydrophobicContact CG-CD2 4.42Å; K1307-Y1350 HydrophobicContact CG-CE1 4.01Å; K1307-Y1350 HydrophobicContact CG-CE2 4.25Å; K1307-Y1350 HydrophobicContact CG-CG 4.31Å
1308R81.5Confident85.7Confident116.8 Ų116.843.2 Ų43.244%0.44123%0.227SC..Hα-helixtrans-86-26.6-176.4-100.2148.4175.6172.4-2.3113.5R995 D1266 Y1301 I1304 P1305R995-R1308 VanDerWaalsContact CD-CZ 3.48Å; R995-R1308 VanDerWaalsContact CG-NH2 3.25Å; R995-R1308 PolarHBondContact NH2-O 3.19Å; D1266-R1308 WeakPolarHBondContact OD1-CD 3.35Å; D1266-R1308 IonicContact OD1-CZ 2.93Å; D1266-R1308 IonicContact OD1-NE 3.05Å; D1266-R1308 IonicContact OD1-NH1 2.95Å; D1266-R1308 PolarHBondContact OD1-NH1 3.17Å; D1266-R1308 IonicContact OD2-CZ 3.49Å; D1266-R1308 IonicContact OD2-NE 3.07Å; D1266-R1308 PolarHBondContact OD2-NE 3.31Å; D1266-R1308 IonicContact OD2-NH1 3.17Å; D1266-R1308 PolarHBondContact OD2-NH1 3.18Å; D1266-R1308 IonicContact OD2-NH2 3.04Å; D1266-R1308 PolarHBondContact OD2-NH2 3.43Å; Y1301-R1308 VanDerWaalsContact OH-CD 3.28Å; Y1301-R1308 WeakPolarHBondContact OH-CD 3.38Å; Y1301-R1308 PolarHBondContact OH-NE 3.18Å; Y1301-R1308 PolarHBondContact OH-NH1 3.14Å; I1304-R1308 HydrophobicContact CG2-CG 4.1Å; I1304-R1308 WeakPolarHBondContact O-CB 3.44Å; I1304-R1308 PolarHBondContact O-N 3.1Å; P1305-R1308 PolarHBondContact O-N 3.04Å
1309Y83.2Confident85.7Confident32.2 Ų32.241.1 Ų41.113%0.12622%0.217CC..  trans-138.478.1180-80.3-80.5000110.3R995 D1266 I1269 P1270 A1273 P1305 Q1311 L1312 I1315R995-Y1309 VanDerWaalsContact CZ-OH 3.24Å; R995-Y1309 PolarHBondContact NH1-OH 3.43Å; R995-Y1309 VanDerWaalsContact NH2-CE2 3.32Å; R995-Y1309 VanDerWaalsContact NH2-CZ 3.34Å; R995-Y1309 PolarHBondContact NH2-OH 3.09Å; R995-Y1309 VanDerWaalsContact NH2-OH 3.16Å; D1266-Y1309 PolarHBondContact O-OH 3.24Å; I1269-Y1309 HydrophobicContact CB-CD2 3.89Å; I1269-Y1309 HydrophobicContact CB-CE2 3.89Å; I1269-Y1309 HydrophobicContact CD1-CD2 4.46Å; I1269-Y1309 HydrophobicContact CG2-CD1 4.45Å; I1269-Y1309 HydrophobicContact CG2-CD2 3.37Å; I1269-Y1309 VanDerWaalsContact CG2-CD2 3.43Å; I1269-Y1309 HydrophobicContact CG2-CE2 3.9Å; I1269-Y1309 HydrophobicContact CG2-CG 3.88Å; P1270-Y1309 HydrophobicContact CB-CD1 4.43Å; P1270-Y1309 HydrophobicContact CB-CD2 4.49Å; P1270-Y1309 HydrophobicContact CB-CE1 3.66Å; P1270-Y1309 HydrophobicContact CB-CE2 4.27Å; P1270-Y1309 WeakPolarHBondContact CB-OH 3.29Å; P1270-Y1309 WeakPolarHBondContact CD-OH 3.33Å; P1270-Y1309 HydrophobicContact CG-CD2 4.27Å; P1270-Y1309 HydrophobicContact CG-CE1 3.87Å; P1270-Y1309 HydrophobicContact CG-CE2 4.29Å; P1270-Y1309 WeakPolarHBondContact CG-OH 3.38Å; A1273-Y1309 HydrophobicContact CB-CD1 4.12Å; A1273-Y1309 HydrophobicContact CB-CE1 3.41Å; A1273-Y1309 VanDerWaalsContact CB-CE1 3.41Å; P1305-Y1309 CarbonylContact O-C 3.56Å; P1305-Y1309 WeakPolarHBondContact O-CA 3.35Å; P1305-Y1309 WeakPolarHBondContact O-CB 3.38Å; P1305-Y1309 PolarHBondContact O-N 3.22Å; Y1309-Q1311 HydrophobicContact CD1-CB 4.28Å; Y1309-Q1311 HydrophobicContact CE1-CB 3.78Å; Y1309-Q1311 PolarHBondContact O-N 3.13Å; Y1309-Q1311 VanDerWaalsContact O-N 3.12Å; Y1309-L1312 HydrophobicContact CD1-CB 3.89Å; Y1309-L1312 VanDerWaalsContact O-CB 3.24Å; Y1309-L1312 WeakPolarHBondContact O-CB 3.32Å; Y1309-L1312 PolarHBondContact O-N 3.1Å; Y1309-I1315 HydrophobicContact CE1-CD1 3.71Å
1310P81.2Confident85.7Confident41.4 Ų41.441.8 Ų41.827%0.26922%0.221SC..THydrogen-bonded Turntrans-62.1-24.5-173.723.3-33.8000113.9Y1306 L1312 F1347 Y1350Y1306-P1310 WeakPolarHBondContact O-CA 3.42Å; P1310-L1312 VanDerWaalsContact C-N 3.27Å; P1310-L1312 PolarHBondContact O-N 3.12Å; P1310-L1312 VanDerWaalsContact O-N 3.15Å; P1310-F1347 HydrophobicContact CB-CE2 4.28Å; P1310-F1347 WeakPolarHBondContact O-CE2 3.49Å; P1310-F1347 WeakPolarHBondContact O-CZ 3.4Å; P1310-Y1350 VanDerWaalsContact CB-O 3.28Å; P1310-Y1350 WeakPolarHBondContact CB-O 3.43Å; P1310-Y1350 WeakPolarHBondContact CG-O 3.45Å
1311Q83Confident85.8Confident103.4 Ų103.446.7 Ų46.748%0.48323%0.229SC..Hα-helixtrans-67.4-18.3175.7-62.8-178.5-200113.6Y1309 L1313 N1314 I1315Y1309-Q1311 HydrophobicContact CD1-CB 4.28Å; Y1309-Q1311 HydrophobicContact CE1-CB 3.78Å; Y1309-Q1311 PolarHBondContact O-N 3.13Å; Y1309-Q1311 VanDerWaalsContact O-N 3.12Å; Q1311-L1313 VanDerWaalsContact C-N 3.32Å; Q1311-L1313 PolarHBondContact O-N 3.14Å; Q1311-N1314 PolarHBondContact O-N 3.15Å; Q1311-N1314 VanDerWaalsContact O-N 3.14Å; Q1311-I1315 HydrophobicContact CB-CD1 4.2Å; Q1311-I1315 WeakPolarHBondContact O-CD1 3.42Å; Q1311-I1315 VanDerWaalsContact O-CG1 3.3Å; Q1311-I1315 WeakPolarHBondContact O-CG1 3.4Å; Q1311-I1315 PolarHBondContact O-N 3.14Å
1312L87.7Confident85.8Confident1.6 Ų1.653.7 Ų53.71%0.00826%0.255CS..Hα-helixtrans-56.6-43.1-174.5-178.160.9000112.8I1269 M1276 L1292 P1305 Y1306 Y1309 P1310 I1315 L1316 L1339I1269-L1312 HydrophobicContact CG2-CD2 4.46Å; M1276-L1312 HydrophobicContact CE-CD1 3.78Å; L1292-L1312 HydrophobicContact CD2-CD1 3.99Å; L1292-L1312 HydrophobicContact CD2-CD2 4.4Å; P1305-L1312 HydrophobicContact CB-CD2 3.64Å; Y1306-L1312 HydrophobicContact CD1-CB 4.39Å; Y1306-L1312 HydrophobicContact CD1-CD2 4.39Å; Y1306-L1312 HydrophobicContact CD1-CG 4.47Å; Y1306-L1312 HydrophobicContact CE1-CB 4.49Å; Y1306-L1312 HydrophobicContact CE1-CD2 4.39Å; Y1306-L1312 HydrophobicContact CE1-CG 4.4Å; Y1309-L1312 HydrophobicContact CD1-CB 3.89Å; Y1309-L1312 VanDerWaalsContact O-CB 3.24Å; Y1309-L1312 WeakPolarHBondContact O-CB 3.32Å; Y1309-L1312 PolarHBondContact O-N 3.1Å; P1310-L1312 VanDerWaalsContact C-N 3.27Å; P1310-L1312 PolarHBondContact O-N 3.12Å; P1310-L1312 VanDerWaalsContact O-N 3.15Å; L1312-I1315 PolarHBondContact O-N 3.06Å; L1312-L1316 HydrophobicContact CD1-CD1 4.34Å; L1312-L1316 HydrophobicContact CD1-CG 4.37Å; L1312-L1316 HydrophobicContact CG-CD1 4.2Å; L1312-L1316 WeakPolarHBondContact O-CG 3.39Å; L1312-L1316 PolarHBondContact O-N 3.1Å; L1312-L1339 HydrophobicContact CD2-CD1 4.14Å; L1312-L1339 HydrophobicContact CD2-CD2 4.37Å
1313L88.2Confident85.7Confident18.6 Ų18.652 Ų5210%0.09724%0.244CC..Hα-helixtrans-64.7-43.4179.8-174.659.9000111.4Y1306 Q1311 I1315 L1316 L1317 L1336 L1342 F1347 Y2178Y1306-L1313 HydrophobicContact CD1-CB 3.99Å; Y1306-L1313 HydrophobicContact CE1-CB 3.73Å; Y1306-L1313 HydrophobicContact CE1-CD1 3.99Å; Y1306-L1313 HydrophobicContact CE1-CG 4.37Å; Q1311-L1313 VanDerWaalsContact C-N 3.32Å; Q1311-L1313 PolarHBondContact O-N 3.14Å; L1313-I1315 VanDerWaalsContact C-N 3.31Å; L1313-I1315 PolarHBondContact O-N 3.27Å; L1313-L1316 PolarHBondContact O-N 3.13Å; L1313-L1317 HydrophobicContact CD1-CD1 4.19Å; L1313-L1317 HydrophobicContact CD1-CG 4.28Å; L1313-L1317 HydrophobicContact CG-CD1 3.99Å; L1313-L1317 HydrophobicContact CG-CG 4.46Å; L1313-L1317 WeakPolarHBondContact O-CB 3.28Å; L1313-L1317 VanDerWaalsContact O-CG 3.3Å; L1313-L1317 WeakPolarHBondContact O-CG 3.36Å; L1313-L1317 PolarHBondContact O-N 3.24Å; L1313-L1336 HydrophobicContact CD1-CD2 3.66Å; L1313-L1342 HydrophobicContact CD2-CD2 4.08Å; L1313-F1347 HydrophobicContact CB-CD2 4.42Å; L1313-F1347 HydrophobicContact CB-CE2 4.05Å; L1313-F1347 HydrophobicContact CB-CZ 4.15Å; L1313-F1347 HydrophobicContact CD2-CD1 4.34Å; L1313-F1347 HydrophobicContact CD2-CD2 3.53Å; L1313-F1347 HydrophobicContact CD2-CE1 4.23Å; L1313-F1347 HydrophobicContact CD2-CE2 3.7Å; L1313-F1347 VanDerWaalsContact CD2-CE2 3.48Å; L1313-F1347 HydrophobicContact CD2-CG 4.12Å; L1313-F1347 HydrophobicContact CD2-CZ 4.13Å; L1313-F1347 HydrophobicContact CG-CE2 4.26Å; L1313-F1347 HydrophobicContact CG-CZ 4.48Å; L1313-Y2178 HydrophobicContact CD1-CE2 4.33Å; L1313-Y2178 HydrophobicContact CD2-CD2 3.91Å; L1313-Y2178 HydrophobicContact CD2-CE2 3.37Å; L1313-Y2178 HydrophobicContact CG-CE2 4.26Å
1314N87.1Confident85.7Confident90.6 Ų90.658.2 Ų58.248%0.48427%0.27SS..Hα-helixtrans-65.5-35.1177.7-69.4-20.8000111.9Q1311 G1318Q1311-N1314 PolarHBondContact O-N 3.15Å; Q1311-N1314 VanDerWaalsContact O-N 3.14Å; N1314-G1318 WeakPolarHBondContact O-CA 3.29Å; N1314-G1318 PolarHBondContact O-N 3.25Å
1315I88.9Confident85.6Confident14.8 Ų14.858.4 Ų58.48%0.07627%0.271CS..Hα-helixtrans-65.4-49.4174.9-64.9159.7000110.3A1273 M1276 Q1277 Y1309 Q1311 L1312 L1313 G1318 M1319A1273-I1315 HydrophobicContact CB-CD1 4.11Å; M1276-I1315 HydrophobicContact CB-CG2 4.04Å; M1276-I1315 HydrophobicContact CE-CG2 4.36Å; Q1277-I1315 HydrophobicContact CG-CD1 4.43Å; Q1277-I1315 HydrophobicContact CG-CG1 4.22Å; Q1277-I1315 HydrophobicContact CG-CG2 4.03Å; Q1277-I1315 VanDerWaalsContact NE2-CD1 3.26Å; Y1309-I1315 HydrophobicContact CE1-CD1 3.71Å; Q1311-I1315 HydrophobicContact CB-CD1 4.2Å; Q1311-I1315 WeakPolarHBondContact O-CD1 3.42Å; Q1311-I1315 VanDerWaalsContact O-CG1 3.3Å; Q1311-I1315 WeakPolarHBondContact O-CG1 3.4Å; Q1311-I1315 PolarHBondContact O-N 3.14Å; L1312-I1315 PolarHBondContact O-N 3.06Å; L1313-I1315 VanDerWaalsContact C-N 3.31Å; L1313-I1315 PolarHBondContact O-N 3.27Å; I1315-G1318 CarbonylContact O-C 3.55Å; I1315-G1318 WeakPolarHBondContact O-CA 3.41Å; I1315-G1318 PolarHBondContact O-N 3.24Å; I1315-M1319 HydrophobicContact CG2-CG 4.45Å; I1315-M1319 HydrophobicContact CG2-SD 4.44Å; I1315-M1319 WeakPolarHBondContact O-CG 3.31Å; I1315-M1319 PolarHBondContact O-N 3.19Å
1316L90.5Very high85.7Confident0 Ų063.9 Ų63.90%030%0.295CS..Hα-helixtrans-63.3-46.3179.8-70.7170000112.1M1276 V1289 L1312 L1313 G1318 M1319 L1320 V1332 A1335 L1336 L1339M1276-L1316 HydrophobicContact CE-CD2 4.19Å; M1276-L1316 VanDerWaalsContact CE-CD2 3.45Å; M1276-L1316 HydrophobicContact CE-CG 3.82Å; M1276-L1316 HydrophobicContact SD-CD2 3.76Å; V1289-L1316 HydrophobicContact CG1-CD2 4.48Å; L1312-L1316 HydrophobicContact CD1-CD1 4.34Å; L1312-L1316 HydrophobicContact CD1-CG 4.37Å; L1312-L1316 HydrophobicContact CG-CD1 4.2Å; L1312-L1316 WeakPolarHBondContact O-CG 3.39Å; L1312-L1316 PolarHBondContact O-N 3.1Å; L1313-L1316 PolarHBondContact O-N 3.13Å; L1316-G1318 VanDerWaalsContact C-N 3.29Å; L1316-G1318 PolarHBondContact O-N 3.15Å; L1316-M1319 WeakPolarHBondContact O-CB 3.31Å; L1316-M1319 PolarHBondContact O-N 3.23Å; L1316-M1319 VanDerWaalsContact O-N 3.1Å; L1316-L1320 PolarHBondContact O-N 3.16Å; L1316-L1320 VanDerWaalsContact O-N 3.11Å; L1316-V1332 HydrophobicContact CB-CG1 4.29Å; L1316-V1332 HydrophobicContact CD2-CG1 4.24Å; L1316-V1332 HydrophobicContact CD2-CG2 4.43Å; L1316-V1332 WeakPolarHBondContact O-CG1 3.32Å; L1316-A1335 HydrophobicContact CD1-CB 4.48Å; L1316-A1335 HydrophobicContact CD2-CB 4.28Å; L1316-L1336 HydrophobicContact CB-CD2 3.91Å; L1316-L1336 HydrophobicContact CB-CG 4.34Å; L1316-L1336 HydrophobicContact CD1-CD2 3.86Å; L1316-L1336 HydrophobicContact CD1-CG 4.4Å; L1316-L1336 HydrophobicContact CG-CD2 4.48Å; L1316-L1339 HydrophobicContact CD1-CD1 3.59Å; L1316-L1339 VanDerWaalsContact CD1-CD1 3.48Å
1317L89.1Confident85.6Confident49.4 Ų49.466.2 Ų66.226%0.25931%0.311SS..Hα-helixtrans-64-35.3174.5-67.6175.3000111.8L1313 M1319 L1320 K1321 L1336 A2174 Y2178L1313-L1317 HydrophobicContact CD1-CD1 4.19Å; L1313-L1317 HydrophobicContact CD1-CG 4.28Å; L1313-L1317 HydrophobicContact CG-CD1 3.99Å; L1313-L1317 HydrophobicContact CG-CG 4.46Å; L1313-L1317 WeakPolarHBondContact O-CB 3.28Å; L1313-L1317 VanDerWaalsContact O-CG 3.3Å; L1313-L1317 WeakPolarHBondContact O-CG 3.36Å; L1313-L1317 PolarHBondContact O-N 3.24Å; L1317-M1319 VanDerWaalsContact C-N 3.34Å; L1317-L1320 HydrophobicContact CD2-CD1 4.3Å; L1317-L1320 PolarHBondContact O-N 2.97Å; L1317-K1321 WeakPolarHBondContact O-CG 3.32Å; L1317-K1321 PolarHBondContact O-N 3.12Å; L1317-L1336 HydrophobicContact CD2-CD1 4.22Å; L1317-A2174 HydrophobicContact CD2-CB 4.24Å; L1317-Y2178 HydrophobicContact CD1-CD2 4.25Å
1318G87.7Confident85.8Confident16.4 Ų16.459.6 Ų59.617%0.16928%0.283CS..Hα-helixtrans-65.9-38.2172.600000112.9N1314 I1315 L1316 K1321 R1322N1314-G1318 WeakPolarHBondContact O-CA 3.29Å; N1314-G1318 PolarHBondContact O-N 3.25Å; I1315-G1318 CarbonylContact O-C 3.55Å; I1315-G1318 WeakPolarHBondContact O-CA 3.41Å; I1315-G1318 PolarHBondContact O-N 3.24Å; L1316-G1318 VanDerWaalsContact C-N 3.29Å; L1316-G1318 PolarHBondContact O-N 3.15Å; G1318-K1321 WeakPolarHBondContact O-CB 3.36Å; G1318-K1321 PolarHBondContact O-N 3.08Å; G1318-R1322 WeakPolarHBondContact O-CB 3.34Å; G1318-R1322 VanDerWaalsContact O-CG 3.29Å; G1318-R1322 WeakPolarHBondContact O-CG 3.35Å; G1318-R1322 PolarHBondContact O-N 3.03Å; G1318-R1322 PolarHBondContact O-NE 2.93Å
1319M86.7Confident86.2Confident3.4 Ų3.457.8 Ų57.82%0.01728%0.276CS..Hα-helixtrans-65.1-41.9173.8-72.8-176.773.300111.7M1276 R1285 V1289 I1315 L1316 L1317 K1321 R1322 E1323 I1328 V1332M1276-M1319 HydrophobicContact CB-CE 4.47Å; M1276-M1319 HydrophobicContact CB-SD 3.62Å; M1276-M1319 VanDerWaalsContact CB-SD 3.53Å; M1276-M1319 HydrophobicContact CE-SD 3.73Å; M1276-M1319 HydrophobicContact CG-CE 4.47Å; M1276-M1319 HydrophobicContact CG-SD 3.86Å; M1276-M1319 HydrophobicContact SD-SD 4.01Å; R1285-M1319 HydrophobicContact CB-CE 3.93Å; R1285-M1319 HydrophobicContact CG-CE 4.41Å; V1289-M1319 HydrophobicContact CG2-CE 3.51Å; V1289-M1319 VanDerWaalsContact CG2-CE 3.48Å; V1289-M1319 HydrophobicContact CG2-SD 3.86Å; I1315-M1319 HydrophobicContact CG2-CG 4.45Å; I1315-M1319 HydrophobicContact CG2-SD 4.44Å; I1315-M1319 WeakPolarHBondContact O-CG 3.31Å; I1315-M1319 PolarHBondContact O-N 3.19Å; L1316-M1319 WeakPolarHBondContact O-CB 3.31Å; L1316-M1319 PolarHBondContact O-N 3.23Å; L1316-M1319 VanDerWaalsContact O-N 3.1Å; L1317-M1319 VanDerWaalsContact C-N 3.34Å; M1319-K1321 PolarHBondContact O-N 3.02Å; M1319-R1322 PolarHBondContact O-N 3.14Å; M1319-R1322 VanDerWaalsContact O-N 3.12Å; M1319-E1323 HydrophobicContact CB-CG 4.43Å; M1319-E1323 HydrophobicContact CE-CG 4.41Å; M1319-E1323 VanDerWaalsContact CE-OE1 3.29Å; M1319-E1323 WeakPolarHBondContact CE-OE1 3.29Å; M1319-E1323 VanDerWaalsContact O-CB 3.3Å; M1319-E1323 WeakPolarHBondContact O-CB 3.41Å; M1319-E1323 VanDerWaalsContact O-CG 3.26Å; M1319-E1323 WeakPolarHBondContact O-CG 3.33Å; M1319-E1323 PolarHBondContact O-N 3.24Å; M1319-I1328 HydrophobicContact CE-CG2 4.12Å; M1319-V1332 HydrophobicContact CB-CG2 4.16Å; M1319-V1332 HydrophobicContact CE-CG2 4.21Å; M1319-V1332 HydrophobicContact SD-CG2 4.35Å
1320L87.9Confident86.5Confident34 Ų3459.2 Ų59.218%0.17828%0.283CS..Hα-helixtrans-58.9-31.7176.8-153.780.7000112.6L1316 L1317 R1329 V1332 L1333 L1336 D2167 L2170L1316-L1320 PolarHBondContact O-N 3.16Å; L1316-L1320 VanDerWaalsContact O-N 3.11Å; L1317-L1320 HydrophobicContact CD2-CD1 4.3Å; L1317-L1320 PolarHBondContact O-N 2.97Å; L1320-R1329 HydrophobicContact CD1-CB 4.07Å; L1320-R1329 HydrophobicContact CD1-CG 4.22Å; L1320-R1329 HydrophobicContact CD2-CB 4.23Å; L1320-V1332 HydrophobicContact CB-CG1 4.22Å; L1320-V1332 HydrophobicContact CD1-CG1 4.35Å; L1320-V1332 HydrophobicContact CD2-CB 4.04Å; L1320-V1332 HydrophobicContact CD2-CG1 3.8Å; L1320-V1332 HydrophobicContact CG-CB 4.46Å; L1320-V1332 HydrophobicContact CG-CG1 3.69Å; L1320-L1333 HydrophobicContact CD1-CD1 4.4Å; L1320-L1333 HydrophobicContact CD1-CD2 4.29Å; L1320-L1333 HydrophobicContact CD1-CG 4.11Å; L1320-L1333 HydrophobicContact CD2-CD2 4.15Å; L1320-L1333 HydrophobicContact CD2-CG 4.11Å; L1320-L1336 HydrophobicContact CD1-CD1 3.79Å; L1320-D2167 VanDerWaalsContact CD1-OD1 3.28Å; L1320-D2167 WeakPolarHBondContact CD1-OD1 3.33Å; L1320-L2170 HydrophobicContact CD2-CB 3.69Å
1321K87.4Confident86.7Confident148.4 Ų148.458.6 Ų58.665%0.64528%0.277SS*.Hα-helixtrans-80.9-38.5175.6-66.8178.8-177.6-178.90113.7L1317 G1318 M1319 A2174L1317-K1321 WeakPolarHBondContact O-CG 3.32Å; L1317-K1321 PolarHBondContact O-N 3.12Å; G1318-K1321 WeakPolarHBondContact O-CB 3.36Å; G1318-K1321 PolarHBondContact O-N 3.08Å; M1319-K1321 PolarHBondContact O-N 3.02Å; K1321-A2174 PolarHBondContact NZ-O 3.42Å
1322R85.6Confident87.1Confident155.8 Ų155.853.7 Ų53.759%0.58825%0.254SS*.Hα-helixtrans-86.3-28.4-173.1-70.9-177.6-73.7-137.61.5114.2G1318 M1319G1318-R1322 WeakPolarHBondContact O-CB 3.34Å; G1318-R1322 VanDerWaalsContact O-CG 3.29Å; G1318-R1322 WeakPolarHBondContact O-CG 3.35Å; G1318-R1322 PolarHBondContact O-N 3.03Å; G1318-R1322 PolarHBondContact O-NE 2.93Å; M1319-R1322 PolarHBondContact O-N 3.14Å; M1319-R1322 VanDerWaalsContact O-N 3.12Å
1323E83.2Confident87.4Confident11.2 Ų11.256.5 Ų56.55%0.05227%0.269CS..  trans-89.4130.9-172.4-100.8-73.9-157.100111.7R1285 M1319 I1325 I1328 R1329R1285-E1323 VanDerWaalsContact CD-OE1 3.29Å; R1285-E1323 WeakPolarHBondContact CD-OE1 3.31Å; R1285-E1323 IonicContact CZ-OE1 3.01Å; R1285-E1323 VanDerWaalsContact CZ-OE1 3.27Å; R1285-E1323 IonicContact CZ-OE2 3.45Å; R1285-E1323 VanDerWaalsContact CZ-OE2 3.25Å; R1285-E1323 IonicContact NE-OE1 3.08Å; R1285-E1323 PolarHBondContact NE-OE1 3.31Å; R1285-E1323 VanDerWaalsContact NE-OE1 3.08Å; R1285-E1323 IonicContact NE-OE2 3.31Å; R1285-E1323 PolarHBondContact NE-OE2 3.21Å; R1285-E1323 IonicContact NH1-OE1 3.18Å; R1285-E1323 PolarHBondContact NH1-OE1 3.35Å; R1285-E1323 IonicContact NH1-OE2 3.74Å; R1285-E1323 PolarHBondContact NH1-OE2 3.24Å; R1285-E1323 VanDerWaalsContact NH2-CD 3.33Å; R1285-E1323 IonicContact NH2-OE1 2.86Å; R1285-E1323 PolarHBondContact NH2-OE1 3.13Å; R1285-E1323 IonicContact NH2-OE2 3.55Å; R1285-E1323 PolarHBondContact NH2-OE2 3.34Å; R1285-E1323 VanDerWaalsContact NH2-OE2 3.11Å; M1319-E1323 HydrophobicContact CB-CG 4.43Å; M1319-E1323 HydrophobicContact CE-CG 4.41Å; M1319-E1323 VanDerWaalsContact CE-OE1 3.29Å; M1319-E1323 WeakPolarHBondContact CE-OE1 3.29Å; M1319-E1323 VanDerWaalsContact O-CB 3.3Å; M1319-E1323 WeakPolarHBondContact O-CB 3.41Å; M1319-E1323 VanDerWaalsContact O-CG 3.26Å; M1319-E1323 WeakPolarHBondContact O-CG 3.33Å; M1319-E1323 PolarHBondContact O-N 3.24Å; E1323-I1325 HydrophobicContact CG-CB 4.43Å; E1323-I1328 HydrophobicContact CB-CG2 4.46Å; E1323-I1328 HydrophobicContact CG-CB 4.03Å; E1323-I1328 HydrophobicContact CG-CD1 4.02Å; E1323-I1328 HydrophobicContact CG-CG1 4.42Å; E1323-I1328 HydrophobicContact CG-CG2 3.88Å; E1323-I1328 WeakPolarHBondContact OE1-CD1 3.45Å; E1323-I1328 WeakPolarHBondContact OE2-CB 3.47Å; E1323-I1328 WeakPolarHBondContact OE2-CG2 3.48Å; E1323-R1329 HydrophobicContact CB-CG 4.36Å; E1323-R1329 VanDerWaalsContact O-CD 3.23Å; E1323-R1329 WeakPolarHBondContact O-CD 3.42Å; E1323-R1329 PolarHBondContact O-NE 3.43Å; E1323-R1329 PolarHBondContact O-NH1 3.47Å; E1323-R1329 PolarHBondContact O-NH2 3.1Å
1324E84Confident87.5Confident176.8 Ų176.859.3 Ų59.383%0.82628%0.278SS*.  trans-89.2-25.9176.3-61.9-177.2167.300112.4K1326 R1329E1324-K1326 PolarHBondContact O-N 3.26Å; E1324-R1329 PolarHBondContact O-NH2 2.88Å
1325I83.2Confident87.7Confident66.6 Ų66.655 Ų5534%0.34226%0.255SS..  trans-73.5117.3-172.3-51.5177.8000110.5F1282 E1323 C1327 I1328 R1329F1282-I1325 HydrophobicContact CB-CD1 4.13Å; F1282-I1325 HydrophobicContact CD1-CD1 4.37Å; F1282-I1325 HydrophobicContact CD2-CD1 3.82Å; F1282-I1325 HydrophobicContact CE2-CD1 4.31Å; F1282-I1325 HydrophobicContact CG-CD1 3.97Å; E1323-I1325 HydrophobicContact CG-CB 4.43Å; I1325-C1327 VanDerWaalsContact C-N 3.32Å; I1325-C1327 WeakPolarHBondContact CG2-SG 3.4Å; I1325-C1327 PolarHBondContact O-N 3Å; I1325-I1328 HydrophobicContact CB-CD1 4.18Å; I1325-I1328 HydrophobicContact CB-CG1 4.22Å; I1325-I1328 HydrophobicContact CD1-CD1 4.03Å; I1325-I1328 HydrophobicContact CG2-CD1 4.39Å; I1325-I1328 HydrophobicContact CG2-CG1 4.29Å; I1325-I1328 PolarHBondContact O-N 3.22Å; I1325-I1328 VanDerWaalsContact O-N 3.1Å; I1325-R1329 PolarHBondContact O-N 3.14Å; I1325-R1329 VanDerWaalsContact O-N 3.15Å
1326K86.1Confident87.8Confident114.6 Ų114.655.2 Ų55.250%0.49826%0.256SS..Hα-helixtrans-54.7-41.7-176.9-156.1-173.5-174.4-178.30113.7E1324 I1328 R1329 Q1330 D2164E1324-K1326 PolarHBondContact O-N 3.26Å; K1326-I1328 VanDerWaalsContact C-N 3.33Å; K1326-I1328 PolarHBondContact O-N 3.3Å; K1326-R1329 PolarHBondContact O-N 3.19Å; K1326-Q1330 HydrophobicContact CG-CG 4.43Å; K1326-Q1330 WeakPolarHBondContact O-CB 3.26Å; K1326-Q1330 WeakPolarHBondContact O-CG 3.32Å; K1326-Q1330 PolarHBondContact O-N 3.19Å; K1326-Q1330 PolarHBondContact O-OE1 2.71Å; K1326-D2164 VanDerWaalsContact CE-CG 3.48Å; K1326-D2164 WeakPolarHBondContact CE-OD1 3.22Å; K1326-D2164 WeakPolarHBondContact CE-OD2 3.36Å; K1326-D2164 IonicContact NZ-OD1 2.78Å; K1326-D2164 PolarHBondContact NZ-OD1 3.28Å; K1326-D2164 IonicContact NZ-OD2 2.67Å; K1326-D2164 PolarHBondContact NZ-OD2 2.96Å
1327C82.4Confident87.9Confident54 Ų5456.9 Ų56.937%0.36527%0.274SS..Hα-helixtrans-65.2-36.4-17864.60000112.6F1183 I1325 Q1330 E1331F1183-C1327 HydrophobicContact CD2-CB 3.94Å; F1183-C1327 HydrophobicContact CE1-CB 4.38Å; F1183-C1327 HydrophobicContact CE2-CB 3.6Å; F1183-C1327 HydrophobicContact CG-CB 4.48Å; F1183-C1327 HydrophobicContact CZ-CB 3.85Å; F1183-C1327 WeakPolarHBondContact CZ-SG 3.46Å; I1325-C1327 VanDerWaalsContact C-N 3.32Å; I1325-C1327 WeakPolarHBondContact CG2-SG 3.4Å; I1325-C1327 PolarHBondContact O-N 3Å; C1327-Q1330 PolarHBondContact O-N 2.93Å; C1327-E1331 WeakPolarHBondContact O-CB 3.23Å; C1327-E1331 PolarHBondContact O-N 2.91Å; C1327-E1331 VanDerWaalsContact O-N 3.12Å
1328I86.4Confident88Confident2.6 Ų2.655.8 Ų55.81%0.01327%0.269CS..Hα-helixtrans-70.6-41.9176.5-53.5179.7000109.9F1282 M1319 E1323 I1325 K1326 Q1330 E1331 V1332F1282-I1328 HydrophobicContact CB-CD1 4.28Å; F1282-I1328 HydrophobicContact CD2-CD1 4.38Å; M1319-I1328 HydrophobicContact CE-CG2 4.12Å; E1323-I1328 HydrophobicContact CB-CG2 4.46Å; E1323-I1328 HydrophobicContact CG-CB 4.03Å; E1323-I1328 HydrophobicContact CG-CD1 4.02Å; E1323-I1328 HydrophobicContact CG-CG1 4.42Å; E1323-I1328 HydrophobicContact CG-CG2 3.88Å; E1323-I1328 WeakPolarHBondContact OE1-CD1 3.45Å; E1323-I1328 WeakPolarHBondContact OE2-CB 3.47Å; E1323-I1328 WeakPolarHBondContact OE2-CG2 3.48Å; I1325-I1328 HydrophobicContact CB-CD1 4.18Å; I1325-I1328 HydrophobicContact CB-CG1 4.22Å; I1325-I1328 HydrophobicContact CD1-CD1 4.03Å; I1325-I1328 HydrophobicContact CG2-CD1 4.39Å; I1325-I1328 HydrophobicContact CG2-CG1 4.29Å; I1325-I1328 PolarHBondContact O-N 3.22Å; I1325-I1328 VanDerWaalsContact O-N 3.1Å; K1326-I1328 VanDerWaalsContact C-N 3.33Å; K1326-I1328 PolarHBondContact O-N 3.3Å; I1328-Q1330 VanDerWaalsContact C-N 3.31Å; I1328-Q1330 PolarHBondContact O-N 3.09Å; I1328-E1331 WeakPolarHBondContact O-CB 3.44Å; I1328-E1331 PolarHBondContact O-N 3.19Å; I1328-E1331 VanDerWaalsContact O-N 3.14Å; I1328-V1332 HydrophobicContact CG2-CG2 4.3Å; I1328-V1332 WeakPolarHBondContact O-CB 3.45Å; I1328-V1332 VanDerWaalsContact O-CG2 3.28Å; I1328-V1332 WeakPolarHBondContact O-CG2 3.35Å; I1328-V1332 PolarHBondContact O-N 3.11Å
1329R90.2Very high88.1Confident79 Ų7955.1 Ų55.130%0.29826%0.262SS..Hα-helixtrans-58.9-42.4174.6-67.5-178.1137.6156.70.8112.2L1320 E1323 E1324 I1325 K1326 E1331 V1332 L1333 D2167 T2171L1320-R1329 HydrophobicContact CD1-CB 4.07Å; L1320-R1329 HydrophobicContact CD1-CG 4.22Å; L1320-R1329 HydrophobicContact CD2-CB 4.23Å; E1323-R1329 HydrophobicContact CB-CG 4.36Å; E1323-R1329 VanDerWaalsContact O-CD 3.23Å; E1323-R1329 WeakPolarHBondContact O-CD 3.42Å; E1323-R1329 PolarHBondContact O-NE 3.43Å; E1323-R1329 PolarHBondContact O-NH1 3.47Å; E1323-R1329 PolarHBondContact O-NH2 3.1Å; E1324-R1329 PolarHBondContact O-NH2 2.88Å; I1325-R1329 PolarHBondContact O-N 3.14Å; I1325-R1329 VanDerWaalsContact O-N 3.15Å; K1326-R1329 PolarHBondContact O-N 3.19Å; R1329-E1331 VanDerWaalsContact C-N 3.34Å; R1329-E1331 PolarHBondContact O-N 3.2Å; R1329-V1332 WeakPolarHBondContact O-CB 3.39Å; R1329-V1332 PolarHBondContact O-N 3.22Å; R1329-L1333 WeakPolarHBondContact O-CB 3.41Å; R1329-L1333 VanDerWaalsContact O-CG 3.27Å; R1329-L1333 WeakPolarHBondContact O-CG 3.38Å; R1329-L1333 PolarHBondContact O-N 3.15Å; R1329-D2167 IonicContact CZ-OD1 3.44Å; R1329-D2167 IonicContact CZ-OD2 3.49Å; R1329-D2167 IonicContact NE-OD1 3.61Å; R1329-D2167 PolarHBondContact NE-OD1 3.48Å; R1329-D2167 IonicContact NE-OD2 3.79Å; R1329-D2167 PolarHBondContact NE-OD2 2.88Å; R1329-D2167 VanDerWaalsContact NH2-CG 3.3Å; R1329-D2167 IonicContact NH2-OD1 3.74Å; R1329-D2167 PolarHBondContact NH2-OD1 2.99Å; R1329-D2167 IonicContact NH2-OD2 2.98Å; R1329-D2167 PolarHBondContact NH2-OD2 3.17Å; R1329-T2171 PolarHBondContact NH2-OG1 2.72Å
1330Q89Confident88.1Confident60.8 Ų60.855.6 Ų55.628%0.28427%0.267SS..Hα-helixtrans-63.2-42.6175.3-73.7174.1-28.500112.1K1326 C1327 I1328 V1332 L1333 R1334 D2164K1326-Q1330 HydrophobicContact CG-CG 4.43Å; K1326-Q1330 WeakPolarHBondContact O-CB 3.26Å; K1326-Q1330 WeakPolarHBondContact O-CG 3.32Å; K1326-Q1330 PolarHBondContact O-N 3.19Å; K1326-Q1330 PolarHBondContact O-OE1 2.71Å; C1327-Q1330 PolarHBondContact O-N 2.93Å; I1328-Q1330 VanDerWaalsContact C-N 3.31Å; I1328-Q1330 PolarHBondContact O-N 3.09Å; Q1330-V1332 PolarHBondContact O-N 3.4Å; Q1330-L1333 PolarHBondContact O-N 3.3Å; Q1330-R1334 WeakPolarHBondContact O-CB 3.34Å; Q1330-R1334 PolarHBondContact O-N 3.14Å; Q1330-D2164 PolarHBondContact NE2-OD1 3.23Å
1331E86.8Confident88Confident28.4 Ų28.457.2 Ų57.213%0.13329%0.286CS..Hα-helixtrans-67.7-36.2176.3-13215.3-164.500112.1V1289 W1290 T1293 C1327 I1328 R1329 R1334 A1335V1289-E1331 HydrophobicContact CB-CG 4.18Å; V1289-E1331 HydrophobicContact CG1-CB 4.15Å; V1289-E1331 HydrophobicContact CG1-CG 3.86Å; V1289-E1331 WeakPolarHBondContact CG1-O 3.38Å; W1290-E1331 VanDerWaalsContact CA-OE1 3.27Å; W1290-E1331 WeakPolarHBondContact CA-OE1 3.49Å; W1290-E1331 HydrophobicContact CB-CG 4.11Å; T1293-E1331 WeakPolarHBondContact CB-OE1 3.42Å; T1293-E1331 WeakPolarHBondContact CG2-OE1 3.17Å; T1293-E1331 PolarHBondContact OG1-OE1 2.98Å; C1327-E1331 WeakPolarHBondContact O-CB 3.23Å; C1327-E1331 PolarHBondContact O-N 2.91Å; C1327-E1331 VanDerWaalsContact O-N 3.12Å; I1328-E1331 WeakPolarHBondContact O-CB 3.44Å; I1328-E1331 PolarHBondContact O-N 3.19Å; I1328-E1331 VanDerWaalsContact O-N 3.14Å; R1329-E1331 VanDerWaalsContact C-N 3.34Å; R1329-E1331 PolarHBondContact O-N 3.2Å; E1331-R1334 VanDerWaalsContact CD-NH1 3.31Å; E1331-R1334 WeakPolarHBondContact O-CB 3.35Å; E1331-R1334 PolarHBondContact O-N 3.04Å; E1331-R1334 IonicContact OE1-CZ 3.56Å; E1331-R1334 VanDerWaalsContact OE1-CZ 3.24Å; E1331-R1334 IonicContact OE1-NE 3.24Å; E1331-R1334 PolarHBondContact OE1-NE 2.91Å; E1331-R1334 IonicContact OE1-NH1 3.03Å; E1331-R1334 PolarHBondContact OE1-NH1 3.03Å; E1331-R1334 IonicContact OE1-NH2 3.02Å; E1331-R1334 PolarHBondContact OE1-NH2 3.25Å; E1331-R1334 IonicContact OE2-CZ 3Å; E1331-R1334 IonicContact OE2-NE 3.3Å; E1331-R1334 PolarHBondContact OE2-NE 2.91Å; E1331-R1334 VanDerWaalsContact OE2-NE 3.08Å; E1331-R1334 IonicContact OE2-NH1 3.42Å; E1331-R1334 PolarHBondContact OE2-NH1 3.45Å; E1331-R1334 IonicContact OE2-NH2 2.92Å; E1331-R1334 PolarHBondContact OE2-NH2 3.16Å; E1331-A1335 WeakPolarHBondContact O-CB 3.37Å; E1331-A1335 PolarHBondContact O-N 3.1Å
1332V92Very high87.8Confident0.2 Ų0.251.2 Ų51.20%0.00126%0.261CS..Hα-helixtrans-65.3-42.7173.31700000111.1V1289 L1316 M1319 L1320 I1328 R1329 Q1330 R1334 A1335 L1336V1289-V1332 HydrophobicContact CB-CG2 4.44Å; V1289-V1332 HydrophobicContact CG1-CB 4.42Å; V1289-V1332 HydrophobicContact CG1-CG2 3.85Å; V1289-V1332 HydrophobicContact CG2-CG2 3.87Å; L1316-V1332 HydrophobicContact CB-CG1 4.29Å; L1316-V1332 HydrophobicContact CD2-CG1 4.24Å; L1316-V1332 HydrophobicContact CD2-CG2 4.43Å; L1316-V1332 WeakPolarHBondContact O-CG1 3.32Å; M1319-V1332 HydrophobicContact CB-CG2 4.16Å; M1319-V1332 HydrophobicContact CE-CG2 4.21Å; M1319-V1332 HydrophobicContact SD-CG2 4.35Å; L1320-V1332 HydrophobicContact CB-CG1 4.22Å; L1320-V1332 HydrophobicContact CD1-CG1 4.35Å; L1320-V1332 HydrophobicContact CD2-CB 4.04Å; L1320-V1332 HydrophobicContact CD2-CG1 3.8Å; L1320-V1332 HydrophobicContact CG-CB 4.46Å; L1320-V1332 HydrophobicContact CG-CG1 3.69Å; I1328-V1332 HydrophobicContact CG2-CG2 4.3Å; I1328-V1332 WeakPolarHBondContact O-CB 3.45Å; I1328-V1332 VanDerWaalsContact O-CG2 3.28Å; I1328-V1332 WeakPolarHBondContact O-CG2 3.35Å; I1328-V1332 PolarHBondContact O-N 3.11Å; R1329-V1332 WeakPolarHBondContact O-CB 3.39Å; R1329-V1332 PolarHBondContact O-N 3.22Å; Q1330-V1332 PolarHBondContact O-N 3.4Å; V1332-R1334 VanDerWaalsContact C-N 3.31Å; V1332-R1334 PolarHBondContact O-N 3.26Å; V1332-A1335 WeakPolarHBondContact O-CB 3.33Å; V1332-A1335 PolarHBondContact O-N 3.25Å; V1332-L1336 HydrophobicContact CG1-CD1 4.34Å; V1332-L1336 WeakPolarHBondContact O-CG 3.35Å; V1332-L1336 PolarHBondContact O-N 3.05Å
1333L92Very high87.7Confident61.2 Ų61.246.6 Ų46.632%0.3225%0.248SC..Hα-helixtrans-63.5-38.7174.2-86.2153.2000111.6L1320 R1329 Q1330 L1336 G1337 D2167 L2170 T2188L1320-L1333 HydrophobicContact CD1-CD1 4.4Å; L1320-L1333 HydrophobicContact CD1-CD2 4.29Å; L1320-L1333 HydrophobicContact CD1-CG 4.11Å; L1320-L1333 HydrophobicContact CD2-CD2 4.15Å; L1320-L1333 HydrophobicContact CD2-CG 4.11Å; R1329-L1333 WeakPolarHBondContact O-CB 3.41Å; R1329-L1333 VanDerWaalsContact O-CG 3.27Å; R1329-L1333 WeakPolarHBondContact O-CG 3.38Å; R1329-L1333 PolarHBondContact O-N 3.15Å; Q1330-L1333 PolarHBondContact O-N 3.3Å; L1333-L1336 PolarHBondContact O-N 3.14Å; L1333-G1337 PolarHBondContact O-N 3.09Å; L1333-D2167 HydrophobicContact CD1-CB 3.5Å; L1333-L2170 HydrophobicContact CD2-CD1 3.4Å; L1333-L2170 VanDerWaalsContact CD2-CD1 3.4Å; L1333-T2188 HydrophobicContact CD2-CG2 3.89Å
1334R91.1Very high87.6Confident76.4 Ų76.449.1 Ų49.129%0.28827%0.265SS..Hα-helixtrans-64.6-42.2173.6-163.5176.5121.4163.48.3111.6D421 W1290 T1293 Q1330 E1331 V1332 L1336 G1337 V1338 S2192 E2195D421-R1334 PolarHBondContact O-NH1 3.16Å; W1290-R1334 VanDerWaalsContact CD1-NH2 3.35Å; T1293-R1334 HydrophobicContact CG2-CB 4.38Å; T1293-R1334 HydrophobicContact CG2-CG 3.98Å; Q1330-R1334 WeakPolarHBondContact O-CB 3.34Å; Q1330-R1334 PolarHBondContact O-N 3.14Å; E1331-R1334 VanDerWaalsContact CD-NH1 3.31Å; E1331-R1334 WeakPolarHBondContact O-CB 3.35Å; E1331-R1334 PolarHBondContact O-N 3.04Å; E1331-R1334 IonicContact OE1-CZ 3.56Å; E1331-R1334 VanDerWaalsContact OE1-CZ 3.24Å; E1331-R1334 IonicContact OE1-NE 3.24Å; E1331-R1334 PolarHBondContact OE1-NE 2.91Å; E1331-R1334 IonicContact OE1-NH1 3.03Å; E1331-R1334 PolarHBondContact OE1-NH1 3.03Å; E1331-R1334 IonicContact OE1-NH2 3.02Å; E1331-R1334 PolarHBondContact OE1-NH2 3.25Å; E1331-R1334 IonicContact OE2-CZ 3Å; E1331-R1334 IonicContact OE2-NE 3.3Å; E1331-R1334 PolarHBondContact OE2-NE 2.91Å; E1331-R1334 VanDerWaalsContact OE2-NE 3.08Å; E1331-R1334 IonicContact OE2-NH1 3.42Å; E1331-R1334 PolarHBondContact OE2-NH1 3.45Å; E1331-R1334 IonicContact OE2-NH2 2.92Å; E1331-R1334 PolarHBondContact OE2-NH2 3.16Å; V1332-R1334 VanDerWaalsContact C-N 3.31Å; V1332-R1334 PolarHBondContact O-N 3.26Å; R1334-L1336 PolarHBondContact O-N 3.36Å; R1334-G1337 PolarHBondContact O-N 2.9Å; R1334-V1338 HydrophobicContact CG-CG2 4.45Å; R1334-V1338 WeakPolarHBondContact O-CB 3.31Å; R1334-V1338 VanDerWaalsContact O-CG2 3.31Å; R1334-V1338 WeakPolarHBondContact O-CG2 3.45Å; R1334-V1338 PolarHBondContact O-N 3.17Å; R1334-S2192 PolarHBondContact O-OG 2.94Å; R1334-E2195 IonicContact CZ-OE2 3.03Å; R1334-E2195 IonicContact NE-OE2 3.77Å; R1334-E2195 PolarHBondContact NE-OE2 2.86Å; R1334-E2195 IonicContact NH2-OE1 2.7Å; R1334-E2195 IonicContact NH2-OE2 3.5Å; R1334-E2195 PolarHBondContact NH2-OE2 2.89Å
1335A91.3Very high87.4Confident1 Ų145.8 Ų45.81%0.00825%0.248CC..Hα-helixtrans-59.5-46.4174.900000111.6V1289 T1293 L1316 E1331 V1332 G1337 V1338 L1339V1289-A1335 HydrophobicContact CG1-CB 3.95Å; T1293-A1335 VanDerWaalsContact OG1-CA 3.26Å; T1293-A1335 WeakPolarHBondContact OG1-CA 3.42Å; T1293-A1335 VanDerWaalsContact OG1-CB 3.26Å; T1293-A1335 WeakPolarHBondContact OG1-CB 3.3Å; L1316-A1335 HydrophobicContact CD1-CB 4.48Å; L1316-A1335 HydrophobicContact CD2-CB 4.28Å; E1331-A1335 WeakPolarHBondContact O-CB 3.37Å; E1331-A1335 PolarHBondContact O-N 3.1Å; V1332-A1335 WeakPolarHBondContact O-CB 3.33Å; V1332-A1335 PolarHBondContact O-N 3.25Å; A1335-G1337 VanDerWaalsContact C-N 3.33Å; A1335-G1337 PolarHBondContact O-N 2.92Å; A1335-V1338 PolarHBondContact O-N 3.1Å; A1335-L1339 VanDerWaalsContact O-CB 3.29Å; A1335-L1339 WeakPolarHBondContact O-CB 3.36Å; A1335-L1339 WeakPolarHBondContact O-CD1 3.4Å; A1335-L1339 VanDerWaalsContact O-CG 3.26Å; A1335-L1339 WeakPolarHBondContact O-CG 3.41Å; A1335-L1339 PolarHBondContact O-N 3.25Å
1336L91.8Very high87.2Confident19.2 Ų19.247.1 Ų47.110%0.10125%0.251CS..Hα-helixtrans-61.1-41.8176-71.8170.5000111.9L1313 L1316 L1317 L1320 V1332 L1333 R1334 G1340 L2185L1313-L1336 HydrophobicContact CD1-CD2 3.66Å; L1316-L1336 HydrophobicContact CB-CD2 3.91Å; L1316-L1336 HydrophobicContact CB-CG 4.34Å; L1316-L1336 HydrophobicContact CD1-CD2 3.86Å; L1316-L1336 HydrophobicContact CD1-CG 4.4Å; L1316-L1336 HydrophobicContact CG-CD2 4.48Å; L1317-L1336 HydrophobicContact CD2-CD1 4.22Å; L1320-L1336 HydrophobicContact CD1-CD1 3.79Å; V1332-L1336 HydrophobicContact CG1-CD1 4.34Å; V1332-L1336 WeakPolarHBondContact O-CG 3.35Å; V1332-L1336 PolarHBondContact O-N 3.05Å; L1333-L1336 PolarHBondContact O-N 3.14Å; R1334-L1336 PolarHBondContact O-N 3.36Å; L1336-G1340 PolarHBondContact O-N 3.38Å; L1336-L2185 HydrophobicContact CB-CD2 4.26Å; L1336-L2185 HydrophobicContact CD1-CD2 4.13Å; L1336-L2185 HydrophobicContact CD2-CD2 4.39Å
1337G91Very high86.8Confident36.4 Ų36.442.9 Ų42.938%0.37523%0.233SC..Hα-helixtrans-64.9-44.3175.600000113.3L1333 R1334 A1335 L1339 G1340 T2188L1333-G1337 PolarHBondContact O-N 3.09Å; R1334-G1337 PolarHBondContact O-N 2.9Å; A1335-G1337 VanDerWaalsContact C-N 3.33Å; A1335-G1337 PolarHBondContact O-N 2.92Å; G1337-L1339 PolarHBondContact O-N 3.06Å; G1337-G1340 WeakPolarHBondContact O-CA 3.22Å; G1337-G1340 PolarHBondContact O-N 3.05Å; G1337-T2188 WeakPolarHBondContact CA-O 3.03Å
1338V91.2Very high86.6Confident25.4 Ų25.444.7 Ų44.715%0.15424%0.235CC..Hα-helixtrans-71.5-33.4-179.2169.80000112.4T1293 V1296 V1302 R1334 A1335 G1340T1293-V1338 HydrophobicContact CG2-CB 4.26Å; T1293-V1338 HydrophobicContact CG2-CG1 4.41Å; T1293-V1338 HydrophobicContact CG2-CG2 4Å; V1296-V1338 HydrophobicContact CB-CG1 4.05Å; V1296-V1338 HydrophobicContact CG1-CG1 3.76Å; V1302-V1338 VanDerWaalsContact CG1-O 3.27Å; V1302-V1338 WeakPolarHBondContact CG1-O 3.37Å; R1334-V1338 HydrophobicContact CG-CG2 4.45Å; R1334-V1338 WeakPolarHBondContact O-CB 3.31Å; R1334-V1338 VanDerWaalsContact O-CG2 3.31Å; R1334-V1338 WeakPolarHBondContact O-CG2 3.45Å; R1334-V1338 PolarHBondContact O-N 3.17Å; A1335-V1338 PolarHBondContact O-N 3.1Å; V1338-G1340 VanDerWaalsContact C-N 3.27Å; V1338-G1340 PolarHBondContact O-N 3.07Å
1339L90Very high86.1Confident1.8 Ų1.847.6 Ų47.61%0.00925%0.25CS..Hα-helixtrans-70.6-19.1173.6-76.7165.6000113.2V1296 V1302 V1303 P1305 Y1306 L1312 L1316 A1335 G1337V1296-L1339 HydrophobicContact CB-CD2 4.5Å; V1296-L1339 HydrophobicContact CG1-CD2 4.11Å; V1296-L1339 HydrophobicContact CG1-CG 4.48Å; V1296-L1339 HydrophobicContact CG2-CD2 3.93Å; V1302-L1339 VanDerWaalsContact CG1-C 3.45Å; V1302-L1339 WeakPolarHBondContact CG1-O 3.25Å; V1303-L1339 PolarHBondContact N-O 3.05Å; V1303-L1339 VanDerWaalsContact N-O 3.08Å; P1305-L1339 HydrophobicContact CB-CD2 3.85Å; P1305-L1339 HydrophobicContact CG-CD2 3.7Å; Y1306-L1339 HydrophobicContact CE1-CD1 4.22Å; Y1306-L1339 HydrophobicContact CE2-CB 3.82Å; Y1306-L1339 VanDerWaalsContact OH-CB 3.29Å; Y1306-L1339 WeakPolarHBondContact OH-CB 3.3Å; Y1306-L1339 WeakPolarHBondContact OH-CD1 3.36Å; L1312-L1339 HydrophobicContact CD2-CD1 4.14Å; L1312-L1339 HydrophobicContact CD2-CD2 4.37Å; L1316-L1339 HydrophobicContact CD1-CD1 3.59Å; L1316-L1339 VanDerWaalsContact CD1-CD1 3.48Å; A1335-L1339 VanDerWaalsContact O-CB 3.29Å; A1335-L1339 WeakPolarHBondContact O-CB 3.36Å; A1335-L1339 WeakPolarHBondContact O-CD1 3.4Å; A1335-L1339 VanDerWaalsContact O-CG 3.26Å; A1335-L1339 WeakPolarHBondContact O-CG 3.41Å; A1335-L1339 PolarHBondContact O-N 3.25Å; G1337-L1339 PolarHBondContact O-N 3.06Å
1340G87.3Confident85.4Confident13.2 Ų13.247 Ų4714%0.13625%0.248CC..  trans88.1154177.400000113.8Y1306 L1336 G1337 V1338 L1342Y1306-G1340 WeakPolarHBondContact CE2-O 3.27Å; L1336-G1340 PolarHBondContact O-N 3.38Å; G1337-G1340 WeakPolarHBondContact O-CA 3.22Å; G1337-G1340 PolarHBondContact O-N 3.05Å; V1338-G1340 VanDerWaalsContact C-N 3.27Å; V1338-G1340 PolarHBondContact O-N 3.07Å; G1340-L1342 PolarHBondContact O-N 3.17Å; G1340-L1342 VanDerWaalsContact O-N 3.12Å
1341A85.5Confident84.6Confident68 Ų6846.1 Ų46.156%0.56225%0.249SC*.  trans-69.8120.1175.200000110.6D1343 Y2182 L2185 V2186A1341-D1343 PolarHBondContact O-N 3.16Å; A1341-Y2182 HydrophobicContact CB-CE2 3.91Å; A1341-Y2182 PolarHBondContact O-OH 3.46Å; A1341-L2185 HydrophobicContact CB-CB 4.05Å; A1341-V2186 HydrophobicContact CB-CG2 3.86Å
1342L83.6Confident83.5Confident22.6 Ų22.646.7 Ų46.712%0.11826%0.262CS..  trans-93.8129.7177.7-175.664.3000110.2V1303 Y1306 L1313 G1340 P1344 K1346 F1347 Y1350 Y2178 Y2182V1303-L1342 HydrophobicContact CG1-CD1 4.14Å; Y1306-L1342 HydrophobicContact CD1-CD2 4.3Å; Y1306-L1342 HydrophobicContact CD2-CB 4.22Å; Y1306-L1342 HydrophobicContact CD2-CD1 4.03Å; Y1306-L1342 HydrophobicContact CD2-CD2 4.08Å; Y1306-L1342 HydrophobicContact CD2-CG 4.39Å; Y1306-L1342 HydrophobicContact CE2-CB 4.37Å; Y1306-L1342 HydrophobicContact CE2-CD2 4.36Å; Y1306-L1342 HydrophobicContact CG-CD1 4.34Å; Y1306-L1342 HydrophobicContact CG-CD2 4.09Å; L1313-L1342 HydrophobicContact CD2-CD2 4.08Å; G1340-L1342 PolarHBondContact O-N 3.17Å; G1340-L1342 VanDerWaalsContact O-N 3.12Å; L1342-P1344 WeakPolarHBondContact O-CD 3.39Å; L1342-K1346 HydrophobicContact CD1-CB 3.8Å; L1342-K1346 HydrophobicContact CD1-CD 4.15Å; L1342-K1346 HydrophobicContact CD2-CB 4.4Å; L1342-K1346 HydrophobicContact CG-CB 4.05Å; L1342-F1347 HydrophobicContact CD1-CB 4.48Å; L1342-F1347 HydrophobicContact CD2-CB 3.78Å; L1342-F1347 HydrophobicContact CD2-CD2 3.92Å; L1342-F1347 HydrophobicContact CD2-CE2 4.12Å; L1342-F1347 HydrophobicContact CD2-CG 4.03Å; L1342-F1347 HydrophobicContact CG-CB 4.2Å; L1342-F1347 HydrophobicContact CG-CD2 4.46Å; L1342-F1347 HydrophobicContact CG-CG 4.45Å; L1342-Y1350 HydrophobicContact CD1-CD2 4.41Å; L1342-Y1350 HydrophobicContact CD1-CE2 3.93Å; L1342-Y1350 HydrophobicContact CD2-CD2 3.94Å; L1342-Y1350 HydrophobicContact CD2-CE2 4.24Å; L1342-Y2178 PolarHBondContact N-OH 2.93Å; L1342-Y2178 VanDerWaalsContact O-CE1 3.28Å; L1342-Y2178 WeakPolarHBondContact O-CE1 3.3Å; L1342-Y2178 PolarHBondContact O-OH 3.38Å; L1342-Y2182 WeakPolarHBondContact O-CE2 3.46Å
1343D83.4Confident82Confident60 Ų6052.1 Ų52.132%0.32129%0.287SS..  trans-56.4126171.51721.9000110.6A1341 F1345 K1346 F1347A1341-D1343 PolarHBondContact O-N 3.16Å; D1343-F1345 PolarHBondContact O-N 3.12Å; D1343-F1345 VanDerWaalsContact O-N 3.14Å; D1343-F1345 WeakPolarHBondContact OD1-CB 3.43Å; D1343-F1345 PolarHBondContact OD1-N 3.15Å; D1343-K1346 HydrophobicContact CB-CB 4.19Å; D1343-K1346 HydrophobicContact CB-CD 4.09Å; D1343-K1346 HydrophobicContact CB-CG 4.11Å; D1343-K1346 CarbonylContact O-C 3.59Å; D1343-K1346 WeakPolarHBondContact O-CA 3.5Å; D1343-K1346 WeakPolarHBondContact O-CB 3.35Å; D1343-K1346 PolarHBondContact O-N 3.04Å; D1343-K1346 VanDerWaalsContact O-N 3.11Å; D1343-K1346 WeakPolarHBondContact OD2-CE 3.26Å; D1343-K1346 WeakPolarHBondContact OD2-CG 3.35Å; D1343-K1346 PolarHBondContact OD2-N 3.18Å; D1343-K1346 IonicContact OD2-NZ 3.4Å; D1343-F1347 PolarHBondContact O-N 3.21Å
1344P81.9Confident80.1Confident63.8 Ų63.850.7 Ų50.741%0.41428%0.281SS..Hα-helixtrans-52.1-32.9177.6-28.335.7000114.7L1342 F1347 K1348 Y2178 N2179 Y2182L1342-P1344 WeakPolarHBondContact O-CD 3.39Å; P1344-F1347 PolarHBondContact O-N 2.92Å; P1344-K1348 WeakPolarHBondContact O-CG 3.47Å; P1344-K1348 PolarHBondContact O-N 3.18Å; P1344-K1348 VanDerWaalsContact O-N 3.11Å; P1344-Y2178 HydrophobicContact CB-CD1 4.08Å; P1344-Y2178 HydrophobicContact CB-CE1 4.18Å; P1344-Y2178 HydrophobicContact CG-CD1 4.23Å; P1344-Y2178 HydrophobicContact CG-CE1 4.04Å; P1344-N2179 WeakPolarHBondContact CB-OD1 3.2Å; P1344-Y2182 HydrophobicContact CG-CD2 3.79Å; P1344-Y2182 HydrophobicContact CG-CE2 4.26Å; P1344-Y2182 HydrophobicContact CG-CG 3.96Å
1345F78.6Confident77.9Confident106.8 Ų106.851.8 Ų51.847%0.46829%0.293SS..Hα-helixtrans-68.5-47.3176.1-166.1-94.5000111.4D1343 F1347 K1348 L1349 V1354 T1360 A1363D1343-F1345 PolarHBondContact O-N 3.12Å; D1343-F1345 VanDerWaalsContact O-N 3.14Å; D1343-F1345 WeakPolarHBondContact OD1-CB 3.43Å; D1343-F1345 PolarHBondContact OD1-N 3.15Å; F1345-F1347 VanDerWaalsContact C-N 3.28Å; F1345-F1347 PolarHBondContact O-N 2.99Å; F1345-K1348 PolarHBondContact O-N 3.2Å; F1345-L1349 HydrophobicContact CE1-CD1 4.4Å; F1345-L1349 WeakPolarHBondContact O-CB 3.45Å; F1345-L1349 PolarHBondContact O-N 3.16Å; F1345-L1349 VanDerWaalsContact O-N 3.07Å; F1345-V1354 HydrophobicContact CE2-CG1 4.08Å; F1345-V1354 HydrophobicContact CZ-CG1 4.34Å; F1345-T1360 HydrophobicContact CE2-CG2 3.98Å; F1345-T1360 HydrophobicContact CZ-CG2 3.82Å; F1345-A1363 HydrophobicContact CE2-CB 3.84Å; F1345-A1363 HydrophobicContact CZ-CB 3.77Å; F1345-A1363 VanDerWaalsContact CZ-CB 3.43Å
1346K79.1Confident75.9Confident92.8 Ų92.857 Ų5740%0.40333%0.325SS..Hα-helixtrans-62.7-35174.8-67.5178.9-169.9170.30112.1L1342 D1343 L1349 Y1350L1342-K1346 HydrophobicContact CD1-CB 3.8Å; L1342-K1346 HydrophobicContact CD1-CD 4.15Å; L1342-K1346 HydrophobicContact CD2-CB 4.4Å; L1342-K1346 HydrophobicContact CG-CB 4.05Å; D1343-K1346 HydrophobicContact CB-CB 4.19Å; D1343-K1346 HydrophobicContact CB-CD 4.09Å; D1343-K1346 HydrophobicContact CB-CG 4.11Å; D1343-K1346 CarbonylContact O-C 3.59Å; D1343-K1346 WeakPolarHBondContact O-CA 3.5Å; D1343-K1346 WeakPolarHBondContact O-CB 3.35Å; D1343-K1346 PolarHBondContact O-N 3.04Å; D1343-K1346 VanDerWaalsContact O-N 3.11Å; D1343-K1346 WeakPolarHBondContact OD2-CE 3.26Å; D1343-K1346 WeakPolarHBondContact OD2-CG 3.35Å; D1343-K1346 PolarHBondContact OD2-N 3.18Å; D1343-K1346 IonicContact OD2-NZ 3.4Å; K1346-L1349 WeakPolarHBondContact O-CB 3.41Å; K1346-L1349 PolarHBondContact O-N 3.26Å; K1346-Y1350 HydrophobicContact CB-CE2 4.19Å; K1346-Y1350 WeakPolarHBondContact O-CB 3.48Å; K1346-Y1350 WeakPolarHBondContact O-CD2 3.25Å; K1346-Y1350 VanDerWaalsContact O-CG 3.27Å; K1346-Y1350 PolarHBondContact O-N 3.08Å
1347F78.8Confident73.5Confident27.6 Ų27.665.4 Ų65.412%0.12136%0.356CS..Hα-helixtrans-64.1-45.6174.6179.9-111.6000112.2P1310 L1313 L1342 D1343 P1344 F1345 L1349 Y1350 S1351 Y2178P1310-F1347 HydrophobicContact CB-CE2 4.28Å; P1310-F1347 WeakPolarHBondContact O-CE2 3.49Å; P1310-F1347 WeakPolarHBondContact O-CZ 3.4Å; L1313-F1347 HydrophobicContact CB-CD2 4.42Å; L1313-F1347 HydrophobicContact CB-CE2 4.05Å; L1313-F1347 HydrophobicContact CB-CZ 4.15Å; L1313-F1347 HydrophobicContact CD2-CD1 4.34Å; L1313-F1347 HydrophobicContact CD2-CD2 3.53Å; L1313-F1347 HydrophobicContact CD2-CE1 4.23Å; L1313-F1347 HydrophobicContact CD2-CE2 3.7Å; L1313-F1347 VanDerWaalsContact CD2-CE2 3.48Å; L1313-F1347 HydrophobicContact CD2-CG 4.12Å; L1313-F1347 HydrophobicContact CD2-CZ 4.13Å; L1313-F1347 HydrophobicContact CG-CE2 4.26Å; L1313-F1347 HydrophobicContact CG-CZ 4.48Å; L1342-F1347 HydrophobicContact CD1-CB 4.48Å; L1342-F1347 HydrophobicContact CD2-CB 3.78Å; L1342-F1347 HydrophobicContact CD2-CD2 3.92Å; L1342-F1347 HydrophobicContact CD2-CE2 4.12Å; L1342-F1347 HydrophobicContact CD2-CG 4.03Å; L1342-F1347 HydrophobicContact CG-CB 4.2Å; L1342-F1347 HydrophobicContact CG-CD2 4.46Å; L1342-F1347 HydrophobicContact CG-CG 4.45Å; D1343-F1347 PolarHBondContact O-N 3.21Å; P1344-F1347 PolarHBondContact O-N 2.92Å; F1345-F1347 VanDerWaalsContact C-N 3.28Å; F1345-F1347 PolarHBondContact O-N 2.99Å; F1347-L1349 VanDerWaalsContact C-N 3.31Å; F1347-L1349 PolarHBondContact O-N 3.29Å; F1347-Y1350 CarbonylContact O-C 3.56Å; F1347-Y1350 PolarHBondContact O-N 3.1Å; F1347-Y1350 VanDerWaalsContact O-N 3.15Å; F1347-S1351 WeakPolarHBondContact CE2-OG 3.45Å; F1347-S1351 VanDerWaalsContact O-CB 3.3Å; F1347-S1351 WeakPolarHBondContact O-CB 3.41Å; F1347-S1351 PolarHBondContact O-N 3.23Å; F1347-S1351 PolarHBondContact O-OG 2.88Å; F1347-Y2178 HydrophobicContact CB-CD1 4.3Å; F1347-Y2178 HydrophobicContact CB-CE1 4.11Å; F1347-Y2178 AromaticContact CD1-CD1 3.89Å; F1347-Y2178 HydrophobicContact CD1-CD1 3.89Å; F1347-Y2178 HydrophobicContact CD1-CE1 4.48Å; F1347-Y2178 AromaticContact CD1-CG 3.99Å; F1347-Y2178 HydrophobicContact CD1-CG 3.99Å; F1347-Y2178 HydrophobicContact CE1-CG 4.19Å; F1347-Y2178 HydrophobicContact CG-CD1 4.17Å; F1347-Y2178 HydrophobicContact CG-CE1 4.3Å; F1347-Y2178 HydrophobicContact CG-CG 4.44Å
1348K77.7Confident71.2Confident92.4 Ų92.466.7 Ų66.740%0.40237%0.37SS..Hα-helixtrans-60.9-40.3174.8-72.6-179.5177.2-174.80112P1344 F1345 S1351 G1352 Q1353 V1354P1344-K1348 WeakPolarHBondContact O-CG 3.47Å; P1344-K1348 PolarHBondContact O-N 3.18Å; P1344-K1348 VanDerWaalsContact O-N 3.11Å; F1345-K1348 PolarHBondContact O-N 3.2Å; K1348-S1351 CarbonylContact O-C 3.54Å; K1348-S1351 PolarHBondContact O-N 3.02Å; K1348-S1351 VanDerWaalsContact O-N 3.16Å; K1348-G1352 PolarHBondContact O-N 3.13Å; K1348-G1352 VanDerWaalsContact O-N 3.09Å; K1348-Q1353 HydrophobicContact CB-CB 4.34Å; K1348-Q1353 HydrophobicContact CG-CB 4.48Å; K1348-Q1353 WeakPolarHBondContact O-CB 3.24Å; K1348-Q1353 PolarHBondContact O-N 3.23Å; K1348-V1354 HydrophobicContact CB-CB 4.41Å; K1348-V1354 HydrophobicContact CB-CG2 3.86Å; K1348-V1354 HydrophobicContact CD-CG2 4.23Å
1349L75.1Confident68.7Low63.4 Ų63.473.6 Ų73.633%0.33241%0.406SS..Hα-helixtrans-61.6-47.9174.4-174.282.3000111.7F1345 K1346 F1347 S1351 G1352 V1354 T1356 Y1357F1345-L1349 HydrophobicContact CE1-CD1 4.4Å; F1345-L1349 WeakPolarHBondContact O-CB 3.45Å; F1345-L1349 PolarHBondContact O-N 3.16Å; F1345-L1349 VanDerWaalsContact O-N 3.07Å; K1346-L1349 WeakPolarHBondContact O-CB 3.41Å; K1346-L1349 PolarHBondContact O-N 3.26Å; F1347-L1349 VanDerWaalsContact C-N 3.31Å; F1347-L1349 PolarHBondContact O-N 3.29Å; L1349-S1351 VanDerWaalsContact C-N 3.31Å; L1349-S1351 PolarHBondContact O-N 3.08Å; L1349-G1352 PolarHBondContact O-N 3.15Å; L1349-V1354 HydrophobicContact CD1-CB 4.33Å; L1349-V1354 HydrophobicContact CD1-CG1 4.36Å; L1349-V1354 VanDerWaalsContact CD1-O 3.26Å; L1349-V1354 WeakPolarHBondContact CD1-O 3.36Å; L1349-T1356 HydrophobicContact CD1-CG2 3.86Å; L1349-T1356 VanDerWaalsContact CD1-CG2 3.41Å; L1349-T1356 HydrophobicContact CD2-CG2 4.27Å; L1349-T1356 HydrophobicContact CG-CG2 4.49Å; L1349-Y1357 HydrophobicContact CD1-CE2 4.48Å
1350Y77Confident66.4Low66 Ų6678.7 Ų78.726%0.25944%0.437SS..Hα-helixtrans-69.4-25.7177.7-61.6-22.1000113.4K1307 P1310 L1342 K1346 F1347 G1352K1307-Y1350 HydrophobicContact CB-CD1 4.48Å; K1307-Y1350 HydrophobicContact CB-CD2 4.23Å; K1307-Y1350 HydrophobicContact CB-CE1 4.32Å; K1307-Y1350 HydrophobicContact CB-CE2 4.07Å; K1307-Y1350 HydrophobicContact CB-CG 4.42Å; K1307-Y1350 HydrophobicContact CD-CE1 4.3Å; K1307-Y1350 HydrophobicContact CG-CD1 4.25Å; K1307-Y1350 HydrophobicContact CG-CD2 4.42Å; K1307-Y1350 HydrophobicContact CG-CE1 4.01Å; K1307-Y1350 HydrophobicContact CG-CE2 4.25Å; K1307-Y1350 HydrophobicContact CG-CG 4.31Å; P1310-Y1350 VanDerWaalsContact CB-O 3.28Å; P1310-Y1350 WeakPolarHBondContact CB-O 3.43Å; P1310-Y1350 WeakPolarHBondContact CG-O 3.45Å; L1342-Y1350 HydrophobicContact CD1-CD2 4.41Å; L1342-Y1350 HydrophobicContact CD1-CE2 3.93Å; L1342-Y1350 HydrophobicContact CD2-CD2 3.94Å; L1342-Y1350 HydrophobicContact CD2-CE2 4.24Å; K1346-Y1350 HydrophobicContact CB-CE2 4.19Å; K1346-Y1350 WeakPolarHBondContact O-CB 3.48Å; K1346-Y1350 WeakPolarHBondContact O-CD2 3.25Å; K1346-Y1350 VanDerWaalsContact O-CG 3.27Å; K1346-Y1350 PolarHBondContact O-N 3.08Å; F1347-Y1350 CarbonylContact O-C 3.56Å; F1347-Y1350 PolarHBondContact O-N 3.1Å; F1347-Y1350 VanDerWaalsContact O-N 3.15Å; Y1350-G1352 VanDerWaalsContact C-N 3.34Å; Y1350-G1352 PolarHBondContact O-N 3.28Å
1351S71Confident64.1Low42.4 Ų42.481.7 Ų81.730%0.29747%0.468SS..THydrogen-bonded Turntrans-81.5-0175.5-153.20000113.4F1347 K1348 L1349 Q1353F1347-S1351 WeakPolarHBondContact CE2-OG 3.45Å; F1347-S1351 VanDerWaalsContact O-CB 3.3Å; F1347-S1351 WeakPolarHBondContact O-CB 3.41Å; F1347-S1351 PolarHBondContact O-N 3.23Å; F1347-S1351 PolarHBondContact O-OG 2.88Å; K1348-S1351 CarbonylContact O-C 3.54Å; K1348-S1351 PolarHBondContact O-N 3.02Å; K1348-S1351 VanDerWaalsContact O-N 3.16Å; L1349-S1351 VanDerWaalsContact C-N 3.31Å; L1349-S1351 PolarHBondContact O-N 3.08Å; S1351-Q1353 VanDerWaalsContact C-N 3.26Å; S1351-Q1353 PolarHBondContact O-N 3.06Å
1352G64.1Low61.9Low39.8 Ų39.884.8 Ų84.841%0.4147%0.474SS..THydrogen-bonded Turntrans69.518.2-177.100000114.1K1348 L1349 Y1350 V1354 H1366K1348-G1352 PolarHBondContact O-N 3.13Å; K1348-G1352 VanDerWaalsContact O-N 3.09Å; L1349-G1352 PolarHBondContact O-N 3.15Å; Y1350-G1352 VanDerWaalsContact C-N 3.34Å; Y1350-G1352 PolarHBondContact O-N 3.28Å; G1352-V1354 VanDerWaalsContact C-N 3.3Å; G1352-V1354 PolarHBondContact O-N 3.01Å; G1352-H1366 PolarHBondContact O-CD2 2.91Å
1353Q60.5Low59.8Low113.2 Ų113.287 Ų8753%0.52950%0.495SS..SBendtrans-86.8-5178.8-66.7-174.8-20.100113K1348 S1351 H1366K1348-Q1353 HydrophobicContact CB-CB 4.34Å; K1348-Q1353 HydrophobicContact CG-CB 4.48Å; K1348-Q1353 WeakPolarHBondContact O-CB 3.24Å; K1348-Q1353 PolarHBondContact O-N 3.23Å; S1351-Q1353 VanDerWaalsContact C-N 3.26Å; S1351-Q1353 PolarHBondContact O-N 3.06Å; Q1353-H1366 WeakPolarHBondContact O-CB 3.29Å; Q1353-H1366 PolarHBondContact O-N 3.07Å
1354V51.3Low57.5Low32.4 Ų32.488.9 Ų88.920%0.19651%0.509CS..SBendtrans-138.8112.2178.2176.40000107.1F1345 K1348 L1349 G1352 T1356 A1363F1345-V1354 HydrophobicContact CE2-CG1 4.08Å; F1345-V1354 HydrophobicContact CZ-CG1 4.34Å; K1348-V1354 HydrophobicContact CB-CB 4.41Å; K1348-V1354 HydrophobicContact CB-CG2 3.86Å; K1348-V1354 HydrophobicContact CD-CG2 4.23Å; L1349-V1354 HydrophobicContact CD1-CB 4.33Å; L1349-V1354 HydrophobicContact CD1-CG1 4.36Å; L1349-V1354 VanDerWaalsContact CD1-O 3.26Å; L1349-V1354 WeakPolarHBondContact CD1-O 3.36Å; G1352-V1354 VanDerWaalsContact C-N 3.3Å; G1352-V1354 PolarHBondContact O-N 3.01Å; V1354-T1356 PolarHBondContact O-N 3.26Å; V1354-A1363 HydrophobicContact CG1-CB 3.93Å; V1354-A1363 VanDerWaalsContact CG1-CB 3.45Å
1355D46.5Very low55.3Low99.2 Ų99.289.8 Ų89.853%0.5352%0.517SS..  trans-82.2132174-74.2-32.6000110.2Y1357 H1366D1355-Y1357 HydrophobicContact CB-CD2 4.28Å; D1355-Y1357 HydrophobicContact CB-CE2 4.35Å; D1355-Y1357 PolarHBondContact O-N 3.2Å; D1355-H1366 IonicContact OD2-CD2 3.2Å; D1355-H1366 IonicContact OD2-NE2 2.72Å
1356T48.5Very low53.3Low110.6 Ų110.689.8 Ų89.868%0.67952%0.518SS*.  trans-73.8105.4168.648.90000110.1L1349 V1354 G1358L1349-T1356 HydrophobicContact CD1-CG2 3.86Å; L1349-T1356 VanDerWaalsContact CD1-CG2 3.41Å; L1349-T1356 HydrophobicContact CD2-CG2 4.27Å; L1349-T1356 HydrophobicContact CG-CG2 4.49Å; V1354-T1356 PolarHBondContact O-N 3.26Å; T1356-G1358 PolarHBondContact O-N 2.95Å
1357Y41.5Very low51.2Low195.8 Ų195.893.6 Ų93.677%0.76854%0.537SS*.  trans-50.5126.1166-98.7-95.4000113.1L1349 D1355 D1359 T1360L1349-Y1357 HydrophobicContact CD1-CE2 4.48Å; D1355-Y1357 HydrophobicContact CB-CD2 4.28Å; D1355-Y1357 HydrophobicContact CB-CE2 4.35Å; D1355-Y1357 PolarHBondContact O-N 3.2Å; Y1357-D1359 PolarHBondContact O-N 2.99Å; Y1357-T1360 PolarHBondContact O-OG1 3.4Å
1358G42.2Very low49Very low63.8 Ų63.8100.1 Ų100.166%0.65857%0.567SS**THydrogen-bonded Turntrans-54.3133.5-178.400000115.8T1356 T1360T1356-G1358 PolarHBondContact O-N 2.95Å; G1358-T1360 PolarHBondContact O-N 3.26Å; G1358-T1360 PolarHBondContact O-OG1 3.02Å
1359D38.2Very low46.9Very low169.2 Ų169.2100.9 Ų100.991%0.90558%0.58SS**THydrogen-bonded Turntrans13.818.1168.7-84.3-6.4000119Y1357 G1361Y1357-D1359 PolarHBondContact O-N 2.99Å; D1359-G1361 PolarHBondContact O-N 2.93Å
1360T42.2Very low45Very low108.8 Ų108.8102 Ų10267%0.66759%0.589SS**  trans-86.439.9175.755.90000113F1345 Y1357 G1358 I1362F1345-T1360 HydrophobicContact CE2-CG2 3.98Å; F1345-T1360 HydrophobicContact CZ-CG2 3.82Å; Y1357-T1360 PolarHBondContact O-OG1 3.4Å; G1358-T1360 PolarHBondContact O-N 3.26Å; G1358-T1360 PolarHBondContact O-OG1 3.02Å; T1360-I1362 PolarHBondContact O-N 3.03Å; T1360-I1362 VanDerWaalsContact O-N 3.15Å
1361G39.5Very low42.9Very low76.8 Ų76.8106.3 Ų106.379%0.79261%0.612SS**  trans-81.117.3179.500000115.5D1359 A1363D1359-G1361 PolarHBondContact O-N 2.93Å; G1361-A1363 PolarHBondContact O-N 3.49Å
1362I39.3Very low41Very low132.8 Ų132.8113.5 Ų113.568%0.68163%0.632SS**  trans-98.5104.2174.9-53.2175.9000111.2T1360 V1364T1360-I1362 PolarHBondContact O-N 3.03Å; T1360-I1362 VanDerWaalsContact O-N 3.15Å; I1362-V1364 HydrophobicContact CG2-CG2 4.16Å; I1362-V1364 PolarHBondContact O-N 3.02Å; I1362-V1364 VanDerWaalsContact O-N 3.13Å
1363A38.8Very low39.6Very low68.4 Ų68.4120.1 Ų120.157%0.56565%0.65SS**  trans-84.8101.7173.500000111.3F1345 V1354 G1361F1345-A1363 HydrophobicContact CE2-CB 3.84Å; F1345-A1363 HydrophobicContact CZ-CB 3.77Å; F1345-A1363 VanDerWaalsContact CZ-CB 3.43Å; V1354-A1363 HydrophobicContact CG1-CB 3.93Å; V1354-A1363 VanDerWaalsContact CG1-CB 3.45Å; G1361-A1363 PolarHBondContact O-N 3.49Å
1364V36.6Very low38.4Very low100 Ų100121.7 Ų121.761%0.60666%0.662SS**EExtended strand (participates in β ladder)trans-112.2122.6167.3-178.10000108.3I1362 H1366I1362-V1364 HydrophobicContact CG2-CG2 4.16Å; I1362-V1364 PolarHBondContact O-N 3.02Å; I1362-V1364 VanDerWaalsContact O-N 3.13Å; V1364-H1366 PolarHBondContact O-N 3.09Å
1365S35.5Very low37.9Very low83.2 Ų83.2124.2 Ų124.258%0.58268%0.677SS**EExtended strand (participates in β ladder)trans-55135.1172.555.70000112.1H1367S1365-H1367 PolarHBondContact O-N 3.03Å
1366H35.3Very low37.6Very low107.6 Ų107.6123.9 Ų123.950%0.49868%0.676SS.*  trans-69.775176.1-129.5-69.4000113.2W1219 G1352 Q1353 D1355 V1364 E1368 V1369 V1370W1219-H1366 PolarHBondContact O-NE2 3.2Å; G1352-H1366 PolarHBondContact O-CD2 2.91Å; Q1353-H1366 WeakPolarHBondContact O-CB 3.29Å; Q1353-H1366 PolarHBondContact O-N 3.07Å; D1355-H1366 IonicContact OD2-CD2 3.2Å; D1355-H1366 IonicContact OD2-NE2 2.72Å; V1364-H1366 PolarHBondContact O-N 3.09Å; H1366-E1368 VanDerWaalsContact C-N 3.26Å; H1366-E1368 IonicContact CE1-OE2 3.3Å; H1366-E1368 PolarHBondContact ND1-O 2.86Å; H1366-E1368 PolarHBondContact O-N 3.15Å; H1366-V1369 PolarHBondContact O-N 2.9Å; H1366-V1370 PolarHBondContact O-N 3.03Å
1367H35.3Very low37.5Very low171.2 Ų171.2122.6 Ų122.679%0.79366%0.664SS**  trans-6022.8170.9-139.4-29.3000113.7S1365 V1369S1365-H1367 PolarHBondContact O-N 3.03Å; H1367-V1369 PolarHBondContact O-N 3Å
1368E32.7Very low37.9Very low164.4 Ų164.4116.9 Ų116.977%0.76865%0.649SS**G310 helixtrans-9076.6164.8-82.7-178.114200111.5H1366 V1370H1366-E1368 VanDerWaalsContact C-N 3.26Å; H1366-E1368 IonicContact CE1-OE2 3.3Å; H1366-E1368 PolarHBondContact ND1-O 2.86Å; H1366-E1368 PolarHBondContact O-N 3.15Å; E1368-V1370 VanDerWaalsContact C-N 3.32Å; E1368-V1370 HydrophobicContact CB-CG2 4.1Å; E1368-V1370 HydrophobicContact CG-CG2 4Å; E1368-V1370 PolarHBondContact O-N 3.06Å; E1368-V1370 VanDerWaalsContact OE1-CG2 3.31Å; E1368-V1370 WeakPolarHBondContact OE1-CG2 3.34Å
1369V34.4Very low38.2Very low109.6 Ų109.6118.3 Ų118.366%0.66464%0.639SS**  trans-98.460.9174.3-1780000110.4H1366 H1367 E1371H1366-V1369 PolarHBondContact O-N 2.9Å; H1367-V1369 PolarHBondContact O-N 3Å; V1369-E1371 VanDerWaalsContact C-N 3.26Å; V1369-E1371 HydrophobicContact CG1-CG 4.2Å; V1369-E1371 PolarHBondContact O-N 3.21Å; V1369-E1371 VanDerWaalsContact O-N 3.11Å
1370V34.8Very low38.7Very low87.8 Ų87.8114.1 Ų114.153%0.53262%0.622SS.*  trans-78.790.8173.2160.10000109.1W1219 H1366 E1368 R1372 V1375W1219-V1370 HydrophobicContact CB-CG2 4.18Å; W1219-V1370 HydrophobicContact CD2-CG1 3.9Å; W1219-V1370 HydrophobicContact CG-CG1 4Å; W1219-V1370 HydrophobicContact CG-CG2 4.14Å; W1219-V1370 HydrophobicContact CZ2-CG1 4.25Å; H1366-V1370 PolarHBondContact O-N 3.03Å; E1368-V1370 VanDerWaalsContact C-N 3.32Å; E1368-V1370 HydrophobicContact CB-CG2 4.1Å; E1368-V1370 HydrophobicContact CG-CG2 4Å; E1368-V1370 PolarHBondContact O-N 3.06Å; E1368-V1370 VanDerWaalsContact OE1-CG2 3.31Å; E1368-V1370 WeakPolarHBondContact OE1-CG2 3.34Å; V1370-R1372 HydrophobicContact CG1-CG 4.21Å; V1370-R1372 PolarHBondContact O-N 3.28Å; V1370-V1375 VanDerWaalsContact O-CG2 3.29Å; V1370-V1375 WeakPolarHBondContact O-CG2 3.45Å
1371E32.7Very low39Very low155 Ų155113 Ų11372%0.72461%0.61SS**  trans-7560.8164.7-78-175.9167.400113.8V1369 K1373V1369-E1371 VanDerWaalsContact C-N 3.26Å; V1369-E1371 HydrophobicContact CG1-CG 4.2Å; V1369-E1371 PolarHBondContact O-N 3.21Å; V1369-E1371 VanDerWaalsContact O-N 3.11Å; E1371-K1373 PolarHBondContact O-N 2.93Å; E1371-K1373 IonicContact OE2-NZ 3.23Å
1372R31.6Very low39.6Very low194.6 Ų194.6110.9 Ų110.973%0.73458%0.58SS**  trans-105.597.4167.1-70.2179.5-178.4154.92.1110.5V1370 D1374 V1375V1370-R1372 HydrophobicContact CG1-CG 4.21Å; V1370-R1372 PolarHBondContact O-N 3.28Å; R1372-D1374 PolarHBondContact O-N 3.24Å; R1372-V1375 HydrophobicContact CB-CG2 3.65Å; R1372-V1375 PolarHBondContact O-N 3.31Å
1373K33.7Very low40.2Very low177 Ų177106.8 Ų106.877%0.7756%0.562SS**THydrogen-bonded Turntrans-127.528.8148-85170179.4175.50113.3E1371 V1375E1371-K1373 PolarHBondContact O-N 2.93Å; E1371-K1373 IonicContact OE2-NZ 3.23Å; K1373-V1375 PolarHBondContact O-N 3.1Å
1374D36.3Very low40.8Very low147.2 Ų147.2109.1 Ų109.179%0.78756%0.563SS**THydrogen-bonded Turntrans-101.835.5177.2-56.4-47.1000113.3R1372 D1376R1372-D1374 PolarHBondContact O-N 3.24Å; D1374-D1376 PolarHBondContact O-N 3.12Å; D1374-D1376 VanDerWaalsContact O-N 3.13Å
1375V40Very low41.5Very low86.2 Ų86.2110.1 Ų110.152%0.52257%0.565SS.*  trans-78.2119.2176.9-177.90000109.4V1370 R1372 K1373 I1377 E1381V1370-V1375 VanDerWaalsContact O-CG2 3.29Å; V1370-V1375 WeakPolarHBondContact O-CG2 3.45Å; R1372-V1375 HydrophobicContact CB-CG2 3.65Å; R1372-V1375 PolarHBondContact O-N 3.31Å; K1373-V1375 PolarHBondContact O-N 3.1Å; V1375-I1377 PolarHBondContact O-N 3.29Å; V1375-I1377 VanDerWaalsContact O-N 3.15Å; V1375-E1381 HydrophobicContact CG1-CG 4.34Å; V1375-E1381 WeakPolarHBondContact CG1-OE1 3.31Å; V1375-E1381 WeakPolarHBondContact CG1-OE2 3.38Å
1376D41.1Very low42.4Very low92.8 Ų92.8108.6 Ų108.650%0.49655%0.55SS..  trans-50.8121.3167-76.3-48.5000110D1374 T1378 R1408 Q1440D1374-D1376 PolarHBondContact O-N 3.12Å; D1374-D1376 VanDerWaalsContact O-N 3.13Å; D1376-T1378 VanDerWaalsContact C-N 3.35Å; D1376-T1378 WeakPolarHBondContact O-CG2 3.35Å; D1376-T1378 PolarHBondContact O-N 2.98Å; D1376-R1408 VanDerWaalsContact CG-NH1 3.34Å; D1376-R1408 IonicContact OD1-CZ 3.1Å; D1376-R1408 IonicContact OD1-NH1 3.06Å; D1376-R1408 PolarHBondContact OD1-NH1 3.12Å; D1376-R1408 IonicContact OD1-NH2 3.53Å; D1376-R1408 PolarHBondContact OD1-NH2 3.1Å; D1376-R1408 IonicContact OD2-CZ 2.67Å; D1376-R1408 IonicContact OD2-NH1 2.98Å; D1376-R1408 PolarHBondContact OD2-NH1 3.1Å; D1376-Q1440 PolarHBondContact OD1-NE2 3.09Å
1377I45.6Very low43.1Very low83.2 Ų83.2107.3 Ų107.343%0.42755%0.553SS.*  trans-58.6100.3174.6-60.7172.3000107.7V1375 E1381 L1382 Q1440V1375-I1377 PolarHBondContact O-N 3.29Å; V1375-I1377 VanDerWaalsContact O-N 3.15Å; I1377-E1381 HydrophobicContact CG2-CB 3.78Å; I1377-L1382 HydrophobicContact CB-CD2 4.27Å; I1377-L1382 HydrophobicContact CB-CG 4.37Å; I1377-L1382 HydrophobicContact CG2-CB 4.21Å; I1377-L1382 HydrophobicContact CG2-CD1 3.86Å; I1377-L1382 VanDerWaalsContact CG2-CD1 3.49Å; I1377-L1382 HydrophobicContact CG2-CD2 3.55Å; I1377-L1382 VanDerWaalsContact CG2-CD2 3.42Å; I1377-L1382 HydrophobicContact CG2-CG 3.69Å; I1377-Q1440 VanDerWaalsContact CG1-NE2 3.33Å
1378T50.3Low44Very low76 Ų76105.8 Ų105.847%0.46654%0.54SS..  trans-69.6153.1179.259.10000109D1376 S1380 E1381 L1382D1376-T1378 VanDerWaalsContact C-N 3.35Å; D1376-T1378 WeakPolarHBondContact O-CG2 3.35Å; D1376-T1378 PolarHBondContact O-N 2.98Å; T1378-S1380 PolarHBondContact O-N 3.14Å; T1378-S1380 VanDerWaalsContact O-N 3.15Å; T1378-E1381 WeakPolarHBondContact CB-OE1 3.47Å; T1378-E1381 WeakPolarHBondContact CG2-OE1 3.29Å; T1378-E1381 PolarHBondContact N-OE1 3.31Å; T1378-E1381 PolarHBondContact O-N 3.16Å; T1378-E1381 PolarHBondContact OG1-N 3.1Å; T1378-E1381 PolarHBondContact OG1-OE1 3.33Å; T1378-L1382 PolarHBondContact O-N 3.26Å; T1378-L1382 VanDerWaalsContact O-N 3.12Å
1379Q47.7Very low45.1Very low92.8 Ų92.8106.2 Ų106.243%0.43454%0.542SS..Hα-helixtrans-54.6-22.4-178.6-66.1179.4-46.100113.5L1382 V1383 T1897Q1379-L1382 WeakPolarHBondContact O-CB 3.46Å; Q1379-L1382 PolarHBondContact O-N 3.3Å; Q1379-V1383 VanDerWaalsContact O-CG2 3.31Å; Q1379-V1383 WeakPolarHBondContact O-CG2 3.39Å; Q1379-V1383 PolarHBondContact O-N 3.18Å; Q1379-T1897 PolarHBondContact NE2-O 3.27Å; Q1379-T1897 PolarHBondContact OE1-O 2.9Å
1380S48.4Very low46.6Very low80.4 Ų80.4103.1 Ų103.156%0.56253%0.526SS*.Hα-helixtrans-67.2-38.7176.8-52.70000113.1T1378 L1382 V1383 I1384T1378-S1380 PolarHBondContact O-N 3.14Å; T1378-S1380 VanDerWaalsContact O-N 3.15Å; S1380-L1382 VanDerWaalsContact C-N 3.32Å; S1380-L1382 PolarHBondContact O-N 3.1Å; S1380-V1383 PolarHBondContact O-N 3.14Å; S1380-I1384 WeakPolarHBondContact O-CB 3.17Å; S1380-I1384 WeakPolarHBondContact O-CD1 3.38Å; S1380-I1384 VanDerWaalsContact O-CG1 3.32Å; S1380-I1384 WeakPolarHBondContact O-CG1 3.35Å; S1380-I1384 PolarHBondContact O-N 3.2Å; S1380-I1384 VanDerWaalsContact O-N 3.11Å
1381E49.4Very low48.2Very low85 Ų85105.7 Ų105.740%0.39753%0.526SS..Hα-helixtrans-73.1-28.5175.5-71.9-177.3-18000112.7V1375 I1377 T1378 V1383 I1384 N1385V1375-E1381 HydrophobicContact CG1-CG 4.34Å; V1375-E1381 WeakPolarHBondContact CG1-OE1 3.31Å; V1375-E1381 WeakPolarHBondContact CG1-OE2 3.38Å; I1377-E1381 HydrophobicContact CG2-CB 3.78Å; T1378-E1381 WeakPolarHBondContact CB-OE1 3.47Å; T1378-E1381 WeakPolarHBondContact CG2-OE1 3.29Å; T1378-E1381 PolarHBondContact N-OE1 3.31Å; T1378-E1381 PolarHBondContact O-N 3.16Å; T1378-E1381 PolarHBondContact OG1-N 3.1Å; T1378-E1381 PolarHBondContact OG1-OE1 3.33Å; E1381-V1383 VanDerWaalsContact C-N 3.31Å; E1381-V1383 PolarHBondContact O-N 3.3Å; E1381-I1384 PolarHBondContact O-N 3.02Å; E1381-I1384 VanDerWaalsContact O-N 3.17Å; E1381-N1385 VanDerWaalsContact O-CB 3.28Å; E1381-N1385 WeakPolarHBondContact O-CB 3.31Å; E1381-N1385 PolarHBondContact O-N 3.04Å; E1381-N1385 PolarHBondContact O-ND2 3.2Å
1382L53.1Low49.9Very low33 Ų33103 Ų10317%0.17352%0.517CS..Hα-helixtrans-67.9-31.5176.3-94.5166.7000112.6I1377 T1378 Q1379 S1380 I1384 L1386 F1394 V1397I1377-L1382 HydrophobicContact CB-CD2 4.27Å; I1377-L1382 HydrophobicContact CB-CG 4.37Å; I1377-L1382 HydrophobicContact CG2-CB 4.21Å; I1377-L1382 HydrophobicContact CG2-CD1 3.86Å; I1377-L1382 VanDerWaalsContact CG2-CD1 3.49Å; I1377-L1382 HydrophobicContact CG2-CD2 3.55Å; I1377-L1382 VanDerWaalsContact CG2-CD2 3.42Å; I1377-L1382 HydrophobicContact CG2-CG 3.69Å; T1378-L1382 PolarHBondContact O-N 3.26Å; T1378-L1382 VanDerWaalsContact O-N 3.12Å; Q1379-L1382 WeakPolarHBondContact O-CB 3.46Å; Q1379-L1382 PolarHBondContact O-N 3.3Å; S1380-L1382 VanDerWaalsContact C-N 3.32Å; S1380-L1382 PolarHBondContact O-N 3.1Å; L1382-I1384 VanDerWaalsContact C-N 3.33Å; L1382-I1384 PolarHBondContact O-N 3.17Å; L1382-L1386 HydrophobicContact CB-CD1 4.18Å; L1382-L1386 HydrophobicContact CD2-CD1 4.06Å; L1382-L1386 HydrophobicContact CD2-CD2 4.33Å; L1382-L1386 HydrophobicContact CG-CD1 4.19Å; L1382-L1386 VanDerWaalsContact O-CB 3.29Å; L1382-L1386 WeakPolarHBondContact O-CB 3.37Å; L1382-L1386 PolarHBondContact O-N 3.08Å; L1382-L1386 VanDerWaalsContact O-N 3.14Å; L1382-F1394 HydrophobicContact CB-CE2 4.43Å; L1382-V1397 HydrophobicContact CD1-CG1 4.15Å; L1382-V1397 HydrophobicContact CD2-CG1 3.69Å; L1382-V1397 HydrophobicContact CG-CG1 4.45Å
1383V51.9Low51.9Low48 Ų4895.3 Ų95.329%0.29149%0.491SS..Hα-helixtrans-76-28.4177.9177.80000112.2Q1379 S1380 E1381 F1394 F1945 H1948 M1949Q1379-V1383 VanDerWaalsContact O-CG2 3.31Å; Q1379-V1383 WeakPolarHBondContact O-CG2 3.39Å; Q1379-V1383 PolarHBondContact O-N 3.18Å; S1380-V1383 PolarHBondContact O-N 3.14Å; E1381-V1383 VanDerWaalsContact C-N 3.31Å; E1381-V1383 PolarHBondContact O-N 3.3Å; V1383-F1394 HydrophobicContact CB-CE2 4.48Å; V1383-F1394 HydrophobicContact CG2-CE2 3.98Å; V1383-F1394 HydrophobicContact CG2-CZ 3.89Å; V1383-F1945 HydrophobicContact CB-CE2 4.35Å; V1383-F1945 HydrophobicContact CG1-CD2 3.99Å; V1383-F1945 HydrophobicContact CG1-CE2 3.86Å; V1383-F1945 HydrophobicContact CG2-CD2 4.06Å; V1383-F1945 HydrophobicContact CG2-CE2 3.53Å; V1383-F1945 VanDerWaalsContact CG2-CE2 3.47Å; V1383-F1945 HydrophobicContact CG2-CZ 4.16Å; V1383-H1948 HydrophobicContact CG1-CB 4.45Å; V1383-M1949 HydrophobicContact CG1-SD 3.6Å; V1383-M1949 VanDerWaalsContact CG1-SD 3.6Å; V1383-M1949 HydrophobicContact CG2-SD 4.26Å
1384I50.9Low53.9Low116.8 Ų116.889 Ų8960%0.59946%0.464SS*.Hα-helixtrans-92-31.8-173.2-63169.9000112.5S1380 E1381 L1382S1380-I1384 WeakPolarHBondContact O-CB 3.17Å; S1380-I1384 WeakPolarHBondContact O-CD1 3.38Å; S1380-I1384 VanDerWaalsContact O-CG1 3.32Å; S1380-I1384 WeakPolarHBondContact O-CG1 3.35Å; S1380-I1384 PolarHBondContact O-N 3.2Å; S1380-I1384 VanDerWaalsContact O-N 3.11Å; E1381-I1384 PolarHBondContact O-N 3.02Å; E1381-I1384 VanDerWaalsContact O-N 3.17Å; L1382-I1384 VanDerWaalsContact C-N 3.33Å; L1382-I1384 PolarHBondContact O-N 3.17Å
1385N51.1Low56Low120.4 Ų120.484.5 Ų84.564%0.64444%0.437SS*.Hα-helixtrans-100-9.9-170.7-72.1-26.4000115.2E1381 S1387E1381-N1385 VanDerWaalsContact O-CB 3.28Å; E1381-N1385 WeakPolarHBondContact O-CB 3.31Å; E1381-N1385 PolarHBondContact O-N 3.04Å; E1381-N1385 PolarHBondContact O-ND2 3.2Å; N1385-S1387 PolarHBondContact O-N 3.35Å
1386L54.5Low57.9Low51.2 Ų51.281.3 Ų81.327%0.26842%0.419SS..SBendtrans-99.4109.6179-101.794.1000111.5L1382 W1388 F1394 V1397 Y1437L1382-L1386 HydrophobicContact CB-CD1 4.18Å; L1382-L1386 HydrophobicContact CD2-CD1 4.06Å; L1382-L1386 HydrophobicContact CD2-CD2 4.33Å; L1382-L1386 HydrophobicContact CG-CD1 4.19Å; L1382-L1386 VanDerWaalsContact O-CB 3.29Å; L1382-L1386 WeakPolarHBondContact O-CB 3.37Å; L1382-L1386 PolarHBondContact O-N 3.08Å; L1382-L1386 VanDerWaalsContact O-N 3.14Å; L1386-W1388 PolarHBondContact O-N 3.18Å; L1386-W1388 VanDerWaalsContact O-N 3.15Å; L1386-W1388 PolarHBondContact O-NE1 2.81Å; L1386-W1388 VanDerWaalsContact O-NE1 3.15Å; L1386-F1394 HydrophobicContact CD2-CD2 4.31Å; L1386-V1397 HydrophobicContact CB-CG1 4.46Å; L1386-V1397 HydrophobicContact CD1-CB 4.31Å; L1386-V1397 HydrophobicContact CD1-CG1 4.01Å; L1386-V1397 HydrophobicContact CD2-CB 4.4Å; L1386-V1397 HydrophobicContact CD2-CG1 4.15Å; L1386-V1397 HydrophobicContact CD2-CG2 4.34Å; L1386-Y1437 WeakPolarHBondContact CD2-OH 3.37Å
1387S49.7Very low59.6Low79.8 Ų79.877.4 Ų77.456%0.55840%0.398SS*.  trans-45.2114168.1-12.90000112.3N1385 E1389N1385-S1387 PolarHBondContact O-N 3.35Å; S1387-E1389 WeakPolarHBondContact CB-OE2 3.3Å; S1387-E1389 PolarHBondContact O-N 3.08Å; S1387-E1389 PolarHBondContact OG-OE2 3.36Å
1388W54.3Low61.2Low140.6 Ų140.674.6 Ų74.653%0.53339%0.386SS..THydrogen-bonded Turntrans-6612.1177.516.329000115.4L1386 S1390 F1394 L1904 M1949 Y1952L1386-W1388 PolarHBondContact O-N 3.18Å; L1386-W1388 VanDerWaalsContact O-N 3.15Å; L1386-W1388 PolarHBondContact O-NE1 2.81Å; L1386-W1388 VanDerWaalsContact O-NE1 3.15Å; W1388-S1390 VanDerWaalsContact C-N 3.3Å; W1388-S1390 PolarHBondContact O-N 3.27Å; W1388-S1390 VanDerWaalsContact O-N 3.09Å; W1388-F1394 AromaticContact CH2-CD1 3.85Å; W1388-F1394 HydrophobicContact CH2-CD1 3.85Å; W1388-F1394 AromaticContact CH2-CE1 3.92Å; W1388-F1394 HydrophobicContact CH2-CE1 3.92Å; W1388-F1394 HydrophobicContact CH2-CG 4.24Å; W1388-F1394 HydrophobicContact CH2-CZ 4.37Å; W1388-F1394 AromaticContact CZ2-CD1 3.99Å; W1388-F1394 HydrophobicContact CZ2-CD1 3.99Å; W1388-F1394 AromaticContact CZ2-CD2 4Å; W1388-F1394 HydrophobicContact CZ2-CD2 4Å; W1388-F1394 AromaticContact CZ2-CE1 3.96Å; W1388-F1394 HydrophobicContact CZ2-CE1 3.96Å; W1388-F1394 AromaticContact CZ2-CE2 3.97Å; W1388-F1394 HydrophobicContact CZ2-CE2 3.97Å; W1388-F1394 HydrophobicContact CZ2-CG 4.01Å; W1388-F1394 AromaticContact CZ2-CZ 3.95Å; W1388-F1394 HydrophobicContact CZ2-CZ 3.95Å; W1388-L1904 HydrophobicContact CH2-CD2 3.46Å; W1388-L1904 VanDerWaalsContact CH2-CD2 3.46Å; W1388-L1904 HydrophobicContact CZ2-CD2 4.48Å; W1388-L1904 HydrophobicContact CZ3-CD2 4.03Å; W1388-M1949 HydrophobicContact CD2-CE 3.37Å; W1388-M1949 HydrophobicContact CD2-SD 4.46Å; W1388-M1949 VanDerWaalsContact CE2-SD 3.54Å; W1388-M1949 HydrophobicContact CE3-CE 3.48Å; W1388-M1949 VanDerWaalsContact CE3-CE 3.48Å; W1388-M1949 HydrophobicContact CG-CE 4.35Å; W1388-M1949 HydrophobicContact CH2-CE 3.11Å; W1388-M1949 HydrophobicContact CH2-CG 4.49Å; W1388-M1949 HydrophobicContact CH2-SD 3.57Å; W1388-M1949 VanDerWaalsContact CH2-SD 3.57Å; W1388-M1949 HydrophobicContact CZ2-CE 2.94Å; W1388-M1949 HydrophobicContact CZ2-CG 4.44Å; W1388-M1949 HydrophobicContact CZ2-SD 3.05Å; W1388-M1949 WeakPolarHBondContact CZ2-SD 3.48Å; W1388-M1949 HydrophobicContact CZ3-CE 3.34Å; W1388-M1949 HydrophobicContact CZ3-SD 4.4Å; W1388-Y1952 VanDerWaalsContact CE3-CB 3.42Å; W1388-Y1952 HydrophobicContact CE3-CD2 4.09Å; W1388-Y1952 AromaticContact CE3-CG 3.88Å; W1388-Y1952 HydrophobicContact CE3-CG 3.88Å; W1388-Y1952 AromaticContact CH2-CD1 2.88Å; W1388-Y1952 HydrophobicContact CH2-CD1 2.88Å; W1388-Y1952 AromaticContact CH2-CD2 3.52Å; W1388-Y1952 HydrophobicContact CH2-CD2 3.52Å; W1388-Y1952 AromaticContact CH2-CE1 3.45Å; W1388-Y1952 HydrophobicContact CH2-CE1 3.45Å; W1388-Y1952 VanDerWaalsContact CH2-CE1 3.45Å; W1388-Y1952 HydrophobicContact CH2-CE2 4.02Å; W1388-Y1952 AromaticContact CH2-CG 2.88Å; W1388-Y1952 HydrophobicContact CH2-CG 2.88Å; W1388-Y1952 AromaticContact CH2-CZ 3.98Å; W1388-Y1952 AromaticContact CZ2-CD1 3.51Å; W1388-Y1952 HydrophobicContact CZ2-CD1 3.51Å; W1388-Y1952 HydrophobicContact CZ2-CE1 4.32Å; W1388-Y1952 AromaticContact CZ2-CG 3.63Å; W1388-Y1952 HydrophobicContact CZ2-CG 3.63Å; W1388-Y1952 AromaticContact CZ3-CD1 3.54Å; W1388-Y1952 HydrophobicContact CZ3-CD1 3.54Å; W1388-Y1952 AromaticContact CZ3-CD2 3.14Å; W1388-Y1952 HydrophobicContact CZ3-CD2 3.14Å; W1388-Y1952 HydrophobicContact CZ3-CE1 4.1Å; W1388-Y1952 AromaticContact CZ3-CE2 3.79Å; W1388-Y1952 HydrophobicContact CZ3-CE2 3.79Å; W1388-Y1952 AromaticContact CZ3-CG 2.97Å; W1388-Y1952 HydrophobicContact CZ3-CG 2.97Å
1389E56Low62.8Low172 Ų17271.7 Ų71.780%0.80437%0.37SS*.THydrogen-bonded Turntrans-66.1-18.2-174.8-65.7176.6161.100114.3S1387S1387-E1389 WeakPolarHBondContact CB-OE2 3.3Å; S1387-E1389 PolarHBondContact O-N 3.08Å; S1387-E1389 PolarHBondContact OG-OE2 3.36Å
1390S65Low64.6Low45.6 Ų45.667.4 Ų67.432%0.31935%0.349SS..  trans-141.6110.5172.174.60000113.2W1388 D1392 V1393 F1394W1388-S1390 VanDerWaalsContact C-N 3.3Å; W1388-S1390 PolarHBondContact O-N 3.27Å; W1388-S1390 VanDerWaalsContact O-N 3.09Å; S1390-D1392 VanDerWaalsContact C-N 3.3Å; S1390-D1392 PolarHBondContact O-N 3.16Å; S1390-D1392 VanDerWaalsContact O-N 3.1Å; S1390-D1392 PolarHBondContact OG-N 2.96Å; S1390-V1393 PolarHBondContact O-N 3.11Å; S1390-V1393 VanDerWaalsContact O-N 3.09Å; S1390-V1393 VanDerWaalsContact OG-CB 3.29Å; S1390-V1393 WeakPolarHBondContact OG-CB 3.43Å; S1390-V1393 WeakPolarHBondContact OG-CG2 3.35Å; S1390-F1394 WeakPolarHBondContact O-CB 3.4Å; S1390-F1394 PolarHBondContact O-N 3.05Å; S1390-F1394 VanDerWaalsContact O-N 3.17Å
1391R68.4Low66.1Low141.4 Ų141.465.2 Ų65.253%0.53433%0.334SS..Hα-helixtrans-50.8-40.8176.6-86.6179.279-180-1.4112.5V1393 F1394 F1395R1391-V1393 VanDerWaalsContact C-N 3.33Å; R1391-V1393 PolarHBondContact O-N 2.89Å; R1391-F1394 WeakPolarHBondContact O-CB 3.11Å; R1391-F1394 PolarHBondContact O-N 3.08Å; R1391-F1395 HydrophobicContact CB-CD2 4.46Å; R1391-F1395 HydrophobicContact CB-CE2 4.05Å; R1391-F1395 HydrophobicContact CG-CD2 4.31Å; R1391-F1395 HydrophobicContact CG-CE2 3.7Å; R1391-F1395 HydrophobicContact CG-CZ 4.48Å; R1391-F1395 WeakPolarHBondContact O-CD2 3.4Å; R1391-F1395 WeakPolarHBondContact O-CG 3.39Å; R1391-F1395 PolarHBondContact O-N 2.91Å; R1391-F1395 VanDerWaalsContact O-N 3.11Å
1392D69.1Low67.7Low99.6 Ų99.661.9 Ų61.953%0.53332%0.322SS..Hα-helixtrans-67.3-35.4-176.8-58.3-33.7000112.8S1390 S1396S1390-D1392 VanDerWaalsContact C-N 3.3Å; S1390-D1392 PolarHBondContact O-N 3.16Å; S1390-D1392 VanDerWaalsContact O-N 3.1Å; S1390-D1392 PolarHBondContact OG-N 2.96Å; D1392-S1396 WeakPolarHBondContact O-CB 3.44Å; D1392-S1396 PolarHBondContact O-N 3.38Å; D1392-S1396 VanDerWaalsContact O-N 3.08Å; D1392-S1396 PolarHBondContact O-OG 3.11Å
1393V72.8Confident69.2Low32.8 Ų32.860.6 Ų60.620%0.19932%0.315CS..Hα-helixtrans-69.6-45.9175.3178.60000109.6S1390 R1391 F1395 S1396 V1397S1390-V1393 PolarHBondContact O-N 3.11Å; S1390-V1393 VanDerWaalsContact O-N 3.09Å; S1390-V1393 VanDerWaalsContact OG-CB 3.29Å; S1390-V1393 WeakPolarHBondContact OG-CB 3.43Å; S1390-V1393 WeakPolarHBondContact OG-CG2 3.35Å; R1391-V1393 VanDerWaalsContact C-N 3.33Å; R1391-V1393 PolarHBondContact O-N 2.89Å; V1393-F1395 PolarHBondContact O-N 3.28Å; V1393-S1396 WeakPolarHBondContact O-CA 3.4Å; V1393-S1396 WeakPolarHBondContact O-CB 3.45Å; V1393-S1396 PolarHBondContact O-N 3.14Å; V1393-S1396 VanDerWaalsContact O-N 3.12Å; V1393-S1396 PolarHBondContact O-OG 3.41Å; V1393-V1397 HydrophobicContact CG1-CG2 4Å; V1393-V1397 WeakPolarHBondContact O-CB 3.38Å; V1393-V1397 VanDerWaalsContact O-CG2 3.26Å; V1393-V1397 WeakPolarHBondContact O-CG2 3.43Å; V1393-V1397 PolarHBondContact O-N 3.12Å
1394F75.4Confident70.7Confident43.6 Ų43.658.5 Ų58.519%0.19130%0.302CS..Hα-helixtrans-53.9-50.3179.2176.3-97.3000112.6L1382 V1383 L1386 W1388 S1390 R1391 S1396 V1397 C1398 L1904 F1945L1382-F1394 HydrophobicContact CB-CE2 4.43Å; V1383-F1394 HydrophobicContact CB-CE2 4.48Å; V1383-F1394 HydrophobicContact CG2-CE2 3.98Å; V1383-F1394 HydrophobicContact CG2-CZ 3.89Å; L1386-F1394 HydrophobicContact CD2-CD2 4.31Å; W1388-F1394 AromaticContact CH2-CD1 3.85Å; W1388-F1394 HydrophobicContact CH2-CD1 3.85Å; W1388-F1394 AromaticContact CH2-CE1 3.92Å; W1388-F1394 HydrophobicContact CH2-CE1 3.92Å; W1388-F1394 HydrophobicContact CH2-CG 4.24Å; W1388-F1394 HydrophobicContact CH2-CZ 4.37Å; W1388-F1394 AromaticContact CZ2-CD1 3.99Å; W1388-F1394 HydrophobicContact CZ2-CD1 3.99Å; W1388-F1394 AromaticContact CZ2-CD2 4Å; W1388-F1394 HydrophobicContact CZ2-CD2 4Å; W1388-F1394 AromaticContact CZ2-CE1 3.96Å; W1388-F1394 HydrophobicContact CZ2-CE1 3.96Å; W1388-F1394 AromaticContact CZ2-CE2 3.97Å; W1388-F1394 HydrophobicContact CZ2-CE2 3.97Å; W1388-F1394 HydrophobicContact CZ2-CG 4.01Å; W1388-F1394 AromaticContact CZ2-CZ 3.95Å; W1388-F1394 HydrophobicContact CZ2-CZ 3.95Å; S1390-F1394 WeakPolarHBondContact O-CB 3.4Å; S1390-F1394 PolarHBondContact O-N 3.05Å; S1390-F1394 VanDerWaalsContact O-N 3.17Å; R1391-F1394 WeakPolarHBondContact O-CB 3.11Å; R1391-F1394 PolarHBondContact O-N 3.08Å; F1394-S1396 VanDerWaalsContact C-N 3.31Å; F1394-S1396 PolarHBondContact O-N 2.96Å; F1394-V1397 PolarHBondContact O-N 3.09Å; F1394-C1398 VanDerWaalsContact CZ-SG 3.53Å; F1394-C1398 WeakPolarHBondContact CZ-SG 3.42Å; F1394-C1398 WeakPolarHBondContact O-CB 3.49Å; F1394-C1398 PolarHBondContact O-N 3.05Å; F1394-C1398 PolarHBondContact O-SG 3.22Å; F1394-C1398 VanDerWaalsContact O-SG 3.38Å; F1394-L1904 HydrophobicContact CE1-CD2 4.49Å; F1394-F1945 HydrophobicContact CE1-CZ 4.12Å; F1394-F1945 HydrophobicContact CZ-CE2 4.24Å; F1394-F1945 AromaticContact CZ-CZ 3.86Å; F1394-F1945 HydrophobicContact CZ-CZ 4.1Å
1395F80.5Confident72.2Confident53.6 Ų53.658.9 Ų58.924%0.23530%0.301CS..Hα-helixtrans-62.9-38.2179-65.5-51.9000112.7R1391 V1393 V1397 C1398 A1399 I1881 A1901R1391-F1395 HydrophobicContact CB-CD2 4.46Å; R1391-F1395 HydrophobicContact CB-CE2 4.05Å; R1391-F1395 HydrophobicContact CG-CD2 4.31Å; R1391-F1395 HydrophobicContact CG-CE2 3.7Å; R1391-F1395 HydrophobicContact CG-CZ 4.48Å; R1391-F1395 WeakPolarHBondContact O-CD2 3.4Å; R1391-F1395 WeakPolarHBondContact O-CG 3.39Å; R1391-F1395 PolarHBondContact O-N 2.91Å; R1391-F1395 VanDerWaalsContact O-N 3.11Å; V1393-F1395 PolarHBondContact O-N 3.28Å; F1395-V1397 VanDerWaalsContact C-N 3.32Å; F1395-V1397 PolarHBondContact O-N 2.9Å; F1395-C1398 PolarHBondContact O-N 3.38Å; F1395-A1399 VanDerWaalsContact O-CB 3.31Å; F1395-A1399 WeakPolarHBondContact O-CB 3.39Å; F1395-A1399 PolarHBondContact O-N 2.98Å; F1395-I1881 HydrophobicContact CB-CD1 3.91Å; F1395-I1881 HydrophobicContact CB-CG1 4.19Å; F1395-I1881 HydrophobicContact CD1-CD1 3.68Å; F1395-I1881 HydrophobicContact CE1-CD1 4.46Å; F1395-I1881 HydrophobicContact CG-CD1 3.98Å; F1395-A1901 HydrophobicContact CD1-CB 4.36Å; F1395-A1901 WeakPolarHBondContact CE1-O 3.26Å
1396S80.6Confident73.7Confident19.4 Ų19.453.8 Ų53.814%0.13628%0.275CS..Hα-helixtrans-70-33.1178.9-39.30000112.3D1392 V1393 F1394 L1400 V1426D1392-S1396 WeakPolarHBondContact O-CB 3.44Å; D1392-S1396 PolarHBondContact O-N 3.38Å; D1392-S1396 VanDerWaalsContact O-N 3.08Å; D1392-S1396 PolarHBondContact O-OG 3.11Å; V1393-S1396 WeakPolarHBondContact O-CA 3.4Å; V1393-S1396 WeakPolarHBondContact O-CB 3.45Å; V1393-S1396 PolarHBondContact O-N 3.14Å; V1393-S1396 VanDerWaalsContact O-N 3.12Å; V1393-S1396 PolarHBondContact O-OG 3.41Å; F1394-S1396 VanDerWaalsContact C-N 3.31Å; F1394-S1396 PolarHBondContact O-N 2.96Å; S1396-L1400 VanDerWaalsContact O-CB 3.29Å; S1396-L1400 WeakPolarHBondContact O-CB 3.37Å; S1396-L1400 PolarHBondContact O-N 3.32Å; S1396-V1426 WeakPolarHBondContact O-CG1 3.31Å
1397V77.4Confident74.9Confident9.8 Ų9.851.6 Ų51.66%0.05926%0.263CS..Hα-helixtrans-72.9-42.8175.5176.20000111.5L1382 L1386 V1393 F1394 F1395 A1399 L1400 S1401 L1430 Y1437L1382-V1397 HydrophobicContact CD1-CG1 4.15Å; L1382-V1397 HydrophobicContact CD2-CG1 3.69Å; L1382-V1397 HydrophobicContact CG-CG1 4.45Å; L1386-V1397 HydrophobicContact CB-CG1 4.46Å; L1386-V1397 HydrophobicContact CD1-CB 4.31Å; L1386-V1397 HydrophobicContact CD1-CG1 4.01Å; L1386-V1397 HydrophobicContact CD2-CB 4.4Å; L1386-V1397 HydrophobicContact CD2-CG1 4.15Å; L1386-V1397 HydrophobicContact CD2-CG2 4.34Å; V1393-V1397 HydrophobicContact CG1-CG2 4Å; V1393-V1397 WeakPolarHBondContact O-CB 3.38Å; V1393-V1397 VanDerWaalsContact O-CG2 3.26Å; V1393-V1397 WeakPolarHBondContact O-CG2 3.43Å; V1393-V1397 PolarHBondContact O-N 3.12Å; F1394-V1397 PolarHBondContact O-N 3.09Å; F1395-V1397 VanDerWaalsContact C-N 3.32Å; F1395-V1397 PolarHBondContact O-N 2.9Å; V1397-A1399 VanDerWaalsContact C-N 3.31Å; V1397-A1399 PolarHBondContact O-N 3.4Å; V1397-L1400 PolarHBondContact O-N 3.16Å; V1397-S1401 WeakPolarHBondContact O-CB 3.24Å; V1397-S1401 PolarHBondContact O-N 3.32Å; V1397-S1401 PolarHBondContact O-OG 3.24Å; V1397-L1430 HydrophobicContact CG2-CD2 4.13Å; V1397-Y1437 HydrophobicContact CB-CE1 4.39Å; V1397-Y1437 HydrophobicContact CG1-CD1 4.36Å; V1397-Y1437 HydrophobicContact CG1-CE1 3.64Å; V1397-Y1437 VanDerWaalsContact CG1-CE1 3.48Å; V1397-Y1437 HydrophobicContact CG1-CE2 4.49Å; V1397-Y1437 HydrophobicContact CG2-CD2 4.44Å; V1397-Y1437 HydrophobicContact CG2-CE1 3.97Å; V1397-Y1437 HydrophobicContact CG2-CE2 3.77Å; V1397-Y1437 VanDerWaalsContact CG2-CZ 3.46Å; V1397-Y1437 WeakPolarHBondContact CG2-OH 3.44Å
1398C79.3Confident76.4Confident24.4 Ų24.452.2 Ų52.217%0.16525%0.253CS..Hα-helixtrans-59.3-43.7173-68.40000111.4F1394 F1395 S1401 A1402 L1898 A1901F1394-C1398 VanDerWaalsContact CZ-SG 3.53Å; F1394-C1398 WeakPolarHBondContact CZ-SG 3.42Å; F1394-C1398 WeakPolarHBondContact O-CB 3.49Å; F1394-C1398 PolarHBondContact O-N 3.05Å; F1394-C1398 PolarHBondContact O-SG 3.22Å; F1394-C1398 VanDerWaalsContact O-SG 3.38Å; F1395-C1398 PolarHBondContact O-N 3.38Å; C1398-S1401 PolarHBondContact O-N 3.03Å; C1398-S1401 PolarHBondContact O-OG 3.34Å; C1398-S1401 VanDerWaalsContact O-OG 3.05Å; C1398-A1402 WeakPolarHBondContact O-CB 3.44Å; C1398-A1402 PolarHBondContact O-N 3.05Å; C1398-A1402 VanDerWaalsContact O-N 3.13Å; C1398-L1898 HydrophobicContact CB-CD2 4.12Å; C1398-L1898 WeakPolarHBondContact O-CD2 3.44Å; C1398-A1901 HydrophobicContact CB-CB 4.23Å
1399A84.1Confident77.6Confident16.2 Ų16.248.9 Ų48.913%0.13425%0.246CC..Hα-helixtrans-61.2-46.6174.200000111.6F1395 V1397 S1401 A1402 L1403 V1426 A1880F1395-A1399 VanDerWaalsContact O-CB 3.31Å; F1395-A1399 WeakPolarHBondContact O-CB 3.39Å; F1395-A1399 PolarHBondContact O-N 2.98Å; V1397-A1399 VanDerWaalsContact C-N 3.31Å; V1397-A1399 PolarHBondContact O-N 3.4Å; A1399-S1401 PolarHBondContact O-N 3.33Å; A1399-A1402 PolarHBondContact O-N 3.16Å; A1399-L1403 WeakPolarHBondContact O-CB 3.26Å; A1399-L1403 WeakPolarHBondContact O-CD1 3.37Å; A1399-L1403 VanDerWaalsContact O-CG 3.22Å; A1399-L1403 WeakPolarHBondContact O-CG 3.34Å; A1399-L1403 PolarHBondContact O-N 3.35Å; A1399-V1426 HydrophobicContact CB-CG2 4.43Å; A1399-A1880 HydrophobicContact CB-CB 4.14Å
1400L83.6Confident78.5Confident1 Ų144.2 Ų44.21%0.00523%0.23CC..Hα-helixtrans-63.4-42.9179.7-172.463000112.4S1396 V1397 A1402 L1403 I1404 I1423 V1426 L1427 Y1437 L1441S1396-L1400 VanDerWaalsContact O-CB 3.29Å; S1396-L1400 WeakPolarHBondContact O-CB 3.37Å; S1396-L1400 PolarHBondContact O-N 3.32Å; V1397-L1400 PolarHBondContact O-N 3.16Å; L1400-A1402 VanDerWaalsContact C-N 3.32Å; L1400-A1402 PolarHBondContact O-N 3.14Å; L1400-L1403 PolarHBondContact O-N 3.15Å; L1400-I1404 HydrophobicContact CD1-CD1 4.3Å; L1400-I1404 HydrophobicContact CD1-CG1 4.4Å; L1400-I1404 HydrophobicContact CG-CD1 3.95Å; L1400-I1404 HydrophobicContact CG-CG1 4.46Å; L1400-I1404 WeakPolarHBondContact O-CB 3.27Å; L1400-I1404 VanDerWaalsContact O-CG1 3.28Å; L1400-I1404 WeakPolarHBondContact O-CG1 3.37Å; L1400-I1404 PolarHBondContact O-N 3.26Å; L1400-I1423 HydrophobicContact CD1-CG1 4.47Å; L1400-I1423 HydrophobicContact CD1-CG2 4.18Å; L1400-V1426 HydrophobicContact CB-CG1 4.27Å; L1400-V1426 HydrophobicContact CD1-CG1 4.5Å; L1400-L1427 HydrophobicContact CD1-CD2 4.35Å; L1400-L1427 HydrophobicContact CD2-CD2 4.34Å; L1400-Y1437 VanDerWaalsContact CD2-CB 3.45Å; L1400-Y1437 HydrophobicContact CD2-CD1 4.19Å; L1400-Y1437 HydrophobicContact CD2-CD2 4.06Å; L1400-Y1437 HydrophobicContact CD2-CG 3.7Å; L1400-L1441 HydrophobicContact CD1-CD1 3.83Å
1401S81Confident79Confident35.6 Ų35.645.7 Ų45.725%0.24925%0.246CC..Hα-helixtrans-62-43.4176.6162.10000111.9V1397 C1398 A1399 L1403 I1404 H1405V1397-S1401 WeakPolarHBondContact O-CB 3.24Å; V1397-S1401 PolarHBondContact O-N 3.32Å; V1397-S1401 PolarHBondContact O-OG 3.24Å; C1398-S1401 PolarHBondContact O-N 3.03Å; C1398-S1401 PolarHBondContact O-OG 3.34Å; C1398-S1401 VanDerWaalsContact O-OG 3.05Å; A1399-S1401 PolarHBondContact O-N 3.33Å; S1401-L1403 VanDerWaalsContact C-N 3.32Å; S1401-L1403 PolarHBondContact O-N 3Å; S1401-I1404 PolarHBondContact O-N 3.24Å; S1401-H1405 WeakPolarHBondContact O-CB 3.42Å; S1401-H1405 PolarHBondContact O-N 3.05Å
1402A82.8Confident79.4Confident15.2 Ų15.240 Ų4013%0.12623%0.226CC..Hα-helixtrans-63.6-38.5175.900000112.3C1398 A1399 L1400 H1405 S1406 I1894 T1897 L1898C1398-A1402 WeakPolarHBondContact O-CB 3.44Å; C1398-A1402 PolarHBondContact O-N 3.05Å; C1398-A1402 VanDerWaalsContact O-N 3.13Å; A1399-A1402 PolarHBondContact O-N 3.16Å; L1400-A1402 VanDerWaalsContact C-N 3.32Å; L1400-A1402 PolarHBondContact O-N 3.14Å; A1402-H1405 WeakPolarHBondContact O-CB 3.33Å; A1402-H1405 PolarHBondContact O-N 3.06Å; A1402-S1406 WeakPolarHBondContact O-CB 3.43Å; A1402-S1406 PolarHBondContact O-N 3.05Å; A1402-S1406 VanDerWaalsContact O-N 3.14Å; A1402-S1406 PolarHBondContact O-OG 2.93Å; A1402-S1406 VanDerWaalsContact O-OG 3.13Å; A1402-I1894 HydrophobicContact CB-CG2 4.41Å; A1402-T1897 WeakPolarHBondContact CB-OG1 3.39Å; A1402-L1898 HydrophobicContact CB-CD1 4.31Å; A1402-L1898 HydrophobicContact CB-CD2 3.98Å; A1402-L1898 HydrophobicContact CB-CG 3.95Å
1403L85.2Confident79.8Confident6 Ų638.1 Ų38.13%0.03121%0.214CC..Hα-helixtrans-69.6-41.4176.6-68.5167.1000112.4A1399 L1400 S1401 H1405 S1406 L1407 I1419 T1422 I1423 V1426 L1887 I1894A1399-L1403 WeakPolarHBondContact O-CB 3.26Å; A1399-L1403 WeakPolarHBondContact O-CD1 3.37Å; A1399-L1403 VanDerWaalsContact O-CG 3.22Å; A1399-L1403 WeakPolarHBondContact O-CG 3.34Å; A1399-L1403 PolarHBondContact O-N 3.35Å; L1400-L1403 PolarHBondContact O-N 3.15Å; S1401-L1403 VanDerWaalsContact C-N 3.32Å; S1401-L1403 PolarHBondContact O-N 3Å; L1403-H1405 VanDerWaalsContact C-N 3.33Å; L1403-H1405 PolarHBondContact O-N 3.35Å; L1403-S1406 WeakPolarHBondContact O-CB 3.18Å; L1403-S1406 PolarHBondContact O-N 3.06Å; L1403-S1406 VanDerWaalsContact O-N 3.15Å; L1403-L1407 PolarHBondContact O-N 3.12Å; L1403-L1407 VanDerWaalsContact O-N 3.11Å; L1403-I1419 HydrophobicContact CB-CG2 4.5Å; L1403-I1419 HydrophobicContact CD2-CG2 4.21Å; L1403-T1422 HydrophobicContact CD1-CG2 3.96Å; L1403-T1422 HydrophobicContact CD2-CG2 4.19Å; L1403-I1423 HydrophobicContact CB-CD1 4.03Å; L1403-I1423 HydrophobicContact CB-CG1 3.65Å; L1403-I1423 HydrophobicContact CD1-CG1 3.89Å; L1403-I1423 HydrophobicContact CD2-CG1 4.33Å; L1403-I1423 HydrophobicContact CG-CG1 4.26Å; L1403-V1426 HydrophobicContact CD1-CG2 4.19Å; L1403-L1887 HydrophobicContact CD2-CD1 3.38Å; L1403-I1894 HydrophobicContact CD2-CD1 4.32Å
1404I83.8Confident80Confident4.4 Ų4.441.5 Ų41.52%0.02324%0.239CC..Hα-helixtrans-61.4-44.7174.8-70.4166.8000110.2L1400 S1401 S1406 L1407 R1408 Q1440 L1441 D1444L1400-I1404 HydrophobicContact CD1-CD1 4.3Å; L1400-I1404 HydrophobicContact CD1-CG1 4.4Å; L1400-I1404 HydrophobicContact CG-CD1 3.95Å; L1400-I1404 HydrophobicContact CG-CG1 4.46Å; L1400-I1404 WeakPolarHBondContact O-CB 3.27Å; L1400-I1404 VanDerWaalsContact O-CG1 3.28Å; L1400-I1404 WeakPolarHBondContact O-CG1 3.37Å; L1400-I1404 PolarHBondContact O-N 3.26Å; S1401-I1404 PolarHBondContact O-N 3.24Å; I1404-S1406 VanDerWaalsContact C-N 3.3Å; I1404-S1406 PolarHBondContact O-N 3.08Å; I1404-L1407 VanDerWaalsContact O-CB 3.31Å; I1404-L1407 WeakPolarHBondContact O-CB 3.38Å; I1404-L1407 PolarHBondContact O-N 3.01Å; I1404-L1407 VanDerWaalsContact O-N 3.12Å; I1404-R1408 WeakPolarHBondContact O-CG 3.43Å; I1404-R1408 PolarHBondContact O-N 2.96Å; I1404-Q1440 HydrophobicContact CG2-CG 4.42Å; I1404-L1441 HydrophobicContact CD1-CB 4.2Å; I1404-L1441 HydrophobicContact CD1-CD1 4.33Å; I1404-L1441 HydrophobicContact CG1-CB 4.42Å; I1404-L1441 HydrophobicContact CG1-CD1 3.85Å; I1404-D1444 WeakPolarHBondContact CG2-OD2 3.33Å
1405H82.1Confident80.3Confident124.2 Ų124.242.6 Ų42.658%0.57524%0.244SC*.Hα-helixtrans-60.3-38.9175.8-170.769.9000111.8S1401 A1402 L1403 L1407 R1408 D1409S1401-H1405 WeakPolarHBondContact O-CB 3.42Å; S1401-H1405 PolarHBondContact O-N 3.05Å; A1402-H1405 WeakPolarHBondContact O-CB 3.33Å; A1402-H1405 PolarHBondContact O-N 3.06Å; L1403-H1405 VanDerWaalsContact C-N 3.33Å; L1403-H1405 PolarHBondContact O-N 3.35Å; H1405-L1407 VanDerWaalsContact C-N 3.32Å; H1405-L1407 PolarHBondContact O-N 3.17Å; H1405-R1408 WeakPolarHBondContact O-CB 3.33Å; H1405-R1408 PolarHBondContact O-N 3.1Å; H1405-R1408 VanDerWaalsContact O-N 3.15Å; H1405-D1409 PolarHBondContact O-N 3.27Å
1406S81.4Confident80.4Confident13.6 Ų13.640.3 Ų40.310%0.09523%0.234CC..Hα-helixtrans-68.4-27.8176.3-55.30000113.3A1402 L1403 I1404 R1408 D1409 L1412 I1894A1402-S1406 WeakPolarHBondContact O-CB 3.43Å; A1402-S1406 PolarHBondContact O-N 3.05Å; A1402-S1406 VanDerWaalsContact O-N 3.14Å; A1402-S1406 PolarHBondContact O-OG 2.93Å; A1402-S1406 VanDerWaalsContact O-OG 3.13Å; L1403-S1406 WeakPolarHBondContact O-CB 3.18Å; L1403-S1406 PolarHBondContact O-N 3.06Å; L1403-S1406 VanDerWaalsContact O-N 3.15Å; I1404-S1406 VanDerWaalsContact C-N 3.3Å; I1404-S1406 PolarHBondContact O-N 3.08Å; S1406-R1408 VanDerWaalsContact C-N 3.29Å; S1406-R1408 PolarHBondContact O-N 3.19Å; S1406-D1409 PolarHBondContact O-N 3.04Å; S1406-L1412 WeakPolarHBondContact O-CD1 3.48Å; S1406-I1894 VanDerWaalsContact OG-CD1 3.3Å; S1406-I1894 WeakPolarHBondContact OG-CD1 3.36Å; S1406-I1894 WeakPolarHBondContact OG-CG1 3.39Å
1407L80.3Confident80.7Confident5.4 Ų5.440 Ų403%0.02824%0.235CC..Hα-helixtrans-71.6-21.8173.7-107.4157.1000113L1403 I1404 H1405 D1409 Y1416 I1419 V1420 I1423 L1441 D1444 C1448L1403-L1407 PolarHBondContact O-N 3.12Å; L1403-L1407 VanDerWaalsContact O-N 3.11Å; I1404-L1407 VanDerWaalsContact O-CB 3.31Å; I1404-L1407 WeakPolarHBondContact O-CB 3.38Å; I1404-L1407 PolarHBondContact O-N 3.01Å; I1404-L1407 VanDerWaalsContact O-N 3.12Å; H1405-L1407 VanDerWaalsContact C-N 3.32Å; H1405-L1407 PolarHBondContact O-N 3.17Å; L1407-D1409 VanDerWaalsContact C-N 3.31Å; L1407-Y1416 HydrophobicContact CD1-CD1 4.5Å; L1407-Y1416 HydrophobicContact CD2-CD1 4.3Å; L1407-Y1416 PolarHBondContact O-OH 3.31Å; L1407-I1419 HydrophobicContact CB-CG2 4.48Å; L1407-I1419 HydrophobicContact CD1-CG2 4.36Å; L1407-I1419 HydrophobicContact CD2-CB 4.22Å; L1407-I1419 HydrophobicContact CD2-CG2 3.65Å; L1407-I1419 HydrophobicContact CG-CG2 3.95Å; L1407-V1420 HydrophobicContact CD1-CG2 3.92Å; L1407-V1420 HydrophobicContact CD2-CG2 4Å; L1407-I1423 HydrophobicContact CD1-CD1 3.47Å; L1407-I1423 VanDerWaalsContact CD1-CD1 3.46Å; L1407-I1423 HydrophobicContact CD2-CD1 4.42Å; L1407-I1423 HydrophobicContact CG-CD1 3.88Å; L1407-L1441 HydrophobicContact CD1-CD1 4.13Å; L1407-D1444 VanDerWaalsContact CD2-C 3.43Å; L1407-D1444 HydrophobicContact CD2-CB 3.91Å; L1407-D1444 WeakPolarHBondContact CD2-O 3.24Å; L1407-C1448 HydrophobicContact CD1-CB 4.24Å; L1407-C1448 HydrophobicContact CD2-CB 3.99Å; L1407-C1448 HydrophobicContact CG-CB 4.17Å
1408R81.1Confident81.1Confident92.4 Ų92.442.6 Ų42.635%0.34925%0.253SS..THydrogen-bonded Turntrans-81.7-17179.1-66.6177.6-179.7-173.61.4113.5D1376 I1404 H1405 S1406 P1410 D1444D1376-R1408 VanDerWaalsContact CG-NH1 3.34Å; D1376-R1408 IonicContact OD1-CZ 3.1Å; D1376-R1408 IonicContact OD1-NH1 3.06Å; D1376-R1408 PolarHBondContact OD1-NH1 3.12Å; D1376-R1408 IonicContact OD1-NH2 3.53Å; D1376-R1408 PolarHBondContact OD1-NH2 3.1Å; D1376-R1408 IonicContact OD2-CZ 2.67Å; D1376-R1408 IonicContact OD2-NH1 2.98Å; D1376-R1408 PolarHBondContact OD2-NH1 3.1Å; I1404-R1408 WeakPolarHBondContact O-CG 3.43Å; I1404-R1408 PolarHBondContact O-N 2.96Å; H1405-R1408 WeakPolarHBondContact O-CB 3.33Å; H1405-R1408 PolarHBondContact O-N 3.1Å; H1405-R1408 VanDerWaalsContact O-N 3.15Å; S1406-R1408 VanDerWaalsContact C-N 3.29Å; S1406-R1408 PolarHBondContact O-N 3.19Å; R1408-P1410 VanDerWaalsContact O-CD 3.28Å; R1408-P1410 WeakPolarHBondContact O-CD 3.4Å; R1408-D1444 IonicContact CZ-OD1 3.87Å; R1408-D1444 IonicContact CZ-OD2 3.17Å; R1408-D1444 VanDerWaalsContact CZ-OD2 3.27Å; R1408-D1444 VanDerWaalsContact NE-CG 3.29Å; R1408-D1444 IonicContact NE-OD1 3.1Å; R1408-D1444 PolarHBondContact NE-OD1 3.32Å; R1408-D1444 IonicContact NE-OD2 3.21Å; R1408-D1444 PolarHBondContact NE-OD2 3.2Å; R1408-D1444 IonicContact NH2-OD1 3.75Å; R1408-D1444 IonicContact NH2-OD2 3.07Å; R1408-D1444 PolarHBondContact NH2-OD2 3.01Å
1409D78.9Confident81.5Confident71.6 Ų71.641.6 Ų41.638%0.38325%0.246SC..  trans-83.1112.6-178.8-174.7-4.4000110.8H1405 S1406 L1407 A1411 L1412 Y1416H1405-D1409 PolarHBondContact O-N 3.27Å; S1406-D1409 PolarHBondContact O-N 3.04Å; L1407-D1409 VanDerWaalsContact C-N 3.31Å; D1409-A1411 PolarHBondContact O-N 3.19Å; D1409-A1411 VanDerWaalsContact O-N 3.12Å; D1409-A1411 VanDerWaalsContact OD1-CB 3.26Å; D1409-A1411 WeakPolarHBondContact OD1-CB 3.39Å; D1409-A1411 PolarHBondContact OD1-N 3.11Å; D1409-L1412 HydrophobicContact CB-CD1 4.01Å; D1409-L1412 HydrophobicContact CB-CG 4.4Å; D1409-L1412 PolarHBondContact O-N 3.15Å; D1409-L1412 VanDerWaalsContact O-N 3.07Å; D1409-L1412 WeakPolarHBondContact OD2-CD1 3.29Å; D1409-Y1416 WeakPolarHBondContact O-CE1 3.45Å; D1409-Y1416 PolarHBondContact O-OH 3.25Å
1410P74.8Confident81.6Confident72 Ų7240.9 Ų40.947%0.46824%0.24SC..G310 helixtrans-68.2-9178.130.7-36.6000113.4E1229 R1408 L1412 H1413 Y1416E1229-P1410 HydrophobicContact CB-CG 4.07Å; E1229-P1410 HydrophobicContact CG-CG 3.78Å; E1229-P1410 WeakPolarHBondContact OE2-CD 3.24Å; E1229-P1410 WeakPolarHBondContact OE2-CG 3.38Å; R1408-P1410 VanDerWaalsContact O-CD 3.28Å; R1408-P1410 WeakPolarHBondContact O-CD 3.4Å; P1410-L1412 PolarHBondContact O-N 3.11Å; P1410-H1413 VanDerWaalsContact CA-CE1 3.44Å; P1410-H1413 WeakPolarHBondContact CA-CE1 3.41Å; P1410-H1413 WeakPolarHBondContact CA-ND1 3.17Å; P1410-H1413 VanDerWaalsContact CB-CE1 3.45Å; P1410-H1413 WeakPolarHBondContact CB-CE1 2.98Å; P1410-H1413 PolarHBondContact O-CE1 3.09Å; P1410-H1413 VanDerWaalsContact O-CE1 3.26Å; P1410-H1413 PolarHBondContact O-ND1 3.24Å; P1410-Y1416 WeakPolarHBondContact CA-OH 3.33Å
1411A76.9Confident81.9Confident78.2 Ų78.245.8 Ų45.865%0.64626%0.263SS*.G310 helixtrans-67.5-22.3171.600000112.5D1409D1409-A1411 PolarHBondContact O-N 3.19Å; D1409-A1411 VanDerWaalsContact O-N 3.12Å; D1409-A1411 VanDerWaalsContact OD1-CB 3.26Å; D1409-A1411 WeakPolarHBondContact OD1-CB 3.39Å; D1409-A1411 PolarHBondContact OD1-N 3.11Å
1412L76.7Confident82.2Confident22 Ų2245.1 Ų45.112%0.11526%0.257CS..G310 helixtrans-98.514.4-170.7-68.7140000114.6S1406 D1409 P1410 S1414 Q1415 Y1416 I1419 T1891S1406-L1412 WeakPolarHBondContact O-CD1 3.48Å; D1409-L1412 HydrophobicContact CB-CD1 4.01Å; D1409-L1412 HydrophobicContact CB-CG 4.4Å; D1409-L1412 PolarHBondContact O-N 3.15Å; D1409-L1412 VanDerWaalsContact O-N 3.07Å; D1409-L1412 WeakPolarHBondContact OD2-CD1 3.29Å; P1410-L1412 PolarHBondContact O-N 3.11Å; L1412-S1414 VanDerWaalsContact C-N 3.26Å; L1412-S1414 PolarHBondContact O-N 3.24Å; L1412-S1414 VanDerWaalsContact O-N 3.1Å; L1412-Q1415 WeakPolarHBondContact O-CA 3.39Å; L1412-Q1415 PolarHBondContact O-N 3.1Å; L1412-Y1416 VanDerWaalsContact C-CE1 3.46Å; L1412-Y1416 HydrophobicContact CB-CD1 4.39Å; L1412-Y1416 HydrophobicContact CB-CE1 4.07Å; L1412-Y1416 VanDerWaalsContact O-CD1 3.28Å; L1412-Y1416 WeakPolarHBondContact O-CD1 3.36Å; L1412-Y1416 WeakPolarHBondContact O-CE1 3.43Å; L1412-Y1416 PolarHBondContact O-N 2.98Å; L1412-I1419 HydrophobicContact CB-CD1 4.36Å; L1412-I1419 HydrophobicContact CD1-CD1 4.42Å; L1412-I1419 HydrophobicContact CD2-CD1 4.03Å; L1412-T1891 HydrophobicContact CD1-CG2 3.7Å; L1412-T1891 HydrophobicContact CD2-CG2 4.28Å; L1412-T1891 WeakPolarHBondContact CD2-OG1 3.31Å
1413H76.3Confident82.5Confident59.2 Ų59.244.5 Ų44.527%0.27425%0.251SS..G310 helixtrans-50.2-39-177.1-81.496.2000114.5P1410 Q1415 Y1416 N1451 L1457P1410-H1413 VanDerWaalsContact CA-CE1 3.44Å; P1410-H1413 WeakPolarHBondContact CA-CE1 3.41Å; P1410-H1413 WeakPolarHBondContact CA-ND1 3.17Å; P1410-H1413 VanDerWaalsContact CB-CE1 3.45Å; P1410-H1413 WeakPolarHBondContact CB-CE1 2.98Å; P1410-H1413 PolarHBondContact O-CE1 3.09Å; P1410-H1413 VanDerWaalsContact O-CE1 3.26Å; P1410-H1413 PolarHBondContact O-ND1 3.24Å; H1413-Q1415 PolarHBondContact O-N 2.96Å; H1413-Y1416 HydrophobicContact CB-CD2 4.43Å; H1413-Y1416 HydrophobicContact CB-CE2 4.15Å; H1413-Y1416 AromaticContact CD2-CD2 3.88Å; H1413-Y1416 AromaticContact CD2-CE2 3.2Å; H1413-Y1416 WeakPolarHBondContact CD2-CE2 3.43Å; H1413-Y1416 AromaticContact CD2-CZ 3.77Å; H1413-Y1416 PolarHBondContact CD2-OH 3.3Å; H1413-Y1416 PolarHBondContact CE1-OH 2.98Å; H1413-Y1416 AromaticContact CG-CE2 3.67Å; H1413-Y1416 AromaticContact CG-CZ 3.87Å; H1413-Y1416 AromaticContact NE2-CE2 3.73Å; H1413-Y1416 AromaticContact NE2-CZ 3.9Å; H1413-Y1416 PolarHBondContact NE2-OH 3Å; H1413-Y1416 WeakPolarHBondContact O-CB 3.37Å; H1413-Y1416 PolarHBondContact O-N 3.16Å; H1413-N1451 WeakPolarHBondContact NE2-CB 3.24Å; H1413-L1457 WeakPolarHBondContact O-CD2 3.17Å
1414S78.2Confident82.6Confident104.4 Ų104.444.6 Ų44.673%0.7325%0.252SS*.G310 helixtrans-68-17.6-18057.30000113.8L1412L1412-S1414 VanDerWaalsContact C-N 3.26Å; L1412-S1414 PolarHBondContact O-N 3.24Å; L1412-S1414 VanDerWaalsContact O-N 3.1Å
1415Q80.4Confident82.8Confident65.6 Ų65.649.5 Ų49.531%0.30727%0.271SS..G310 helixtrans-112.5-1.7-172.1-64.1161.24.300112.9L1412 H1413 G1417 S1418 I1419 I1890L1412-Q1415 WeakPolarHBondContact O-CA 3.39Å; L1412-Q1415 PolarHBondContact O-N 3.1Å; H1413-Q1415 PolarHBondContact O-N 2.96Å; Q1415-G1417 PolarHBondContact O-N 3.16Å; Q1415-G1417 VanDerWaalsContact O-N 3.1Å; Q1415-S1418 PolarHBondContact O-N 3.13Å; Q1415-I1419 HydrophobicContact CB-CD1 4.09Å; Q1415-I1419 HydrophobicContact CB-CG1 4.45Å; Q1415-I1419 WeakPolarHBondContact O-CG1 3.49Å; Q1415-I1419 PolarHBondContact O-N 3.33Å; Q1415-I1419 VanDerWaalsContact O-N 3.14Å; Q1415-I1890 HydrophobicContact CB-CG2 4.37Å; Q1415-I1890 HydrophobicContact CG-CG2 3.71Å; Q1415-I1890 VanDerWaalsContact NE2-CG2 3.25Å
1416Y84Confident82.9Confident5.2 Ų5.243.7 Ų43.72%0.0225%0.245CC..Hα-helixtrans-52.3-33.5177.7-70.3-13.3000112.8L1407 D1409 P1410 L1412 H1413 S1418 I1419 V1420 C1448L1407-Y1416 HydrophobicContact CD1-CD1 4.5Å; L1407-Y1416 HydrophobicContact CD2-CD1 4.3Å; L1407-Y1416 PolarHBondContact O-OH 3.31Å; D1409-Y1416 WeakPolarHBondContact O-CE1 3.45Å; D1409-Y1416 PolarHBondContact O-OH 3.25Å; P1410-Y1416 WeakPolarHBondContact CA-OH 3.33Å; L1412-Y1416 VanDerWaalsContact C-CE1 3.46Å; L1412-Y1416 HydrophobicContact CB-CD1 4.39Å; L1412-Y1416 HydrophobicContact CB-CE1 4.07Å; L1412-Y1416 VanDerWaalsContact O-CD1 3.28Å; L1412-Y1416 WeakPolarHBondContact O-CD1 3.36Å; L1412-Y1416 WeakPolarHBondContact O-CE1 3.43Å; L1412-Y1416 PolarHBondContact O-N 2.98Å; H1413-Y1416 HydrophobicContact CB-CD2 4.43Å; H1413-Y1416 HydrophobicContact CB-CE2 4.15Å; H1413-Y1416 AromaticContact CD2-CD2 3.88Å; H1413-Y1416 AromaticContact CD2-CE2 3.2Å; H1413-Y1416 WeakPolarHBondContact CD2-CE2 3.43Å; H1413-Y1416 AromaticContact CD2-CZ 3.77Å; H1413-Y1416 PolarHBondContact CD2-OH 3.3Å; H1413-Y1416 PolarHBondContact CE1-OH 2.98Å; H1413-Y1416 AromaticContact CG-CE2 3.67Å; H1413-Y1416 AromaticContact CG-CZ 3.87Å; H1413-Y1416 AromaticContact NE2-CE2 3.73Å; H1413-Y1416 AromaticContact NE2-CZ 3.9Å; H1413-Y1416 PolarHBondContact NE2-OH 3Å; H1413-Y1416 WeakPolarHBondContact O-CB 3.37Å; H1413-Y1416 PolarHBondContact O-N 3.16Å; Y1416-S1418 PolarHBondContact O-N 3.17Å; Y1416-I1419 HydrophobicContact CD1-CD1 4.39Å; Y1416-I1419 PolarHBondContact O-N 3.14Å; Y1416-V1420 VanDerWaalsContact O-CB 3.28Å; Y1416-V1420 WeakPolarHBondContact O-CB 3.28Å; Y1416-V1420 VanDerWaalsContact O-CG2 3.3Å; Y1416-V1420 WeakPolarHBondContact O-CG2 3.41Å; Y1416-V1420 PolarHBondContact O-N 3.08Å; Y1416-C1448 HydrophobicContact CD2-CB 4.4Å; Y1416-C1448 WeakPolarHBondContact CD2-SG 3.44Å; Y1416-C1448 HydrophobicContact CE2-CB 4.35Å; Y1416-C1448 VanDerWaalsContact CE2-SG 3.53Å
1417G85.9Confident83.1Confident14 Ų1443.1 Ų43.114%0.14424%0.241CC..Hα-helixtrans-57.9-47.1175.100000113Q1415 H1421 F1460Q1415-G1417 PolarHBondContact O-N 3.16Å; Q1415-G1417 VanDerWaalsContact O-N 3.1Å; G1417-H1421 VanDerWaalsContact O-CB 3.31Å; G1417-H1421 WeakPolarHBondContact O-CB 3.37Å; G1417-H1421 PolarHBondContact O-N 3.16Å; G1417-F1460 VanDerWaalsContact O-CE1 3.26Å; G1417-F1460 WeakPolarHBondContact O-CE1 3.38Å
1418S85.6Confident83.3Confident64 Ų6449.1 Ų49.145%0.44827%0.266SS..Hα-helixtrans-70.3-38.9179-56.70000112.2Q1415 Y1416 H1421 T1422Q1415-S1418 PolarHBondContact O-N 3.13Å; Y1416-S1418 PolarHBondContact O-N 3.17Å; S1418-H1421 PolarHBondContact O-N 3.18Å; S1418-T1422 WeakPolarHBondContact O-CB 3.42Å; S1418-T1422 PolarHBondContact O-N 2.87Å; S1418-T1422 VanDerWaalsContact O-N 3.11Å; S1418-T1422 PolarHBondContact O-OG1 3.03Å
1419I87.4Confident83.4Confident3.6 Ų3.647.9 Ų47.92%0.01827%0.267CS..Hα-helixtrans-64.1-49.8177.7-62.5169.7000109.8L1403 L1407 L1412 Q1415 Y1416 H1421 T1422 I1423 L1887L1403-I1419 HydrophobicContact CB-CG2 4.5Å; L1403-I1419 HydrophobicContact CD2-CG2 4.21Å; L1407-I1419 HydrophobicContact CB-CG2 4.48Å; L1407-I1419 HydrophobicContact CD1-CG2 4.36Å; L1407-I1419 HydrophobicContact CD2-CB 4.22Å; L1407-I1419 HydrophobicContact CD2-CG2 3.65Å; L1407-I1419 HydrophobicContact CG-CG2 3.95Å; L1412-I1419 HydrophobicContact CB-CD1 4.36Å; L1412-I1419 HydrophobicContact CD1-CD1 4.42Å; L1412-I1419 HydrophobicContact CD2-CD1 4.03Å; Q1415-I1419 HydrophobicContact CB-CD1 4.09Å; Q1415-I1419 HydrophobicContact CB-CG1 4.45Å; Q1415-I1419 WeakPolarHBondContact O-CG1 3.49Å; Q1415-I1419 PolarHBondContact O-N 3.33Å; Q1415-I1419 VanDerWaalsContact O-N 3.14Å; Y1416-I1419 HydrophobicContact CD1-CD1 4.39Å; Y1416-I1419 PolarHBondContact O-N 3.14Å; I1419-H1421 VanDerWaalsContact C-N 3.35Å; I1419-H1421 PolarHBondContact O-N 3.12Å; I1419-T1422 WeakPolarHBondContact O-CB 3.32Å; I1419-T1422 PolarHBondContact O-N 3.15Å; I1419-T1422 VanDerWaalsContact O-N 3.14Å; I1419-I1423 HydrophobicContact CG2-CD1 3.98Å; I1419-I1423 WeakPolarHBondContact O-CG1 3.32Å; I1419-I1423 PolarHBondContact O-N 3.14Å; I1419-L1887 HydrophobicContact CG1-CD1 4.45Å; I1419-L1887 HydrophobicContact CG1-CD2 4.37Å
1420V87.9Confident83.5Confident0.4 Ų0.445.2 Ų45.20%0.00225%0.252CS..Hα-helixtrans-63.1-40.9178.5164.90000111.8L1407 Y1416 T1422 I1423 V1424 Y1445 L1461 Q1464L1407-V1420 HydrophobicContact CD1-CG2 3.92Å; L1407-V1420 HydrophobicContact CD2-CG2 4Å; Y1416-V1420 VanDerWaalsContact O-CB 3.28Å; Y1416-V1420 WeakPolarHBondContact O-CB 3.28Å; Y1416-V1420 VanDerWaalsContact O-CG2 3.3Å; Y1416-V1420 WeakPolarHBondContact O-CG2 3.41Å; Y1416-V1420 PolarHBondContact O-N 3.08Å; V1420-T1422 VanDerWaalsContact C-N 3.26Å; V1420-T1422 PolarHBondContact O-N 2.88Å; V1420-I1423 WeakPolarHBondContact O-CB 3.41Å; V1420-I1423 PolarHBondContact O-N 3.15Å; V1420-I1423 VanDerWaalsContact O-N 3.17Å; V1420-V1424 HydrophobicContact CG1-CG2 4.43Å; V1420-V1424 WeakPolarHBondContact O-CG2 3.4Å; V1420-V1424 PolarHBondContact O-N 3.32Å; V1420-Y1445 HydrophobicContact CB-CE2 4.32Å; V1420-Y1445 HydrophobicContact CG1-CE2 3.57Å; V1420-Y1445 HydrophobicContact CG2-CD2 4.27Å; V1420-Y1445 HydrophobicContact CG2-CE2 3.78Å; V1420-L1461 HydrophobicContact CB-CD2 3.86Å; V1420-L1461 HydrophobicContact CG1-CD2 3.85Å; V1420-L1461 HydrophobicContact CG2-CD2 3.6Å; V1420-Q1464 HydrophobicContact CG1-CB 3.86Å; V1420-Q1464 HydrophobicContact CG1-CG 4.12Å
1421H88.9Confident83.7Confident105 Ų10542.6 Ų42.649%0.48624%0.238SC..Hα-helixtrans-57.4-43.3174.3-172.668.2000111.9G1417 S1418 I1419 V1424 Y1425 F1460G1417-H1421 VanDerWaalsContact O-CB 3.31Å; G1417-H1421 WeakPolarHBondContact O-CB 3.37Å; G1417-H1421 PolarHBondContact O-N 3.16Å; S1418-H1421 PolarHBondContact O-N 3.18Å; I1419-H1421 VanDerWaalsContact C-N 3.35Å; I1419-H1421 PolarHBondContact O-N 3.12Å; H1421-V1424 PolarHBondContact O-N 3.08Å; H1421-Y1425 WeakPolarHBondContact O-CB 3.4Å; H1421-Y1425 PolarHBondContact O-N 2.94Å; H1421-F1460 HydrophobicContact CB-CE1 4.43Å; H1421-F1460 HydrophobicContact CB-CZ 4.13Å
1422T87.9Confident83.5Confident21.2 Ų21.244.2 Ų44.213%0.1324%0.241CC..Hα-helixtrans-66.7-39.7177.4-520000111.4L1403 S1418 I1419 V1420 Y1425 V1426 A1883 L1887L1403-T1422 HydrophobicContact CD1-CG2 3.96Å; L1403-T1422 HydrophobicContact CD2-CG2 4.19Å; S1418-T1422 WeakPolarHBondContact O-CB 3.42Å; S1418-T1422 PolarHBondContact O-N 2.87Å; S1418-T1422 VanDerWaalsContact O-N 3.11Å; S1418-T1422 PolarHBondContact O-OG1 3.03Å; I1419-T1422 WeakPolarHBondContact O-CB 3.32Å; I1419-T1422 PolarHBondContact O-N 3.15Å; I1419-T1422 VanDerWaalsContact O-N 3.14Å; V1420-T1422 VanDerWaalsContact C-N 3.26Å; V1420-T1422 PolarHBondContact O-N 2.88Å; T1422-Y1425 WeakPolarHBondContact O-CB 3.39Å; T1422-Y1425 PolarHBondContact O-N 3.1Å; T1422-V1426 WeakPolarHBondContact O-CG2 3.38Å; T1422-V1426 PolarHBondContact O-N 3.04Å; T1422-A1883 HydrophobicContact CG2-CB 3.9Å; T1422-L1887 HydrophobicContact CG2-CD1 3.93Å; T1422-L1887 WeakPolarHBondContact OG1-CD1 3.45Å
1423I87.9Confident83.4Confident1.4 Ų1.450.7 Ų50.71%0.00727%0.265CS..Hα-helixtrans-59.7-48.6173.6-70.6168.6000110.7L1400 L1403 L1407 I1419 V1420 Y1425 V1426 L1427 L1441L1400-I1423 HydrophobicContact CD1-CG1 4.47Å; L1400-I1423 HydrophobicContact CD1-CG2 4.18Å; L1403-I1423 HydrophobicContact CB-CD1 4.03Å; L1403-I1423 HydrophobicContact CB-CG1 3.65Å; L1403-I1423 HydrophobicContact CD1-CG1 3.89Å; L1403-I1423 HydrophobicContact CD2-CG1 4.33Å; L1403-I1423 HydrophobicContact CG-CG1 4.26Å; L1407-I1423 HydrophobicContact CD1-CD1 3.47Å; L1407-I1423 VanDerWaalsContact CD1-CD1 3.46Å; L1407-I1423 HydrophobicContact CD2-CD1 4.42Å; L1407-I1423 HydrophobicContact CG-CD1 3.88Å; I1419-I1423 HydrophobicContact CG2-CD1 3.98Å; I1419-I1423 WeakPolarHBondContact O-CG1 3.32Å; I1419-I1423 PolarHBondContact O-N 3.14Å; V1420-I1423 WeakPolarHBondContact O-CB 3.41Å; V1420-I1423 PolarHBondContact O-N 3.15Å; V1420-I1423 VanDerWaalsContact O-N 3.17Å; I1423-Y1425 VanDerWaalsContact C-N 3.28Å; I1423-Y1425 PolarHBondContact O-N 3.21Å; I1423-V1426 PolarHBondContact O-N 3.22Å; I1423-V1426 VanDerWaalsContact O-N 3.16Å; I1423-L1427 HydrophobicContact CG2-CD1 3.87Å; I1423-L1427 HydrophobicContact CG2-CG 4.22Å; I1423-L1427 WeakPolarHBondContact O-CB 3.31Å; I1423-L1427 VanDerWaalsContact O-CG 3.28Å; I1423-L1427 WeakPolarHBondContact O-CG 3.34Å; I1423-L1427 PolarHBondContact O-N 3.22Å; I1423-L1441 HydrophobicContact CD1-CD1 4.15Å; I1423-L1441 HydrophobicContact CG2-CD1 3.88Å; I1423-L1441 HydrophobicContact CG2-CD2 3.81Å
1424V87.7Confident83.3Confident7.8 Ų7.847.9 Ų47.95%0.04725%0.252CS..Hα-helixtrans-60.4-40.1178.2174.90000111.1V1420 H1421 L1427 K1428 Q1464 N1467 V1468 I1471V1420-V1424 HydrophobicContact CG1-CG2 4.43Å; V1420-V1424 WeakPolarHBondContact O-CG2 3.4Å; V1420-V1424 PolarHBondContact O-N 3.32Å; H1421-V1424 PolarHBondContact O-N 3.08Å; V1424-L1427 PolarHBondContact O-N 3.24Å; V1424-K1428 WeakPolarHBondContact O-CB 3.39Å; V1424-K1428 WeakPolarHBondContact O-CG 3.32Å; V1424-K1428 PolarHBondContact O-N 3.23Å; V1424-Q1464 HydrophobicContact CG2-CB 4.1Å; V1424-N1467 HydrophobicContact CG1-CB 3.9Å; V1424-V1468 HydrophobicContact CG2-CG2 3.77Å; V1424-I1471 HydrophobicContact CG1-CD1 4.11Å
1425Y87.7Confident83.1Confident108.4 Ų108.444.6 Ų44.643%0.42523%0.227SC..Hα-helixtrans-62.4-46.5174.7-179.1-103.4000112.3H1421 T1422 I1423 L1427 K1428 L1429 P1879 A1883H1421-Y1425 WeakPolarHBondContact O-CB 3.4Å; H1421-Y1425 PolarHBondContact O-N 2.94Å; T1422-Y1425 WeakPolarHBondContact O-CB 3.39Å; T1422-Y1425 PolarHBondContact O-N 3.1Å; I1423-Y1425 VanDerWaalsContact C-N 3.28Å; I1423-Y1425 PolarHBondContact O-N 3.21Å; Y1425-L1427 VanDerWaalsContact C-N 3.34Å; Y1425-L1427 PolarHBondContact O-N 3.27Å; Y1425-K1428 WeakPolarHBondContact O-CB 3.28Å; Y1425-K1428 PolarHBondContact O-N 3.25Å; Y1425-K1428 VanDerWaalsContact O-N 3.17Å; Y1425-L1429 HydrophobicContact CD1-CD1 4.14Å; Y1425-L1429 HydrophobicContact CE1-CD1 3.7Å; Y1425-L1429 HydrophobicContact CE1-CG 4.32Å; Y1425-L1429 WeakPolarHBondContact O-CG 3.48Å; Y1425-L1429 PolarHBondContact O-N 3.26Å; Y1425-L1429 VanDerWaalsContact O-N 3.13Å; Y1425-P1879 HydrophobicContact CE1-CB 4.47Å; Y1425-A1883 HydrophobicContact CD1-CB 3.75Å; Y1425-A1883 HydrophobicContact CE1-CB 3.95Å
1426V85.5Confident82.9Confident3.2 Ų3.247.5 Ų47.52%0.01924%0.243CC..Hα-helixtrans-62.1-42.5175.9173.50000110.9S1396 A1399 L1400 L1403 T1422 I1423 K1428 L1429 L1430 A1880S1396-V1426 WeakPolarHBondContact O-CG1 3.31Å; A1399-V1426 HydrophobicContact CB-CG2 4.43Å; L1400-V1426 HydrophobicContact CB-CG1 4.27Å; L1400-V1426 HydrophobicContact CD1-CG1 4.5Å; L1403-V1426 HydrophobicContact CD1-CG2 4.19Å; T1422-V1426 WeakPolarHBondContact O-CG2 3.38Å; T1422-V1426 PolarHBondContact O-N 3.04Å; I1423-V1426 PolarHBondContact O-N 3.22Å; I1423-V1426 VanDerWaalsContact O-N 3.16Å; V1426-K1428 VanDerWaalsContact C-N 3.31Å; V1426-K1428 PolarHBondContact O-N 3.02Å; V1426-L1429 WeakPolarHBondContact O-CA 3.07Å; V1426-L1429 WeakPolarHBondContact O-CB 3.38Å; V1426-L1429 PolarHBondContact O-N 3.13Å; V1426-L1430 HydrophobicContact CG1-CD1 3.73Å; V1426-L1430 WeakPolarHBondContact O-CD1 3.41Å; V1426-L1430 PolarHBondContact O-N 3.17Å; V1426-L1430 VanDerWaalsContact O-N 3.09Å; V1426-A1880 HydrophobicContact CG1-CB 4.4Å; V1426-A1880 HydrophobicContact CG2-CB 4.18Å
1427L84.8Confident82.5Confident1 Ų148.4 Ų48.41%0.00525%0.247CC..Hα-helixtrans-60.6-38.7174.8-69.7172.7000112.2L1400 I1423 V1424 Y1425 L1429 L1430 G1431 L1441 V1468 I1471L1400-L1427 HydrophobicContact CD1-CD2 4.35Å; L1400-L1427 HydrophobicContact CD2-CD2 4.34Å; I1423-L1427 HydrophobicContact CG2-CD1 3.87Å; I1423-L1427 HydrophobicContact CG2-CG 4.22Å; I1423-L1427 WeakPolarHBondContact O-CB 3.31Å; I1423-L1427 VanDerWaalsContact O-CG 3.28Å; I1423-L1427 WeakPolarHBondContact O-CG 3.34Å; I1423-L1427 PolarHBondContact O-N 3.22Å; V1424-L1427 PolarHBondContact O-N 3.24Å; Y1425-L1427 VanDerWaalsContact C-N 3.34Å; Y1425-L1427 PolarHBondContact O-N 3.27Å; L1427-L1429 VanDerWaalsContact C-N 3.28Å; L1427-L1429 PolarHBondContact O-N 3.1Å; L1427-L1430 PolarHBondContact O-N 3.12Å; L1427-G1431 PolarHBondContact O-N 3.06Å; L1427-L1441 HydrophobicContact CD1-CD2 3.77Å; L1427-L1441 HydrophobicContact CD2-CD2 4.41Å; L1427-V1468 HydrophobicContact CD1-CG1 4.29Å; L1427-V1468 HydrophobicContact CD1-CG2 4.04Å; L1427-I1471 HydrophobicContact CB-CD1 4.28Å; L1427-I1471 HydrophobicContact CB-CG2 4.45Å; L1427-I1471 WeakPolarHBondContact O-CG2 3.35Å
1428K85.3Confident82.1Confident130.2 Ų130.247.8 Ų47.857%0.56624%0.24SC*.Hα-helixtrans-62.1-35.2173.9-108.7-179.8179.3-176.80112.1V1424 Y1425 V1426 G1431 I1471V1424-K1428 WeakPolarHBondContact O-CB 3.39Å; V1424-K1428 WeakPolarHBondContact O-CG 3.32Å; V1424-K1428 PolarHBondContact O-N 3.23Å; Y1425-K1428 WeakPolarHBondContact O-CB 3.28Å; Y1425-K1428 PolarHBondContact O-N 3.25Å; Y1425-K1428 VanDerWaalsContact O-N 3.17Å; V1426-K1428 VanDerWaalsContact C-N 3.31Å; V1426-K1428 PolarHBondContact O-N 3.02Å; K1428-G1431 PolarHBondContact O-N 3.23Å; K1428-I1471 HydrophobicContact CB-CD1 4.23Å; K1428-I1471 HydrophobicContact CD-CD1 4.36Å; K1428-I1471 HydrophobicContact CG-CD1 3.3Å; K1428-I1471 HydrophobicContact CG-CG1 3.79Å
1429L82.3Confident81.7Confident68 Ų6853.2 Ų53.236%0.35625%0.251SS..Hα-helixtrans-70.2-37.6175.6-64.3172.6000112.5Y1425 V1426 L1427 P1879 A1880Y1425-L1429 HydrophobicContact CD1-CD1 4.14Å; Y1425-L1429 HydrophobicContact CE1-CD1 3.7Å; Y1425-L1429 HydrophobicContact CE1-CG 4.32Å; Y1425-L1429 WeakPolarHBondContact O-CG 3.48Å; Y1425-L1429 PolarHBondContact O-N 3.26Å; Y1425-L1429 VanDerWaalsContact O-N 3.13Å; V1426-L1429 WeakPolarHBondContact O-CA 3.07Å; V1426-L1429 WeakPolarHBondContact O-CB 3.38Å; V1426-L1429 PolarHBondContact O-N 3.13Å; L1427-L1429 VanDerWaalsContact C-N 3.28Å; L1427-L1429 PolarHBondContact O-N 3.1Å; L1429-P1879 HydrophobicContact CD1-CB 3.91Å; L1429-P1879 HydrophobicContact CD2-CB 4.43Å; L1429-A1880 HydrophobicContact CD1-CB 4.12Å
1430L81.5Confident81.2Confident15.4 Ų15.455.7 Ų55.78%0.08126%0.262CS..Hα-helixtrans-74.1-29.5175.8-79.497.3000112.9V1397 V1426 L1427 R1433 Y1437V1397-L1430 HydrophobicContact CG2-CD2 4.13Å; V1426-L1430 HydrophobicContact CG1-CD1 3.73Å; V1426-L1430 WeakPolarHBondContact O-CD1 3.41Å; V1426-L1430 PolarHBondContact O-N 3.17Å; V1426-L1430 VanDerWaalsContact O-N 3.09Å; L1427-L1430 PolarHBondContact O-N 3.12Å; L1430-R1433 WeakPolarHBondContact O-CB 3.38Å; L1430-R1433 PolarHBondContact O-N 3.3Å; L1430-R1433 VanDerWaalsContact O-N 3.14Å; L1430-Y1437 HydrophobicContact CD2-CD2 3.96Å; L1430-Y1437 HydrophobicContact CD2-CE2 3.9Å
1431G78.3Confident81Confident16 Ų1655.8 Ų55.817%0.16526%0.263CS..G310 helixtrans55.3-130.1-175.500000112L1427 K1428 R1433 S1434L1427-G1431 PolarHBondContact O-N 3.06Å; K1428-G1431 PolarHBondContact O-N 3.23Å; G1431-R1433 PolarHBondContact O-N 3.08Å; G1431-R1433 VanDerWaalsContact O-N 3.13Å; G1431-S1434 WeakPolarHBondContact O-CB 3.4Å; G1431-S1434 PolarHBondContact O-N 3.29Å; G1431-S1434 VanDerWaalsContact O-N 3.15Å; G1431-S1434 PolarHBondContact O-OG 3Å
1432P73.7Confident80.7Confident111.4 Ų111.451.3 Ų51.372%0.72324%0.242SC*.G310 helixtrans-68.2-13.9-176.928.8-35.2000114S1434 V1435P1432-S1434 PolarHBondContact O-N 3.17Å; P1432-V1435 WeakPolarHBondContact O-CG2 3.33Å
1433R73.1Confident80.5Confident160 Ų16053 Ų5360%0.60425%0.254SS*.G310 helixtrans-73.8-12.5175.9-61.5-179.8-179.3173.6-0.3112.9L1430 G1431 V1435L1430-R1433 WeakPolarHBondContact O-CB 3.38Å; L1430-R1433 PolarHBondContact O-N 3.3Å; L1430-R1433 VanDerWaalsContact O-N 3.14Å; G1431-R1433 PolarHBondContact O-N 3.08Å; G1431-R1433 VanDerWaalsContact O-N 3.13Å; R1433-V1435 VanDerWaalsContact C-N 3.27Å; R1433-V1435 PolarHBondContact O-N 3.19Å; R1433-V1435 VanDerWaalsContact O-N 3.17Å
1434S76Confident80.2Confident0 Ų053.3 Ų53.30%026%0.256CS..G310 helixtrans-68.1-15.8-178.161.80000114.6G1431 P1432 I1436 Y1437 L1438G1431-S1434 WeakPolarHBondContact O-CB 3.4Å; G1431-S1434 PolarHBondContact O-N 3.29Å; G1431-S1434 VanDerWaalsContact O-N 3.15Å; G1431-S1434 PolarHBondContact O-OG 3Å; P1432-S1434 PolarHBondContact O-N 3.17Å; S1434-I1436 VanDerWaalsContact C-N 3.28Å; S1434-I1436 PolarHBondContact O-N 3.14Å; S1434-I1436 VanDerWaalsContact O-N 3.14Å; S1434-Y1437 WeakPolarHBondContact O-CD2 3.26Å; S1434-Y1437 PolarHBondContact O-N 3.11Å; S1434-L1438 PolarHBondContact O-N 3.26Å
1435V74Confident80.1Confident34.4 Ų34.453.3 Ų53.321%0.20826%0.255CS..Hα-helixtrans-55.7-37.6-171.2175.10000113.2P1432 R1433 Y1437 L1438 N1475P1432-V1435 WeakPolarHBondContact O-CG2 3.33Å; R1433-V1435 VanDerWaalsContact C-N 3.27Å; R1433-V1435 PolarHBondContact O-N 3.19Å; R1433-V1435 VanDerWaalsContact O-N 3.17Å; V1435-Y1437 VanDerWaalsContact C-N 3.28Å; V1435-Y1437 PolarHBondContact O-N 3.14Å; V1435-L1438 HydrophobicContact CB-CD1 4.41Å; V1435-L1438 HydrophobicContact CG2-CD1 4.32Å; V1435-L1438 VanDerWaalsContact O-CB 3.28Å; V1435-L1438 WeakPolarHBondContact O-CB 3.26Å; V1435-L1438 PolarHBondContact O-N 3.14Å; V1435-L1438 VanDerWaalsContact O-N 3.13Å; V1435-N1475 HydrophobicContact CG1-CB 4.03Å; V1435-N1475 WeakPolarHBondContact CG1-ND2 3.16Å; V1435-N1475 HydrophobicContact CG2-CB 3.95Å; V1435-N1475 WeakPolarHBondContact CG2-ND2 3.32Å
1436I75.6Confident80Confident127.6 Ų127.648.8 Ų48.865%0.65424%0.237SC*.Hα-helixtrans-61.5-33.7-178.4-53.5172000111S1434S1434-I1436 VanDerWaalsContact C-N 3.28Å; S1434-I1436 PolarHBondContact O-N 3.14Å; S1434-I1436 VanDerWaalsContact O-N 3.14Å
1437Y75Confident79.8Confident23.2 Ų23.254 Ų549%0.09126%0.257CS..Hα-helixtrans-88.4-13.2-176.9-50.5-71.1000113.1L1386 V1397 L1400 L1430 S1434 V1435 R1439 Q1440 L1441L1386-Y1437 WeakPolarHBondContact CD2-OH 3.37Å; V1397-Y1437 HydrophobicContact CB-CE1 4.39Å; V1397-Y1437 HydrophobicContact CG1-CD1 4.36Å; V1397-Y1437 HydrophobicContact CG1-CE1 3.64Å; V1397-Y1437 VanDerWaalsContact CG1-CE1 3.48Å; V1397-Y1437 HydrophobicContact CG1-CE2 4.49Å; V1397-Y1437 HydrophobicContact CG2-CD2 4.44Å; V1397-Y1437 HydrophobicContact CG2-CE1 3.97Å; V1397-Y1437 HydrophobicContact CG2-CE2 3.77Å; V1397-Y1437 VanDerWaalsContact CG2-CZ 3.46Å; V1397-Y1437 WeakPolarHBondContact CG2-OH 3.44Å; L1400-Y1437 VanDerWaalsContact CD2-CB 3.45Å; L1400-Y1437 HydrophobicContact CD2-CD1 4.19Å; L1400-Y1437 HydrophobicContact CD2-CD2 4.06Å; L1400-Y1437 HydrophobicContact CD2-CG 3.7Å; L1430-Y1437 HydrophobicContact CD2-CD2 3.96Å; L1430-Y1437 HydrophobicContact CD2-CE2 3.9Å; S1434-Y1437 WeakPolarHBondContact O-CD2 3.26Å; S1434-Y1437 PolarHBondContact O-N 3.11Å; V1435-Y1437 VanDerWaalsContact C-N 3.28Å; V1435-Y1437 PolarHBondContact O-N 3.14Å; Y1437-R1439 VanDerWaalsContact C-N 3.28Å; Y1437-R1439 PolarHBondContact O-N 3.11Å; Y1437-Q1440 PolarHBondContact O-N 3Å; Y1437-Q1440 VanDerWaalsContact O-N 3.14Å; Y1437-L1441 WeakPolarHBondContact O-CB 3.34Å; Y1437-L1441 PolarHBondContact O-N 3.03Å
1438L78Confident79.6Confident2.4 Ų2.454.1 Ų54.11%0.01326%0.258CS..Hα-helixtrans-62.7-36.9-177.5-104.1133.3000112.2S1434 V1435 Q1440 L1441 I1442 V1468 V1472 F1479S1434-L1438 PolarHBondContact O-N 3.26Å; V1435-L1438 HydrophobicContact CB-CD1 4.41Å; V1435-L1438 HydrophobicContact CG2-CD1 4.32Å; V1435-L1438 VanDerWaalsContact O-CB 3.28Å; V1435-L1438 WeakPolarHBondContact O-CB 3.26Å; V1435-L1438 PolarHBondContact O-N 3.14Å; V1435-L1438 VanDerWaalsContact O-N 3.13Å; L1438-Q1440 PolarHBondContact O-N 3.09Å; L1438-Q1440 VanDerWaalsContact O-N 3.16Å; L1438-L1441 PolarHBondContact O-N 3.15Å; L1438-L1441 VanDerWaalsContact O-N 3.17Å; L1438-I1442 HydrophobicContact CB-CD1 4.03Å; L1438-I1442 HydrophobicContact CB-CG1 4.19Å; L1438-I1442 HydrophobicContact CD1-CD1 3.7Å; L1438-I1442 HydrophobicContact CD1-CG1 3.69Å; L1438-I1442 HydrophobicContact CD2-CD1 4.18Å; L1438-I1442 HydrophobicContact CD2-CG1 4.34Å; L1438-I1442 HydrophobicContact CG-CD1 3.94Å; L1438-I1442 HydrophobicContact CG-CG1 3.82Å; L1438-I1442 VanDerWaalsContact O-CB 3.25Å; L1438-I1442 WeakPolarHBondContact O-CB 3.4Å; L1438-I1442 VanDerWaalsContact O-CG1 3.24Å; L1438-I1442 WeakPolarHBondContact O-CG1 3.38Å; L1438-I1442 PolarHBondContact O-N 3.19Å; L1438-V1468 HydrophobicContact CD1-CG1 4.26Å; L1438-V1468 HydrophobicContact CD2-CG1 4.34Å; L1438-V1472 HydrophobicContact CD1-CB 4.21Å; L1438-V1472 HydrophobicContact CD1-CG1 3.35Å; L1438-V1472 VanDerWaalsContact CD1-CG1 3.44Å; L1438-V1472 HydrophobicContact CD1-CG2 3.85Å; L1438-V1472 VanDerWaalsContact CD1-CG2 3.48Å; L1438-V1472 HydrophobicContact CD2-CB 4.32Å; L1438-V1472 HydrophobicContact CD2-CG1 3.47Å; L1438-V1472 VanDerWaalsContact CD2-CG1 3.43Å; L1438-V1472 HydrophobicContact CD2-CG2 3.81Å; L1438-V1472 HydrophobicContact CG-CG2 4.19Å; L1438-F1479 HydrophobicContact CB-CE2 4Å; L1438-F1479 HydrophobicContact CB-CZ 4.2Å; L1438-F1479 HydrophobicContact CD1-CE1 4.36Å; L1438-F1479 HydrophobicContact CD2-CD1 4.04Å; L1438-F1479 HydrophobicContact CD2-CD2 4.13Å; L1438-F1479 HydrophobicContact CD2-CE1 3.37Å; L1438-F1479 HydrophobicContact CD2-CE2 3.6Å; L1438-F1479 HydrophobicContact CD2-CZ 4.28Å; L1438-F1479 HydrophobicContact CG-CE1 4.1Å; L1438-F1479 HydrophobicContact CG-CE2 3.88Å; L1438-F1479 HydrophobicContact CG-CZ 4.21Å
1439R77.5Confident79.4Confident177.2 Ų177.248 Ų4867%0.66923%0.231SC*.Hα-helixtrans-61.2-28.7178.2-85.1179.3175.8-1170.1113.1Y1437 P1443 E1478 F1479Y1437-R1439 VanDerWaalsContact C-N 3.28Å; Y1437-R1439 PolarHBondContact O-N 3.11Å; R1439-P1443 VanDerWaalsContact O-CD 3.26Å; R1439-P1443 WeakPolarHBondContact O-CD 3.31Å; R1439-P1443 WeakPolarHBondContact O-CG 3.34Å; R1439-E1478 IonicContact CZ-OE1 3.41Å; R1439-E1478 IonicContact CZ-OE2 3.27Å; R1439-E1478 VanDerWaalsContact CZ-OE2 3.3Å; R1439-E1478 IonicContact NE-OE1 3.37Å; R1439-E1478 IonicContact NE-OE2 3.73Å; R1439-E1478 PolarHBondContact NE-OE2 3.1Å; R1439-E1478 VanDerWaalsContact NE-OE2 3.16Å; R1439-E1478 VanDerWaalsContact NH2-CD 3.28Å; R1439-E1478 IonicContact NH2-OE1 2.98Å; R1439-E1478 PolarHBondContact NH2-OE1 3.26Å; R1439-E1478 IonicContact NH2-OE2 3.32Å; R1439-E1478 PolarHBondContact NH2-OE2 3.32Å; R1439-F1479 HydrophobicContact CB-CZ 4.46Å; R1439-F1479 HydrophobicContact CG-CE1 4.39Å; R1439-F1479 HydrophobicContact CG-CZ 3.75Å
1440Q77.1Confident79.4Confident55 Ų5551.1 Ų51.126%0.25724%0.244SC..Hα-helixtrans-88.6-40.4175.2-153.6179.14.600111.6D1376 I1377 I1404 Y1437 L1438D1376-Q1440 PolarHBondContact OD1-NE2 3.09Å; I1377-Q1440 VanDerWaalsContact CG1-NE2 3.33Å; I1404-Q1440 HydrophobicContact CG2-CG 4.42Å; Y1437-Q1440 PolarHBondContact O-N 3Å; Y1437-Q1440 VanDerWaalsContact O-N 3.14Å; L1438-Q1440 PolarHBondContact O-N 3.09Å; L1438-Q1440 VanDerWaalsContact O-N 3.16Å
1441L82.4Confident79.2Confident3.2 Ų3.253.8 Ų53.82%0.01726%0.258CS..Hα-helixtrans-69.1-44.8-176.3178.778.1000113L1400 I1404 L1407 I1423 L1427 Y1437 L1438 D1444 Y1445L1400-L1441 HydrophobicContact CD1-CD1 3.83Å; I1404-L1441 HydrophobicContact CD1-CB 4.2Å; I1404-L1441 HydrophobicContact CD1-CD1 4.33Å; I1404-L1441 HydrophobicContact CG1-CB 4.42Å; I1404-L1441 HydrophobicContact CG1-CD1 3.85Å; L1407-L1441 HydrophobicContact CD1-CD1 4.13Å; I1423-L1441 HydrophobicContact CD1-CD1 4.15Å; I1423-L1441 HydrophobicContact CG2-CD1 3.88Å; I1423-L1441 HydrophobicContact CG2-CD2 3.81Å; L1427-L1441 HydrophobicContact CD1-CD2 3.77Å; L1427-L1441 HydrophobicContact CD2-CD2 4.41Å; Y1437-L1441 WeakPolarHBondContact O-CB 3.34Å; Y1437-L1441 PolarHBondContact O-N 3.03Å; L1438-L1441 PolarHBondContact O-N 3.15Å; L1438-L1441 VanDerWaalsContact O-N 3.17Å; L1441-D1444 PolarHBondContact O-N 3.19Å; L1441-Y1445 HydrophobicContact CD2-CD2 4.5Å; L1441-Y1445 WeakPolarHBondContact O-CB 3.29Å; L1441-Y1445 PolarHBondContact O-N 3.05Å
1442I84Confident79.2Confident10.2 Ų10.253.4 Ų53.45%0.05225%0.252CS..Hα-helixtrans-63.9-46.4-169.2-72.2-107.1000113L1438 D1444 Y1445 F1446 F1479L1438-I1442 HydrophobicContact CB-CD1 4.03Å; L1438-I1442 HydrophobicContact CB-CG1 4.19Å; L1438-I1442 HydrophobicContact CD1-CD1 3.7Å; L1438-I1442 HydrophobicContact CD1-CG1 3.69Å; L1438-I1442 HydrophobicContact CD2-CD1 4.18Å; L1438-I1442 HydrophobicContact CD2-CG1 4.34Å; L1438-I1442 HydrophobicContact CG-CD1 3.94Å; L1438-I1442 HydrophobicContact CG-CG1 3.82Å; L1438-I1442 VanDerWaalsContact O-CB 3.25Å; L1438-I1442 WeakPolarHBondContact O-CB 3.4Å; L1438-I1442 VanDerWaalsContact O-CG1 3.24Å; L1438-I1442 WeakPolarHBondContact O-CG1 3.38Å; L1438-I1442 PolarHBondContact O-N 3.19Å; I1442-D1444 VanDerWaalsContact C-N 3.3Å; I1442-D1444 PolarHBondContact O-N 3.26Å; I1442-Y1445 WeakPolarHBondContact O-CB 3.29Å; I1442-Y1445 PolarHBondContact O-N 3.14Å; I1442-Y1445 VanDerWaalsContact O-N 3.13Å; I1442-F1446 HydrophobicContact CG2-CD1 4.34Å; I1442-F1446 HydrophobicContact CG2-CD2 3.48Å; I1442-F1446 VanDerWaalsContact CG2-CD2 3.45Å; I1442-F1446 HydrophobicContact CG2-CE1 4.25Å; I1442-F1446 HydrophobicContact CG2-CE2 3.11Å; I1442-F1446 HydrophobicContact CG2-CG 4.32Å; I1442-F1446 HydrophobicContact CG2-CZ 3.82Å; I1442-F1446 VanDerWaalsContact CG2-CZ 3.41Å; I1442-F1446 WeakPolarHBondContact O-CD2 3.28Å; I1442-F1446 WeakPolarHBondContact O-CG 3.33Å; I1442-F1446 PolarHBondContact O-N 2.97Å; I1442-F1479 HydrophobicContact CB-CD1 3.95Å; I1442-F1479 HydrophobicContact CB-CE1 4.01Å; I1442-F1479 HydrophobicContact CB-CG 4.46Å; I1442-F1479 HydrophobicContact CB-CZ 4.5Å; I1442-F1479 HydrophobicContact CD1-CB 4.04Å; I1442-F1479 HydrophobicContact CD1-CD1 4.02Å; I1442-F1479 HydrophobicContact CD1-CD2 3.68Å; I1442-F1479 HydrophobicContact CD1-CE1 4.06Å; I1442-F1479 HydrophobicContact CD1-CE2 3.74Å; I1442-F1479 HydrophobicContact CD1-CG 3.83Å; I1442-F1479 VanDerWaalsContact CD1-CG 3.47Å; I1442-F1479 HydrophobicContact CD1-CZ 3.92Å; I1442-F1479 HydrophobicContact CG1-CD1 4.18Å; I1442-F1479 HydrophobicContact CG1-CD2 4.39Å; I1442-F1479 HydrophobicContact CG1-CE1 4.28Å; I1442-F1479 HydrophobicContact CG1-CG 4.2Å; I1442-F1479 HydrophobicContact CG1-CZ 4.48Å; I1442-F1479 HydrophobicContact CG2-CB 3.96Å; I1442-F1479 HydrophobicContact CG2-CD1 3.82Å; I1442-F1479 VanDerWaalsContact CG2-CD1 3.49Å; I1442-F1479 HydrophobicContact CG2-CD2 4.23Å; I1442-F1479 HydrophobicContact CG2-CE1 4.06Å; I1442-F1479 HydrophobicContact CG2-CG 3.97Å
1443P82.7Confident79.3Confident56.8 Ų56.858.1 Ų58.137%0.36926%0.256SS..Hα-helixtrans-60.6-36.4177.3-25.535.4000113.4R1439 R1447R1439-P1443 VanDerWaalsContact O-CD 3.26Å; R1439-P1443 WeakPolarHBondContact O-CD 3.31Å; R1439-P1443 WeakPolarHBondContact O-CG 3.34Å; P1443-R1447 WeakPolarHBondContact O-CB 3.33Å; P1443-R1447 PolarHBondContact O-N 3.01Å; P1443-R1447 PolarHBondContact O-NH2 3.44Å
1444D81.8Confident79.7Confident8.6 Ų8.655 Ų555%0.04625%0.251CS..Hα-helixtrans-74.6-35.7177-67.5-35.1000111.4I1404 L1407 R1408 L1441 I1442 F1446 R1447 C1448I1404-D1444 WeakPolarHBondContact CG2-OD2 3.33Å; L1407-D1444 VanDerWaalsContact CD2-C 3.43Å; L1407-D1444 HydrophobicContact CD2-CB 3.91Å; L1407-D1444 WeakPolarHBondContact CD2-O 3.24Å; R1408-D1444 IonicContact CZ-OD1 3.87Å; R1408-D1444 IonicContact CZ-OD2 3.17Å; R1408-D1444 VanDerWaalsContact CZ-OD2 3.27Å; R1408-D1444 VanDerWaalsContact NE-CG 3.29Å; R1408-D1444 IonicContact NE-OD1 3.1Å; R1408-D1444 PolarHBondContact NE-OD1 3.32Å; R1408-D1444 IonicContact NE-OD2 3.21Å; R1408-D1444 PolarHBondContact NE-OD2 3.2Å; R1408-D1444 IonicContact NH2-OD1 3.75Å; R1408-D1444 IonicContact NH2-OD2 3.07Å; R1408-D1444 PolarHBondContact NH2-OD2 3.01Å; L1441-D1444 PolarHBondContact O-N 3.19Å; I1442-D1444 VanDerWaalsContact C-N 3.3Å; I1442-D1444 PolarHBondContact O-N 3.26Å; D1444-F1446 PolarHBondContact O-N 3.01Å; D1444-R1447 PolarHBondContact O-N 3.28Å; D1444-R1447 IonicContact OD1-CZ 3.2Å; D1444-R1447 IonicContact OD1-NH1 3.17Å; D1444-R1447 PolarHBondContact OD1-NH1 3.08Å; D1444-R1447 IonicContact OD1-NH2 3.18Å; D1444-R1447 PolarHBondContact OD1-NH2 3.44Å; D1444-C1448 VanDerWaalsContact O-CB 3.25Å; D1444-C1448 WeakPolarHBondContact O-CB 3.42Å; D1444-C1448 PolarHBondContact O-N 3.17Å
1445Y86Confident79.9Confident7 Ų756.7 Ų56.73%0.02727%0.265CS..Hα-helixtrans-63-44.6173.7-166.4-86.2000112.3V1420 L1441 I1442 C1448 L1449 L1461 Q1464 L1465V1420-Y1445 HydrophobicContact CB-CE2 4.32Å; V1420-Y1445 HydrophobicContact CG1-CE2 3.57Å; V1420-Y1445 HydrophobicContact CG2-CD2 4.27Å; V1420-Y1445 HydrophobicContact CG2-CE2 3.78Å; L1441-Y1445 HydrophobicContact CD2-CD2 4.5Å; L1441-Y1445 WeakPolarHBondContact O-CB 3.29Å; L1441-Y1445 PolarHBondContact O-N 3.05Å; I1442-Y1445 WeakPolarHBondContact O-CB 3.29Å; I1442-Y1445 PolarHBondContact O-N 3.14Å; I1442-Y1445 VanDerWaalsContact O-N 3.13Å; Y1445-C1448 WeakPolarHBondContact O-CB 3.4Å; Y1445-C1448 PolarHBondContact O-N 3.16Å; Y1445-L1449 HydrophobicContact CD1-CD1 3.81Å; Y1445-L1449 HydrophobicContact CE1-CD1 4Å; Y1445-L1449 HydrophobicContact CE1-CG 4.28Å; Y1445-L1449 PolarHBondContact O-N 3.25Å; Y1445-L1461 HydrophobicContact CE2-CD2 4.4Å; Y1445-L1461 PolarHBondContact OH-O 3.02Å; Y1445-Q1464 WeakPolarHBondContact OH-CB 3.47Å; Y1445-L1465 HydrophobicContact CD1-CD1 4.4Å; Y1445-L1465 HydrophobicContact CE1-CB 4.13Å; Y1445-L1465 HydrophobicContact CE1-CD1 4.13Å; Y1445-L1465 HydrophobicContact CE1-CG 4.47Å; Y1445-L1465 PolarHBondContact OH-N 3.14Å
1446F84.8Confident80.4Confident13.8 Ų13.864.6 Ų64.66%0.06129%0.291CS..Hα-helixtrans-66.8-41.9176.7-70.4-38.4000111.8I1442 D1444 C1448 L1449 E1450 L1465 F1479 E1482 V1483 L1486I1442-F1446 HydrophobicContact CG2-CD1 4.34Å; I1442-F1446 HydrophobicContact CG2-CD2 3.48Å; I1442-F1446 VanDerWaalsContact CG2-CD2 3.45Å; I1442-F1446 HydrophobicContact CG2-CE1 4.25Å; I1442-F1446 HydrophobicContact CG2-CE2 3.11Å; I1442-F1446 HydrophobicContact CG2-CG 4.32Å; I1442-F1446 HydrophobicContact CG2-CZ 3.82Å; I1442-F1446 VanDerWaalsContact CG2-CZ 3.41Å; I1442-F1446 WeakPolarHBondContact O-CD2 3.28Å; I1442-F1446 WeakPolarHBondContact O-CG 3.33Å; I1442-F1446 PolarHBondContact O-N 2.97Å; D1444-F1446 PolarHBondContact O-N 3.01Å; F1446-C1448 VanDerWaalsContact C-N 3.29Å; F1446-C1448 PolarHBondContact O-N 3.09Å; F1446-L1449 HydrophobicContact CD1-CD1 4.32Å; F1446-L1449 WeakPolarHBondContact O-CB 3.25Å; F1446-L1449 PolarHBondContact O-N 3.27Å; F1446-L1449 VanDerWaalsContact O-N 3.1Å; F1446-E1450 WeakPolarHBondContact O-CG 3.35Å; F1446-E1450 PolarHBondContact O-N 3.3Å; F1446-L1465 HydrophobicContact CE1-CD1 4.18Å; F1446-L1465 HydrophobicContact CE1-CD2 4.11Å; F1446-F1479 HydrophobicContact CE2-CB 4.37Å; F1446-F1479 HydrophobicContact CE2-CD2 4.42Å; F1446-F1479 HydrophobicContact CZ-CD2 4.21Å; F1446-E1482 HydrophobicContact CD2-CB 4.06Å; F1446-E1482 VanDerWaalsContact CD2-OE2 3.24Å; F1446-E1482 WeakPolarHBondContact CD2-OE2 3.39Å; F1446-E1482 HydrophobicContact CE1-CB 4.2Å; F1446-E1482 HydrophobicContact CE2-CB 3.46Å; F1446-E1482 VanDerWaalsContact CE2-CB 3.47Å; F1446-E1482 HydrophobicContact CE2-CG 4.38Å; F1446-E1482 VanDerWaalsContact CE2-OE2 3.3Å; F1446-E1482 WeakPolarHBondContact CE2-OE2 3.33Å; F1446-E1482 HydrophobicContact CZ-CB 4.01Å; F1446-V1483 HydrophobicContact CE1-CG2 4.32Å; F1446-V1483 HydrophobicContact CZ-CG2 3.74Å; F1446-L1486 HydrophobicContact CB-CD1 4.13Å; F1446-L1486 HydrophobicContact CD1-CB 4.38Å; F1446-L1486 HydrophobicContact CD1-CD1 3.32Å; F1446-L1486 VanDerWaalsContact CD1-CD1 3.45Å; F1446-L1486 HydrophobicContact CD2-CD1 3.87Å; F1446-L1486 HydrophobicContact CE1-CB 4.02Å; F1446-L1486 HydrophobicContact CE1-CD1 3.61Å; F1446-L1486 HydrophobicContact CE1-CG 4.42Å; F1446-L1486 HydrophobicContact CE2-CD1 4.2Å; F1446-L1486 HydrophobicContact CG-CD1 4.06Å; F1446-L1486 HydrophobicContact CZ-CD1 4.12Å
1447R81.7Confident80.8Confident112.2 Ų112.259.8 Ų59.842%0.42327%0.267SS..Hα-helixtrans-59.7-39.4173.1-166.3-176.5-55.8124.812.4112.1P1443 D1444 L1449 E1450 N1451P1443-R1447 WeakPolarHBondContact O-CB 3.33Å; P1443-R1447 PolarHBondContact O-N 3.01Å; P1443-R1447 PolarHBondContact O-NH2 3.44Å; D1444-R1447 PolarHBondContact O-N 3.28Å; D1444-R1447 IonicContact OD1-CZ 3.2Å; D1444-R1447 IonicContact OD1-NH1 3.17Å; D1444-R1447 PolarHBondContact OD1-NH1 3.08Å; D1444-R1447 IonicContact OD1-NH2 3.18Å; D1444-R1447 PolarHBondContact OD1-NH2 3.44Å; R1447-L1449 VanDerWaalsContact C-N 3.33Å; R1447-L1449 PolarHBondContact O-N 3.39Å; R1447-E1450 PolarHBondContact O-N 3.2Å; R1447-N1451 VanDerWaalsContact O-CB 3.3Å; R1447-N1451 WeakPolarHBondContact O-CB 3.36Å; R1447-N1451 VanDerWaalsContact O-CG 3.24Å; R1447-N1451 PolarHBondContact O-N 3.25Å; R1447-N1451 PolarHBondContact O-ND2 3.04Å
1448C81.4Confident81.4Confident3.8 Ų3.859.2 Ų59.23%0.02627%0.265CS..Hα-helixtrans-61.1-42.5173.5168.60000111.8L1407 Y1416 D1444 Y1445 F1446 T1452L1407-C1448 HydrophobicContact CD1-CB 4.24Å; L1407-C1448 HydrophobicContact CD2-CB 3.99Å; L1407-C1448 HydrophobicContact CG-CB 4.17Å; Y1416-C1448 HydrophobicContact CD2-CB 4.4Å; Y1416-C1448 WeakPolarHBondContact CD2-SG 3.44Å; Y1416-C1448 HydrophobicContact CE2-CB 4.35Å; Y1416-C1448 VanDerWaalsContact CE2-SG 3.53Å; D1444-C1448 VanDerWaalsContact O-CB 3.25Å; D1444-C1448 WeakPolarHBondContact O-CB 3.42Å; D1444-C1448 PolarHBondContact O-N 3.17Å; Y1445-C1448 WeakPolarHBondContact O-CB 3.4Å; Y1445-C1448 PolarHBondContact O-N 3.16Å; F1446-C1448 VanDerWaalsContact C-N 3.29Å; F1446-C1448 PolarHBondContact O-N 3.09Å; C1448-T1452 VanDerWaalsContact O-CB 3.26Å; C1448-T1452 WeakPolarHBondContact O-CB 3.39Å; C1448-T1452 PolarHBondContact O-N 3.29Å; C1448-T1452 VanDerWaalsContact O-N 3.14Å; C1448-T1452 PolarHBondContact O-OG1 3.2Å
1449L81.3Confident81.8Confident1.2 Ų1.260.7 Ų60.71%0.00627%0.272CS..Hα-helixtrans-67-43.3177.5-150.6124.2000112.3Y1445 F1446 R1447 N1451 T1452 Q1458 L1461 I1462 L1486 H1490Y1445-L1449 HydrophobicContact CD1-CD1 3.81Å; Y1445-L1449 HydrophobicContact CE1-CD1 4Å; Y1445-L1449 HydrophobicContact CE1-CG 4.28Å; Y1445-L1449 PolarHBondContact O-N 3.25Å; F1446-L1449 HydrophobicContact CD1-CD1 4.32Å; F1446-L1449 WeakPolarHBondContact O-CB 3.25Å; F1446-L1449 PolarHBondContact O-N 3.27Å; F1446-L1449 VanDerWaalsContact O-N 3.1Å; R1447-L1449 VanDerWaalsContact C-N 3.33Å; R1447-L1449 PolarHBondContact O-N 3.39Å; L1449-N1451 VanDerWaalsContact C-N 3.34Å; L1449-N1451 PolarHBondContact O-N 2.92Å; L1449-T1452 PolarHBondContact O-N 3.37Å; L1449-Q1458 HydrophobicContact CD1-CB 4.49Å; L1449-Q1458 HydrophobicContact CD1-CG 4.47Å; L1449-L1461 HydrophobicContact CB-CD1 4.48Å; L1449-L1461 HydrophobicContact CD1-CB 3.69Å; L1449-L1461 HydrophobicContact CD1-CD1 4.09Å; L1449-L1461 HydrophobicContact CD1-CG 4.22Å; L1449-L1461 HydrophobicContact CD2-CB 3.5Å; L1449-L1461 VanDerWaalsContact CD2-CB 3.5Å; L1449-L1461 HydrophobicContact CD2-CD1 3.7Å; L1449-L1461 HydrophobicContact CD2-CG 4.25Å; L1449-L1461 HydrophobicContact CG-CB 4.41Å; L1449-L1461 HydrophobicContact CG-CD1 4.37Å; L1449-I1462 HydrophobicContact CD1-CD1 4.39Å; L1449-I1462 HydrophobicContact CD1-CG1 3.89Å; L1449-I1462 HydrophobicContact CD2-CD1 4.42Å; L1449-I1462 HydrophobicContact CD2-CG1 4.16Å; L1449-L1486 HydrophobicContact CB-CD1 4.3Å; L1449-L1486 HydrophobicContact CD1-CD1 3.77Å; L1449-L1486 VanDerWaalsContact CD1-CD1 3.45Å; L1449-L1486 HydrophobicContact CD1-CD2 4.15Å; L1449-L1486 HydrophobicContact CD1-CG 4.43Å; L1449-L1486 HydrophobicContact CD2-CB 4.38Å; L1449-L1486 HydrophobicContact CD2-CD1 3.71Å; L1449-L1486 VanDerWaalsContact CD2-CD1 3.49Å; L1449-L1486 HydrophobicContact CD2-CD2 3.99Å; L1449-L1486 VanDerWaalsContact CD2-CD2 3.48Å; L1449-L1486 HydrophobicContact CD2-CG 3.76Å; L1449-L1486 HydrophobicContact CG-CD1 4.27Å; L1449-L1486 HydrophobicContact CG-CD2 4.43Å; L1449-H1490 VanDerWaalsContact CD2-CE1 3.46Å; L1449-H1490 WeakPolarHBondContact CD2-CE1 3.2Å; L1449-H1490 VanDerWaalsContact CD2-NE2 3.31Å; L1449-H1490 WeakPolarHBondContact CD2-NE2 3.39Å
1450E80.8Confident82.3Confident134.6 Ų134.655.2 Ų55.263%0.62925%0.253SS*.Hα-helixtrans-64.2-39.6177.9-71.8179.2172.900112.8F1446 R1447 T1452 L1486F1446-E1450 WeakPolarHBondContact O-CG 3.35Å; F1446-E1450 PolarHBondContact O-N 3.3Å; R1447-E1450 PolarHBondContact O-N 3.2Å; E1450-T1452 VanDerWaalsContact C-N 3.33Å; E1450-L1486 HydrophobicContact CG-CD2 4Å
1451N78.9Confident82.8Confident72 Ų7252.6 Ų52.639%0.38524%0.241SC..Hα-helixtrans-76-21.9179.9-72.6-15.8000113.2E1229 H1413 R1447 L1449 R1453E1229-N1451 PolarHBondContact OE2-ND2 3.48Å; E1229-N1451 VanDerWaalsContact OE2-ND2 3.17Å; H1413-N1451 WeakPolarHBondContact NE2-CB 3.24Å; R1447-N1451 VanDerWaalsContact O-CB 3.3Å; R1447-N1451 WeakPolarHBondContact O-CB 3.36Å; R1447-N1451 VanDerWaalsContact O-CG 3.24Å; R1447-N1451 PolarHBondContact O-N 3.25Å; R1447-N1451 PolarHBondContact O-ND2 3.04Å; L1449-N1451 VanDerWaalsContact C-N 3.34Å; L1449-N1451 PolarHBondContact O-N 2.92Å; N1451-R1453 PolarHBondContact O-N 3.26Å
1452T78.7Confident83.1Confident6.4 Ų6.452.5 Ų52.54%0.03924%0.24CC..  trans-75.7122.3-177.2-65.40000111.1C1448 L1449 E1450 D1454 L1457 Q1458C1448-T1452 VanDerWaalsContact O-CB 3.26Å; C1448-T1452 WeakPolarHBondContact O-CB 3.39Å; C1448-T1452 PolarHBondContact O-N 3.29Å; C1448-T1452 VanDerWaalsContact O-N 3.14Å; C1448-T1452 PolarHBondContact O-OG1 3.2Å; L1449-T1452 PolarHBondContact O-N 3.37Å; E1450-T1452 VanDerWaalsContact C-N 3.33Å; T1452-D1454 HydrophobicContact CG2-CB 4.45Å; T1452-L1457 HydrophobicContact CG2-CB 3.86Å; T1452-L1457 HydrophobicContact CG2-CD2 3.63Å; T1452-L1457 HydrophobicContact CG2-CG 3.78Å; T1452-Q1458 HydrophobicContact CG2-CG 4.03Å; T1452-Q1458 PolarHBondContact O-NE2 3.15Å
1453R74.6Confident83.4Confident209.6 Ų209.657.7 Ų57.779%0.79126%0.259SS*.  trans-94.7-19177.9-62.8-177.8-177.3179.6-0.7114.6S1231 S1232 N1451 A1455S1231-R1453 PolarHBondContact O-NH1 3.06Å; S1231-R1453 PolarHBondContact O-NH2 2.89Å; S1232-R1453 PolarHBondContact OG-NH2 3.43Å; N1451-R1453 PolarHBondContact O-N 3.26Å; R1453-A1455 PolarHBondContact O-N 3.09Å
1454D81Confident83.6Confident95.8 Ų95.855.8 Ų55.851%0.51225%0.245SC..  trans-78.1115.7-177.9-137.8-13.5000111T1452 R1456 L1457 Q1458T1452-D1454 HydrophobicContact CG2-CB 4.45Å; D1454-R1456 VanDerWaalsContact C-N 3.26Å; D1454-R1456 PolarHBondContact O-N 3.03Å; D1454-R1456 WeakPolarHBondContact OD1-CB 3.31Å; D1454-R1456 PolarHBondContact OD1-N 3.24Å; D1454-R1456 VanDerWaalsContact OD1-N 3.09Å; D1454-L1457 HydrophobicContact CB-CB 4.09Å; D1454-L1457 PolarHBondContact O-N 2.98Å; D1454-L1457 VanDerWaalsContact O-N 3.12Å; D1454-Q1458 WeakPolarHBondContact O-CG 3.43Å; D1454-Q1458 PolarHBondContact O-N 3.39Å
1455A81.5Confident84Confident34.8 Ų34.855.6 Ų55.629%0.28824%0.244SC..Hα-helixtrans-58.6-32.3-18000000113.3R1453 L1457 Q1458 E1459 A1494 V1497R1453-A1455 PolarHBondContact O-N 3.09Å; A1455-L1457 VanDerWaalsContact C-N 3.35Å; A1455-Q1458 PolarHBondContact O-N 3.24Å; A1455-E1459 VanDerWaalsContact O-CB 3.26Å; A1455-E1459 WeakPolarHBondContact O-CB 3.37Å; A1455-E1459 PolarHBondContact O-N 3.23Å; A1455-A1494 HydrophobicContact CB-CB 4.03Å; A1455-V1497 HydrophobicContact CB-CG2 4.15Å; A1455-V1497 VanDerWaalsContact O-CG2 3.27Å; A1455-V1497 WeakPolarHBondContact O-CG2 3.32Å
1456R84.2Confident84Confident201.2 Ų201.255.5 Ų55.576%0.75925%0.245SC*.Hα-helixtrans-68.8-38.6176.8-67-178.5-136.6-178-1.2111.9D1454 F1460D1454-R1456 VanDerWaalsContact C-N 3.26Å; D1454-R1456 PolarHBondContact O-N 3.03Å; D1454-R1456 WeakPolarHBondContact OD1-CB 3.31Å; D1454-R1456 PolarHBondContact OD1-N 3.24Å; D1454-R1456 VanDerWaalsContact OD1-N 3.09Å; R1456-F1460 PolarHBondContact O-N 3.23Å; R1456-F1460 VanDerWaalsContact O-N 3.13Å
1457L84.1Confident84.2Confident26.6 Ų26.657.8 Ų57.814%0.13926%0.258CS..Hα-helixtrans-73.2-41.8177.3-176.857.5000110.5H1413 T1452 D1454 A1455 E1459 F1460 L1461H1413-L1457 WeakPolarHBondContact O-CD2 3.17Å; T1452-L1457 HydrophobicContact CG2-CB 3.86Å; T1452-L1457 HydrophobicContact CG2-CD2 3.63Å; T1452-L1457 HydrophobicContact CG2-CG 3.78Å; D1454-L1457 HydrophobicContact CB-CB 4.09Å; D1454-L1457 PolarHBondContact O-N 2.98Å; D1454-L1457 VanDerWaalsContact O-N 3.12Å; A1455-L1457 VanDerWaalsContact C-N 3.35Å; L1457-E1459 VanDerWaalsContact C-N 3.34Å; L1457-E1459 PolarHBondContact O-N 3.21Å; L1457-F1460 WeakPolarHBondContact O-CB 3.32Å; L1457-F1460 PolarHBondContact O-N 3.19Å; L1457-F1460 VanDerWaalsContact O-N 3.13Å; L1457-L1461 HydrophobicContact CD1-CD1 4.4Å; L1457-L1461 HydrophobicContact CD1-CG 4.21Å; L1457-L1461 HydrophobicContact CG-CD1 4.08Å; L1457-L1461 HydrophobicContact CG-CG 4.33Å; L1457-L1461 WeakPolarHBondContact O-CB 3.37Å; L1457-L1461 VanDerWaalsContact O-CG 3.24Å; L1457-L1461 WeakPolarHBondContact O-CG 3.36Å; L1457-L1461 PolarHBondContact O-N 3.15Å
1458Q86.4Confident84.4Confident11 Ų1152.8 Ų52.85%0.05124%0.24CC..Hα-helixtrans-56.2-47.1172-70.6-179.4-15.800111.8L1449 T1452 D1454 A1455 F1460 L1461 I1462 V1497L1449-Q1458 HydrophobicContact CD1-CB 4.49Å; L1449-Q1458 HydrophobicContact CD1-CG 4.47Å; T1452-Q1458 HydrophobicContact CG2-CG 4.03Å; T1452-Q1458 PolarHBondContact O-NE2 3.15Å; D1454-Q1458 WeakPolarHBondContact O-CG 3.43Å; D1454-Q1458 PolarHBondContact O-N 3.39Å; A1455-Q1458 PolarHBondContact O-N 3.24Å; Q1458-F1460 VanDerWaalsContact C-N 3.33Å; Q1458-F1460 PolarHBondContact O-N 3.36Å; Q1458-L1461 PolarHBondContact O-N 3.21Å; Q1458-I1462 WeakPolarHBondContact O-CB 3.35Å; Q1458-I1462 WeakPolarHBondContact O-CD1 3.25Å; Q1458-I1462 VanDerWaalsContact O-CG1 3.26Å; Q1458-I1462 WeakPolarHBondContact O-CG1 3.31Å; Q1458-I1462 PolarHBondContact O-N 2.87Å; Q1458-V1497 HydrophobicContact CB-CG2 4.15Å
1459E87.3Confident84.5Confident33.6 Ų33.652.7 Ų52.716%0.15724%0.239CC..Hα-helixtrans-55.6-46.5175.2-178.3-161.5151.100111.7A1455 L1457 I1462 R1463 N1496 V1497 A1500A1455-E1459 VanDerWaalsContact O-CB 3.26Å; A1455-E1459 WeakPolarHBondContact O-CB 3.37Å; A1455-E1459 PolarHBondContact O-N 3.23Å; L1457-E1459 VanDerWaalsContact C-N 3.34Å; L1457-E1459 PolarHBondContact O-N 3.21Å; E1459-I1462 PolarHBondContact O-N 3.16Å; E1459-R1463 VanDerWaalsContact CD-NH2 3.31Å; E1459-R1463 WeakPolarHBondContact O-CB 3.18Å; E1459-R1463 WeakPolarHBondContact O-CG 3.36Å; E1459-R1463 PolarHBondContact O-N 3.36Å; E1459-R1463 VanDerWaalsContact O-N 3.11Å; E1459-R1463 IonicContact OE1-CZ 3.45Å; E1459-R1463 VanDerWaalsContact OE1-CZ 3.27Å; E1459-R1463 IonicContact OE1-NH1 3.71Å; E1459-R1463 PolarHBondContact OE1-NH1 3.21Å; E1459-R1463 VanDerWaalsContact OE1-NH1 3.15Å; E1459-R1463 IonicContact OE1-NH2 3.22Å; E1459-R1463 PolarHBondContact OE1-NH2 3.06Å; E1459-N1496 HydrophobicContact CG-CB 4.4Å; E1459-N1496 VanDerWaalsContact OE2-CB 3.29Å; E1459-N1496 WeakPolarHBondContact OE2-CB 3.44Å; E1459-N1496 PolarHBondContact OE2-ND2 3.49Å; E1459-N1496 VanDerWaalsContact OE2-ND2 3.07Å; E1459-V1497 HydrophobicContact CB-CG2 4.33Å; E1459-A1500 HydrophobicContact CB-CB 4.47Å; E1459-A1500 HydrophobicContact CG-CB 3.93Å
1460F87.9Confident84.7Confident62 Ų6255.7 Ų55.727%0.27226%0.258SS..Hα-helixtrans-63.4-47.2177.3179.2-94.6000112.1G1417 H1421 R1456 L1457 Q1458 I1462 R1463 Q1464G1417-F1460 VanDerWaalsContact O-CE1 3.26Å; G1417-F1460 WeakPolarHBondContact O-CE1 3.38Å; H1421-F1460 HydrophobicContact CB-CE1 4.43Å; H1421-F1460 HydrophobicContact CB-CZ 4.13Å; R1456-F1460 PolarHBondContact O-N 3.23Å; R1456-F1460 VanDerWaalsContact O-N 3.13Å; L1457-F1460 WeakPolarHBondContact O-CB 3.32Å; L1457-F1460 PolarHBondContact O-N 3.19Å; L1457-F1460 VanDerWaalsContact O-N 3.13Å; Q1458-F1460 VanDerWaalsContact C-N 3.33Å; Q1458-F1460 PolarHBondContact O-N 3.36Å; F1460-I1462 VanDerWaalsContact C-N 3.34Å; F1460-I1462 PolarHBondContact O-N 3.23Å; F1460-R1463 WeakPolarHBondContact O-CB 3.45Å; F1460-R1463 PolarHBondContact O-N 3.2Å; F1460-Q1464 HydrophobicContact CD1-CG 4.01Å; F1460-Q1464 HydrophobicContact CE1-CG 3.56Å; F1460-Q1464 HydrophobicContact CE2-CG 4.24Å; F1460-Q1464 HydrophobicContact CG-CG 4.47Å; F1460-Q1464 HydrophobicContact CZ-CG 3.7Å; F1460-Q1464 VanDerWaalsContact CZ-NE2 3.31Å; F1460-Q1464 WeakPolarHBondContact O-CG 3.49Å; F1460-Q1464 PolarHBondContact O-N 3.17Å
1461L87.5Confident84.8Confident0.6 Ų0.650.7 Ų50.70%0.00324%0.235CC..Hα-helixtrans-62.8-39.3180-68.9174.9000112V1420 Y1445 L1449 L1457 Q1458 R1463 Q1464 L1465V1420-L1461 HydrophobicContact CB-CD2 3.86Å; V1420-L1461 HydrophobicContact CG1-CD2 3.85Å; V1420-L1461 HydrophobicContact CG2-CD2 3.6Å; Y1445-L1461 HydrophobicContact CE2-CD2 4.4Å; Y1445-L1461 PolarHBondContact OH-O 3.02Å; L1449-L1461 HydrophobicContact CB-CD1 4.48Å; L1449-L1461 HydrophobicContact CD1-CB 3.69Å; L1449-L1461 HydrophobicContact CD1-CD1 4.09Å; L1449-L1461 HydrophobicContact CD1-CG 4.22Å; L1449-L1461 HydrophobicContact CD2-CB 3.5Å; L1449-L1461 VanDerWaalsContact CD2-CB 3.5Å; L1449-L1461 HydrophobicContact CD2-CD1 3.7Å; L1449-L1461 HydrophobicContact CD2-CG 4.25Å; L1449-L1461 HydrophobicContact CG-CB 4.41Å; L1449-L1461 HydrophobicContact CG-CD1 4.37Å; L1457-L1461 HydrophobicContact CD1-CD1 4.4Å; L1457-L1461 HydrophobicContact CD1-CG 4.21Å; L1457-L1461 HydrophobicContact CG-CD1 4.08Å; L1457-L1461 HydrophobicContact CG-CG 4.33Å; L1457-L1461 WeakPolarHBondContact O-CB 3.37Å; L1457-L1461 VanDerWaalsContact O-CG 3.24Å; L1457-L1461 WeakPolarHBondContact O-CG 3.36Å; L1457-L1461 PolarHBondContact O-N 3.15Å; Q1458-L1461 PolarHBondContact O-N 3.21Å; L1461-R1463 VanDerWaalsContact C-N 3.34Å; L1461-Q1464 PolarHBondContact O-N 3.39Å; L1461-L1465 WeakPolarHBondContact O-CB 3.42Å; L1461-L1465 PolarHBondContact O-N 3.08Å
1462I89.1Confident84.9Confident1.6 Ų1.647.6 Ų47.61%0.00822%0.219CC..Hα-helixtrans-67.2-38.9176.6-68.2165.4000110.8L1449 Q1458 E1459 F1460 L1465 G1466 L1486 H1490 V1497 A1500 L1504L1449-I1462 HydrophobicContact CD1-CD1 4.39Å; L1449-I1462 HydrophobicContact CD1-CG1 3.89Å; L1449-I1462 HydrophobicContact CD2-CD1 4.42Å; L1449-I1462 HydrophobicContact CD2-CG1 4.16Å; Q1458-I1462 WeakPolarHBondContact O-CB 3.35Å; Q1458-I1462 WeakPolarHBondContact O-CD1 3.25Å; Q1458-I1462 VanDerWaalsContact O-CG1 3.26Å; Q1458-I1462 WeakPolarHBondContact O-CG1 3.31Å; Q1458-I1462 PolarHBondContact O-N 2.87Å; E1459-I1462 PolarHBondContact O-N 3.16Å; F1460-I1462 VanDerWaalsContact C-N 3.34Å; F1460-I1462 PolarHBondContact O-N 3.23Å; I1462-L1465 WeakPolarHBondContact O-CB 3.38Å; I1462-L1465 PolarHBondContact O-N 3.07Å; I1462-G1466 PolarHBondContact O-N 3.06Å; I1462-L1486 HydrophobicContact CD1-CD2 4.49Å; I1462-L1486 HydrophobicContact CG1-CD2 4.37Å; I1462-H1490 HydrophobicContact CD1-CB 4.46Å; I1462-V1497 HydrophobicContact CD1-CG1 3.76Å; I1462-A1500 HydrophobicContact CB-CB 4.2Å; I1462-A1500 HydrophobicContact CG2-CB 3.95Å; I1462-L1504 HydrophobicContact CG2-CB 4.26Å; I1462-L1504 HydrophobicContact CG2-CD2 4.12Å
1463R89.6Confident85.1Confident117.6 Ų117.653.1 Ų53.144%0.44424%0.244SC..Hα-helixtrans-65.2-41.4173.8-134.7178.1-104.1124.85.5112.2E1459 F1460 L1461 L1465 G1466 N1467 A1500E1459-R1463 VanDerWaalsContact CD-NH2 3.31Å; E1459-R1463 WeakPolarHBondContact O-CB 3.18Å; E1459-R1463 WeakPolarHBondContact O-CG 3.36Å; E1459-R1463 PolarHBondContact O-N 3.36Å; E1459-R1463 VanDerWaalsContact O-N 3.11Å; E1459-R1463 IonicContact OE1-CZ 3.45Å; E1459-R1463 VanDerWaalsContact OE1-CZ 3.27Å; E1459-R1463 IonicContact OE1-NH1 3.71Å; E1459-R1463 PolarHBondContact OE1-NH1 3.21Å; E1459-R1463 VanDerWaalsContact OE1-NH1 3.15Å; E1459-R1463 IonicContact OE1-NH2 3.22Å; E1459-R1463 PolarHBondContact OE1-NH2 3.06Å; F1460-R1463 WeakPolarHBondContact O-CB 3.45Å; F1460-R1463 PolarHBondContact O-N 3.2Å; L1461-R1463 VanDerWaalsContact C-N 3.34Å; R1463-L1465 VanDerWaalsContact C-N 3.31Å; R1463-L1465 PolarHBondContact O-N 2.97Å; R1463-G1466 PolarHBondContact O-N 3.24Å; R1463-G1466 VanDerWaalsContact O-N 3.12Å; R1463-N1467 PolarHBondContact O-N 3.16Å; R1463-A1500 HydrophobicContact CG-CB 4.18Å
1464Q87.8Confident85.3Confident17.4 Ų17.448.6 Ų48.68%0.08124%0.235CC..Hα-helixtrans-66.7-33176-68.1-53.9-21.500112.3V1420 V1424 Y1445 F1460 L1461 G1466 N1467 V1468V1420-Q1464 HydrophobicContact CG1-CB 3.86Å; V1420-Q1464 HydrophobicContact CG1-CG 4.12Å; V1424-Q1464 HydrophobicContact CG2-CB 4.1Å; Y1445-Q1464 WeakPolarHBondContact OH-CB 3.47Å; F1460-Q1464 HydrophobicContact CD1-CG 4.01Å; F1460-Q1464 HydrophobicContact CE1-CG 3.56Å; F1460-Q1464 HydrophobicContact CE2-CG 4.24Å; F1460-Q1464 HydrophobicContact CG-CG 4.47Å; F1460-Q1464 HydrophobicContact CZ-CG 3.7Å; F1460-Q1464 VanDerWaalsContact CZ-NE2 3.31Å; F1460-Q1464 WeakPolarHBondContact O-CG 3.49Å; F1460-Q1464 PolarHBondContact O-N 3.17Å; L1461-Q1464 PolarHBondContact O-N 3.39Å; Q1464-G1466 VanDerWaalsContact C-N 3.26Å; Q1464-G1466 PolarHBondContact O-N 3.1Å; Q1464-N1467 WeakPolarHBondContact O-CA 3.36Å; Q1464-N1467 WeakPolarHBondContact O-CB 3.42Å; Q1464-N1467 PolarHBondContact O-N 3.19Å; Q1464-N1467 VanDerWaalsContact O-N 3.11Å; Q1464-N1467 PolarHBondContact OE1-ND2 3.23Å; Q1464-V1468 WeakPolarHBondContact O-CG2 3.37Å; Q1464-V1468 PolarHBondContact O-N 3.12Å
1465L89.1Confident85Confident5.2 Ų5.247.1 Ų47.13%0.02723%0.227CC..Hα-helixtrans-59.2-38.5172-176.661.2000111.3Y1445 F1446 L1461 I1462 R1463 N1467 V1468 M1469 V1483 L1504Y1445-L1465 HydrophobicContact CD1-CD1 4.4Å; Y1445-L1465 HydrophobicContact CE1-CB 4.13Å; Y1445-L1465 HydrophobicContact CE1-CD1 4.13Å; Y1445-L1465 HydrophobicContact CE1-CG 4.47Å; Y1445-L1465 PolarHBondContact OH-N 3.14Å; F1446-L1465 HydrophobicContact CE1-CD1 4.18Å; F1446-L1465 HydrophobicContact CE1-CD2 4.11Å; L1461-L1465 WeakPolarHBondContact O-CB 3.42Å; L1461-L1465 PolarHBondContact O-N 3.08Å; I1462-L1465 WeakPolarHBondContact O-CB 3.38Å; I1462-L1465 PolarHBondContact O-N 3.07Å; R1463-L1465 VanDerWaalsContact C-N 3.31Å; R1463-L1465 PolarHBondContact O-N 2.97Å; L1465-N1467 VanDerWaalsContact C-N 3.32Å; L1465-N1467 PolarHBondContact O-N 3.15Å; L1465-V1468 WeakPolarHBondContact O-CB 3.34Å; L1465-V1468 PolarHBondContact O-N 2.98Å; L1465-V1468 VanDerWaalsContact O-N 3.14Å; L1465-M1469 HydrophobicContact CG-SD 4.46Å; L1465-M1469 VanDerWaalsContact O-CG 3.31Å; L1465-M1469 WeakPolarHBondContact O-CG 3.36Å; L1465-M1469 PolarHBondContact O-N 3.18Å; L1465-V1483 HydrophobicContact CD2-CG1 4.29Å; L1465-V1483 HydrophobicContact CD2-CG2 4.37Å; L1465-L1504 HydrophobicContact CD2-CD2 4.01Å; L1465-L1504 HydrophobicContact CG-CD2 4.38Å
1466G87.2Confident84.9Confident5 Ų545.6 Ų45.65%0.05221%0.214CC..Hα-helixtrans-60.1-41.6172.700000113.1I1462 R1463 Q1464 V1468 M1469 T1470 L1504I1462-G1466 PolarHBondContact O-N 3.06Å; R1463-G1466 PolarHBondContact O-N 3.24Å; R1463-G1466 VanDerWaalsContact O-N 3.12Å; Q1464-G1466 VanDerWaalsContact C-N 3.26Å; Q1464-G1466 PolarHBondContact O-N 3.1Å; G1466-V1468 VanDerWaalsContact C-N 3.34Å; G1466-V1468 PolarHBondContact O-N 3.2Å; G1466-M1469 PolarHBondContact O-N 2.95Å; G1466-T1470 WeakPolarHBondContact O-CG2 3.42Å; G1466-T1470 PolarHBondContact O-N 3.26Å; G1466-T1470 VanDerWaalsContact O-N 3.14Å; G1466-T1470 PolarHBondContact O-OG1 3.16Å; G1466-L1504 VanDerWaalsContact CA-CD1 3.44Å; G1466-L1504 VanDerWaalsContact N-CD1 3.29Å
1467N87.2Confident84.7Confident61.4 Ų61.440 Ų4033%0.32820%0.195SC..Hα-helixtrans-63.6-40.3173.6-65.7-27.7000111.8V1424 R1463 Q1464 L1465 M1469 T1470 I1471V1424-N1467 HydrophobicContact CG1-CB 3.9Å; R1463-N1467 PolarHBondContact O-N 3.16Å; Q1464-N1467 WeakPolarHBondContact O-CA 3.36Å; Q1464-N1467 WeakPolarHBondContact O-CB 3.42Å; Q1464-N1467 PolarHBondContact O-N 3.19Å; Q1464-N1467 VanDerWaalsContact O-N 3.11Å; Q1464-N1467 PolarHBondContact OE1-ND2 3.23Å; L1465-N1467 VanDerWaalsContact C-N 3.32Å; L1465-N1467 PolarHBondContact O-N 3.15Å; N1467-M1469 VanDerWaalsContact C-N 3.33Å; N1467-M1469 PolarHBondContact O-N 3.26Å; N1467-T1470 VanDerWaalsContact CA-OG1 3.28Å; N1467-T1470 WeakPolarHBondContact CA-OG1 3.06Å; N1467-T1470 PolarHBondContact O-N 3.07Å; N1467-T1470 PolarHBondContact O-OG1 3.19Å; N1467-I1471 VanDerWaalsContact O-CD1 3.27Å; N1467-I1471 WeakPolarHBondContact O-CD1 3.33Å; N1467-I1471 VanDerWaalsContact O-CG1 3.26Å; N1467-I1471 WeakPolarHBondContact O-CG1 3.3Å; N1467-I1471 PolarHBondContact O-N 3.2Å; N1467-I1471 VanDerWaalsContact O-N 3.11Å
1468V85.7Confident84.6Confident6.6 Ų6.643.8 Ų43.84%0.0421%0.213CC..Hα-helixtrans-60.7-45174.8176.50000110.7V1424 L1427 L1438 Q1464 L1465 G1466 T1470 I1471 V1472V1424-V1468 HydrophobicContact CG2-CG2 3.77Å; L1427-V1468 HydrophobicContact CD1-CG1 4.29Å; L1427-V1468 HydrophobicContact CD1-CG2 4.04Å; L1438-V1468 HydrophobicContact CD1-CG1 4.26Å; L1438-V1468 HydrophobicContact CD2-CG1 4.34Å; Q1464-V1468 WeakPolarHBondContact O-CG2 3.37Å; Q1464-V1468 PolarHBondContact O-N 3.12Å; L1465-V1468 WeakPolarHBondContact O-CB 3.34Å; L1465-V1468 PolarHBondContact O-N 2.98Å; L1465-V1468 VanDerWaalsContact O-N 3.14Å; G1466-V1468 VanDerWaalsContact C-N 3.34Å; G1466-V1468 PolarHBondContact O-N 3.2Å; V1468-T1470 VanDerWaalsContact C-N 3.33Å; V1468-T1470 PolarHBondContact O-N 3.22Å; V1468-I1471 PolarHBondContact O-N 3.22Å; V1468-I1471 VanDerWaalsContact O-N 3.13Å; V1468-V1472 HydrophobicContact CG1-CG2 4.07Å; V1468-V1472 WeakPolarHBondContact O-CB 3.38Å; V1468-V1472 VanDerWaalsContact O-CG2 3.3Å; V1468-V1472 WeakPolarHBondContact O-CG2 3.42Å; V1468-V1472 PolarHBondContact O-N 3.19Å
1469M85Confident84.3Confident2.2 Ų2.243.9 Ų43.91%0.01121%0.213CC..Hα-helixtrans-61.6-39.7178.6-66173.481.400112.2L1465 G1466 N1467 I1471 V1472 Q1473 T1476 F1479 V1483 L1504 M1508 V1511L1465-M1469 HydrophobicContact CG-SD 4.46Å; L1465-M1469 VanDerWaalsContact O-CG 3.31Å; L1465-M1469 WeakPolarHBondContact O-CG 3.36Å; L1465-M1469 PolarHBondContact O-N 3.18Å; G1466-M1469 PolarHBondContact O-N 2.95Å; N1467-M1469 VanDerWaalsContact C-N 3.33Å; N1467-M1469 PolarHBondContact O-N 3.26Å; M1469-I1471 VanDerWaalsContact C-N 3.3Å; M1469-I1471 PolarHBondContact O-N 3.3Å; M1469-V1472 PolarHBondContact O-N 3.2Å; M1469-Q1473 PolarHBondContact O-N 3.07Å; M1469-T1476 HydrophobicContact CB-CG2 4.19Å; M1469-T1476 HydrophobicContact CE-CG2 3.43Å; M1469-T1476 VanDerWaalsContact CE-CG2 3.42Å; M1469-T1476 HydrophobicContact CG-CG2 3.79Å; M1469-T1476 PolarHBondContact O-OG1 3.12Å; M1469-T1476 HydrophobicContact SD-CG2 4.39Å; M1469-F1479 HydrophobicContact CG-CE2 4.43Å; M1469-V1483 HydrophobicContact CE-CG1 4.38Å; M1469-V1483 HydrophobicContact SD-CG1 4.37Å; M1469-L1504 HydrophobicContact SD-CD1 3.72Å; M1469-L1504 HydrophobicContact SD-CD2 4.48Å; M1469-L1504 HydrophobicContact SD-CG 4.25Å; M1469-M1508 HydrophobicContact CE-CB 3.73Å; M1469-M1508 HydrophobicContact CE-CE 4.28Å; M1469-M1508 HydrophobicContact CE-CG 3.66Å; M1469-M1508 HydrophobicContact CE-SD 4.06Å; M1469-V1511 WeakPolarHBondContact O-CG2 3.38Å
1470T84.8Confident84.2Confident64.4 Ų64.442.3 Ų42.340%0.39521%0.205SC..Hα-helixtrans-67.4-31.7176.4390000113.3G1466 N1467 V1468 Q1473 P1507G1466-T1470 WeakPolarHBondContact O-CG2 3.42Å; G1466-T1470 PolarHBondContact O-N 3.26Å; G1466-T1470 VanDerWaalsContact O-N 3.14Å; G1466-T1470 PolarHBondContact O-OG1 3.16Å; N1467-T1470 VanDerWaalsContact CA-OG1 3.28Å; N1467-T1470 WeakPolarHBondContact CA-OG1 3.06Å; N1467-T1470 PolarHBondContact O-N 3.07Å; N1467-T1470 PolarHBondContact O-OG1 3.19Å; V1468-T1470 VanDerWaalsContact C-N 3.33Å; V1468-T1470 PolarHBondContact O-N 3.22Å; T1470-Q1473 VanDerWaalsContact O-CG 3.26Å; T1470-Q1473 WeakPolarHBondContact O-CG 3.34Å; T1470-P1507 HydrophobicContact CG2-CB 3.85Å
1471I83.3Confident84.1Confident30.4 Ų30.444.3 Ų44.316%0.15622%0.215CC..Hα-helixtrans-73.7-44.2176.5-64.8159.4000111V1424 L1427 K1428 N1467 V1468 M1469 Q1473V1424-I1471 HydrophobicContact CG1-CD1 4.11Å; L1427-I1471 HydrophobicContact CB-CD1 4.28Å; L1427-I1471 HydrophobicContact CB-CG2 4.45Å; L1427-I1471 WeakPolarHBondContact O-CG2 3.35Å; K1428-I1471 HydrophobicContact CB-CD1 4.23Å; K1428-I1471 HydrophobicContact CD-CD1 4.36Å; K1428-I1471 HydrophobicContact CG-CD1 3.3Å; K1428-I1471 HydrophobicContact CG-CG1 3.79Å; N1467-I1471 VanDerWaalsContact O-CD1 3.27Å; N1467-I1471 WeakPolarHBondContact O-CD1 3.33Å; N1467-I1471 VanDerWaalsContact O-CG1 3.26Å; N1467-I1471 WeakPolarHBondContact O-CG1 3.3Å; N1467-I1471 PolarHBondContact O-N 3.2Å; N1467-I1471 VanDerWaalsContact O-N 3.11Å; V1468-I1471 PolarHBondContact O-N 3.22Å; V1468-I1471 VanDerWaalsContact O-N 3.13Å; M1469-I1471 VanDerWaalsContact C-N 3.3Å; M1469-I1471 PolarHBondContact O-N 3.3Å; I1471-Q1473 VanDerWaalsContact C-N 3.35Å
1472V80.2Confident84Confident6.2 Ų6.248.6 Ų48.64%0.03824%0.235CC..Hα-helixtrans-79.5-25.3-174.1172.90000112.4L1438 V1468 M1469 L1474 N1475 T1476 F1479L1438-V1472 HydrophobicContact CD1-CB 4.21Å; L1438-V1472 HydrophobicContact CD1-CG1 3.35Å; L1438-V1472 VanDerWaalsContact CD1-CG1 3.44Å; L1438-V1472 HydrophobicContact CD1-CG2 3.85Å; L1438-V1472 VanDerWaalsContact CD1-CG2 3.48Å; L1438-V1472 HydrophobicContact CD2-CB 4.32Å; L1438-V1472 HydrophobicContact CD2-CG1 3.47Å; L1438-V1472 VanDerWaalsContact CD2-CG1 3.43Å; L1438-V1472 HydrophobicContact CD2-CG2 3.81Å; L1438-V1472 HydrophobicContact CG-CG2 4.19Å; V1468-V1472 HydrophobicContact CG1-CG2 4.07Å; V1468-V1472 WeakPolarHBondContact O-CB 3.38Å; V1468-V1472 VanDerWaalsContact O-CG2 3.3Å; V1468-V1472 WeakPolarHBondContact O-CG2 3.42Å; V1468-V1472 PolarHBondContact O-N 3.19Å; M1469-V1472 PolarHBondContact O-N 3.2Å; V1472-L1474 PolarHBondContact O-N 3.24Å; V1472-N1475 HydrophobicContact CG1-CB 3.6Å; V1472-N1475 VanDerWaalsContact CG1-CB 3.43Å; V1472-N1475 PolarHBondContact O-N 2.93Å; V1472-N1475 PolarHBondContact O-ND2 3.32Å; V1472-N1475 VanDerWaalsContact O-ND2 3.1Å; V1472-T1476 HydrophobicContact CB-CG2 3.85Å; V1472-T1476 HydrophobicContact CG1-CG2 3.76Å; V1472-T1476 WeakPolarHBondContact CG1-OG1 3.39Å; V1472-F1479 HydrophobicContact CG1-CE1 4.36Å
1473Q83.4Confident83.9Confident121.6 Ų121.648.6 Ų48.657%0.56824%0.236SC*.G310 helixtrans51.6-126.4-179.7-56.7-177.8-1.700111.3M1469 T1470 I1471 N1475 T1476 V1511M1469-Q1473 PolarHBondContact O-N 3.07Å; T1470-Q1473 VanDerWaalsContact O-CG 3.26Å; T1470-Q1473 WeakPolarHBondContact O-CG 3.34Å; I1471-Q1473 VanDerWaalsContact C-N 3.35Å; Q1473-N1475 PolarHBondContact O-N 3.22Å; Q1473-N1475 VanDerWaalsContact O-N 3.14Å; Q1473-T1476 VanDerWaalsContact O-CB 3.23Å; Q1473-T1476 WeakPolarHBondContact O-CB 3.34Å; Q1473-T1476 PolarHBondContact O-N 3.08Å; Q1473-T1476 PolarHBondContact O-OG1 3.16Å; Q1473-V1511 VanDerWaalsContact O-CG1 3.27Å; Q1473-V1511 WeakPolarHBondContact O-CG1 3.43Å
1474L77.9Confident83.7Confident114.4 Ų114.443 Ų4360%0.59922%0.215SC*.G310 helixtrans-57.3-25.4-171.3-96.1106.5000114.7V1472 T1476 K1477V1472-L1474 PolarHBondContact O-N 3.24Å; L1474-T1476 PolarHBondContact O-N 3.18Å; L1474-K1477 VanDerWaalsContact CD1-CE 3.47Å; L1474-K1477 HydrophobicContact CG-CD 4.38Å; L1474-K1477 VanDerWaalsContact O-CB 3.3Å; L1474-K1477 WeakPolarHBondContact O-CB 3.44Å; L1474-K1477 WeakPolarHBondContact O-CD 3.29Å; L1474-K1477 VanDerWaalsContact O-CG 3.23Å; L1474-K1477 WeakPolarHBondContact O-CG 3.26Å; L1474-K1477 PolarHBondContact O-N 3.13Å; L1474-K1477 VanDerWaalsContact O-N 3.08Å
1475N76.4Confident83.6Confident65.2 Ų65.245.5 Ų45.535%0.34923%0.229SC..G310 helixtrans-74.8-6.4-178.4-60.1-26.5000113.1V1435 V1472 Q1473 K1477 E1478V1435-N1475 HydrophobicContact CG1-CB 4.03Å; V1435-N1475 WeakPolarHBondContact CG1-ND2 3.16Å; V1435-N1475 HydrophobicContact CG2-CB 3.95Å; V1435-N1475 WeakPolarHBondContact CG2-ND2 3.32Å; V1472-N1475 HydrophobicContact CG1-CB 3.6Å; V1472-N1475 VanDerWaalsContact CG1-CB 3.43Å; V1472-N1475 PolarHBondContact O-N 2.93Å; V1472-N1475 PolarHBondContact O-ND2 3.32Å; V1472-N1475 VanDerWaalsContact O-ND2 3.1Å; Q1473-N1475 PolarHBondContact O-N 3.22Å; Q1473-N1475 VanDerWaalsContact O-N 3.14Å; N1475-K1477 PolarHBondContact O-N 3.33Å; N1475-K1477 VanDerWaalsContact O-N 3.11Å; N1475-E1478 PolarHBondContact O-N 3.31Å
1476T77.6Confident83.4Confident4 Ų445.8 Ų45.83%0.02523%0.23CC..G310 helixtrans-60.8-19.5169.9-41.30000112.7M1469 V1472 Q1473 L1474 E1478 F1479 A1480M1469-T1476 HydrophobicContact CB-CG2 4.19Å; M1469-T1476 HydrophobicContact CE-CG2 3.43Å; M1469-T1476 VanDerWaalsContact CE-CG2 3.42Å; M1469-T1476 HydrophobicContact CG-CG2 3.79Å; M1469-T1476 PolarHBondContact O-OG1 3.12Å; M1469-T1476 HydrophobicContact SD-CG2 4.39Å; V1472-T1476 HydrophobicContact CB-CG2 3.85Å; V1472-T1476 HydrophobicContact CG1-CG2 3.76Å; V1472-T1476 WeakPolarHBondContact CG1-OG1 3.39Å; Q1473-T1476 VanDerWaalsContact O-CB 3.23Å; Q1473-T1476 WeakPolarHBondContact O-CB 3.34Å; Q1473-T1476 PolarHBondContact O-N 3.08Å; Q1473-T1476 PolarHBondContact O-OG1 3.16Å; L1474-T1476 PolarHBondContact O-N 3.18Å; T1476-E1478 VanDerWaalsContact C-N 3.26Å; T1476-E1478 PolarHBondContact O-N 3.28Å; T1476-F1479 VanDerWaalsContact CA-CE1 3.48Å; T1476-F1479 HydrophobicContact CG2-CE1 4.43Å; T1476-F1479 HydrophobicContact CG2-CE2 4.03Å; T1476-F1479 HydrophobicContact CG2-CZ 3.91Å; T1476-F1479 PolarHBondContact O-N 3.26Å; T1476-F1479 VanDerWaalsContact O-N 3.13Å; T1476-A1480 WeakPolarHBondContact O-CB 3.38Å; T1476-A1480 PolarHBondContact O-N 3.21Å; T1476-A1480 VanDerWaalsContact O-N 3.16Å
1477K80.9Confident83.4Confident82.8 Ų82.845.6 Ų45.636%0.3623%0.228SC..G310 helixtrans-53.9-36.2177.7-107.5177.2-172.2-177.20113.5L1474 N1475 F1479 A1480 L1512 E1515L1474-K1477 VanDerWaalsContact CD1-CE 3.47Å; L1474-K1477 HydrophobicContact CG-CD 4.38Å; L1474-K1477 VanDerWaalsContact O-CB 3.3Å; L1474-K1477 WeakPolarHBondContact O-CB 3.44Å; L1474-K1477 WeakPolarHBondContact O-CD 3.29Å; L1474-K1477 VanDerWaalsContact O-CG 3.23Å; L1474-K1477 WeakPolarHBondContact O-CG 3.26Å; L1474-K1477 PolarHBondContact O-N 3.13Å; L1474-K1477 VanDerWaalsContact O-N 3.08Å; N1475-K1477 PolarHBondContact O-N 3.33Å; N1475-K1477 VanDerWaalsContact O-N 3.11Å; K1477-F1479 PolarHBondContact O-N 3.2Å; K1477-A1480 PolarHBondContact O-N 3.42Å; K1477-L1512 HydrophobicContact CB-CD2 4.49Å; K1477-L1512 HydrophobicContact CG-CD2 3.8Å; K1477-E1515 VanDerWaalsContact CD-OE2 3.3Å; K1477-E1515 WeakPolarHBondContact CD-OE2 3.34Å; K1477-E1515 VanDerWaalsContact CE-CD 3.47Å; K1477-E1515 WeakPolarHBondContact CE-OE1 3.46Å; K1477-E1515 VanDerWaalsContact CE-OE2 3.3Å; K1477-E1515 WeakPolarHBondContact CE-OE2 3.36Å; K1477-E1515 WeakPolarHBondContact CG-OE2 3.34Å; K1477-E1515 VanDerWaalsContact NZ-CD 3.34Å; K1477-E1515 IonicContact NZ-OE1 3.01Å; K1477-E1515 PolarHBondContact NZ-OE1 2.93Å; K1477-E1515 IonicContact NZ-OE2 3.31Å; K1477-E1515 PolarHBondContact NZ-OE2 3.14Å; K1477-E1515 VanDerWaalsContact NZ-OE2 3.11Å
1478E81.1Confident83.3Confident107.4 Ų107.445.2 Ų45.250%0.50223%0.225SC..G310 helixtrans-62.6-29.8-176.4-61.1-167.3159.600112.7R1439 N1475 T1476R1439-E1478 IonicContact CZ-OE1 3.41Å; R1439-E1478 IonicContact CZ-OE2 3.27Å; R1439-E1478 VanDerWaalsContact CZ-OE2 3.3Å; R1439-E1478 IonicContact NE-OE1 3.37Å; R1439-E1478 IonicContact NE-OE2 3.73Å; R1439-E1478 PolarHBondContact NE-OE2 3.1Å; R1439-E1478 VanDerWaalsContact NE-OE2 3.16Å; R1439-E1478 VanDerWaalsContact NH2-CD 3.28Å; R1439-E1478 IonicContact NH2-OE1 2.98Å; R1439-E1478 PolarHBondContact NH2-OE1 3.26Å; R1439-E1478 IonicContact NH2-OE2 3.32Å; R1439-E1478 PolarHBondContact NH2-OE2 3.32Å; N1475-E1478 PolarHBondContact O-N 3.31Å; T1476-E1478 VanDerWaalsContact C-N 3.26Å; T1476-E1478 PolarHBondContact O-N 3.28Å
1479F82Confident83.3Confident11.6 Ų11.649.5 Ų49.55%0.05125%0.252CS..THydrogen-bonded Turntrans-1183.6-175.321.1-85.1000113.1L1438 R1439 I1442 F1446 M1469 V1472 T1476 K1477 H1481 E1482 V1483L1438-F1479 HydrophobicContact CB-CE2 4Å; L1438-F1479 HydrophobicContact CB-CZ 4.2Å; L1438-F1479 HydrophobicContact CD1-CE1 4.36Å; L1438-F1479 HydrophobicContact CD2-CD1 4.04Å; L1438-F1479 HydrophobicContact CD2-CD2 4.13Å; L1438-F1479 HydrophobicContact CD2-CE1 3.37Å; L1438-F1479 HydrophobicContact CD2-CE2 3.6Å; L1438-F1479 HydrophobicContact CD2-CZ 4.28Å; L1438-F1479 HydrophobicContact CG-CE1 4.1Å; L1438-F1479 HydrophobicContact CG-CE2 3.88Å; L1438-F1479 HydrophobicContact CG-CZ 4.21Å; R1439-F1479 HydrophobicContact CB-CZ 4.46Å; R1439-F1479 HydrophobicContact CG-CE1 4.39Å; R1439-F1479 HydrophobicContact CG-CZ 3.75Å; I1442-F1479 HydrophobicContact CB-CD1 3.95Å; I1442-F1479 HydrophobicContact CB-CE1 4.01Å; I1442-F1479 HydrophobicContact CB-CG 4.46Å; I1442-F1479 HydrophobicContact CB-CZ 4.5Å; I1442-F1479 HydrophobicContact CD1-CB 4.04Å; I1442-F1479 HydrophobicContact CD1-CD1 4.02Å; I1442-F1479 HydrophobicContact CD1-CD2 3.68Å; I1442-F1479 HydrophobicContact CD1-CE1 4.06Å; I1442-F1479 HydrophobicContact CD1-CE2 3.74Å; I1442-F1479 HydrophobicContact CD1-CG 3.83Å; I1442-F1479 VanDerWaalsContact CD1-CG 3.47Å; I1442-F1479 HydrophobicContact CD1-CZ 3.92Å; I1442-F1479 HydrophobicContact CG1-CD1 4.18Å; I1442-F1479 HydrophobicContact CG1-CD2 4.39Å; I1442-F1479 HydrophobicContact CG1-CE1 4.28Å; I1442-F1479 HydrophobicContact CG1-CG 4.2Å; I1442-F1479 HydrophobicContact CG1-CZ 4.48Å; I1442-F1479 HydrophobicContact CG2-CB 3.96Å; I1442-F1479 HydrophobicContact CG2-CD1 3.82Å; I1442-F1479 VanDerWaalsContact CG2-CD1 3.49Å; I1442-F1479 HydrophobicContact CG2-CD2 4.23Å; I1442-F1479 HydrophobicContact CG2-CE1 4.06Å; I1442-F1479 HydrophobicContact CG2-CG 3.97Å; F1446-F1479 HydrophobicContact CE2-CB 4.37Å; F1446-F1479 HydrophobicContact CE2-CD2 4.42Å; F1446-F1479 HydrophobicContact CZ-CD2 4.21Å; M1469-F1479 HydrophobicContact CG-CE2 4.43Å; V1472-F1479 HydrophobicContact CG1-CE1 4.36Å; T1476-F1479 VanDerWaalsContact CA-CE1 3.48Å; T1476-F1479 HydrophobicContact CG2-CE1 4.43Å; T1476-F1479 HydrophobicContact CG2-CE2 4.03Å; T1476-F1479 HydrophobicContact CG2-CZ 3.91Å; T1476-F1479 PolarHBondContact O-N 3.26Å; T1476-F1479 VanDerWaalsContact O-N 3.13Å; K1477-F1479 PolarHBondContact O-N 3.2Å; F1479-H1481 VanDerWaalsContact C-N 3.25Å; F1479-H1481 PolarHBondContact O-N 3.25Å; F1479-H1481 VanDerWaalsContact O-N 3.15Å; F1479-E1482 WeakPolarHBondContact O-CB 3.4Å; F1479-E1482 PolarHBondContact O-N 3.15Å; F1479-E1482 VanDerWaalsContact O-N 3.1Å; F1479-V1483 HydrophobicContact CD2-CG2 3.62Å; F1479-V1483 HydrophobicContact CE2-CG2 3.95Å; F1479-V1483 WeakPolarHBondContact O-CG2 3.34Å; F1479-V1483 PolarHBondContact O-N 3.18Å; F1479-V1483 VanDerWaalsContact O-N 3.08Å
1480A84.1Confident83.3Confident0.6 Ų0.650.1 Ų50.11%0.00525%0.254CS..Hα-helixtrans-58.9-33.6-177.200000112.9T1476 K1477 V1483 I1484 M1508 L1512 Y1519T1476-A1480 WeakPolarHBondContact O-CB 3.38Å; T1476-A1480 PolarHBondContact O-N 3.21Å; T1476-A1480 VanDerWaalsContact O-N 3.16Å; K1477-A1480 PolarHBondContact O-N 3.42Å; A1480-V1483 PolarHBondContact O-N 3.29Å; A1480-I1484 VanDerWaalsContact O-CD1 3.3Å; A1480-I1484 WeakPolarHBondContact O-CD1 3.38Å; A1480-I1484 VanDerWaalsContact O-CG1 3.24Å; A1480-I1484 WeakPolarHBondContact O-CG1 3.34Å; A1480-I1484 PolarHBondContact O-N 3.18Å; A1480-I1484 VanDerWaalsContact O-N 3.12Å; A1480-M1508 HydrophobicContact CB-CE 4.21Å; A1480-L1512 HydrophobicContact CB-CD1 4.16Å; A1480-L1512 HydrophobicContact CB-CD2 4.35Å; A1480-Y1519 HydrophobicContact CB-CD2 4.44Å; A1480-Y1519 HydrophobicContact CB-CE1 4.05Å; A1480-Y1519 HydrophobicContact CB-CE2 3.93Å; A1480-Y1519 VanDerWaalsContact CB-CZ 3.46Å; A1480-Y1519 WeakPolarHBondContact CB-OH 3.48Å
1481H86.2Confident83.3Confident103.4 Ų103.447.1 Ų47.148%0.47924%0.236SC..Hα-helixtrans-60.3-47.4173.6-76-80.3000112.1F1479 V1483 I1484 D1485 Y1519F1479-H1481 VanDerWaalsContact C-N 3.25Å; F1479-H1481 PolarHBondContact O-N 3.25Å; F1479-H1481 VanDerWaalsContact O-N 3.15Å; H1481-V1483 VanDerWaalsContact C-N 3.33Å; H1481-V1483 PolarHBondContact O-N 3.15Å; H1481-I1484 WeakPolarHBondContact O-CB 3.45Å; H1481-I1484 PolarHBondContact O-N 3.02Å; H1481-I1484 VanDerWaalsContact O-N 3.09Å; H1481-D1485 PolarHBondContact O-N 3.23Å; H1481-D1485 VanDerWaalsContact O-N 3.12Å; H1481-D1485 VanDerWaalsContact O-OD2 3.09Å; H1481-Y1519 HydrophobicContact CB-CE1 4.45Å; H1481-Y1519 AromaticContact CD2-CE1 3.69Å; H1481-Y1519 AromaticContact CD2-CZ 3.98Å; H1481-Y1519 PolarHBondContact CD2-OH 3.07Å; H1481-Y1519 AromaticContact CE1-CE1 3.56Å; H1481-Y1519 VanDerWaalsContact CE1-CE1 3.47Å; H1481-Y1519 WeakPolarHBondContact CE1-CE1 3.41Å; H1481-Y1519 AromaticContact CG-CE1 3.73Å; H1481-Y1519 AromaticContact ND1-CE1 3.61Å; H1481-Y1519 WeakPolarHBondContact ND1-CE1 3.42Å; H1481-Y1519 AromaticContact NE2-CE1 3.59Å; H1481-Y1519 WeakPolarHBondContact NE2-CE1 3.37Å; H1481-Y1519 AromaticContact NE2-CZ 3.84Å; H1481-Y1519 PolarHBondContact NE2-OH 3.06Å
1482E84.3Confident83.3Confident91.4 Ų91.450.6 Ų50.643%0.42725%0.247SC..Hα-helixtrans-66.1-38179.6-61.6178.3-179.200111.2F1446 F1479 I1484 D1485 L1486F1446-E1482 HydrophobicContact CD2-CB 4.06Å; F1446-E1482 VanDerWaalsContact CD2-OE2 3.24Å; F1446-E1482 WeakPolarHBondContact CD2-OE2 3.39Å; F1446-E1482 HydrophobicContact CE1-CB 4.2Å; F1446-E1482 HydrophobicContact CE2-CB 3.46Å; F1446-E1482 VanDerWaalsContact CE2-CB 3.47Å; F1446-E1482 HydrophobicContact CE2-CG 4.38Å; F1446-E1482 VanDerWaalsContact CE2-OE2 3.3Å; F1446-E1482 WeakPolarHBondContact CE2-OE2 3.33Å; F1446-E1482 HydrophobicContact CZ-CB 4.01Å; F1479-E1482 WeakPolarHBondContact O-CB 3.4Å; F1479-E1482 PolarHBondContact O-N 3.15Å; F1479-E1482 VanDerWaalsContact O-N 3.1Å; E1482-I1484 VanDerWaalsContact C-N 3.3Å; E1482-I1484 PolarHBondContact O-N 3.26Å; E1482-D1485 PolarHBondContact O-N 3.23Å; E1482-L1486 VanDerWaalsContact O-CB 3.3Å; E1482-L1486 WeakPolarHBondContact O-CB 3.28Å; E1482-L1486 WeakPolarHBondContact O-CG 3.26Å; E1482-L1486 PolarHBondContact O-N 3.19Å
1483V87Confident83.3Confident2.2 Ų2.254.5 Ų54.51%0.01327%0.267CS..Hα-helixtrans-60.5-38.6173.4178.50000111.6F1446 L1465 M1469 F1479 A1480 H1481 L1486 L1487 L1504 M1508F1446-V1483 HydrophobicContact CE1-CG2 4.32Å; F1446-V1483 HydrophobicContact CZ-CG2 3.74Å; L1465-V1483 HydrophobicContact CD2-CG1 4.29Å; L1465-V1483 HydrophobicContact CD2-CG2 4.37Å; M1469-V1483 HydrophobicContact CE-CG1 4.38Å; M1469-V1483 HydrophobicContact SD-CG1 4.37Å; F1479-V1483 HydrophobicContact CD2-CG2 3.62Å; F1479-V1483 HydrophobicContact CE2-CG2 3.95Å; F1479-V1483 WeakPolarHBondContact O-CG2 3.34Å; F1479-V1483 PolarHBondContact O-N 3.18Å; F1479-V1483 VanDerWaalsContact O-N 3.08Å; A1480-V1483 PolarHBondContact O-N 3.29Å; H1481-V1483 VanDerWaalsContact C-N 3.33Å; H1481-V1483 PolarHBondContact O-N 3.15Å; V1483-L1486 WeakPolarHBondContact O-CB 3.32Å; V1483-L1486 PolarHBondContact O-N 3.14Å; V1483-L1487 HydrophobicContact CG1-CD1 4.19Å; V1483-L1487 HydrophobicContact CG1-CG 4.38Å; V1483-L1487 WeakPolarHBondContact O-CB 3.26Å; V1483-L1487 VanDerWaalsContact O-CG 3.28Å; V1483-L1487 WeakPolarHBondContact O-CG 3.37Å; V1483-L1487 PolarHBondContact O-N 3.08Å; V1483-L1504 HydrophobicContact CG1-CD2 4.02Å; V1483-M1508 HydrophobicContact CB-CE 4.21Å; V1483-M1508 HydrophobicContact CG1-CE 4.23Å; V1483-M1508 HydrophobicContact CG1-SD 4.23Å
1484I86.3Confident83.2Confident0 Ų049.8 Ų49.80%025%0.249CC..Hα-helixtrans-70.9-40.5178.2-66.9-163.8000111.4A1480 H1481 E1482 L1486 L1487 I1488 M1508 Y1519 R1522 L1523A1480-I1484 VanDerWaalsContact O-CD1 3.3Å; A1480-I1484 WeakPolarHBondContact O-CD1 3.38Å; A1480-I1484 VanDerWaalsContact O-CG1 3.24Å; A1480-I1484 WeakPolarHBondContact O-CG1 3.34Å; A1480-I1484 PolarHBondContact O-N 3.18Å; A1480-I1484 VanDerWaalsContact O-N 3.12Å; H1481-I1484 WeakPolarHBondContact O-CB 3.45Å; H1481-I1484 PolarHBondContact O-N 3.02Å; H1481-I1484 VanDerWaalsContact O-N 3.09Å; E1482-I1484 VanDerWaalsContact C-N 3.3Å; E1482-I1484 PolarHBondContact O-N 3.26Å; I1484-L1486 VanDerWaalsContact C-N 3.28Å; I1484-L1486 PolarHBondContact O-N 3.23Å; I1484-L1487 HydrophobicContact CD1-CD1 4.31Å; I1484-L1487 PolarHBondContact O-N 3.17Å; I1484-I1488 HydrophobicContact CG2-CD1 3.71Å; I1484-I1488 HydrophobicContact CG2-CG1 4.32Å; I1484-I1488 WeakPolarHBondContact O-CB 3.28Å; I1484-I1488 VanDerWaalsContact O-CG1 3.29Å; I1484-I1488 WeakPolarHBondContact O-CG1 3.39Å; I1484-I1488 PolarHBondContact O-N 3.12Å; I1484-M1508 HydrophobicContact CD1-CE 3.7Å; I1484-M1508 VanDerWaalsContact CD1-CE 3.44Å; I1484-M1508 HydrophobicContact CD1-SD 3.79Å; I1484-M1508 HydrophobicContact CG1-CE 3.76Å; I1484-Y1519 HydrophobicContact CD1-CD1 3.04Å; I1484-Y1519 HydrophobicContact CD1-CD2 4.37Å; I1484-Y1519 HydrophobicContact CD1-CE1 3.91Å; I1484-Y1519 HydrophobicContact CD1-CG 3.32Å; I1484-Y1519 VanDerWaalsContact CD1-CG 3.41Å; I1484-Y1519 HydrophobicContact CG1-CD1 4Å; I1484-Y1519 HydrophobicContact CG1-CG 4.14Å; I1484-R1522 HydrophobicContact CG2-CB 4.11Å; I1484-L1523 HydrophobicContact CD1-CD1 3.6Å; I1484-L1523 HydrophobicContact CD1-CD2 4.05Å; I1484-L1523 HydrophobicContact CD1-CG 3.87Å; I1484-L1523 HydrophobicContact CG2-CD2 4.23Å; I1484-L1523 HydrophobicContact CG2-CG 4.37Å
1485D86.1Confident83.4Confident70.4 Ų70.447.4 Ų47.438%0.37624%0.24SC..Hα-helixtrans-60.5-41.6175-69.6-28000110.8H1481 E1482 I1488 T1489 R1522H1481-D1485 PolarHBondContact O-N 3.23Å; H1481-D1485 VanDerWaalsContact O-N 3.12Å; H1481-D1485 VanDerWaalsContact O-OD2 3.09Å; E1482-D1485 PolarHBondContact O-N 3.23Å; D1485-I1488 PolarHBondContact O-N 3.14Å; D1485-T1489 VanDerWaalsContact O-CB 3.3Å; D1485-T1489 WeakPolarHBondContact O-CB 3.28Å; D1485-T1489 VanDerWaalsContact O-CG2 3.28Å; D1485-T1489 WeakPolarHBondContact O-CG2 3.47Å; D1485-T1489 PolarHBondContact O-N 2.98Å; D1485-T1489 PolarHBondContact O-OG1 3.07Å; D1485-R1522 IonicContact OD1-CZ 3.33Å; D1485-R1522 VanDerWaalsContact OD1-CZ 3.3Å; D1485-R1522 IonicContact OD1-NH1 3.2Å; D1485-R1522 PolarHBondContact OD1-NH1 3.34Å; D1485-R1522 VanDerWaalsContact OD1-NH1 3.1Å; D1485-R1522 IonicContact OD1-NH2 3.11Å; D1485-R1522 PolarHBondContact OD1-NH2 3.01Å; D1485-R1522 IonicContact OD2-CZ 3.46Å; D1485-R1522 IonicContact OD2-NH1 3.18Å; D1485-R1522 PolarHBondContact OD2-NH1 2.86Å; D1485-R1522 IonicContact OD2-NH2 3.37Å
1486L85.1Confident83.8Confident10.6 Ų10.648.6 Ų48.66%0.05525%0.246CC..Hα-helixtrans-63.5-47.7173.4-156.5155.7000112F1446 L1449 E1450 I1462 E1482 V1483 I1484 I1488 T1489 H1490F1446-L1486 HydrophobicContact CB-CD1 4.13Å; F1446-L1486 HydrophobicContact CD1-CB 4.38Å; F1446-L1486 HydrophobicContact CD1-CD1 3.32Å; F1446-L1486 VanDerWaalsContact CD1-CD1 3.45Å; F1446-L1486 HydrophobicContact CD2-CD1 3.87Å; F1446-L1486 HydrophobicContact CE1-CB 4.02Å; F1446-L1486 HydrophobicContact CE1-CD1 3.61Å; F1446-L1486 HydrophobicContact CE1-CG 4.42Å; F1446-L1486 HydrophobicContact CE2-CD1 4.2Å; F1446-L1486 HydrophobicContact CG-CD1 4.06Å; F1446-L1486 HydrophobicContact CZ-CD1 4.12Å; L1449-L1486 HydrophobicContact CB-CD1 4.3Å; L1449-L1486 HydrophobicContact CD1-CD1 3.77Å; L1449-L1486 VanDerWaalsContact CD1-CD1 3.45Å; L1449-L1486 HydrophobicContact CD1-CD2 4.15Å; L1449-L1486 HydrophobicContact CD1-CG 4.43Å; L1449-L1486 HydrophobicContact CD2-CB 4.38Å; L1449-L1486 HydrophobicContact CD2-CD1 3.71Å; L1449-L1486 VanDerWaalsContact CD2-CD1 3.49Å; L1449-L1486 HydrophobicContact CD2-CD2 3.99Å; L1449-L1486 VanDerWaalsContact CD2-CD2 3.48Å; L1449-L1486 HydrophobicContact CD2-CG 3.76Å; L1449-L1486 HydrophobicContact CG-CD1 4.27Å; L1449-L1486 HydrophobicContact CG-CD2 4.43Å; E1450-L1486 HydrophobicContact CG-CD2 4Å; I1462-L1486 HydrophobicContact CD1-CD2 4.49Å; I1462-L1486 HydrophobicContact CG1-CD2 4.37Å; E1482-L1486 VanDerWaalsContact O-CB 3.3Å; E1482-L1486 WeakPolarHBondContact O-CB 3.28Å; E1482-L1486 WeakPolarHBondContact O-CG 3.26Å; E1482-L1486 PolarHBondContact O-N 3.19Å; V1483-L1486 WeakPolarHBondContact O-CB 3.32Å; V1483-L1486 PolarHBondContact O-N 3.14Å; I1484-L1486 VanDerWaalsContact C-N 3.28Å; I1484-L1486 PolarHBondContact O-N 3.23Å; L1486-I1488 VanDerWaalsContact C-N 3.32Å; L1486-I1488 PolarHBondContact O-N 3.06Å; L1486-T1489 VanDerWaalsContact CA-OG1 3.31Å; L1486-T1489 WeakPolarHBondContact CA-OG1 3.28Å; L1486-T1489 PolarHBondContact O-N 2.97Å; L1486-T1489 PolarHBondContact O-OG1 3.5Å; L1486-H1490 WeakPolarHBondContact O-CB 3.32Å; L1486-H1490 PolarHBondContact O-CD2 2.94Å; L1486-H1490 VanDerWaalsContact O-CD2 3.24Å; L1486-H1490 PolarHBondContact O-N 3.24Å; L1486-H1490 PolarHBondContact O-ND1 3.43Å
1487L86.3Confident84.2Confident1 Ų148.4 Ų48.41%0.00525%0.245CC..Hα-helixtrans-57.9-45.7177.9-81.7171.7000111.6V1483 I1484 T1489 H1490 W1491 C1501 L1504 L1505 M1508V1483-L1487 HydrophobicContact CG1-CD1 4.19Å; V1483-L1487 HydrophobicContact CG1-CG 4.38Å; V1483-L1487 WeakPolarHBondContact O-CB 3.26Å; V1483-L1487 VanDerWaalsContact O-CG 3.28Å; V1483-L1487 WeakPolarHBondContact O-CG 3.37Å; V1483-L1487 PolarHBondContact O-N 3.08Å; I1484-L1487 HydrophobicContact CD1-CD1 4.31Å; I1484-L1487 PolarHBondContact O-N 3.17Å; L1487-T1489 VanDerWaalsContact C-N 3.33Å; L1487-T1489 PolarHBondContact O-N 3Å; L1487-H1490 PolarHBondContact O-N 2.9Å; L1487-W1491 HydrophobicContact CD2-CE3 4.43Å; L1487-W1491 HydrophobicContact CD2-CZ3 4.33Å; L1487-W1491 WeakPolarHBondContact O-CA 3.27Å; L1487-W1491 VanDerWaalsContact O-CB 3.29Å; L1487-W1491 WeakPolarHBondContact O-CB 3.35Å; L1487-W1491 PolarHBondContact O-N 3.31Å; L1487-W1491 VanDerWaalsContact O-N 3.11Å; L1487-C1501 HydrophobicContact CD2-CB 3.58Å; L1487-L1504 HydrophobicContact CD1-CD2 4.39Å; L1487-L1504 HydrophobicContact CD2-CB 4.39Å; L1487-L1504 HydrophobicContact CD2-CD2 3.98Å; L1487-L1504 HydrophobicContact CG-CD2 4.28Å; L1487-L1505 HydrophobicContact CD1-CD2 3.99Å; L1487-M1508 HydrophobicContact CD1-SD 4.19Å
1488I86.6Confident84.5Confident53.6 Ų53.644.7 Ų44.728%0.27523%0.229SC..Hα-helixtrans-66-41-179.9-67.9168.6000111I1484 D1485 L1486 R1522 L1523I1484-I1488 HydrophobicContact CG2-CD1 3.71Å; I1484-I1488 HydrophobicContact CG2-CG1 4.32Å; I1484-I1488 WeakPolarHBondContact O-CB 3.28Å; I1484-I1488 VanDerWaalsContact O-CG1 3.29Å; I1484-I1488 WeakPolarHBondContact O-CG1 3.39Å; I1484-I1488 PolarHBondContact O-N 3.12Å; D1485-I1488 PolarHBondContact O-N 3.14Å; L1486-I1488 VanDerWaalsContact C-N 3.32Å; L1486-I1488 PolarHBondContact O-N 3.06Å; I1488-R1522 HydrophobicContact CD1-CB 4.23Å; I1488-L1523 HydrophobicContact CG1-CD2 4.34Å
1489T85.4Confident84.8Confident97 Ų9746.2 Ų46.260%0.59523%0.23SC*.Hα-helixtrans-69.1-41.1-179.8-19.40000112.3D1485 L1486 L1487D1485-T1489 VanDerWaalsContact O-CB 3.3Å; D1485-T1489 WeakPolarHBondContact O-CB 3.28Å; D1485-T1489 VanDerWaalsContact O-CG2 3.28Å; D1485-T1489 WeakPolarHBondContact O-CG2 3.47Å; D1485-T1489 PolarHBondContact O-N 2.98Å; D1485-T1489 PolarHBondContact O-OG1 3.07Å; L1486-T1489 VanDerWaalsContact CA-OG1 3.31Å; L1486-T1489 WeakPolarHBondContact CA-OG1 3.28Å; L1486-T1489 PolarHBondContact O-N 2.97Å; L1486-T1489 PolarHBondContact O-OG1 3.5Å; L1487-T1489 VanDerWaalsContact C-N 3.33Å; L1487-T1489 PolarHBondContact O-N 3Å
1490H83.3Confident85.1Confident13.4 Ų13.445.9 Ų45.96%0.06223%0.229CC..Hα-helixtrans-91.6-6.6-174.8-66.345000114.4L1449 I1462 L1486 L1487 W1492 I1493 V1497L1449-H1490 VanDerWaalsContact CD2-CE1 3.46Å; L1449-H1490 WeakPolarHBondContact CD2-CE1 3.2Å; L1449-H1490 VanDerWaalsContact CD2-NE2 3.31Å; L1449-H1490 WeakPolarHBondContact CD2-NE2 3.39Å; I1462-H1490 HydrophobicContact CD1-CB 4.46Å; L1486-H1490 WeakPolarHBondContact O-CB 3.32Å; L1486-H1490 PolarHBondContact O-CD2 2.94Å; L1486-H1490 VanDerWaalsContact O-CD2 3.24Å; L1486-H1490 PolarHBondContact O-N 3.24Å; L1486-H1490 PolarHBondContact O-ND1 3.43Å; L1487-H1490 PolarHBondContact O-N 2.9Å; H1490-W1492 VanDerWaalsContact C-N 3.26Å; H1490-W1492 PolarHBondContact O-N 3.33Å; H1490-W1492 VanDerWaalsContact O-N 3.14Å; H1490-I1493 HydrophobicContact CB-CD1 3.92Å; H1490-I1493 VanDerWaalsContact CD2-CD1 3.41Å; H1490-I1493 WeakPolarHBondContact CD2-CD1 3.43Å; H1490-I1493 VanDerWaalsContact ND1-CD1 3.32Å; H1490-I1493 WeakPolarHBondContact ND1-CD1 3.38Å; H1490-I1493 PolarHBondContact O-N 3.09Å; H1490-V1497 HydrophobicContact CB-CG1 4.34Å; H1490-V1497 WeakPolarHBondContact O-CG1 3.33Å
1491W85.1Confident85.3Confident1.8 Ų1.845.8 Ų45.81%0.00723%0.229CC..THydrogen-bonded Turntrans-56.5-35.6-174.4-158.1-88.1000114.6L1487 Q1498 C1501 I1502 L1505 T1526 M1530L1487-W1491 HydrophobicContact CD2-CE3 4.43Å; L1487-W1491 HydrophobicContact CD2-CZ3 4.33Å; L1487-W1491 WeakPolarHBondContact O-CA 3.27Å; L1487-W1491 VanDerWaalsContact O-CB 3.29Å; L1487-W1491 WeakPolarHBondContact O-CB 3.35Å; L1487-W1491 PolarHBondContact O-N 3.31Å; L1487-W1491 VanDerWaalsContact O-N 3.11Å; W1491-Q1498 HydrophobicContact CG-CG 4.47Å; W1491-Q1498 VanDerWaalsContact O-CB 3.29Å; W1491-Q1498 WeakPolarHBondContact O-CB 3.46Å; W1491-Q1498 VanDerWaalsContact O-CG 3.29Å; W1491-Q1498 WeakPolarHBondContact O-CG 3.32Å; W1491-C1501 HydrophobicContact CD2-CB 4.37Å; W1491-C1501 HydrophobicContact CE3-CB 3.64Å; W1491-C1501 HydrophobicContact CH2-CB 4.23Å; W1491-C1501 HydrophobicContact CZ3-CB 3.67Å; W1491-I1502 HydrophobicContact CH2-CB 4.46Å; W1491-I1502 HydrophobicContact CH2-CG1 3.74Å; W1491-I1502 HydrophobicContact CZ2-CD1 4.35Å; W1491-I1502 HydrophobicContact CZ2-CG1 3.67Å; W1491-L1505 HydrophobicContact CH2-CD1 3.73Å; W1491-L1505 HydrophobicContact CH2-CG 4.43Å; W1491-L1505 HydrophobicContact CZ3-CD1 4.19Å; W1491-L1505 HydrophobicContact CZ3-CG 4.45Å; W1491-T1526 HydrophobicContact CB-CG2 4.19Å; W1491-T1526 HydrophobicContact CD2-CG2 3.74Å; W1491-T1526 HydrophobicContact CE3-CG2 4.41Å; W1491-T1526 HydrophobicContact CG-CG2 3.59Å; W1491-M1530 HydrophobicContact CZ2-CE 3.8Å; W1491-M1530 HydrophobicContact CZ2-SD 3.76Å; W1491-M1530 VanDerWaalsContact CZ2-SD 3.56Å; W1491-M1530 WeakPolarHBondContact CZ2-SD 3.5Å; W1491-M1530 PolarHBondContact NE1-SD 3.12Å
1492W83.2Confident85.4Confident105 Ų10541 Ų4140%0.39821%0.207SC..THydrogen-bonded Turntrans-106.611-170-56.697.3000114.1H1490 T1526 R1529 M1530H1490-W1492 VanDerWaalsContact C-N 3.26Å; H1490-W1492 PolarHBondContact O-N 3.33Å; H1490-W1492 VanDerWaalsContact O-N 3.14Å; W1492-T1526 HydrophobicContact CZ2-CG2 4.24Å; W1492-R1529 HydrophobicContact CH2-CB 4.26Å; W1492-R1529 HydrophobicContact CH2-CG 3.84Å; W1492-R1529 HydrophobicContact CZ2-CB 4.02Å; W1492-R1529 HydrophobicContact CZ2-CG 3.76Å; W1492-M1530 HydrophobicContact CH2-CB 4.29Å; W1492-M1530 HydrophobicContact CH2-CG 4.06Å
1493I80Confident85.5Confident87.8 Ų87.838.6 Ų38.645%0.4521%0.206SC..SBendtrans-74.4-49-175.4-63.1176.4000111.6H1490H1490-I1493 HydrophobicContact CB-CD1 3.92Å; H1490-I1493 VanDerWaalsContact CD2-CD1 3.41Å; H1490-I1493 WeakPolarHBondContact CD2-CD1 3.43Å; H1490-I1493 VanDerWaalsContact ND1-CD1 3.32Å; H1490-I1493 WeakPolarHBondContact ND1-CD1 3.38Å; H1490-I1493 PolarHBondContact O-N 3.09Å
1494A81.5Confident85.6Confident23.2 Ų23.238.7 Ų38.719%0.19221%0.207CC..  trans-154.7150.9-177.500000110.7A1455 N1496 V1497 Q1498A1455-A1494 HydrophobicContact CB-CB 4.03Å; A1494-N1496 VanDerWaalsContact C-N 3.27Å; A1494-N1496 PolarHBondContact O-N 3.15Å; A1494-V1497 HydrophobicContact CB-CB 4.27Å; A1494-V1497 HydrophobicContact CB-CG2 4.02Å; A1494-V1497 PolarHBondContact O-N 3.15Å; A1494-V1497 VanDerWaalsContact O-N 3.14Å; A1494-Q1498 WeakPolarHBondContact O-CB 3.29Å; A1494-Q1498 PolarHBondContact O-N 3.11Å
1495P82.4Confident85.7Confident62.2 Ų62.238.7 Ų38.740%0.40421%0.207SC..Hα-helixtrans-62.6-33.1-178.224.4-34.3000112.9R1499 N1539P1495-R1499 PolarHBondContact O-N 3.07Å; P1495-R1499 VanDerWaalsContact O-N 3.09Å; P1495-N1539 PolarHBondContact O-ND2 3.35Å
1496N84.7Confident85.8Confident91 Ų9136.9 Ų36.949%0.48720%0.2SC..Hα-helixtrans-70.6-40.4176.5-64-2.7000112.1E1459 A1494 R1499 A1500E1459-N1496 HydrophobicContact CG-CB 4.4Å; E1459-N1496 VanDerWaalsContact OE2-CB 3.29Å; E1459-N1496 WeakPolarHBondContact OE2-CB 3.44Å; E1459-N1496 PolarHBondContact OE2-ND2 3.49Å; E1459-N1496 VanDerWaalsContact OE2-ND2 3.07Å; A1494-N1496 VanDerWaalsContact C-N 3.27Å; A1494-N1496 PolarHBondContact O-N 3.15Å; N1496-R1499 WeakPolarHBondContact O-CB 3.35Å; N1496-R1499 PolarHBondContact O-N 3.08Å; N1496-A1500 PolarHBondContact O-N 3.18Å; N1496-A1500 VanDerWaalsContact O-N 3.08Å
1497V86.5Confident85.7Confident0 Ų037.6 Ų37.60%021%0.205CC..Hα-helixtrans-64.8-44.1175.6175.80000109.7A1455 Q1458 E1459 I1462 H1490 A1494 R1499 A1500 C1501A1455-V1497 HydrophobicContact CB-CG2 4.15Å; A1455-V1497 VanDerWaalsContact O-CG2 3.27Å; A1455-V1497 WeakPolarHBondContact O-CG2 3.32Å; Q1458-V1497 HydrophobicContact CB-CG2 4.15Å; E1459-V1497 HydrophobicContact CB-CG2 4.33Å; I1462-V1497 HydrophobicContact CD1-CG1 3.76Å; H1490-V1497 HydrophobicContact CB-CG1 4.34Å; H1490-V1497 WeakPolarHBondContact O-CG1 3.33Å; A1494-V1497 HydrophobicContact CB-CB 4.27Å; A1494-V1497 HydrophobicContact CB-CG2 4.02Å; A1494-V1497 PolarHBondContact O-N 3.15Å; A1494-V1497 VanDerWaalsContact O-N 3.14Å; V1497-R1499 VanDerWaalsContact C-N 3.3Å; V1497-R1499 PolarHBondContact O-N 3.07Å; V1497-A1500 CarbonylContact O-C 3.51Å; V1497-A1500 WeakPolarHBondContact O-CA 3.31Å; V1497-A1500 WeakPolarHBondContact O-CB 3.39Å; V1497-A1500 PolarHBondContact O-N 3.09Å; V1497-A1500 VanDerWaalsContact O-N 3.08Å; V1497-C1501 PolarHBondContact O-N 3.27Å; V1497-C1501 PolarHBondContact O-SG 3.24Å
1498Q87.7Confident85.7Confident5.2 Ų5.237.6 Ų37.62%0.02421%0.205CC..Hα-helixtrans-56.4-43.8173.3-170.6-174.345.800111.6W1491 A1494 A1500 C1501 I1502 M1530 E1534 N1539W1491-Q1498 HydrophobicContact CG-CG 4.47Å; W1491-Q1498 VanDerWaalsContact O-CB 3.29Å; W1491-Q1498 WeakPolarHBondContact O-CB 3.46Å; W1491-Q1498 VanDerWaalsContact O-CG 3.29Å; W1491-Q1498 WeakPolarHBondContact O-CG 3.32Å; A1494-Q1498 WeakPolarHBondContact O-CB 3.29Å; A1494-Q1498 PolarHBondContact O-N 3.11Å; Q1498-A1500 VanDerWaalsContact C-N 3.34Å; Q1498-A1500 PolarHBondContact O-N 3.31Å; Q1498-C1501 WeakPolarHBondContact O-CB 3.34Å; Q1498-C1501 PolarHBondContact O-N 3.24Å; Q1498-I1502 HydrophobicContact CG-CD1 4.19Å; Q1498-I1502 WeakPolarHBondContact O-CD1 3.28Å; Q1498-I1502 VanDerWaalsContact O-CG1 3.28Å; Q1498-I1502 WeakPolarHBondContact O-CG1 3.34Å; Q1498-I1502 PolarHBondContact O-N 3.25Å; Q1498-M1530 HydrophobicContact CG-CE 4.36Å; Q1498-M1530 HydrophobicContact CG-SD 4.34Å; Q1498-M1530 PolarHBondContact NE2-SD 3.44Å; Q1498-M1530 VanDerWaalsContact NE2-SD 3.36Å; Q1498-E1534 PolarHBondContact NE2-OE1 3.3Å; Q1498-E1534 PolarHBondContact NE2-OE2 2.91Å; Q1498-E1534 PolarHBondContact OE1-OE1 3.23Å; Q1498-E1534 PolarHBondContact OE1-OE2 3.22Å; Q1498-N1539 PolarHBondContact OE1-ND2 3.2Å
1499R87.6Confident85.7Confident138 Ų13835.5 Ų35.552%0.52120%0.195SC..Hα-helixtrans-63.5-37.5175.2-169.7173.1-177.4161.32.7112.7P1495 N1496 V1497 I1502 G1503P1495-R1499 PolarHBondContact O-N 3.07Å; P1495-R1499 VanDerWaalsContact O-N 3.09Å; N1496-R1499 WeakPolarHBondContact O-CB 3.35Å; N1496-R1499 PolarHBondContact O-N 3.08Å; V1497-R1499 VanDerWaalsContact C-N 3.3Å; V1497-R1499 PolarHBondContact O-N 3.07Å; R1499-I1502 PolarHBondContact O-N 3.01Å; R1499-G1503 PolarHBondContact O-N 3.26Å
1500A87.1Confident85.6Confident5.2 Ų5.235 Ų354%0.04320%0.196CC..Hα-helixtrans-66.7-40.2172.900000112E1459 I1462 R1463 N1496 V1497 Q1498 I1502 G1503 L1504E1459-A1500 HydrophobicContact CB-CB 4.47Å; E1459-A1500 HydrophobicContact CG-CB 3.93Å; I1462-A1500 HydrophobicContact CB-CB 4.2Å; I1462-A1500 HydrophobicContact CG2-CB 3.95Å; R1463-A1500 HydrophobicContact CG-CB 4.18Å; N1496-A1500 PolarHBondContact O-N 3.18Å; N1496-A1500 VanDerWaalsContact O-N 3.08Å; V1497-A1500 CarbonylContact O-C 3.51Å; V1497-A1500 WeakPolarHBondContact O-CA 3.31Å; V1497-A1500 WeakPolarHBondContact O-CB 3.39Å; V1497-A1500 PolarHBondContact O-N 3.09Å; V1497-A1500 VanDerWaalsContact O-N 3.08Å; Q1498-A1500 VanDerWaalsContact C-N 3.34Å; Q1498-A1500 PolarHBondContact O-N 3.31Å; A1500-I1502 VanDerWaalsContact C-N 3.35Å; A1500-I1502 PolarHBondContact O-N 2.95Å; A1500-G1503 CarbonylContact O-C 3.56Å; A1500-G1503 WeakPolarHBondContact O-CA 3.38Å; A1500-G1503 PolarHBondContact O-N 3.23Å; A1500-L1504 WeakPolarHBondContact O-CB 3.47Å; A1500-L1504 PolarHBondContact O-N 3.07Å
1501C88.4Confident85.6Confident0 Ų035.4 Ų35.40%020%0.199CC..Hα-helixtrans-60.9-44.6173.8-67.90000112L1487 W1491 V1497 Q1498 G1503 L1504 L1505L1487-C1501 HydrophobicContact CD2-CB 3.58Å; W1491-C1501 HydrophobicContact CD2-CB 4.37Å; W1491-C1501 HydrophobicContact CE3-CB 3.64Å; W1491-C1501 HydrophobicContact CH2-CB 4.23Å; W1491-C1501 HydrophobicContact CZ3-CB 3.67Å; V1497-C1501 PolarHBondContact O-N 3.27Å; V1497-C1501 PolarHBondContact O-SG 3.24Å; Q1498-C1501 WeakPolarHBondContact O-CB 3.34Å; Q1498-C1501 PolarHBondContact O-N 3.24Å; C1501-G1503 VanDerWaalsContact C-N 3.31Å; C1501-G1503 PolarHBondContact O-N 3.21Å; C1501-L1504 WeakPolarHBondContact O-CB 3.27Å; C1501-L1504 PolarHBondContact O-N 3.26Å; C1501-L1505 PolarHBondContact O-N 3.23Å
1502I87.9Confident85.5Confident1.8 Ų1.835.8 Ų35.81%0.00920%0.202CC..Hα-helixtrans-62-44174.3-65.5161.6000110.3W1491 Q1498 R1499 A1500 L1504 L1505 M1530 N1539 A1542 L1543 V1546W1491-I1502 HydrophobicContact CH2-CB 4.46Å; W1491-I1502 HydrophobicContact CH2-CG1 3.74Å; W1491-I1502 HydrophobicContact CZ2-CD1 4.35Å; W1491-I1502 HydrophobicContact CZ2-CG1 3.67Å; Q1498-I1502 HydrophobicContact CG-CD1 4.19Å; Q1498-I1502 WeakPolarHBondContact O-CD1 3.28Å; Q1498-I1502 VanDerWaalsContact O-CG1 3.28Å; Q1498-I1502 WeakPolarHBondContact O-CG1 3.34Å; Q1498-I1502 PolarHBondContact O-N 3.25Å; R1499-I1502 PolarHBondContact O-N 3.01Å; A1500-I1502 VanDerWaalsContact C-N 3.35Å; A1500-I1502 PolarHBondContact O-N 2.95Å; I1502-L1504 VanDerWaalsContact C-N 3.27Å; I1502-L1504 PolarHBondContact O-N 3.21Å; I1502-L1505 WeakPolarHBondContact O-CB 3.41Å; I1502-L1505 PolarHBondContact O-N 3.04Å; I1502-L1505 VanDerWaalsContact O-N 3.13Å; I1502-M1530 HydrophobicContact CD1-CE 3.84Å; I1502-M1530 HydrophobicContact CD1-SD 4.01Å; I1502-M1530 HydrophobicContact CG1-CE 4.27Å; I1502-N1539 HydrophobicContact CD1-CB 4.3Å; I1502-N1539 WeakPolarHBondContact CD1-O 3.35Å; I1502-A1542 HydrophobicContact CG2-CB 4.29Å; I1502-L1543 HydrophobicContact CD1-CB 4.34Å; I1502-L1543 HydrophobicContact CG2-CB 4.27Å; I1502-L1543 HydrophobicContact CG2-CD1 4.42Å; I1502-V1546 HydrophobicContact CG2-CB 4.46Å; I1502-V1546 HydrophobicContact CG2-CG2 4.19Å
1503G88Confident85.5Confident40.6 Ų40.632.3 Ų32.342%0.41920%0.197SC..Hα-helixtrans-62-29.4175.700000113.8R1499 A1500 C1501 L1505 S1506 P1507R1499-G1503 PolarHBondContact O-N 3.26Å; A1500-G1503 CarbonylContact O-C 3.56Å; A1500-G1503 WeakPolarHBondContact O-CA 3.38Å; A1500-G1503 PolarHBondContact O-N 3.23Å; C1501-G1503 VanDerWaalsContact C-N 3.31Å; C1501-G1503 PolarHBondContact O-N 3.21Å; G1503-L1505 VanDerWaalsContact C-N 3.32Å; G1503-L1505 PolarHBondContact O-N 3.38Å; G1503-S1506 PolarHBondContact O-N 3.01Å; G1503-P1507 WeakPolarHBondContact O-CD 3.33Å
1504L89Confident85.4Confident4.2 Ų4.230.8 Ų30.82%0.02220%0.199CC..Hα-helixtrans-72.6-26.8176-172.962.6000112.7I1462 L1465 G1466 M1469 V1483 L1487 A1500 C1501 I1502 S1506 P1507 M1508I1462-L1504 HydrophobicContact CG2-CB 4.26Å; I1462-L1504 HydrophobicContact CG2-CD2 4.12Å; L1465-L1504 HydrophobicContact CD2-CD2 4.01Å; L1465-L1504 HydrophobicContact CG-CD2 4.38Å; G1466-L1504 VanDerWaalsContact CA-CD1 3.44Å; G1466-L1504 VanDerWaalsContact N-CD1 3.29Å; M1469-L1504 HydrophobicContact SD-CD1 3.72Å; M1469-L1504 HydrophobicContact SD-CD2 4.48Å; M1469-L1504 HydrophobicContact SD-CG 4.25Å; V1483-L1504 HydrophobicContact CG1-CD2 4.02Å; L1487-L1504 HydrophobicContact CD1-CD2 4.39Å; L1487-L1504 HydrophobicContact CD2-CB 4.39Å; L1487-L1504 HydrophobicContact CD2-CD2 3.98Å; L1487-L1504 HydrophobicContact CG-CD2 4.28Å; A1500-L1504 WeakPolarHBondContact O-CB 3.47Å; A1500-L1504 PolarHBondContact O-N 3.07Å; C1501-L1504 WeakPolarHBondContact O-CB 3.27Å; C1501-L1504 PolarHBondContact O-N 3.26Å; I1502-L1504 VanDerWaalsContact C-N 3.27Å; I1502-L1504 PolarHBondContact O-N 3.21Å; L1504-S1506 VanDerWaalsContact C-N 3.28Å; L1504-S1506 PolarHBondContact O-N 3.09Å; L1504-P1507 HydrophobicContact CD1-CG 4.31Å; L1504-P1507 VanDerWaalsContact O-CD 3.25Å; L1504-P1507 WeakPolarHBondContact O-CD 3.25Å; L1504-P1507 VanDerWaalsContact O-CG 3.31Å; L1504-P1507 WeakPolarHBondContact O-CG 3.39Å; L1504-M1508 VanDerWaalsContact O-CB 3.24Å; L1504-M1508 WeakPolarHBondContact O-CB 3.27Å; L1504-M1508 PolarHBondContact O-N 3.04Å; L1504-M1508 VanDerWaalsContact O-N 3.08Å
1505L88.6Confident85.3Confident0.4 Ų0.433.5 Ų33.50%0.00221%0.207CC..Hα-helixtrans-65-29.4179.1-66.2-179.7000112.9L1487 W1491 C1501 I1502 G1503 S1509 F1516 L1523 V1546 F1550L1487-L1505 HydrophobicContact CD1-CD2 3.99Å; W1491-L1505 HydrophobicContact CH2-CD1 3.73Å; W1491-L1505 HydrophobicContact CH2-CG 4.43Å; W1491-L1505 HydrophobicContact CZ3-CD1 4.19Å; W1491-L1505 HydrophobicContact CZ3-CG 4.45Å; C1501-L1505 PolarHBondContact O-N 3.23Å; I1502-L1505 WeakPolarHBondContact O-CB 3.41Å; I1502-L1505 PolarHBondContact O-N 3.04Å; I1502-L1505 VanDerWaalsContact O-N 3.13Å; G1503-L1505 VanDerWaalsContact C-N 3.32Å; G1503-L1505 PolarHBondContact O-N 3.38Å; L1505-S1509 VanDerWaalsContact O-CB 3.27Å; L1505-S1509 WeakPolarHBondContact O-CB 3.37Å; L1505-S1509 PolarHBondContact O-N 3.19Å; L1505-S1509 PolarHBondContact O-OG 3.2Å; L1505-F1516 HydrophobicContact CD2-CZ 4.4Å; L1505-L1523 HydrophobicContact CD2-CD1 3.74Å; L1505-V1546 HydrophobicContact CB-CG1 4.2Å; L1505-F1550 HydrophobicContact CB-CE1 4.08Å; L1505-F1550 HydrophobicContact CB-CZ 4Å; L1505-F1550 HydrophobicContact CD1-CZ 4.14Å; L1505-F1550 HydrophobicContact CG-CZ 4.46Å
1506S86.6Confident85.4Confident33.6 Ų33.630.6 Ų30.624%0.23519%0.188CC..Hα-helixtrans-65.7-58.5176.9173.20000112.5G1503 L1504 M1508 S1509 S1510 E1549G1503-S1506 PolarHBondContact O-N 3.01Å; L1504-S1506 VanDerWaalsContact C-N 3.28Å; L1504-S1506 PolarHBondContact O-N 3.09Å; S1506-M1508 VanDerWaalsContact C-N 3.27Å; S1506-M1508 PolarHBondContact O-N 3.1Å; S1506-S1509 PolarHBondContact O-N 3.04Å; S1506-S1509 PolarHBondContact O-OG 3.25Å; S1506-S1510 WeakPolarHBondContact O-CB 3.15Å; S1506-S1510 PolarHBondContact O-N 2.98Å; S1506-S1510 PolarHBondContact O-OG 3.33Å; S1506-E1549 VanDerWaalsContact CA-OE2 3.25Å; S1506-E1549 WeakPolarHBondContact CA-OE2 3.32Å; S1506-E1549 WeakPolarHBondContact CB-OE2 3.37Å; S1506-E1549 PolarHBondContact OG-OE1 3.3Å; S1506-E1549 PolarHBondContact OG-OE2 3.24Å
1507P84.6Confident85.3Confident24.6 Ų24.632.3 Ų32.316%0.1619%0.188CC..Hα-helixtrans-59.3-37.51734.1-6.2000112.2T1470 G1503 L1504 S1509 S1510 V1511T1470-P1507 HydrophobicContact CG2-CB 3.85Å; G1503-P1507 WeakPolarHBondContact O-CD 3.33Å; L1504-P1507 HydrophobicContact CD1-CG 4.31Å; L1504-P1507 VanDerWaalsContact O-CD 3.25Å; L1504-P1507 WeakPolarHBondContact O-CD 3.25Å; L1504-P1507 VanDerWaalsContact O-CG 3.31Å; L1504-P1507 WeakPolarHBondContact O-CG 3.39Å; P1507-S1509 PolarHBondContact O-N 3.28Å; P1507-S1510 WeakPolarHBondContact CA-OG 3.46Å; P1507-S1510 PolarHBondContact O-N 3.13Å; P1507-S1510 PolarHBondContact O-OG 3.2Å; P1507-V1511 VanDerWaalsContact O-CB 3.3Å; P1507-V1511 WeakPolarHBondContact O-CB 3.41Å; P1507-V1511 VanDerWaalsContact O-CG2 3.26Å; P1507-V1511 WeakPolarHBondContact O-CG2 3.28Å; P1507-V1511 PolarHBondContact O-N 3.05Å
1508M86.4Confident85.2Confident0 Ų036.7 Ų36.70%022%0.215CC..Hα-helixtrans-62-45.8177.9-175.2168.1-164.100112.8M1469 A1480 V1483 I1484 L1487 L1504 S1506 S1510 V1511 L1512 F1516 Y1519M1469-M1508 HydrophobicContact CE-CB 3.73Å; M1469-M1508 HydrophobicContact CE-CE 4.28Å; M1469-M1508 HydrophobicContact CE-CG 3.66Å; M1469-M1508 HydrophobicContact CE-SD 4.06Å; A1480-M1508 HydrophobicContact CB-CE 4.21Å; V1483-M1508 HydrophobicContact CB-CE 4.21Å; V1483-M1508 HydrophobicContact CG1-CE 4.23Å; V1483-M1508 HydrophobicContact CG1-SD 4.23Å; I1484-M1508 HydrophobicContact CD1-CE 3.7Å; I1484-M1508 VanDerWaalsContact CD1-CE 3.44Å; I1484-M1508 HydrophobicContact CD1-SD 3.79Å; I1484-M1508 HydrophobicContact CG1-CE 3.76Å; L1487-M1508 HydrophobicContact CD1-SD 4.19Å; L1504-M1508 VanDerWaalsContact O-CB 3.24Å; L1504-M1508 WeakPolarHBondContact O-CB 3.27Å; L1504-M1508 PolarHBondContact O-N 3.04Å; L1504-M1508 VanDerWaalsContact O-N 3.08Å; S1506-M1508 VanDerWaalsContact C-N 3.27Å; S1506-M1508 PolarHBondContact O-N 3.1Å; M1508-S1510 VanDerWaalsContact C-N 3.34Å; M1508-V1511 PolarHBondContact O-N 3.47Å; M1508-L1512 HydrophobicContact CE-CD1 3.67Å; M1508-L1512 HydrophobicContact CG-CD1 3.7Å; M1508-L1512 WeakPolarHBondContact O-CB 3.31Å; M1508-L1512 WeakPolarHBondContact O-CG 3.41Å; M1508-L1512 PolarHBondContact O-N 3.09Å; M1508-F1516 HydrophobicContact CE-CD2 4.3Å; M1508-F1516 HydrophobicContact CE-CE2 4.32Å; M1508-F1516 HydrophobicContact CG-CD2 4.12Å; M1508-F1516 HydrophobicContact CG-CE2 3.98Å; M1508-F1516 HydrophobicContact SD-CE2 4.14Å; M1508-Y1519 HydrophobicContact CE-CD2 4.45Å
1509S84.9Confident85Confident10.4 Ų10.437.2 Ų37.27%0.07322%0.216CC..Hα-helixtrans-66.6-39.9177.1109.40000111.7L1505 S1506 P1507 V1511 G1513 E1549 F1550L1505-S1509 VanDerWaalsContact O-CB 3.27Å; L1505-S1509 WeakPolarHBondContact O-CB 3.37Å; L1505-S1509 PolarHBondContact O-N 3.19Å; L1505-S1509 PolarHBondContact O-OG 3.2Å; S1506-S1509 PolarHBondContact O-N 3.04Å; S1506-S1509 PolarHBondContact O-OG 3.25Å; P1507-S1509 PolarHBondContact O-N 3.28Å; S1509-V1511 VanDerWaalsContact C-N 3.33Å; S1509-V1511 PolarHBondContact O-N 3.18Å; S1509-G1513 WeakPolarHBondContact O-CA 3.4Å; S1509-G1513 PolarHBondContact O-N 3.07Å; S1509-E1549 PolarHBondContact OG-O 2.93Å; S1509-F1550 WeakPolarHBondContact OG-CD1 3.48Å
1510S84.2Confident84.9Confident86.4 Ų86.430.6 Ų30.660%0.60419%0.191SC*.Hα-helixtrans-65.7-37.3178.874.60000113.1S1506 P1507 M1508S1506-S1510 WeakPolarHBondContact O-CB 3.15Å; S1506-S1510 PolarHBondContact O-N 2.98Å; S1506-S1510 PolarHBondContact O-OG 3.33Å; P1507-S1510 WeakPolarHBondContact CA-OG 3.46Å; P1507-S1510 PolarHBondContact O-N 3.13Å; P1507-S1510 PolarHBondContact O-OG 3.2Å; M1508-S1510 VanDerWaalsContact C-N 3.34Å
1511V83.7Confident84.8Confident22.6 Ų22.633.7 Ų33.714%0.13721%0.21CC..Hα-helixtrans-81.5-40-176.3168.10000112.3M1469 Q1473 P1507 M1508 S1509M1469-V1511 WeakPolarHBondContact O-CG2 3.38Å; Q1473-V1511 VanDerWaalsContact O-CG1 3.27Å; Q1473-V1511 WeakPolarHBondContact O-CG1 3.43Å; P1507-V1511 VanDerWaalsContact O-CB 3.3Å; P1507-V1511 WeakPolarHBondContact O-CB 3.41Å; P1507-V1511 VanDerWaalsContact O-CG2 3.26Å; P1507-V1511 WeakPolarHBondContact O-CG2 3.28Å; P1507-V1511 PolarHBondContact O-N 3.05Å; M1508-V1511 PolarHBondContact O-N 3.47Å; S1509-V1511 VanDerWaalsContact C-N 3.33Å; S1509-V1511 PolarHBondContact O-N 3.18Å
1512L83.5Confident84.6Confident10.4 Ų10.438.4 Ų38.45%0.05423%0.228CC..Hα-helixtrans-84.6-25-179.3-67172.1000113.1K1477 A1480 M1508 A1514 E1515 F1516 Y1519K1477-L1512 HydrophobicContact CB-CD2 4.49Å; K1477-L1512 HydrophobicContact CG-CD2 3.8Å; A1480-L1512 HydrophobicContact CB-CD1 4.16Å; A1480-L1512 HydrophobicContact CB-CD2 4.35Å; M1508-L1512 HydrophobicContact CE-CD1 3.67Å; M1508-L1512 HydrophobicContact CG-CD1 3.7Å; M1508-L1512 WeakPolarHBondContact O-CB 3.31Å; M1508-L1512 WeakPolarHBondContact O-CG 3.41Å; M1508-L1512 PolarHBondContact O-N 3.09Å; L1512-A1514 PolarHBondContact O-N 3.08Å; L1512-A1514 VanDerWaalsContact O-N 3.14Å; L1512-E1515 HydrophobicContact CB-CB 4.47Å; L1512-E1515 WeakPolarHBondContact O-CB 3.31Å; L1512-E1515 PolarHBondContact O-N 2.98Å; L1512-F1516 HydrophobicContact CB-CB 4.17Å; L1512-F1516 HydrophobicContact CD1-CD2 4.27Å; L1512-Y1519 HydrophobicContact CD1-CD2 4.02Å; L1512-Y1519 HydrophobicContact CD1-CE2 4.15Å
1513G81.7Confident84.6Confident30 Ų3038.4 Ų38.431%0.30923%0.228SC..G310 helixtrans53.7-119.9-179.300000112.4S1509 E1515 F1516S1509-G1513 WeakPolarHBondContact O-CA 3.4Å; S1509-G1513 PolarHBondContact O-N 3.07Å; G1513-E1515 VanDerWaalsContact C-N 3.28Å; G1513-E1515 PolarHBondContact O-N 3.21Å; G1513-F1516 VanDerWaalsContact O-CB 3.26Å; G1513-F1516 WeakPolarHBondContact O-CB 3.26Å; G1513-F1516 PolarHBondContact O-N 3.23Å
1514A78.9Confident84.5Confident57.6 Ų57.636.8 Ų36.848%0.47621%0.21SC..G310 helixtrans-60.9-31.8-178.600000113.9L1512 F1516 R1517 Y1552L1512-A1514 PolarHBondContact O-N 3.08Å; L1512-A1514 VanDerWaalsContact O-N 3.14Å; A1514-F1516 PolarHBondContact O-N 3.21Å; A1514-R1517 WeakPolarHBondContact O-CB 3.35Å; A1514-R1517 PolarHBondContact O-N 3.18Å; A1514-Y1552 WeakPolarHBondContact CA-OH 3.32Å; A1514-Y1552 HydrophobicContact CB-CE2 4.46Å; A1514-Y1552 WeakPolarHBondContact CB-OH 3.33Å; A1514-Y1552 PolarHBondContact N-OH 3.22Å
1515E79.4Confident84.4Confident80 Ų8040 Ų4037%0.37423%0.231SC..G310 helixtrans-71.4-19-176.6-61.7-154.8172.900112.5K1477 L1512 G1513 R1517 T1518 Y1519K1477-E1515 VanDerWaalsContact CD-OE2 3.3Å; K1477-E1515 WeakPolarHBondContact CD-OE2 3.34Å; K1477-E1515 VanDerWaalsContact CE-CD 3.47Å; K1477-E1515 WeakPolarHBondContact CE-OE1 3.46Å; K1477-E1515 VanDerWaalsContact CE-OE2 3.3Å; K1477-E1515 WeakPolarHBondContact CE-OE2 3.36Å; K1477-E1515 WeakPolarHBondContact CG-OE2 3.34Å; K1477-E1515 VanDerWaalsContact NZ-CD 3.34Å; K1477-E1515 IonicContact NZ-OE1 3.01Å; K1477-E1515 PolarHBondContact NZ-OE1 2.93Å; K1477-E1515 IonicContact NZ-OE2 3.31Å; K1477-E1515 PolarHBondContact NZ-OE2 3.14Å; K1477-E1515 VanDerWaalsContact NZ-OE2 3.11Å; L1512-E1515 HydrophobicContact CB-CB 4.47Å; L1512-E1515 WeakPolarHBondContact O-CB 3.31Å; L1512-E1515 PolarHBondContact O-N 2.98Å; G1513-E1515 VanDerWaalsContact C-N 3.28Å; G1513-E1515 PolarHBondContact O-N 3.21Å; E1515-R1517 PolarHBondContact O-N 3.14Å; E1515-R1517 VanDerWaalsContact O-N 3.1Å; E1515-T1518 PolarHBondContact O-N 3.19Å; E1515-T1518 VanDerWaalsContact O-N 3.12Å; E1515-T1518 PolarHBondContact O-OG1 3.16Å; E1515-Y1519 WeakPolarHBondContact O-CD2 3.33Å
1516F83.4Confident84.2Confident0.4 Ų0.440.6 Ų40.60%0.00223%0.234CC..Hα-helixtrans-56.3-25.7174.1-172-116000112.6L1505 M1508 L1512 G1513 A1514 T1518 Y1519 L1520 L1523 F1550L1505-F1516 HydrophobicContact CD2-CZ 4.4Å; M1508-F1516 HydrophobicContact CE-CD2 4.3Å; M1508-F1516 HydrophobicContact CE-CE2 4.32Å; M1508-F1516 HydrophobicContact CG-CD2 4.12Å; M1508-F1516 HydrophobicContact CG-CE2 3.98Å; M1508-F1516 HydrophobicContact SD-CE2 4.14Å; L1512-F1516 HydrophobicContact CB-CB 4.17Å; L1512-F1516 HydrophobicContact CD1-CD2 4.27Å; G1513-F1516 VanDerWaalsContact O-CB 3.26Å; G1513-F1516 WeakPolarHBondContact O-CB 3.26Å; G1513-F1516 PolarHBondContact O-N 3.23Å; A1514-F1516 PolarHBondContact O-N 3.21Å; F1516-T1518 VanDerWaalsContact C-N 3.3Å; F1516-T1518 PolarHBondContact O-N 3.22Å; F1516-Y1519 WeakPolarHBondContact O-CB 3.42Å; F1516-Y1519 PolarHBondContact O-N 3.27Å; F1516-Y1519 VanDerWaalsContact O-N 3.12Å; F1516-L1520 HydrophobicContact CD1-CB 4.42Å; F1516-L1520 HydrophobicContact CE1-CB 4.38Å; F1516-L1520 HydrophobicContact CE1-CD1 4.01Å; F1516-L1520 HydrophobicContact CZ-CD1 4.4Å; F1516-L1520 WeakPolarHBondContact O-CB 3.37Å; F1516-L1520 PolarHBondContact O-N 2.91Å; F1516-L1520 VanDerWaalsContact O-N 3.08Å; F1516-L1523 HydrophobicContact CE2-CD1 3.99Å; F1516-L1523 HydrophobicContact CZ-CD1 3.91Å; F1516-F1550 HydrophobicContact CD1-CD1 4.32Å; F1516-F1550 HydrophobicContact CD1-CG 4.45Å; F1516-F1550 HydrophobicContact CE1-CB 4.45Å; F1516-F1550 AromaticContact CE1-CD1 3.71Å; F1516-F1550 HydrophobicContact CE1-CD1 3.71Å; F1516-F1550 HydrophobicContact CE1-CD2 4.08Å; F1516-F1550 AromaticContact CE1-CE1 3.73Å; F1516-F1550 HydrophobicContact CE1-CE1 3.79Å; F1516-F1550 HydrophobicContact CE1-CE2 4.23Å; F1516-F1550 AromaticContact CE1-CG 3.85Å; F1516-F1550 HydrophobicContact CE1-CG 3.93Å; F1516-F1550 AromaticContact CE1-CZ 3.85Å; F1516-F1550 HydrophobicContact CE1-CZ 4.07Å; F1516-F1550 HydrophobicContact CZ-CD1 4.34Å; F1516-F1550 AromaticContact CZ-CE1 3.97Å; F1516-F1550 HydrophobicContact CZ-CE1 4.05Å; F1516-F1550 HydrophobicContact CZ-CE2 4.5Å; F1516-F1550 HydrophobicContact CZ-CZ 4.16Å
1517R83.7Confident84.2Confident127.8 Ų127.839.1 Ų39.148%0.48222%0.224SC..Hα-helixtrans-56.6-37.9177.4-171.2178.4179.8-163.61.3113.2A1514 E1515 Y1519 L1520 T1553 D1556A1514-R1517 WeakPolarHBondContact O-CB 3.35Å; A1514-R1517 PolarHBondContact O-N 3.18Å; E1515-R1517 PolarHBondContact O-N 3.14Å; E1515-R1517 VanDerWaalsContact O-N 3.1Å; R1517-Y1519 VanDerWaalsContact C-N 3.31Å; R1517-Y1519 PolarHBondContact O-N 3.3Å; R1517-L1520 PolarHBondContact O-N 2.93Å; R1517-T1553 HydrophobicContact CB-CG2 4.36Å; R1517-D1556 IonicContact CZ-OD1 2.71Å; R1517-D1556 IonicContact CZ-OD2 3.34Å; R1517-D1556 IonicContact NE-OD2 3.2Å; R1517-D1556 PolarHBondContact NE-OD2 3Å; R1517-D1556 IonicContact NH2-OD1 3.35Å; R1517-D1556 PolarHBondContact NH2-OD1 2.99Å; R1517-D1556 IonicContact NH2-OD2 3.13Å; R1517-D1556 PolarHBondContact NH2-OD2 3.1Å
1518T84.2Confident84.2Confident91.2 Ų91.239.1 Ų39.156%0.5622%0.222SC*.Hα-helixtrans-66.5-38.2179.8190000111.6E1515 F1516 T1521E1515-T1518 PolarHBondContact O-N 3.19Å; E1515-T1518 VanDerWaalsContact O-N 3.12Å; E1515-T1518 PolarHBondContact O-OG1 3.16Å; F1516-T1518 VanDerWaalsContact C-N 3.3Å; F1516-T1518 PolarHBondContact O-N 3.22Å; T1518-T1521 PolarHBondContact O-OG1 3.11Å
1519Y84Confident84Confident15 Ų1545.8 Ų45.86%0.05925%0.248CC..Hα-helixtrans-78.5-31.5-179-62.4-62000113A1480 H1481 I1484 M1508 L1512 E1515 F1516 R1517 T1521 R1522 L1523A1480-Y1519 HydrophobicContact CB-CD2 4.44Å; A1480-Y1519 HydrophobicContact CB-CE1 4.05Å; A1480-Y1519 HydrophobicContact CB-CE2 3.93Å; A1480-Y1519 VanDerWaalsContact CB-CZ 3.46Å; A1480-Y1519 WeakPolarHBondContact CB-OH 3.48Å; H1481-Y1519 HydrophobicContact CB-CE1 4.45Å; H1481-Y1519 AromaticContact CD2-CE1 3.69Å; H1481-Y1519 AromaticContact CD2-CZ 3.98Å; H1481-Y1519 PolarHBondContact CD2-OH 3.07Å; H1481-Y1519 AromaticContact CE1-CE1 3.56Å; H1481-Y1519 VanDerWaalsContact CE1-CE1 3.47Å; H1481-Y1519 WeakPolarHBondContact CE1-CE1 3.41Å; H1481-Y1519 AromaticContact CG-CE1 3.73Å; H1481-Y1519 AromaticContact ND1-CE1 3.61Å; H1481-Y1519 WeakPolarHBondContact ND1-CE1 3.42Å; H1481-Y1519 AromaticContact NE2-CE1 3.59Å; H1481-Y1519 WeakPolarHBondContact NE2-CE1 3.37Å; H1481-Y1519 AromaticContact NE2-CZ 3.84Å; H1481-Y1519 PolarHBondContact NE2-OH 3.06Å; I1484-Y1519 HydrophobicContact CD1-CD1 3.04Å; I1484-Y1519 HydrophobicContact CD1-CD2 4.37Å; I1484-Y1519 HydrophobicContact CD1-CE1 3.91Å; I1484-Y1519 HydrophobicContact CD1-CG 3.32Å; I1484-Y1519 VanDerWaalsContact CD1-CG 3.41Å; I1484-Y1519 HydrophobicContact CG1-CD1 4Å; I1484-Y1519 HydrophobicContact CG1-CG 4.14Å; M1508-Y1519 HydrophobicContact CE-CD2 4.45Å; L1512-Y1519 HydrophobicContact CD1-CD2 4.02Å; L1512-Y1519 HydrophobicContact CD1-CE2 4.15Å; E1515-Y1519 WeakPolarHBondContact O-CD2 3.33Å; F1516-Y1519 WeakPolarHBondContact O-CB 3.42Å; F1516-Y1519 PolarHBondContact O-N 3.27Å; F1516-Y1519 VanDerWaalsContact O-N 3.12Å; R1517-Y1519 VanDerWaalsContact C-N 3.31Å; R1517-Y1519 PolarHBondContact O-N 3.3Å; Y1519-T1521 VanDerWaalsContact C-N 3.26Å; Y1519-T1521 PolarHBondContact O-N 3.31Å; Y1519-R1522 WeakPolarHBondContact O-CB 3.37Å; Y1519-R1522 PolarHBondContact O-N 3.21Å; Y1519-L1523 PolarHBondContact O-N 3.07Å
1520L84.3Confident83.9Confident0.2 Ų0.245.3 Ų45.30%0.00124%0.244CC..Hα-helixtrans-57.6-34.6-179.6-172.357.7000112.3F1516 R1517 R1522 L1523 I1524 I1527 F1550 T1553 L1554 Y1557F1516-L1520 HydrophobicContact CD1-CB 4.42Å; F1516-L1520 HydrophobicContact CE1-CB 4.38Å; F1516-L1520 HydrophobicContact CE1-CD1 4.01Å; F1516-L1520 HydrophobicContact CZ-CD1 4.4Å; F1516-L1520 WeakPolarHBondContact O-CB 3.37Å; F1516-L1520 PolarHBondContact O-N 2.91Å; F1516-L1520 VanDerWaalsContact O-N 3.08Å; R1517-L1520 PolarHBondContact O-N 2.93Å; L1520-R1522 PolarHBondContact O-N 3.19Å; L1520-R1522 VanDerWaalsContact O-N 3.15Å; L1520-L1523 PolarHBondContact O-N 3.14Å; L1520-I1524 HydrophobicContact CD1-CD1 4.07Å; L1520-I1524 HydrophobicContact CD1-CG1 3.99Å; L1520-I1524 HydrophobicContact CD2-CD1 4.48Å; L1520-I1524 HydrophobicContact CG-CD1 3.94Å; L1520-I1524 HydrophobicContact CG-CG1 3.93Å; L1520-I1524 WeakPolarHBondContact O-CB 2.92Å; L1520-I1524 WeakPolarHBondContact O-CD1 3.17Å; L1520-I1524 VanDerWaalsContact O-CG1 3.28Å; L1520-I1524 WeakPolarHBondContact O-CG1 3.43Å; L1520-I1524 PolarHBondContact O-N 3.14Å; L1520-I1527 HydrophobicContact CD1-CD1 4.41Å; L1520-F1550 HydrophobicContact CD1-CD2 4.24Å; L1520-F1550 HydrophobicContact CD1-CE2 4.39Å; L1520-T1553 WeakPolarHBondContact CD2-O 3.48Å; L1520-L1554 HydrophobicContact CD1-CD1 4.43Å; L1520-L1554 HydrophobicContact CD2-CD1 3.93Å; L1520-Y1557 HydrophobicContact CB-CE2 4.25Å; L1520-Y1557 HydrophobicContact CD2-CD2 3.63Å; L1520-Y1557 VanDerWaalsContact CD2-CD2 3.43Å; L1520-Y1557 HydrophobicContact CD2-CE2 3.74Å; L1520-Y1557 HydrophobicContact CG-CD2 4.07Å; L1520-Y1557 HydrophobicContact CG-CE2 3.94Å
1521T84.9Confident83.8Confident70.8 Ų70.841.6 Ų41.643%0.43422%0.217SC..Hα-helixtrans-50.9-35.7174.1230000113.2T1518 Y1519 P1525 Y1557T1518-T1521 PolarHBondContact O-OG1 3.11Å; Y1519-T1521 VanDerWaalsContact C-N 3.26Å; Y1519-T1521 PolarHBondContact O-N 3.31Å; T1521-P1525 WeakPolarHBondContact O-CD 3.3Å; T1521-Y1557 WeakPolarHBondContact CG2-OH 3.37Å; T1521-Y1557 PolarHBondContact OG1-OH 3.19Å
1522R85.6Confident83.5Confident98 Ų9846.1 Ų46.137%0.3724%0.236SC..Hα-helixtrans-84.6-28.6-179-56.5-176.170.1-158.61.1112.8I1484 D1485 I1488 Y1519 L1520I1484-R1522 HydrophobicContact CG2-CB 4.11Å; D1485-R1522 IonicContact OD1-CZ 3.33Å; D1485-R1522 VanDerWaalsContact OD1-CZ 3.3Å; D1485-R1522 IonicContact OD1-NH1 3.2Å; D1485-R1522 PolarHBondContact OD1-NH1 3.34Å; D1485-R1522 VanDerWaalsContact OD1-NH1 3.1Å; D1485-R1522 IonicContact OD1-NH2 3.11Å; D1485-R1522 PolarHBondContact OD1-NH2 3.01Å; D1485-R1522 IonicContact OD2-CZ 3.46Å; D1485-R1522 IonicContact OD2-NH1 3.18Å; D1485-R1522 PolarHBondContact OD2-NH1 2.86Å; D1485-R1522 IonicContact OD2-NH2 3.37Å; I1488-R1522 HydrophobicContact CD1-CB 4.23Å; Y1519-R1522 WeakPolarHBondContact O-CB 3.37Å; Y1519-R1522 PolarHBondContact O-N 3.21Å; L1520-R1522 PolarHBondContact O-N 3.19Å; L1520-R1522 VanDerWaalsContact O-N 3.15Å
1523L86.2Confident82.9Confident2 Ų252.5 Ų52.51%0.0127%0.265CS..Hα-helixtrans-85.1-29.5-178.1-67.6173.5000113.1I1484 I1488 L1505 F1516 Y1519 L1520 T1526 I1527I1484-L1523 HydrophobicContact CD1-CD1 3.6Å; I1484-L1523 HydrophobicContact CD1-CD2 4.05Å; I1484-L1523 HydrophobicContact CD1-CG 3.87Å; I1484-L1523 HydrophobicContact CG2-CD2 4.23Å; I1484-L1523 HydrophobicContact CG2-CG 4.37Å; I1488-L1523 HydrophobicContact CG1-CD2 4.34Å; L1505-L1523 HydrophobicContact CD2-CD1 3.74Å; F1516-L1523 HydrophobicContact CE2-CD1 3.99Å; F1516-L1523 HydrophobicContact CZ-CD1 3.91Å; Y1519-L1523 PolarHBondContact O-N 3.07Å; L1520-L1523 PolarHBondContact O-N 3.14Å; L1523-T1526 VanDerWaalsContact C-OG1 3.3Å; L1523-T1526 WeakPolarHBondContact CA-OG1 3.45Å; L1523-T1526 WeakPolarHBondContact O-CA 3.33Å; L1523-T1526 WeakPolarHBondContact O-CB 3.3Å; L1523-T1526 PolarHBondContact O-N 3.1Å; L1523-T1526 PolarHBondContact O-OG1 3.19Å; L1523-I1527 HydrophobicContact CB-CD1 4.31Å; L1523-I1527 WeakPolarHBondContact O-CG1 3.25Å; L1523-I1527 PolarHBondContact O-N 3.11Å
1524I86.6Confident82.4Confident7 Ų752 Ų524%0.03626%0.255CS..Hα-helixtrans-54.7-45.9-178.2-74.4-113.9000113.2L1520 T1526 I1527 L1528 L1554 Y1557 I1561L1520-I1524 HydrophobicContact CD1-CD1 4.07Å; L1520-I1524 HydrophobicContact CD1-CG1 3.99Å; L1520-I1524 HydrophobicContact CD2-CD1 4.48Å; L1520-I1524 HydrophobicContact CG-CD1 3.94Å; L1520-I1524 HydrophobicContact CG-CG1 3.93Å; L1520-I1524 WeakPolarHBondContact O-CB 2.92Å; L1520-I1524 WeakPolarHBondContact O-CD1 3.17Å; L1520-I1524 VanDerWaalsContact O-CG1 3.28Å; L1520-I1524 WeakPolarHBondContact O-CG1 3.43Å; L1520-I1524 PolarHBondContact O-N 3.14Å; I1524-T1526 VanDerWaalsContact C-N 3.28Å; I1524-T1526 PolarHBondContact O-N 3.23Å; I1524-I1527 PolarHBondContact O-N 2.97Å; I1524-I1527 VanDerWaalsContact O-N 3.12Å; I1524-L1528 HydrophobicContact CG2-CD1 3.61Å; I1524-L1528 HydrophobicContact CG2-CG 4.13Å; I1524-L1528 WeakPolarHBondContact O-CB 3.3Å; I1524-L1528 VanDerWaalsContact O-CG 3.25Å; I1524-L1528 WeakPolarHBondContact O-CG 3.24Å; I1524-L1528 PolarHBondContact O-N 3.22Å; I1524-L1554 HydrophobicContact CD1-CD1 4.33Å; I1524-Y1557 HydrophobicContact CD1-CD1 3.77Å; I1524-Y1557 HydrophobicContact CD1-CD2 3.94Å; I1524-Y1557 VanDerWaalsContact CD1-CD2 3.5Å; I1524-Y1557 HydrophobicContact CD1-CE1 3.47Å; I1524-Y1557 HydrophobicContact CD1-CE2 3.83Å; I1524-Y1557 HydrophobicContact CD1-CG 3.54Å; I1524-Y1557 HydrophobicContact CG1-CD1 4.01Å; I1524-Y1557 HydrophobicContact CG1-CD2 4.21Å; I1524-Y1557 HydrophobicContact CG1-CE1 4.16Å; I1524-Y1557 HydrophobicContact CG1-CE2 4.44Å; I1524-Y1557 HydrophobicContact CG1-CG 4.03Å; I1524-Y1557 HydrophobicContact CG2-CD1 4.28Å; I1524-I1561 HydrophobicContact CD1-CD1 3.65Å; I1524-I1561 HydrophobicContact CD1-CG1 4.33Å; I1524-I1561 HydrophobicContact CG1-CD1 4.44Å
1525P86.3Confident81.9Confident71.4 Ų71.452.9 Ų52.946%0.46426%0.258SS..Hα-helixtrans-58-37.6176.2-26.135.3000113.3T1521 R1529T1521-P1525 WeakPolarHBondContact O-CD 3.3Å; P1525-R1529 VanDerWaalsContact O-CB 3.29Å; P1525-R1529 WeakPolarHBondContact O-CB 3.21Å; P1525-R1529 PolarHBondContact O-N 3.23Å
1526T85.4Confident81.8Confident13.6 Ų13.652.2 Ų52.28%0.08326%0.257CS..Hα-helixtrans-69.5-42.8177.1-37.80000111.5W1491 W1492 L1523 I1524 R1529 M1530W1491-T1526 HydrophobicContact CB-CG2 4.19Å; W1491-T1526 HydrophobicContact CD2-CG2 3.74Å; W1491-T1526 HydrophobicContact CE3-CG2 4.41Å; W1491-T1526 HydrophobicContact CG-CG2 3.59Å; W1492-T1526 HydrophobicContact CZ2-CG2 4.24Å; L1523-T1526 VanDerWaalsContact C-OG1 3.3Å; L1523-T1526 WeakPolarHBondContact CA-OG1 3.45Å; L1523-T1526 WeakPolarHBondContact O-CA 3.33Å; L1523-T1526 WeakPolarHBondContact O-CB 3.3Å; L1523-T1526 PolarHBondContact O-N 3.1Å; L1523-T1526 PolarHBondContact O-OG1 3.19Å; I1524-T1526 VanDerWaalsContact C-N 3.28Å; I1524-T1526 PolarHBondContact O-N 3.23Å; T1526-R1529 PolarHBondContact O-N 3.11Å; T1526-M1530 PolarHBondContact O-N 3.07Å; T1526-M1530 VanDerWaalsContact O-N 3.11Å
1527I86.1Confident81.5Confident1.8 Ų1.854.5 Ų54.51%0.00927%0.268CS..Hα-helixtrans-61.9-46.2175.8-69.1168.6000111L1520 L1523 I1524 R1529 M1530 F1531 L1543 L1547 F1550L1520-I1527 HydrophobicContact CD1-CD1 4.41Å; L1523-I1527 HydrophobicContact CB-CD1 4.31Å; L1523-I1527 WeakPolarHBondContact O-CG1 3.25Å; L1523-I1527 PolarHBondContact O-N 3.11Å; I1524-I1527 PolarHBondContact O-N 2.97Å; I1524-I1527 VanDerWaalsContact O-N 3.12Å; I1527-R1529 VanDerWaalsContact C-N 3.35Å; I1527-R1529 PolarHBondContact O-N 3.41Å; I1527-M1530 VanDerWaalsContact O-CB 3.25Å; I1527-M1530 WeakPolarHBondContact O-CB 3.42Å; I1527-M1530 PolarHBondContact O-N 3.24Å; I1527-M1530 VanDerWaalsContact O-N 3.15Å; I1527-F1531 HydrophobicContact CG2-CD2 4.12Å; I1527-F1531 HydrophobicContact CG2-CE2 3.67Å; I1527-F1531 HydrophobicContact CG2-CZ 4.43Å; I1527-F1531 WeakPolarHBondContact O-CD2 3.37Å; I1527-F1531 PolarHBondContact O-N 3.2Å; I1527-F1531 VanDerWaalsContact O-N 3.11Å; I1527-L1543 HydrophobicContact CG1-CD1 4.43Å; I1527-L1543 HydrophobicContact CG2-CD1 4.45Å; I1527-L1543 HydrophobicContact CG2-CD2 4.13Å; I1527-L1547 HydrophobicContact CD1-CD2 4.44Å; I1527-L1547 HydrophobicContact CG2-CD2 4.29Å; I1527-F1550 HydrophobicContact CD1-CE2 4.38Å
1528L84.1Confident81.4Confident24.8 Ų24.851.6 Ų51.613%0.1327%0.267CS..Hα-helixtrans-66-38.9177.9-68.4171000112.1I1524 M1530 F1531 H1532 I1560 I1561 A1564I1524-L1528 HydrophobicContact CG2-CD1 3.61Å; I1524-L1528 HydrophobicContact CG2-CG 4.13Å; I1524-L1528 WeakPolarHBondContact O-CB 3.3Å; I1524-L1528 VanDerWaalsContact O-CG 3.25Å; I1524-L1528 WeakPolarHBondContact O-CG 3.24Å; I1524-L1528 PolarHBondContact O-N 3.22Å; L1528-M1530 VanDerWaalsContact C-N 3.28Å; L1528-M1530 PolarHBondContact O-N 3.08Å; L1528-F1531 HydrophobicContact CD2-CD2 4.45Å; L1528-F1531 PolarHBondContact O-N 3Å; L1528-H1532 PolarHBondContact O-CD2 3.01Å; L1528-H1532 VanDerWaalsContact O-CD2 3.26Å; L1528-H1532 PolarHBondContact O-N 3.12Å; L1528-I1560 HydrophobicContact CD1-CB 4.41Å; L1528-I1560 HydrophobicContact CD1-CG2 3.49Å; L1528-I1560 HydrophobicContact CD2-CG2 3.83Å; L1528-I1560 HydrophobicContact CG-CG2 4.31Å; L1528-I1561 HydrophobicContact CD2-CG1 4.4Å; L1528-A1564 HydrophobicContact CD2-CB 4.16Å
1529R83.3Confident81.4Confident141.2 Ų141.247.4 Ų47.453%0.53324%0.241SC..Hα-helixtrans-60.9-38174-172.6178.2-143.6163.1-0.8111.2W1492 P1525 T1526 I1527 H1532 H1533W1492-R1529 HydrophobicContact CH2-CB 4.26Å; W1492-R1529 HydrophobicContact CH2-CG 3.84Å; W1492-R1529 HydrophobicContact CZ2-CB 4.02Å; W1492-R1529 HydrophobicContact CZ2-CG 3.76Å; P1525-R1529 VanDerWaalsContact O-CB 3.29Å; P1525-R1529 WeakPolarHBondContact O-CB 3.21Å; P1525-R1529 PolarHBondContact O-N 3.23Å; T1526-R1529 PolarHBondContact O-N 3.11Å; I1527-R1529 VanDerWaalsContact C-N 3.35Å; I1527-R1529 PolarHBondContact O-N 3.41Å; R1529-H1532 PolarHBondContact O-N 3.1Å; R1529-H1533 WeakPolarHBondContact O-CB 3.33Å; R1529-H1533 PolarHBondContact O-CD2 3.43Å; R1529-H1533 PolarHBondContact O-N 3.21Å; R1529-H1533 VanDerWaalsContact O-N 3.08Å
1530M83.4Confident81.4Confident0 Ų046.8 Ų46.80%024%0.239CC..Hα-helixtrans-62.5-45.7174.6-129.9-179.689.900112W1491 W1492 Q1498 I1502 T1526 I1527 L1528 H1532 H1533 E1534 N1539 L1540 L1543W1491-M1530 HydrophobicContact CZ2-CE 3.8Å; W1491-M1530 HydrophobicContact CZ2-SD 3.76Å; W1491-M1530 VanDerWaalsContact CZ2-SD 3.56Å; W1491-M1530 WeakPolarHBondContact CZ2-SD 3.5Å; W1491-M1530 PolarHBondContact NE1-SD 3.12Å; W1492-M1530 HydrophobicContact CH2-CB 4.29Å; W1492-M1530 HydrophobicContact CH2-CG 4.06Å; Q1498-M1530 HydrophobicContact CG-CE 4.36Å; Q1498-M1530 HydrophobicContact CG-SD 4.34Å; Q1498-M1530 PolarHBondContact NE2-SD 3.44Å; Q1498-M1530 VanDerWaalsContact NE2-SD 3.36Å; I1502-M1530 HydrophobicContact CD1-CE 3.84Å; I1502-M1530 HydrophobicContact CD1-SD 4.01Å; I1502-M1530 HydrophobicContact CG1-CE 4.27Å; T1526-M1530 PolarHBondContact O-N 3.07Å; T1526-M1530 VanDerWaalsContact O-N 3.11Å; I1527-M1530 VanDerWaalsContact O-CB 3.25Å; I1527-M1530 WeakPolarHBondContact O-CB 3.42Å; I1527-M1530 PolarHBondContact O-N 3.24Å; I1527-M1530 VanDerWaalsContact O-N 3.15Å; L1528-M1530 VanDerWaalsContact C-N 3.28Å; L1528-M1530 PolarHBondContact O-N 3.08Å; M1530-H1532 PolarHBondContact O-N 3.08Å; M1530-H1532 VanDerWaalsContact O-N 3.13Å; M1530-H1533 PolarHBondContact O-N 3.21Å; M1530-E1534 HydrophobicContact CB-CG 4.1Å; M1530-E1534 HydrophobicContact CE-CG 4.08Å; M1530-E1534 HydrophobicContact CG-CB 3.77Å; M1530-E1534 HydrophobicContact CG-CG 4.06Å; M1530-E1534 VanDerWaalsContact O-CB 3.28Å; M1530-E1534 WeakPolarHBondContact O-CB 3.35Å; M1530-E1534 WeakPolarHBondContact O-CG 3.38Å; M1530-E1534 PolarHBondContact O-N 3.15Å; M1530-E1534 VanDerWaalsContact O-N 3.1Å; M1530-N1539 HydrophobicContact CE-CB 4.1Å; M1530-N1539 VanDerWaalsContact CE-O 3.25Å; M1530-N1539 WeakPolarHBondContact CE-O 3.22Å; M1530-L1540 HydrophobicContact CE-CD2 4.07Å; M1530-L1540 HydrophobicContact CE-CG 4.49Å; M1530-L1540 HydrophobicContact CG-CD2 4.25Å; M1530-L1543 HydrophobicContact CB-CD2 4.3Å; M1530-L1543 HydrophobicContact CE-CB 3.67Å; M1530-L1543 VanDerWaalsContact CE-CB 3.42Å; M1530-L1543 HydrophobicContact CE-CD1 3.64Å; M1530-L1543 HydrophobicContact CE-CD2 3.78Å; M1530-L1543 HydrophobicContact CE-CG 3.69Å; M1530-L1543 VanDerWaalsContact CE-CG 3.47Å; M1530-L1543 HydrophobicContact CG-CD2 4.24Å; M1530-L1543 HydrophobicContact SD-CB 4.21Å; M1530-L1543 HydrophobicContact SD-CD2 3.91Å; M1530-L1543 VanDerWaalsContact SD-CD2 3.52Å; M1530-L1543 HydrophobicContact SD-CG 4.36Å
1531F81.2Confident81.4Confident8.8 Ų8.848.6 Ų48.64%0.03925%0.248CC..Hα-helixtrans-60.2-28.1177.8-73.1-52.8000114.4I1527 L1528 L1540 L1543 L1544 L1547 I1561 A1564 I1565 L1568I1527-F1531 HydrophobicContact CG2-CD2 4.12Å; I1527-F1531 HydrophobicContact CG2-CE2 3.67Å; I1527-F1531 HydrophobicContact CG2-CZ 4.43Å; I1527-F1531 WeakPolarHBondContact O-CD2 3.37Å; I1527-F1531 PolarHBondContact O-N 3.2Å; I1527-F1531 VanDerWaalsContact O-N 3.11Å; L1528-F1531 HydrophobicContact CD2-CD2 4.45Å; L1528-F1531 PolarHBondContact O-N 3Å; F1531-L1540 HydrophobicContact CD1-CD1 3.69Å; F1531-L1540 HydrophobicContact CD1-CD2 4.17Å; F1531-L1540 HydrophobicContact CE1-CD1 4.09Å; F1531-L1543 HydrophobicContact CE1-CD2 4.06Å; F1531-L1543 HydrophobicContact CE2-CD2 4.19Å; F1531-L1543 HydrophobicContact CZ-CD2 3.95Å; F1531-L1544 HydrophobicContact CE1-CD2 3.85Å; F1531-L1544 HydrophobicContact CE1-CG 4.3Å; F1531-L1544 HydrophobicContact CZ-CD2 4.15Å; F1531-L1547 HydrophobicContact CE1-CD1 4.45Å; F1531-L1547 HydrophobicContact CE2-CD1 4.08Å; F1531-L1547 HydrophobicContact CZ-CD1 3.46Å; F1531-L1547 VanDerWaalsContact CZ-CD1 3.43Å; F1531-I1561 HydrophobicContact CE2-CG2 4.33Å; F1531-A1564 HydrophobicContact CB-CB 4.35Å; F1531-A1564 HydrophobicContact CD2-CB 4.14Å; F1531-A1564 HydrophobicContact CG-CB 4.39Å; F1531-I1565 HydrophobicContact CE1-CG1 4.21Å; F1531-I1565 HydrophobicContact CE2-CG1 4.37Å; F1531-I1565 HydrophobicContact CZ-CD1 4.36Å; F1531-I1565 HydrophobicContact CZ-CG1 3.98Å; F1531-L1568 HydrophobicContact CD1-CD1 3.77Å; F1531-L1568 HydrophobicContact CE1-CD1 4.32Å
1532H77Confident81.5Confident116.8 Ų116.845.9 Ų45.954%0.54123%0.232SC..Hα-helixtrans-95-28-178.6-70.9-53.4000114.9S939 L1528 R1529 M1530S939-H1532 WeakPolarHBondContact CB-NE2 3.46Å; S939-H1532 PolarHBondContact OG-NE2 3.47Å; L1528-H1532 PolarHBondContact O-CD2 3.01Å; L1528-H1532 VanDerWaalsContact O-CD2 3.26Å; L1528-H1532 PolarHBondContact O-N 3.12Å; R1529-H1532 PolarHBondContact O-N 3.1Å; M1530-H1532 PolarHBondContact O-N 3.08Å; M1530-H1532 VanDerWaalsContact O-N 3.13Å
1533H71.8Confident81.6Confident143.2 Ų143.241.2 Ų41.266%0.66322%0.215SC*.Hα-helixtrans-120.9-10.6-169.2-68.4-74.2000115.4R1529 M1530 S1535R1529-H1533 WeakPolarHBondContact O-CB 3.33Å; R1529-H1533 PolarHBondContact O-CD2 3.43Å; R1529-H1533 PolarHBondContact O-N 3.21Å; R1529-H1533 VanDerWaalsContact O-N 3.08Å; M1530-H1533 PolarHBondContact O-N 3.21Å; H1533-S1535 PolarHBondContact O-N 3.12Å
1534E70.8Confident81.5Confident21.4 Ų21.441.2 Ų41.210%0.122%0.215CC..  trans-74.2126.5-177.2-136.617.1-159.200112.1Q1498 M1530 N1536 L1540 V1672Q1498-E1534 PolarHBondContact NE2-OE1 3.3Å; Q1498-E1534 PolarHBondContact NE2-OE2 2.91Å; Q1498-E1534 PolarHBondContact OE1-OE1 3.23Å; Q1498-E1534 PolarHBondContact OE1-OE2 3.22Å; M1530-E1534 HydrophobicContact CB-CG 4.1Å; M1530-E1534 HydrophobicContact CE-CG 4.08Å; M1530-E1534 HydrophobicContact CG-CB 3.77Å; M1530-E1534 HydrophobicContact CG-CG 4.06Å; M1530-E1534 VanDerWaalsContact O-CB 3.28Å; M1530-E1534 WeakPolarHBondContact O-CB 3.35Å; M1530-E1534 WeakPolarHBondContact O-CG 3.38Å; M1530-E1534 PolarHBondContact O-N 3.15Å; M1530-E1534 VanDerWaalsContact O-N 3.1Å; E1534-N1536 HydrophobicContact CG-CB 4.46Å; E1534-N1536 WeakPolarHBondContact OE1-CB 3.36Å; E1534-N1536 PolarHBondContact OE1-N 3.17Å; E1534-N1536 PolarHBondContact OE1-ND2 3.02Å; E1534-N1536 PolarHBondContact OE2-ND2 3.1Å; E1534-L1540 HydrophobicContact CB-CD1 4.22Å; E1534-L1540 HydrophobicContact CB-CD2 3.95Å; E1534-L1540 HydrophobicContact CB-CG 3.99Å; E1534-L1540 HydrophobicContact CG-CD1 4.42Å; E1534-L1540 HydrophobicContact CG-CD2 4.23Å; E1534-L1540 HydrophobicContact CG-CG 3.87Å; E1534-V1672 WeakPolarHBondContact O-CG2 3.24Å
1535S68.1Low81.5Confident76.4 Ų76.445.6 Ų45.653%0.53424%0.235SC..  trans-87-21.9171.453.60000112.6H1533 E1537 V1672H1533-S1535 PolarHBondContact O-N 3.12Å; S1535-E1537 PolarHBondContact O-N 3.07Å; S1535-E1537 VanDerWaalsContact O-N 3.16Å; S1535-V1672 WeakPolarHBondContact O-CG1 3.31Å
1536N77.2Confident81.4Confident64 Ų6442.9 Ų42.934%0.34222%0.217SC..  trans-84.199.6-177.1-63.6-61.8000112.1E1534 S1538 N1539 L1540E1534-N1536 HydrophobicContact CG-CB 4.46Å; E1534-N1536 WeakPolarHBondContact OE1-CB 3.36Å; E1534-N1536 PolarHBondContact OE1-N 3.17Å; E1534-N1536 PolarHBondContact OE1-ND2 3.02Å; E1534-N1536 PolarHBondContact OE2-ND2 3.1Å; N1536-S1538 VanDerWaalsContact C-N 3.26Å; N1536-S1538 PolarHBondContact O-N 3.1Å; N1536-S1538 VanDerWaalsContact O-N 3.08Å; N1536-N1539 HydrophobicContact CB-CB 4.33Å; N1536-N1539 PolarHBondContact O-N 3.1Å; N1536-N1539 VanDerWaalsContact O-N 3.14Å; N1536-L1540 PolarHBondContact O-N 3.23Å
1537E78.4Confident81.5Confident49.8 Ų49.842.3 Ų42.323%0.23321%0.213CC..Hα-helixtrans-57.6-34.2178.8-75.9-166.8148.600113.3S1535 N1539 L1540 I1541 V1672 G1673 S1674 L1677S1535-E1537 PolarHBondContact O-N 3.07Å; S1535-E1537 VanDerWaalsContact O-N 3.16Å; E1537-N1539 VanDerWaalsContact C-N 3.29Å; E1537-N1539 PolarHBondContact O-N 3.06Å; E1537-L1540 WeakPolarHBondContact O-CB 3.37Å; E1537-L1540 PolarHBondContact O-N 3.17Å; E1537-I1541 HydrophobicContact CG-CD1 4.02Å; E1537-I1541 HydrophobicContact CG-CG1 4.39Å; E1537-I1541 WeakPolarHBondContact O-CB 3.23Å; E1537-I1541 WeakPolarHBondContact O-CD1 3.47Å; E1537-I1541 VanDerWaalsContact O-CG1 3.28Å; E1537-I1541 WeakPolarHBondContact O-CG1 3.33Å; E1537-I1541 PolarHBondContact O-N 3.15Å; E1537-V1672 HydrophobicContact CB-CG1 4Å; E1537-V1672 HydrophobicContact CG-CB 4.16Å; E1537-V1672 HydrophobicContact CG-CG1 3.85Å; E1537-G1673 PolarHBondContact OE1-N 3.05Å; E1537-S1674 VanDerWaalsContact CD-OG 3.27Å; E1537-S1674 VanDerWaalsContact OE1-CB 3.25Å; E1537-S1674 WeakPolarHBondContact OE1-CB 3.42Å; E1537-S1674 PolarHBondContact OE1-N 3.11Å; E1537-S1674 PolarHBondContact OE1-OG 3.13Å; E1537-S1674 VanDerWaalsContact OE2-CB 3.23Å; E1537-S1674 WeakPolarHBondContact OE2-CB 3.4Å; E1537-S1674 PolarHBondContact OE2-N 3.25Å; E1537-S1674 PolarHBondContact OE2-OG 3.23Å; E1537-L1677 HydrophobicContact CG-CB 3.69Å; E1537-L1677 HydrophobicContact CG-CD1 4.41Å; E1537-L1677 HydrophobicContact CG-CD2 4.32Å; E1537-L1677 HydrophobicContact CG-CG 4.35Å; E1537-L1677 VanDerWaalsContact OE1-CB 3.24Å; E1537-L1677 WeakPolarHBondContact OE1-CB 3.37Å; E1537-L1677 PolarHBondContact OE1-N 2.68Å
1538S81.2Confident81.4Confident65.6 Ų65.642.6 Ų42.646%0.45922%0.216SC..Hα-helixtrans-61.9-35.8178.647.90000113.6N1536 A1542N1536-S1538 VanDerWaalsContact C-N 3.26Å; N1536-S1538 PolarHBondContact O-N 3.1Å; N1536-S1538 VanDerWaalsContact O-N 3.08Å; S1538-A1542 WeakPolarHBondContact O-CB 3.42Å; S1538-A1542 PolarHBondContact O-N 3.2Å; S1538-A1542 VanDerWaalsContact O-N 3.1Å
1539N83.7Confident81.2Confident4.6 Ų4.644.7 Ų44.73%0.02523%0.225CC..Hα-helixtrans-79.2-34.7-179.9-71.1-4.2000110.7P1495 Q1498 I1502 M1530 N1536 E1537 I1541 A1542 L1543P1495-N1539 PolarHBondContact O-ND2 3.35Å; Q1498-N1539 PolarHBondContact OE1-ND2 3.2Å; I1502-N1539 HydrophobicContact CD1-CB 4.3Å; I1502-N1539 WeakPolarHBondContact CD1-O 3.35Å; M1530-N1539 HydrophobicContact CE-CB 4.1Å; M1530-N1539 VanDerWaalsContact CE-O 3.25Å; M1530-N1539 WeakPolarHBondContact CE-O 3.22Å; N1536-N1539 HydrophobicContact CB-CB 4.33Å; N1536-N1539 PolarHBondContact O-N 3.1Å; N1536-N1539 VanDerWaalsContact O-N 3.14Å; E1537-N1539 VanDerWaalsContact C-N 3.29Å; E1537-N1539 PolarHBondContact O-N 3.06Å; N1539-I1541 VanDerWaalsContact C-N 3.34Å; N1539-I1541 PolarHBondContact O-N 3.29Å; N1539-A1542 PolarHBondContact O-N 2.97Å; N1539-L1543 WeakPolarHBondContact O-CB 3.43Å; N1539-L1543 PolarHBondContact O-N 3.23Å; N1539-L1543 VanDerWaalsContact O-N 3.08Å
1540L84.1Confident81.2Confident2 Ų238.2 Ų38.21%0.0120%0.201CC..Hα-helixtrans-62.3-44.2170.9-85.5158.3000111.7M1530 F1531 E1534 N1536 E1537 L1543 L1544 L1568 V1672 L1677M1530-L1540 HydrophobicContact CE-CD2 4.07Å; M1530-L1540 HydrophobicContact CE-CG 4.49Å; M1530-L1540 HydrophobicContact CG-CD2 4.25Å; F1531-L1540 HydrophobicContact CD1-CD1 3.69Å; F1531-L1540 HydrophobicContact CD1-CD2 4.17Å; F1531-L1540 HydrophobicContact CE1-CD1 4.09Å; E1534-L1540 HydrophobicContact CB-CD1 4.22Å; E1534-L1540 HydrophobicContact CB-CD2 3.95Å; E1534-L1540 HydrophobicContact CB-CG 3.99Å; E1534-L1540 HydrophobicContact CG-CD1 4.42Å; E1534-L1540 HydrophobicContact CG-CD2 4.23Å; E1534-L1540 HydrophobicContact CG-CG 3.87Å; N1536-L1540 PolarHBondContact O-N 3.23Å; E1537-L1540 WeakPolarHBondContact O-CB 3.37Å; E1537-L1540 PolarHBondContact O-N 3.17Å; L1540-L1543 PolarHBondContact O-N 3Å; L1540-L1544 HydrophobicContact CG-CD1 4.49Å; L1540-L1544 WeakPolarHBondContact O-CB 3.45Å; L1540-L1544 VanDerWaalsContact O-CG 3.27Å; L1540-L1544 WeakPolarHBondContact O-CG 3.39Å; L1540-L1544 PolarHBondContact O-N 3.05Å; L1540-L1568 HydrophobicContact CD2-CD1 4.03Å; L1540-V1672 HydrophobicContact CD1-CG1 4.38Å; L1540-V1672 HydrophobicContact CD1-CG2 4.47Å; L1540-L1677 HydrophobicContact CB-CD1 3.95Å; L1540-L1677 HydrophobicContact CD1-CD1 4.43Å; L1540-L1677 HydrophobicContact CD1-CD2 4.27Å; L1540-L1677 HydrophobicContact CD2-CD1 3.47Å; L1540-L1677 VanDerWaalsContact CD2-CD1 3.47Å; L1540-L1677 HydrophobicContact CD2-CD2 3.63Å; L1540-L1677 HydrophobicContact CD2-CG 4.2Å; L1540-L1677 HydrophobicContact CG-CD1 3.69Å
1541I85.2Confident80.9Confident37.6 Ų37.639 Ų3919%0.19321%0.209CC..Hα-helixtrans-61.4-47175.4-67.6164.7000110.6E1537 N1539 L1543 L1544 E1545 H1676 L1677 A1680E1537-I1541 HydrophobicContact CG-CD1 4.02Å; E1537-I1541 HydrophobicContact CG-CG1 4.39Å; E1537-I1541 WeakPolarHBondContact O-CB 3.23Å; E1537-I1541 WeakPolarHBondContact O-CD1 3.47Å; E1537-I1541 VanDerWaalsContact O-CG1 3.28Å; E1537-I1541 WeakPolarHBondContact O-CG1 3.33Å; E1537-I1541 PolarHBondContact O-N 3.15Å; N1539-I1541 VanDerWaalsContact C-N 3.34Å; N1539-I1541 PolarHBondContact O-N 3.29Å; I1541-L1543 VanDerWaalsContact C-N 3.28Å; I1541-L1543 PolarHBondContact O-N 3.12Å; I1541-L1544 WeakPolarHBondContact O-CB 3.41Å; I1541-L1544 PolarHBondContact O-N 2.94Å; I1541-L1544 VanDerWaalsContact O-N 3.13Å; I1541-E1545 HydrophobicContact CG2-CG 4.46Å; I1541-E1545 WeakPolarHBondContact O-CG 3.31Å; I1541-E1545 PolarHBondContact O-N 3.22Å; I1541-H1676 HydrophobicContact CD1-CB 4.21Å; I1541-L1677 HydrophobicContact CG1-CD1 4.09Å; I1541-A1680 HydrophobicContact CB-CB 4.29Å; I1541-A1680 HydrophobicContact CG1-CB 3.97Å; I1541-A1680 HydrophobicContact CG2-CB 4.03Å
1542A85.1Confident80.8Confident13.2 Ų13.245.9 Ų45.911%0.10924%0.236CC..Hα-helixtrans-59.4-38.3177.800000112.6I1502 S1538 N1539 E1545 V1546I1502-A1542 HydrophobicContact CG2-CB 4.29Å; S1538-A1542 WeakPolarHBondContact O-CB 3.42Å; S1538-A1542 PolarHBondContact O-N 3.2Å; S1538-A1542 VanDerWaalsContact O-N 3.1Å; N1539-A1542 PolarHBondContact O-N 2.97Å; A1542-E1545 PolarHBondContact O-N 3.02Å; A1542-V1546 WeakPolarHBondContact O-CG2 3.3Å; A1542-V1546 PolarHBondContact O-N 3.28Å; A1542-V1546 VanDerWaalsContact O-N 3.14Å
1543L87.7Confident81Confident0.2 Ų0.240.6 Ų40.60%0.00121%0.212CC..Hα-helixtrans-66.8-44.1174.9177.868.3000111.8I1502 I1527 M1530 F1531 N1539 L1540 I1541 E1545 V1546 L1547I1502-L1543 HydrophobicContact CD1-CB 4.34Å; I1502-L1543 HydrophobicContact CG2-CB 4.27Å; I1502-L1543 HydrophobicContact CG2-CD1 4.42Å; I1527-L1543 HydrophobicContact CG1-CD1 4.43Å; I1527-L1543 HydrophobicContact CG2-CD1 4.45Å; I1527-L1543 HydrophobicContact CG2-CD2 4.13Å; M1530-L1543 HydrophobicContact CB-CD2 4.3Å; M1530-L1543 HydrophobicContact CE-CB 3.67Å; M1530-L1543 VanDerWaalsContact CE-CB 3.42Å; M1530-L1543 HydrophobicContact CE-CD1 3.64Å; M1530-L1543 HydrophobicContact CE-CD2 3.78Å; M1530-L1543 HydrophobicContact CE-CG 3.69Å; M1530-L1543 VanDerWaalsContact CE-CG 3.47Å; M1530-L1543 HydrophobicContact CG-CD2 4.24Å; M1530-L1543 HydrophobicContact SD-CB 4.21Å; M1530-L1543 HydrophobicContact SD-CD2 3.91Å; M1530-L1543 VanDerWaalsContact SD-CD2 3.52Å; M1530-L1543 HydrophobicContact SD-CG 4.36Å; F1531-L1543 HydrophobicContact CE1-CD2 4.06Å; F1531-L1543 HydrophobicContact CE2-CD2 4.19Å; F1531-L1543 HydrophobicContact CZ-CD2 3.95Å; N1539-L1543 WeakPolarHBondContact O-CB 3.43Å; N1539-L1543 PolarHBondContact O-N 3.23Å; N1539-L1543 VanDerWaalsContact O-N 3.08Å; L1540-L1543 PolarHBondContact O-N 3Å; I1541-L1543 VanDerWaalsContact C-N 3.28Å; I1541-L1543 PolarHBondContact O-N 3.12Å; L1543-E1545 VanDerWaalsContact C-N 3.3Å; L1543-E1545 PolarHBondContact O-N 3.14Å; L1543-V1546 PolarHBondContact O-N 3.18Å; L1543-V1546 VanDerWaalsContact O-N 3.15Å; L1543-L1547 HydrophobicContact CD1-CD1 4.31Å; L1543-L1547 HydrophobicContact CD1-CD2 4.49Å; L1543-L1547 HydrophobicContact CD1-CG 4.15Å; L1543-L1547 HydrophobicContact CD2-CD1 4.21Å; L1543-L1547 HydrophobicContact CG-CD1 3.87Å; L1543-L1547 HydrophobicContact CG-CG 4.2Å; L1543-L1547 WeakPolarHBondContact O-CB 3.42Å; L1543-L1547 VanDerWaalsContact O-CG 3.28Å; L1543-L1547 WeakPolarHBondContact O-CG 3.29Å; L1543-L1547 PolarHBondContact O-N 3.25Å
1544L85.3Confident81.5Confident2.4 Ų2.433.9 Ų33.91%0.01318%0.181CC..Hα-helixtrans-63.3-29.6177.1-71.5166.6000112.5F1531 L1540 I1541 L1547 P1548 I1565 L1677 A1680 C1681 C1684F1531-L1544 HydrophobicContact CE1-CD2 3.85Å; F1531-L1544 HydrophobicContact CE1-CG 4.3Å; F1531-L1544 HydrophobicContact CZ-CD2 4.15Å; L1540-L1544 HydrophobicContact CG-CD1 4.49Å; L1540-L1544 WeakPolarHBondContact O-CB 3.45Å; L1540-L1544 VanDerWaalsContact O-CG 3.27Å; L1540-L1544 WeakPolarHBondContact O-CG 3.39Å; L1540-L1544 PolarHBondContact O-N 3.05Å; I1541-L1544 WeakPolarHBondContact O-CB 3.41Å; I1541-L1544 PolarHBondContact O-N 2.94Å; I1541-L1544 VanDerWaalsContact O-N 3.13Å; L1544-L1547 HydrophobicContact CD2-CD1 4.43Å; L1544-P1548 WeakPolarHBondContact O-CD 3.23Å; L1544-I1565 HydrophobicContact CD2-CD1 4.09Å; L1544-I1565 HydrophobicContact CD2-CG1 4.1Å; L1544-I1565 HydrophobicContact CD2-CG2 4.31Å; L1544-L1677 HydrophobicContact CD1-CD1 3.85Å; L1544-A1680 HydrophobicContact CB-CB 4.49Å; L1544-A1680 HydrophobicContact CD1-CB 4.11Å; L1544-C1681 HydrophobicContact CD1-CB 4.47Å; L1544-C1681 VanDerWaalsContact CD1-SG 3.58Å; L1544-C1681 WeakPolarHBondContact CD1-SG 3.48Å; L1544-C1684 HydrophobicContact CB-CB 4.21Å; L1544-C1684 HydrophobicContact CD2-CB 4.08Å; L1544-C1684 WeakPolarHBondContact O-CB 3.07Å; L1544-C1684 PolarHBondContact O-SG 3.32Å; L1544-C1684 VanDerWaalsContact O-SG 3.39Å
1545E85.5Confident81.9Confident99.2 Ų99.238.4 Ų38.446%0.46420%0.2SC..Hα-helixtrans-71.5-38.1173.5-74.1-179.5175.700112.7I1541 A1542 L1543 R1687 R1821I1541-E1545 HydrophobicContact CG2-CG 4.46Å; I1541-E1545 WeakPolarHBondContact O-CG 3.31Å; I1541-E1545 PolarHBondContact O-N 3.22Å; A1542-E1545 PolarHBondContact O-N 3.02Å; L1543-E1545 VanDerWaalsContact C-N 3.3Å; L1543-E1545 PolarHBondContact O-N 3.14Å; E1545-R1687 PolarHBondContact O-NH1 3.16Å; E1545-R1821 PolarHBondContact O-NH1 3.27Å; E1545-R1821 PolarHBondContact O-NH2 2.98Å
1546V85.7Confident82.5Confident14.2 Ų14.238 Ų389%0.08619%0.192CC..Hα-helixtrans-81.8-35.6-177.5174.50000112.7I1502 L1505 A1542 L1543 P1548 E1549 F1550I1502-V1546 HydrophobicContact CG2-CB 4.46Å; I1502-V1546 HydrophobicContact CG2-CG2 4.19Å; L1505-V1546 HydrophobicContact CB-CG1 4.2Å; A1542-V1546 WeakPolarHBondContact O-CG2 3.3Å; A1542-V1546 PolarHBondContact O-N 3.28Å; A1542-V1546 VanDerWaalsContact O-N 3.14Å; L1543-V1546 PolarHBondContact O-N 3.18Å; L1543-V1546 VanDerWaalsContact O-N 3.15Å; V1546-P1548 VanDerWaalsContact C-CD 3.45Å; V1546-P1548 VanDerWaalsContact C-N 3.35Å; V1546-P1548 VanDerWaalsContact O-N 3.13Å; V1546-E1549 WeakPolarHBondContact O-CA 3.4Å; V1546-E1549 VanDerWaalsContact O-CB 3.25Å; V1546-E1549 WeakPolarHBondContact O-CB 3.34Å; V1546-E1549 WeakPolarHBondContact O-CG 3.36Å; V1546-E1549 PolarHBondContact O-N 3.3Å; V1546-F1550 HydrophobicContact CG1-CE1 4.03Å; V1546-F1550 HydrophobicContact CG1-CZ 4.15Å
1547L86.6Confident82.8Confident0.2 Ų0.236.5 Ų36.50%0.00118%0.182CC..G310 helixtrans-51.1-41.1-176.1-85.8166.5000115.3I1527 F1531 L1543 L1544 E1549 F1550 L1554 F1688I1527-L1547 HydrophobicContact CD1-CD2 4.44Å; I1527-L1547 HydrophobicContact CG2-CD2 4.29Å; F1531-L1547 HydrophobicContact CE1-CD1 4.45Å; F1531-L1547 HydrophobicContact CE2-CD1 4.08Å; F1531-L1547 HydrophobicContact CZ-CD1 3.46Å; F1531-L1547 VanDerWaalsContact CZ-CD1 3.43Å; L1543-L1547 HydrophobicContact CD1-CD1 4.31Å; L1543-L1547 HydrophobicContact CD1-CD2 4.49Å; L1543-L1547 HydrophobicContact CD1-CG 4.15Å; L1543-L1547 HydrophobicContact CD2-CD1 4.21Å; L1543-L1547 HydrophobicContact CG-CD1 3.87Å; L1543-L1547 HydrophobicContact CG-CG 4.2Å; L1543-L1547 WeakPolarHBondContact O-CB 3.42Å; L1543-L1547 VanDerWaalsContact O-CG 3.28Å; L1543-L1547 WeakPolarHBondContact O-CG 3.29Å; L1543-L1547 PolarHBondContact O-N 3.25Å; L1544-L1547 HydrophobicContact CD2-CD1 4.43Å; L1547-E1549 PolarHBondContact O-N 3.13Å; L1547-F1550 HydrophobicContact CD2-CD2 3.89Å; L1547-F1550 HydrophobicContact CD2-CE2 3.66Å; L1547-F1550 HydrophobicContact CG-CE2 4.5Å; L1547-F1550 WeakPolarHBondContact O-CB 3.32Å; L1547-F1550 WeakPolarHBondContact O-CG 3.4Å; L1547-F1550 PolarHBondContact O-N 2.87Å; L1547-L1554 HydrophobicContact CD2-CD2 4.42Å; L1547-F1688 HydrophobicContact CB-CE1 4.24Å; L1547-F1688 HydrophobicContact CB-CZ 4.21Å
1548P83.1Confident83Confident9.6 Ų9.634.3 Ų34.36%0.06217%0.172CC..G310 helixtrans-62.3-21.5175.3-25.335.5000114.9L1544 V1546 F1550 G1551 C1684 R1687 F1688L1544-P1548 WeakPolarHBondContact O-CD 3.23Å; V1546-P1548 VanDerWaalsContact C-CD 3.45Å; V1546-P1548 VanDerWaalsContact C-N 3.35Å; V1546-P1548 VanDerWaalsContact O-N 3.13Å; P1548-F1550 PolarHBondContact O-N 3.27Å; P1548-G1551 PolarHBondContact O-N 3.24Å; P1548-G1551 VanDerWaalsContact O-N 3.11Å; P1548-C1684 HydrophobicContact CG-CB 4.47Å; P1548-R1687 HydrophobicContact CB-CB 3.82Å; P1548-R1687 HydrophobicContact CG-CB 4Å; P1548-F1688 HydrophobicContact CB-CD1 3.99Å; P1548-F1688 HydrophobicContact CB-CE1 4.23Å; P1548-F1688 HydrophobicContact CG-CD1 3.99Å; P1548-F1688 HydrophobicContact CG-CE1 4.12Å
1549E80.8Confident83.2Confident67.4 Ų67.435.3 Ų35.332%0.31517%0.169SC..G310 helixtrans-71-17.3178.1-58.4-178.6-178.200112.8S1506 S1509 V1546 L1547 G1551 R1821S1506-E1549 VanDerWaalsContact CA-OE2 3.25Å; S1506-E1549 WeakPolarHBondContact CA-OE2 3.32Å; S1506-E1549 WeakPolarHBondContact CB-OE2 3.37Å; S1506-E1549 PolarHBondContact OG-OE1 3.3Å; S1506-E1549 PolarHBondContact OG-OE2 3.24Å; S1509-E1549 PolarHBondContact OG-O 2.93Å; V1546-E1549 WeakPolarHBondContact O-CA 3.4Å; V1546-E1549 VanDerWaalsContact O-CB 3.25Å; V1546-E1549 WeakPolarHBondContact O-CB 3.34Å; V1546-E1549 WeakPolarHBondContact O-CG 3.36Å; V1546-E1549 PolarHBondContact O-N 3.3Å; L1547-E1549 PolarHBondContact O-N 3.13Å; E1549-G1551 VanDerWaalsContact C-N 3.25Å; E1549-G1551 PolarHBondContact O-N 3.32Å; E1549-R1821 VanDerWaalsContact CG-NH1 3.28Å; E1549-R1821 IonicContact OE1-CZ 3.27Å; E1549-R1821 IonicContact OE1-NE 3.8Å; E1549-R1821 IonicContact OE1-NH1 2.76Å; E1549-R1821 PolarHBondContact OE1-NH1 2.8Å; E1549-R1821 IonicContact OE1-NH2 2.8Å; E1549-R1821 PolarHBondContact OE1-NH2 3.16Å
1550F82.6Confident83.3Confident5.6 Ų5.637.7 Ų37.73%0.02518%0.181CC..G310 helixtrans-71.3-20.4174.1-57-17.3000111.9L1505 S1509 F1516 L1520 I1527 V1546 L1547 P1548 Y1552 T1553 L1554L1505-F1550 HydrophobicContact CB-CE1 4.08Å; L1505-F1550 HydrophobicContact CB-CZ 4Å; L1505-F1550 HydrophobicContact CD1-CZ 4.14Å; L1505-F1550 HydrophobicContact CG-CZ 4.46Å; S1509-F1550 WeakPolarHBondContact OG-CD1 3.48Å; F1516-F1550 HydrophobicContact CD1-CD1 4.32Å; F1516-F1550 HydrophobicContact CD1-CG 4.45Å; F1516-F1550 HydrophobicContact CE1-CB 4.45Å; F1516-F1550 AromaticContact CE1-CD1 3.71Å; F1516-F1550 HydrophobicContact CE1-CD1 3.71Å; F1516-F1550 HydrophobicContact CE1-CD2 4.08Å; F1516-F1550 AromaticContact CE1-CE1 3.73Å; F1516-F1550 HydrophobicContact CE1-CE1 3.79Å; F1516-F1550 HydrophobicContact CE1-CE2 4.23Å; F1516-F1550 AromaticContact CE1-CG 3.85Å; F1516-F1550 HydrophobicContact CE1-CG 3.93Å; F1516-F1550 AromaticContact CE1-CZ 3.85Å; F1516-F1550 HydrophobicContact CE1-CZ 4.07Å; F1516-F1550 HydrophobicContact CZ-CD1 4.34Å; F1516-F1550 AromaticContact CZ-CE1 3.97Å; F1516-F1550 HydrophobicContact CZ-CE1 4.05Å; F1516-F1550 HydrophobicContact CZ-CE2 4.5Å; F1516-F1550 HydrophobicContact CZ-CZ 4.16Å; L1520-F1550 HydrophobicContact CD1-CD2 4.24Å; L1520-F1550 HydrophobicContact CD1-CE2 4.39Å; I1527-F1550 HydrophobicContact CD1-CE2 4.38Å; V1546-F1550 HydrophobicContact CG1-CE1 4.03Å; V1546-F1550 HydrophobicContact CG1-CZ 4.15Å; L1547-F1550 HydrophobicContact CD2-CD2 3.89Å; L1547-F1550 HydrophobicContact CD2-CE2 3.66Å; L1547-F1550 HydrophobicContact CG-CE2 4.5Å; L1547-F1550 WeakPolarHBondContact O-CB 3.32Å; L1547-F1550 WeakPolarHBondContact O-CG 3.4Å; L1547-F1550 PolarHBondContact O-N 2.87Å; P1548-F1550 PolarHBondContact O-N 3.27Å; F1550-Y1552 PolarHBondContact O-N 3.24Å; F1550-T1553 WeakPolarHBondContact O-CB 3.39Å; F1550-T1553 PolarHBondContact O-N 3.13Å; F1550-T1553 VanDerWaalsContact O-N 3.13Å; F1550-T1553 PolarHBondContact O-OG1 3.08Å; F1550-T1553 VanDerWaalsContact O-OG1 3.09Å; F1550-L1554 HydrophobicContact CB-CB 4.46Å; F1550-L1554 HydrophobicContact CB-CD1 4.44Å; F1550-L1554 HydrophobicContact CD2-CD1 4.2Å
1551G78.5Confident83.4Confident17.4 Ų17.437.6 Ų37.618%0.17918%0.181CC..G310 helixtrans52.3-126.5174.100000113.3P1548 E1549 T1553 L1554 V1692P1548-G1551 PolarHBondContact O-N 3.24Å; P1548-G1551 VanDerWaalsContact O-N 3.11Å; E1549-G1551 VanDerWaalsContact C-N 3.25Å; E1549-G1551 PolarHBondContact O-N 3.32Å; G1551-T1553 VanDerWaalsContact C-N 3.28Å; G1551-T1553 PolarHBondContact O-N 3.19Å; G1551-L1554 WeakPolarHBondContact O-CB 3.44Å; G1551-L1554 PolarHBondContact O-N 3.16Å; G1551-V1692 WeakPolarHBondContact O-CG2 3.46Å
1552Y79.2Confident83.4Confident153.4 Ų153.435.8 Ų35.860%0.60217%0.172SC*.G310 helixtrans-68.3-18.2-176.268.2-90.7000114.3A1514 F1550 L1554 K1555A1514-Y1552 WeakPolarHBondContact CA-OH 3.32Å; A1514-Y1552 HydrophobicContact CB-CE2 4.46Å; A1514-Y1552 WeakPolarHBondContact CB-OH 3.33Å; A1514-Y1552 PolarHBondContact N-OH 3.22Å; F1550-Y1552 PolarHBondContact O-N 3.24Å; Y1552-L1554 PolarHBondContact O-N 3.29Å; Y1552-K1555 WeakPolarHBondContact O-CB 3.38Å; Y1552-K1555 PolarHBondContact O-N 3.11Å; Y1552-K1555 VanDerWaalsContact O-N 3.15Å
1553T80.4Confident83.5Confident5 Ų537.3 Ų37.33%0.03118%0.18CC..G310 helixtrans-66.6-19.5178.567.40000112.2R1517 L1520 F1550 G1551R1517-T1553 HydrophobicContact CB-CG2 4.36Å; L1520-T1553 WeakPolarHBondContact CD2-O 3.48Å; F1550-T1553 WeakPolarHBondContact O-CB 3.39Å; F1550-T1553 PolarHBondContact O-N 3.13Å; F1550-T1553 VanDerWaalsContact O-N 3.13Å; F1550-T1553 PolarHBondContact O-OG1 3.08Å; F1550-T1553 VanDerWaalsContact O-OG1 3.09Å; G1551-T1553 VanDerWaalsContact C-N 3.28Å; G1551-T1553 PolarHBondContact O-N 3.19Å
1554L82Confident83.3Confident2.6 Ų2.637.5 Ų37.51%0.01418%0.182CC..G310 helixtrans-84.5-8.3178.9-152.167.6000113.8L1520 I1524 L1547 F1550 G1551 Y1552 D1556 Y1557 A1558 I1561 F1688L1520-L1554 HydrophobicContact CD1-CD1 4.43Å; L1520-L1554 HydrophobicContact CD2-CD1 3.93Å; I1524-L1554 HydrophobicContact CD1-CD1 4.33Å; L1547-L1554 HydrophobicContact CD2-CD2 4.42Å; F1550-L1554 HydrophobicContact CB-CB 4.46Å; F1550-L1554 HydrophobicContact CB-CD1 4.44Å; F1550-L1554 HydrophobicContact CD2-CD1 4.2Å; G1551-L1554 WeakPolarHBondContact O-CB 3.44Å; G1551-L1554 PolarHBondContact O-N 3.16Å; Y1552-L1554 PolarHBondContact O-N 3.29Å; L1554-D1556 VanDerWaalsContact C-N 3.29Å; L1554-D1556 PolarHBondContact O-N 3.25Å; L1554-Y1557 CarbonylContact O-C 3.53Å; L1554-Y1557 WeakPolarHBondContact O-CA 3.31Å; L1554-Y1557 PolarHBondContact O-N 3.19Å; L1554-A1558 PolarHBondContact O-N 3.21Å; L1554-I1561 HydrophobicContact CD1-CD1 3.33Å; L1554-I1561 VanDerWaalsContact CD1-CD1 3.47Å; L1554-I1561 HydrophobicContact CD2-CD1 3.95Å; L1554-I1561 HydrophobicContact CG-CD1 3.75Å; L1554-F1688 HydrophobicContact CD2-CE1 3.71Å; L1554-F1688 HydrophobicContact CD2-CE2 4.02Å; L1554-F1688 HydrophobicContact CD2-CZ 3.31Å; L1554-F1688 VanDerWaalsContact CD2-CZ 3.41Å
1555K80.1Confident83.4Confident116.8 Ų116.837.4 Ų37.451%0.50818%0.182SC..G310 helixtrans-54.3-42.8-171.2-176.9169.4-179.3163.10113Y1552 Y1557 A1558 V1692 D1693Y1552-K1555 WeakPolarHBondContact O-CB 3.38Å; Y1552-K1555 PolarHBondContact O-N 3.11Å; Y1552-K1555 VanDerWaalsContact O-N 3.15Å; K1555-Y1557 VanDerWaalsContact C-N 3.28Å; K1555-Y1557 PolarHBondContact O-N 3.01Å; K1555-A1558 WeakPolarHBondContact O-CB 3.35Å; K1555-A1558 PolarHBondContact O-N 3.38Å; K1555-V1692 HydrophobicContact CB-CG1 4.43Å; K1555-V1692 HydrophobicContact CG-CG1 4.42Å; K1555-D1693 IonicContact NZ-OD2 3.2Å; K1555-D1693 PolarHBondContact NZ-OD2 3.23Å
1556D80.6Confident83.3Confident66.2 Ų66.233 Ų3335%0.35416%0.162SC..G310 helixtrans-69.9-24.5-179.8-53.6-38.3000112.9R1517 L1554 H1559R1517-D1556 IonicContact CZ-OD1 2.71Å; R1517-D1556 IonicContact CZ-OD2 3.34Å; R1517-D1556 IonicContact NE-OD2 3.2Å; R1517-D1556 PolarHBondContact NE-OD2 3Å; R1517-D1556 IonicContact NH2-OD1 3.35Å; R1517-D1556 PolarHBondContact NH2-OD1 2.99Å; R1517-D1556 IonicContact NH2-OD2 3.13Å; R1517-D1556 PolarHBondContact NH2-OD2 3.1Å; L1554-D1556 VanDerWaalsContact C-N 3.29Å; L1554-D1556 PolarHBondContact O-N 3.25Å; D1556-H1559 PolarHBondContact O-CE1 3.17Å; D1556-H1559 PolarHBondContact O-ND1 3.25Å
1557Y83.1Confident83.2Confident33.2 Ų33.235.2 Ų35.213%0.1318%0.178CC..G310 helixtrans-102.4-3.6-174.9-55.3-72.1000113.2H936 L1520 T1521 I1524 L1554 K1555 H1559 I1560 I1561H936-Y1557 HydrophobicContact CB-CE1 4.43Å; L1520-Y1557 HydrophobicContact CB-CE2 4.25Å; L1520-Y1557 HydrophobicContact CD2-CD2 3.63Å; L1520-Y1557 VanDerWaalsContact CD2-CD2 3.43Å; L1520-Y1557 HydrophobicContact CD2-CE2 3.74Å; L1520-Y1557 HydrophobicContact CG-CD2 4.07Å; L1520-Y1557 HydrophobicContact CG-CE2 3.94Å; T1521-Y1557 WeakPolarHBondContact CG2-OH 3.37Å; T1521-Y1557 PolarHBondContact OG1-OH 3.19Å; I1524-Y1557 HydrophobicContact CD1-CD1 3.77Å; I1524-Y1557 HydrophobicContact CD1-CD2 3.94Å; I1524-Y1557 VanDerWaalsContact CD1-CD2 3.5Å; I1524-Y1557 HydrophobicContact CD1-CE1 3.47Å; I1524-Y1557 HydrophobicContact CD1-CE2 3.83Å; I1524-Y1557 HydrophobicContact CD1-CG 3.54Å; I1524-Y1557 HydrophobicContact CG1-CD1 4.01Å; I1524-Y1557 HydrophobicContact CG1-CD2 4.21Å; I1524-Y1557 HydrophobicContact CG1-CE1 4.16Å; I1524-Y1557 HydrophobicContact CG1-CE2 4.44Å; I1524-Y1557 HydrophobicContact CG1-CG 4.03Å; I1524-Y1557 HydrophobicContact CG2-CD1 4.28Å; L1554-Y1557 CarbonylContact O-C 3.53Å; L1554-Y1557 WeakPolarHBondContact O-CA 3.31Å; L1554-Y1557 PolarHBondContact O-N 3.19Å; K1555-Y1557 VanDerWaalsContact C-N 3.28Å; K1555-Y1557 PolarHBondContact O-N 3.01Å; Y1557-H1559 PolarHBondContact O-N 3.08Å; Y1557-H1559 VanDerWaalsContact O-N 3.15Å; Y1557-I1560 HydrophobicContact CD1-CD1 4.34Å; Y1557-I1560 PolarHBondContact O-N 3.32Å; Y1557-I1561 PolarHBondContact O-N 3.1Å; Y1557-I1561 VanDerWaalsContact O-N 3.14Å
1558A83.4Confident82.9Confident4.4 Ų4.436.3 Ų36.34%0.03618%0.183CC..Hα-helixtrans-53.3-37.5178.400000112L1554 K1555 I1560 I1561 V1562 V1692 F1697L1554-A1558 PolarHBondContact O-N 3.21Å; K1555-A1558 WeakPolarHBondContact O-CB 3.35Å; K1555-A1558 PolarHBondContact O-N 3.38Å; A1558-I1560 PolarHBondContact O-N 2.97Å; A1558-I1560 VanDerWaalsContact O-N 3.14Å; A1558-I1561 PolarHBondContact O-N 3.15Å; A1558-V1562 HydrophobicContact CB-CG2 4.38Å; A1558-V1562 VanDerWaalsContact O-CB 3.25Å; A1558-V1562 WeakPolarHBondContact O-CB 3.25Å; A1558-V1562 VanDerWaalsContact O-CG2 3.26Å; A1558-V1562 WeakPolarHBondContact O-CG2 3.28Å; A1558-V1562 PolarHBondContact O-N 3.09Å; A1558-V1692 HydrophobicContact CB-CG1 4.38Å; A1558-F1697 HydrophobicContact CB-CE2 4.12Å
1559H83.8Confident82.7Confident86.8 Ų86.835.9 Ų35.940%0.40218%0.181SC..Hα-helixtrans-63.7-16.3178.672.7-81.5000115.1H929 D933 D1556 Y1557 P1563 F1697H929-H1559 PolarHBondContact O-NE2 3.48Å; H929-H1559 VanDerWaalsContact O-NE2 3.12Å; D933-H1559 IonicContact OD1-CD2 3.62Å; D933-H1559 PolarHBondContact OD1-CD2 3.33Å; D933-H1559 IonicContact OD1-CG 3.58Å; D933-H1559 IonicContact OD1-NE2 3.8Å; D933-H1559 PolarHBondContact OD1-NE2 3.16Å; D933-H1559 IonicContact OD2-CD2 3.8Å; D1556-H1559 PolarHBondContact O-CE1 3.17Å; D1556-H1559 PolarHBondContact O-ND1 3.25Å; Y1557-H1559 PolarHBondContact O-N 3.08Å; Y1557-H1559 VanDerWaalsContact O-N 3.15Å; H1559-P1563 VanDerWaalsContact O-CD 3.24Å; H1559-P1563 WeakPolarHBondContact O-CD 3.37Å; H1559-P1563 WeakPolarHBondContact O-CG 3.33Å; H1559-F1697 HydrophobicContact CB-CE1 3.69Å; H1559-F1697 HydrophobicContact CB-CZ 3.6Å
1560I85.5Confident82.4Confident53.6 Ų53.634.4 Ų34.428%0.27518%0.175SC..Hα-helixtrans-105-39.1176.9-44173.4000110.7D933 H936 L1528 Y1557 A1558 A1564D933-I1560 WeakPolarHBondContact OD1-CG1 3.08Å; H936-I1560 HydrophobicContact CB-CD1 4.46Å; L1528-I1560 HydrophobicContact CD1-CB 4.41Å; L1528-I1560 HydrophobicContact CD1-CG2 3.49Å; L1528-I1560 HydrophobicContact CD2-CG2 3.83Å; L1528-I1560 HydrophobicContact CG-CG2 4.31Å; Y1557-I1560 HydrophobicContact CD1-CD1 4.34Å; Y1557-I1560 PolarHBondContact O-N 3.32Å; A1558-I1560 PolarHBondContact O-N 2.97Å; A1558-I1560 VanDerWaalsContact O-N 3.14Å; I1560-A1564 PolarHBondContact O-N 3.17Å
1561I86.7Confident81.6Confident0.6 Ų0.635.6 Ų35.60%0.00318%0.182CC..Hα-helixtrans-76.6-42.2-175.7-63.9172000111.7I1524 L1528 F1531 L1554 Y1557 A1558 A1564 I1565 F1688I1524-I1561 HydrophobicContact CD1-CD1 3.65Å; I1524-I1561 HydrophobicContact CD1-CG1 4.33Å; I1524-I1561 HydrophobicContact CG1-CD1 4.44Å; L1528-I1561 HydrophobicContact CD2-CG1 4.4Å; F1531-I1561 HydrophobicContact CE2-CG2 4.33Å; L1554-I1561 HydrophobicContact CD1-CD1 3.33Å; L1554-I1561 VanDerWaalsContact CD1-CD1 3.47Å; L1554-I1561 HydrophobicContact CD2-CD1 3.95Å; L1554-I1561 HydrophobicContact CG-CD1 3.75Å; Y1557-I1561 PolarHBondContact O-N 3.1Å; Y1557-I1561 VanDerWaalsContact O-N 3.14Å; A1558-I1561 PolarHBondContact O-N 3.15Å; I1561-A1564 WeakPolarHBondContact O-CA 3.43Å; I1561-A1564 WeakPolarHBondContact O-CB 3.36Å; I1561-A1564 PolarHBondContact O-N 3.21Å; I1561-A1564 VanDerWaalsContact O-N 3.11Å; I1561-I1565 HydrophobicContact CG2-CD1 3.67Å; I1561-I1565 HydrophobicContact CG2-CG1 4.2Å; I1561-I1565 WeakPolarHBondContact O-CG1 3.27Å; I1561-I1565 PolarHBondContact O-N 3.15Å; I1561-F1688 HydrophobicContact CG2-CE2 4.23Å; I1561-F1688 HydrophobicContact CG2-CZ 4.36Å
1562V86.7Confident80.7Confident0.6 Ų0.639.1 Ų39.10%0.00420%0.2CC..Hα-helixtrans-61.5-45.5-179173.60000111.7A1558 A1564 I1565 S1566 L1685 F1688 L1694 F1697 I1701A1558-V1562 HydrophobicContact CB-CG2 4.38Å; A1558-V1562 VanDerWaalsContact O-CB 3.25Å; A1558-V1562 WeakPolarHBondContact O-CB 3.25Å; A1558-V1562 VanDerWaalsContact O-CG2 3.26Å; A1558-V1562 WeakPolarHBondContact O-CG2 3.28Å; A1558-V1562 PolarHBondContact O-N 3.09Å; V1562-A1564 VanDerWaalsContact C-N 3.32Å; V1562-A1564 PolarHBondContact O-N 3.12Å; V1562-I1565 PolarHBondContact O-N 3.35Å; V1562-S1566 VanDerWaalsContact O-CB 3.26Å; V1562-S1566 WeakPolarHBondContact O-CB 3.4Å; V1562-S1566 PolarHBondContact O-N 3.36Å; V1562-S1566 PolarHBondContact O-OG 3.43Å; V1562-L1685 HydrophobicContact CG1-CD2 4.46Å; V1562-F1688 HydrophobicContact CG2-CD2 4.42Å; V1562-L1694 HydrophobicContact CG2-CD2 3.91Å; V1562-F1697 HydrophobicContact CG1-CB 3.97Å; V1562-F1697 HydrophobicContact CG1-CG 4.41Å; V1562-I1701 HydrophobicContact CG1-CD1 3.85Å; V1562-I1701 HydrophobicContact CG1-CG1 3.76Å
1563P85.4Confident79.8Confident43.8 Ų43.833.5 Ų33.528%0.28418%0.183SC..Hα-helixtrans-59.2-39.9171.7-20.626.6000113.6H1559 S1566 S1567H1559-P1563 VanDerWaalsContact O-CD 3.24Å; H1559-P1563 WeakPolarHBondContact O-CD 3.37Å; H1559-P1563 WeakPolarHBondContact O-CG 3.33Å; P1563-S1566 PolarHBondContact O-N 3.03Å; P1563-S1567 WeakPolarHBondContact O-CB 3.41Å; P1563-S1567 PolarHBondContact O-N 3.31Å
1564A84.5Confident78.7Confident5 Ų541.5 Ų41.54%0.04122%0.22CC..Hα-helixtrans-63.6-45.9178.800000111.4L1528 F1531 I1560 I1561 V1562 S1566 S1567 L1568L1528-A1564 HydrophobicContact CD2-CB 4.16Å; F1531-A1564 HydrophobicContact CB-CB 4.35Å; F1531-A1564 HydrophobicContact CD2-CB 4.14Å; F1531-A1564 HydrophobicContact CG-CB 4.39Å; I1560-A1564 PolarHBondContact O-N 3.17Å; I1561-A1564 WeakPolarHBondContact O-CA 3.43Å; I1561-A1564 WeakPolarHBondContact O-CB 3.36Å; I1561-A1564 PolarHBondContact O-N 3.21Å; I1561-A1564 VanDerWaalsContact O-N 3.11Å; V1562-A1564 VanDerWaalsContact C-N 3.32Å; V1562-A1564 PolarHBondContact O-N 3.12Å; A1564-S1566 VanDerWaalsContact C-N 3.33Å; A1564-S1566 PolarHBondContact O-N 3.15Å; A1564-S1567 PolarHBondContact O-N 3.21Å; A1564-S1567 PolarHBondContact O-OG 3.18Å; A1564-L1568 PolarHBondContact O-N 3.15Å
1565I86.6Confident77.4Confident0 Ų042.8 Ų42.80%023%0.231CC..Hα-helixtrans-64.1-42.2175-63.1171.3000110.8F1531 L1544 I1561 V1562 S1567 L1568 I1569 C1681 L1685 F1688F1531-I1565 HydrophobicContact CE1-CG1 4.21Å; F1531-I1565 HydrophobicContact CE2-CG1 4.37Å; F1531-I1565 HydrophobicContact CZ-CD1 4.36Å; F1531-I1565 HydrophobicContact CZ-CG1 3.98Å; L1544-I1565 HydrophobicContact CD2-CD1 4.09Å; L1544-I1565 HydrophobicContact CD2-CG1 4.1Å; L1544-I1565 HydrophobicContact CD2-CG2 4.31Å; I1561-I1565 HydrophobicContact CG2-CD1 3.67Å; I1561-I1565 HydrophobicContact CG2-CG1 4.2Å; I1561-I1565 WeakPolarHBondContact O-CG1 3.27Å; I1561-I1565 PolarHBondContact O-N 3.15Å; V1562-I1565 PolarHBondContact O-N 3.35Å; I1565-S1567 VanDerWaalsContact C-N 3.31Å; I1565-S1567 PolarHBondContact O-N 3.15Å; I1565-L1568 WeakPolarHBondContact O-CB 3.34Å; I1565-L1568 PolarHBondContact O-N 3.21Å; I1565-I1569 HydrophobicContact CG2-CD1 4.41Å; I1565-I1569 PolarHBondContact O-N 3.2Å; I1565-C1681 HydrophobicContact CG2-CB 3.94Å; I1565-L1685 HydrophobicContact CB-CD2 4.5Å; I1565-L1685 HydrophobicContact CG2-CD1 4.22Å; I1565-L1685 HydrophobicContact CG2-CD2 4.17Å; I1565-L1685 HydrophobicContact CG2-CG 3.96Å; I1565-F1688 HydrophobicContact CD1-CD2 4.49Å; I1565-F1688 HydrophobicContact CD1-CE2 3.73Å; I1565-F1688 HydrophobicContact CD1-CZ 4.35Å
1566S84.7Confident76.6Confident6.4 Ų6.437.6 Ų37.65%0.04521%0.209CC..Hα-helixtrans-65-33.7179.1-98.70000112.4V1562 P1563 A1564 L1568 I1569 D1570 Q1700 P1704V1562-S1566 VanDerWaalsContact O-CB 3.26Å; V1562-S1566 WeakPolarHBondContact O-CB 3.4Å; V1562-S1566 PolarHBondContact O-N 3.36Å; V1562-S1566 PolarHBondContact O-OG 3.43Å; P1563-S1566 PolarHBondContact O-N 3.03Å; A1564-S1566 VanDerWaalsContact C-N 3.33Å; A1564-S1566 PolarHBondContact O-N 3.15Å; S1566-L1568 VanDerWaalsContact C-N 3.27Å; S1566-L1568 PolarHBondContact O-N 3.35Å; S1566-I1569 WeakPolarHBondContact O-CA 3.32Å; S1566-I1569 WeakPolarHBondContact O-CB 3.3Å; S1566-I1569 PolarHBondContact O-N 3.21Å; S1566-I1569 VanDerWaalsContact O-N 3.1Å; S1566-D1570 PolarHBondContact O-N 3.1Å; S1566-D1570 VanDerWaalsContact O-N 3.16Å; S1566-Q1700 WeakPolarHBondContact CB-O 3.34Å; S1566-Q1700 PolarHBondContact OG-O 3.17Å; S1566-P1704 WeakPolarHBondContact OG-CG 3.39Å
1567S81.9Confident75.9Confident61.2 Ų61.236 Ų3643%0.42820%0.201SC..Hα-helixtrans-65.9-27.617676.20000113.3P1563 A1564 I1565 I1569 D1570 I1571P1563-S1567 WeakPolarHBondContact O-CB 3.41Å; P1563-S1567 PolarHBondContact O-N 3.31Å; A1564-S1567 PolarHBondContact O-N 3.21Å; A1564-S1567 PolarHBondContact O-OG 3.18Å; I1565-S1567 VanDerWaalsContact C-N 3.31Å; I1565-S1567 PolarHBondContact O-N 3.15Å; S1567-I1569 VanDerWaalsContact C-N 3.3Å; S1567-I1569 PolarHBondContact O-N 3.45Å; S1567-D1570 PolarHBondContact O-N 3.19Å; S1567-I1571 WeakPolarHBondContact O-CG1 3.3Å
1568L80.3Confident74.9Confident22 Ų2240.3 Ų40.312%0.11522%0.22CC..Hα-helixtrans-74.6-22.4173.1-63.7172.8000112.8F1531 L1540 A1564 I1565 S1566 I1571F1531-L1568 HydrophobicContact CD1-CD1 3.77Å; F1531-L1568 HydrophobicContact CE1-CD1 4.32Å; L1540-L1568 HydrophobicContact CD2-CD1 4.03Å; A1564-L1568 PolarHBondContact O-N 3.15Å; I1565-L1568 WeakPolarHBondContact O-CB 3.34Å; I1565-L1568 PolarHBondContact O-N 3.21Å; S1566-L1568 VanDerWaalsContact C-N 3.27Å; S1566-L1568 PolarHBondContact O-N 3.35Å; L1568-I1571 HydrophobicContact CD2-CD1 4.5Å
1569I79.7Confident74.1Confident1.6 Ų1.642.3 Ų42.31%0.00823%0.232CC..Hα-helixtrans-82.1-36.2176.2-61.4170.9000110.7I1565 S1566 S1567 I1571 R1678 C1681 L1682 L1685 P1704 I1705 L1708I1565-I1569 HydrophobicContact CG2-CD1 4.41Å; I1565-I1569 PolarHBondContact O-N 3.2Å; S1566-I1569 WeakPolarHBondContact O-CA 3.32Å; S1566-I1569 WeakPolarHBondContact O-CB 3.3Å; S1566-I1569 PolarHBondContact O-N 3.21Å; S1566-I1569 VanDerWaalsContact O-N 3.1Å; S1567-I1569 VanDerWaalsContact C-N 3.3Å; S1567-I1569 PolarHBondContact O-N 3.45Å; I1569-I1571 VanDerWaalsContact C-N 3.28Å; I1569-I1571 PolarHBondContact O-N 2.93Å; I1569-R1678 PolarHBondContact O-NH1 2.85Å; I1569-C1681 HydrophobicContact CD1-CB 3.99Å; I1569-C1681 HydrophobicContact CG1-CB 3.76Å; I1569-C1681 VanDerWaalsContact CG1-CB 3.46Å; I1569-L1682 HydrophobicContact CD1-CD2 3.99Å; I1569-L1682 HydrophobicContact CD1-CG 4.45Å; I1569-L1682 HydrophobicContact CG2-CD2 4.28Å; I1569-L1685 HydrophobicContact CD1-CD1 3.51Å; I1569-L1685 VanDerWaalsContact CD1-CD1 3.44Å; I1569-L1685 HydrophobicContact CD1-CG 4.47Å; I1569-P1704 HydrophobicContact CB-CB 4.48Å; I1569-P1704 HydrophobicContact CG2-CB 4.25Å; I1569-I1705 HydrophobicContact CG2-CG1 4.43Å; I1569-L1708 HydrophobicContact CG2-CD2 3.82Å
1570D74.4Confident73.3Confident36.2 Ų36.238.2 Ų38.219%0.19421%0.213CC..  trans-71.998.9-171.4-155.410.3000113.9S1566 S1567 T1572 P1704 R1707S1566-D1570 PolarHBondContact O-N 3.1Å; S1566-D1570 VanDerWaalsContact O-N 3.16Å; S1567-D1570 PolarHBondContact O-N 3.19Å; D1570-T1572 VanDerWaalsContact C-N 3.32Å; D1570-T1572 HydrophobicContact CB-CG2 4.47Å; D1570-T1572 PolarHBondContact O-N 3.07Å; D1570-T1572 PolarHBondContact O-OG1 3.42Å; D1570-T1572 VanDerWaalsContact O-OG1 3.08Å; D1570-T1572 VanDerWaalsContact OD2-CG2 3.27Å; D1570-T1572 WeakPolarHBondContact OD2-CG2 3.41Å; D1570-P1704 HydrophobicContact CB-CB 4.04Å; D1570-P1704 HydrophobicContact CB-CG 4.16Å; D1570-R1707 WeakPolarHBondContact OD1-CD 3.31Å; D1570-R1707 IonicContact OD1-CZ 3Å; D1570-R1707 IonicContact OD1-NE 2.78Å; D1570-R1707 IonicContact OD1-NH1 2.73Å; D1570-R1707 PolarHBondContact OD1-NH1 3.02Å; D1570-R1707 IonicContact OD2-CZ 2.96Å; D1570-R1707 IonicContact OD2-NH1 3.01Å; D1570-R1707 PolarHBondContact OD2-NH1 3.19Å; D1570-R1707 IonicContact OD2-NH2 2.81Å
1571I66.3Low72.5Confident31.6 Ų31.636.5 Ų36.516%0.16220%0.204CC..  trans-89.590.4174.4-50.9-175.6000108.6S1567 L1568 I1569 S1576 L1577 R1678 L1708 T1711 L1712S1567-I1571 WeakPolarHBondContact O-CG1 3.3Å; L1568-I1571 HydrophobicContact CD2-CD1 4.5Å; I1569-I1571 VanDerWaalsContact C-N 3.28Å; I1569-I1571 PolarHBondContact O-N 2.93Å; I1571-S1576 PolarHBondContact O-OG 3.34Å; I1571-L1577 HydrophobicContact CD1-CD1 3.99Å; I1571-L1577 HydrophobicContact CG2-CB 4.07Å; I1571-L1577 HydrophobicContact CG2-CD1 4.32Å; I1571-R1678 PolarHBondContact O-NH1 3.47Å; I1571-R1678 PolarHBondContact O-NH2 3.06Å; I1571-L1708 HydrophobicContact CD1-CD1 3.23Å; I1571-L1708 HydrophobicContact CD1-CG 4.46Å; I1571-L1708 HydrophobicContact CG1-CD1 3.67Å; I1571-T1711 WeakPolarHBondContact CD1-OG1 3.36Å; I1571-L1712 HydrophobicContact CD1-CG 4.5Å
1572T58.9Low71.4Confident90.6 Ų90.639.8 Ų39.856%0.55622%0.222SC*.  trans-105.4-0.9178.953.50000113.5D1570 R1707D1570-T1572 VanDerWaalsContact C-N 3.32Å; D1570-T1572 HydrophobicContact CB-CG2 4.47Å; D1570-T1572 PolarHBondContact O-N 3.07Å; D1570-T1572 PolarHBondContact O-OG1 3.42Å; D1570-T1572 VanDerWaalsContact O-OG1 3.08Å; D1570-T1572 VanDerWaalsContact OD2-CG2 3.27Å; D1570-T1572 WeakPolarHBondContact OD2-CG2 3.41Å; T1572-R1707 HydrophobicContact CG2-CG 4.48Å
1573S60Low70.4Confident35.6 Ų35.640.8 Ų40.825%0.24923%0.229CC..  trans-106143.9-179.965.40000112.5A1575 S1576 L1577 K1671S1573-A1575 VanDerWaalsContact C-N 3.28Å; S1573-A1575 PolarHBondContact O-N 3.23Å; S1573-A1575 VanDerWaalsContact O-N 3.16Å; S1573-S1576 WeakPolarHBondContact CA-OG 3.36Å; S1573-S1576 PolarHBondContact N-OG 3.09Å; S1573-S1576 WeakPolarHBondContact O-CB 3.33Å; S1573-S1576 PolarHBondContact O-N 3.04Å; S1573-S1576 PolarHBondContact O-OG 3.16Å; S1573-S1576 WeakPolarHBondContact OG-CB 3.36Å; S1573-S1576 PolarHBondContact OG-N 3.33Å; S1573-S1576 PolarHBondContact OG-OG 3.2Å; S1573-L1577 PolarHBondContact O-N 3.05Å; S1573-L1577 VanDerWaalsContact O-N 3.09Å; S1573-K1671 PolarHBondContact OG-NZ 2.93Å
1574E57.4Low69.2Low172.8 Ų172.839 Ų3981%0.80722%0.217SC*.Hα-helixtrans-54.8-36.8178.6-67.3-177.8160.900112.5S1576 L1577 F1578E1574-S1576 VanDerWaalsContact C-N 3.33Å; E1574-S1576 PolarHBondContact O-N 3.25Å; E1574-L1577 WeakPolarHBondContact O-CA 3.34Å; E1574-L1577 WeakPolarHBondContact O-CB 3.3Å; E1574-L1577 PolarHBondContact O-N 3.18Å; E1574-L1577 VanDerWaalsContact O-N 3.13Å; E1574-F1578 PolarHBondContact O-N 3.18Å; E1574-F1578 VanDerWaalsContact O-N 3.13Å
1575A56.5Low67.7Low29.2 Ų29.241.4 Ų41.424%0.24123%0.233CC..Hα-helixtrans-60.5-40.3174.900000113.1S1573 L1577 F1578 V1579 L1668 K1671S1573-A1575 VanDerWaalsContact C-N 3.28Å; S1573-A1575 PolarHBondContact O-N 3.23Å; S1573-A1575 VanDerWaalsContact O-N 3.16Å; A1575-L1577 VanDerWaalsContact C-N 3.31Å; A1575-L1577 PolarHBondContact O-N 3.15Å; A1575-F1578 WeakPolarHBondContact O-CB 3.36Å; A1575-F1578 PolarHBondContact O-N 3.2Å; A1575-V1579 WeakPolarHBondContact O-CG2 3.31Å; A1575-V1579 PolarHBondContact O-N 3.02Å; A1575-V1579 VanDerWaalsContact O-N 3.11Å; A1575-L1668 HydrophobicContact CB-CD1 4.26Å; A1575-L1668 HydrophobicContact CB-CD2 3.68Å; A1575-L1668 VanDerWaalsContact CB-CD2 3.48Å; A1575-L1668 HydrophobicContact CB-CG 3.83Å; A1575-K1671 HydrophobicContact CB-CD 3.95Å
1576S61.6Low66Low8.4 Ų8.448.3 Ų48.36%0.05927%0.266CS..Hα-helixtrans-72.4-25.9177.9570000112.7I1571 S1573 E1574 L1580 R1678I1571-S1576 PolarHBondContact O-OG 3.34Å; S1573-S1576 WeakPolarHBondContact CA-OG 3.36Å; S1573-S1576 PolarHBondContact N-OG 3.09Å; S1573-S1576 WeakPolarHBondContact O-CB 3.33Å; S1573-S1576 PolarHBondContact O-N 3.04Å; S1573-S1576 PolarHBondContact O-OG 3.16Å; S1573-S1576 WeakPolarHBondContact OG-CB 3.36Å; S1573-S1576 PolarHBondContact OG-N 3.33Å; S1573-S1576 PolarHBondContact OG-OG 3.2Å; E1574-S1576 VanDerWaalsContact C-N 3.33Å; E1574-S1576 PolarHBondContact O-N 3.25Å; S1576-L1580 VanDerWaalsContact O-CB 3.3Å; S1576-L1580 WeakPolarHBondContact O-CB 3.33Å; S1576-L1580 WeakPolarHBondContact O-CG 3.39Å; S1576-L1580 PolarHBondContact O-N 2.99Å; S1576-L1580 VanDerWaalsContact O-N 3.16Å; S1576-R1678 PolarHBondContact O-NH2 3.46Å
1577L66Low64.2Low33 Ų3350.8 Ų50.817%0.17328%0.278CS..Hα-helixtrans-71.2-40.6170.7-152.5108.4000110.7I1571 S1573 E1574 A1575 L1580 L1581 L1712I1571-L1577 HydrophobicContact CD1-CD1 3.99Å; I1571-L1577 HydrophobicContact CG2-CB 4.07Å; I1571-L1577 HydrophobicContact CG2-CD1 4.32Å; S1573-L1577 PolarHBondContact O-N 3.05Å; S1573-L1577 VanDerWaalsContact O-N 3.09Å; E1574-L1577 WeakPolarHBondContact O-CA 3.34Å; E1574-L1577 WeakPolarHBondContact O-CB 3.3Å; E1574-L1577 PolarHBondContact O-N 3.18Å; E1574-L1577 VanDerWaalsContact O-N 3.13Å; A1575-L1577 VanDerWaalsContact C-N 3.31Å; A1575-L1577 PolarHBondContact O-N 3.15Å; L1577-L1580 WeakPolarHBondContact O-CB 3.48Å; L1577-L1580 PolarHBondContact O-N 3.11Å; L1577-L1581 HydrophobicContact CD1-CD1 4.39Å; L1577-L1581 HydrophobicContact CD2-CD1 4.08Å; L1577-L1581 HydrophobicContact CD2-CG 4.02Å; L1577-L1581 HydrophobicContact CG-CD1 4.18Å; L1577-L1581 WeakPolarHBondContact O-CB 3.32Å; L1577-L1581 WeakPolarHBondContact O-CG 3.35Å; L1577-L1581 PolarHBondContact O-N 3.02Å; L1577-L1581 VanDerWaalsContact O-N 3.07Å; L1577-L1712 HydrophobicContact CD1-CD2 4.06Å; L1577-L1712 HydrophobicContact CD2-CD2 4.18Å
1578F62.8Low62.2Low122.6 Ų122.650.7 Ų50.754%0.53828%0.277SS..Hα-helixtrans-62.2-46176-174.3-103.8000112.4E1574 A1575 L1580 L1581 N1582E1574-F1578 PolarHBondContact O-N 3.18Å; E1574-F1578 VanDerWaalsContact O-N 3.13Å; A1575-F1578 WeakPolarHBondContact O-CB 3.36Å; A1575-F1578 PolarHBondContact O-N 3.2Å; F1578-L1580 VanDerWaalsContact C-N 3.32Å; F1578-L1580 PolarHBondContact O-N 3.31Å; F1578-L1581 PolarHBondContact O-N 3.23Å; F1578-N1582 VanDerWaalsContact CD1-ND2 3.33Å; F1578-N1582 WeakPolarHBondContact CD1-ND2 3.29Å; F1578-N1582 WeakPolarHBondContact CE1-ND2 3.33Å; F1578-N1582 VanDerWaalsContact CZ-ND2 3.35Å; F1578-N1582 WeakPolarHBondContact CZ-ND2 3.3Å; F1578-N1582 WeakPolarHBondContact O-CB 3.39Å; F1578-N1582 VanDerWaalsContact O-CG 3.29Å; F1578-N1582 PolarHBondContact O-N 3.26Å; F1578-N1582 PolarHBondContact O-ND2 2.89Å
1579V65.6Low60Low46.6 Ų46.654 Ų5428%0.28230%0.302SS..Hα-helixtrans-60.6-42.7175.2173.80000111.4A1575 L1581 N1582 S1583 K1671A1575-V1579 WeakPolarHBondContact O-CG2 3.31Å; A1575-V1579 PolarHBondContact O-N 3.02Å; A1575-V1579 VanDerWaalsContact O-N 3.11Å; V1579-L1581 PolarHBondContact O-N 2.91Å; V1579-N1582 PolarHBondContact O-N 3.17Å; V1579-S1583 WeakPolarHBondContact O-CB 3.26Å; V1579-S1583 PolarHBondContact O-N 3.11Å; V1579-S1583 VanDerWaalsContact O-N 3.1Å; V1579-S1583 PolarHBondContact O-OG 2.98Å; V1579-K1671 HydrophobicContact CG2-CB 4.49Å
1580L67.3Low57.8Low0.6 Ų0.657.9 Ų57.90%0.00333%0.33CS..Hα-helixtrans-58.5-51.1175.8-164.5159.6000111.3S1576 L1577 F1578 N1582 S1583 V1584 G1673 V1675 L1708 L1712 A1745 L1749S1576-L1580 VanDerWaalsContact O-CB 3.3Å; S1576-L1580 WeakPolarHBondContact O-CB 3.33Å; S1576-L1580 WeakPolarHBondContact O-CG 3.39Å; S1576-L1580 PolarHBondContact O-N 2.99Å; S1576-L1580 VanDerWaalsContact O-N 3.16Å; L1577-L1580 WeakPolarHBondContact O-CB 3.48Å; L1577-L1580 PolarHBondContact O-N 3.11Å; F1578-L1580 VanDerWaalsContact C-N 3.32Å; F1578-L1580 PolarHBondContact O-N 3.31Å; L1580-N1582 VanDerWaalsContact C-N 3.33Å; L1580-N1582 PolarHBondContact O-N 3.1Å; L1580-S1583 PolarHBondContact O-N 3.06Å; L1580-S1583 PolarHBondContact O-OG 3.06Å; L1580-V1584 HydrophobicContact CD2-CG2 4.35Å; L1580-V1584 WeakPolarHBondContact O-CG2 2.98Å; L1580-V1584 PolarHBondContact O-N 3.32Å; L1580-G1673 WeakPolarHBondContact CD2-O 3.48Å; L1580-V1675 HydrophobicContact CD1-CG2 4.07Å; L1580-V1675 HydrophobicContact CD2-CB 4.4Å; L1580-V1675 HydrophobicContact CD2-CG2 3.83Å; L1580-V1675 HydrophobicContact CG-CG2 3.78Å; L1580-L1708 HydrophobicContact CD1-CD1 4.37Å; L1580-L1712 HydrophobicContact CD1-CD2 4.44Å; L1580-L1712 HydrophobicContact CD2-CD2 4.03Å; L1580-A1745 HydrophobicContact CD2-CB 3.63Å; L1580-A1745 VanDerWaalsContact CD2-CB 3.46Å; L1580-L1749 HydrophobicContact CD1-CD1 4.3Å
1581L68.3Low55.7Low18 Ų1862.2 Ų62.29%0.09435%0.352CS..Hα-helixtrans-66.7-35.4-176.2-66.9172.9000112.4L1577 F1578 V1579 V1584 S1585 L1712 Y1719 A1741 C1742L1577-L1581 HydrophobicContact CD1-CD1 4.39Å; L1577-L1581 HydrophobicContact CD2-CD1 4.08Å; L1577-L1581 HydrophobicContact CD2-CG 4.02Å; L1577-L1581 HydrophobicContact CG-CD1 4.18Å; L1577-L1581 WeakPolarHBondContact O-CB 3.32Å; L1577-L1581 WeakPolarHBondContact O-CG 3.35Å; L1577-L1581 PolarHBondContact O-N 3.02Å; L1577-L1581 VanDerWaalsContact O-N 3.07Å; F1578-L1581 PolarHBondContact O-N 3.23Å; V1579-L1581 PolarHBondContact O-N 2.91Å; L1581-V1584 WeakPolarHBondContact O-CB 3.4Å; L1581-V1584 PolarHBondContact O-N 3.22Å; L1581-S1585 PolarHBondContact O-N 2.99Å; L1581-L1712 HydrophobicContact CD2-CD2 4.35Å; L1581-Y1719 HydrophobicContact CD1-CE2 4.31Å; L1581-A1741 HydrophobicContact CB-CB 4.26Å; L1581-A1741 HydrophobicContact CD2-CB 3.85Å; L1581-A1741 HydrophobicContact CG-CB 4.48Å; L1581-C1742 HydrophobicContact CD2-CB 4.32Å; L1581-C1742 VanDerWaalsContact CD2-SG 3.54Å; L1581-C1742 WeakPolarHBondContact CD2-SG 3.35Å
1582N65.3Low53.9Low70.2 Ų70.270.6 Ų70.638%0.37538%0.384SS..Hα-helixtrans-68.3-39.4175.7-70.6-17.1000112.3F1578 V1579 L1580 V1584 S1585 E1586F1578-N1582 VanDerWaalsContact CD1-ND2 3.33Å; F1578-N1582 WeakPolarHBondContact CD1-ND2 3.29Å; F1578-N1582 WeakPolarHBondContact CE1-ND2 3.33Å; F1578-N1582 VanDerWaalsContact CZ-ND2 3.35Å; F1578-N1582 WeakPolarHBondContact CZ-ND2 3.3Å; F1578-N1582 WeakPolarHBondContact O-CB 3.39Å; F1578-N1582 VanDerWaalsContact O-CG 3.29Å; F1578-N1582 PolarHBondContact O-N 3.26Å; F1578-N1582 PolarHBondContact O-ND2 2.89Å; V1579-N1582 PolarHBondContact O-N 3.17Å; L1580-N1582 VanDerWaalsContact C-N 3.33Å; L1580-N1582 PolarHBondContact O-N 3.1Å; N1582-V1584 PolarHBondContact O-N 3.16Å; N1582-V1584 VanDerWaalsContact O-N 3.12Å; N1582-S1585 VanDerWaalsContact O-CB 3.28Å; N1582-S1585 WeakPolarHBondContact O-CB 3.42Å; N1582-S1585 PolarHBondContact O-N 3.1Å; N1582-S1585 VanDerWaalsContact O-N 3.08Å; N1582-S1585 PolarHBondContact O-OG 3.1Å; N1582-E1586 PolarHBondContact O-N 3.27Å
1583S64.8Low52.4Low21.6 Ų21.673.9 Ų73.915%0.15140%0.396CS..Hα-helixtrans-61-22.617869.60000113.6V1579 L1580 I1587 S1674 V1675V1579-S1583 WeakPolarHBondContact O-CB 3.26Å; V1579-S1583 PolarHBondContact O-N 3.11Å; V1579-S1583 VanDerWaalsContact O-N 3.1Å; V1579-S1583 PolarHBondContact O-OG 2.98Å; L1580-S1583 PolarHBondContact O-N 3.06Å; L1580-S1583 PolarHBondContact O-OG 3.06Å; S1583-I1587 WeakPolarHBondContact O-CD1 3.19Å; S1583-I1587 WeakPolarHBondContact O-CG1 3.32Å; S1583-S1674 VanDerWaalsContact CB-CB 3.49Å; S1583-S1674 WeakPolarHBondContact OG-CA 3.36Å; S1583-V1675 WeakPolarHBondContact OG-CG2 3.24Å; S1583-V1675 PolarHBondContact OG-N 3.37Å; S1583-V1675 VanDerWaalsContact OG-N 3.16Å
1584V61.2Low50.8Low6.6 Ų6.677.8 Ų77.84%0.0442%0.419CS..Hα-helixtrans-80.1-30175.3178.60000112.5L1580 L1581 N1582 E1586 I1587 S1588 V1675 A1741 N1744 A1745L1580-V1584 HydrophobicContact CD2-CG2 4.35Å; L1580-V1584 WeakPolarHBondContact O-CG2 2.98Å; L1580-V1584 PolarHBondContact O-N 3.32Å; L1581-V1584 WeakPolarHBondContact O-CB 3.4Å; L1581-V1584 PolarHBondContact O-N 3.22Å; N1582-V1584 PolarHBondContact O-N 3.16Å; N1582-V1584 VanDerWaalsContact O-N 3.12Å; V1584-E1586 VanDerWaalsContact C-N 3.28Å; V1584-E1586 PolarHBondContact O-N 3.05Å; V1584-I1587 WeakPolarHBondContact O-CB 3.29Å; V1584-I1587 PolarHBondContact O-N 3.22Å; V1584-I1587 VanDerWaalsContact O-N 3.16Å; V1584-S1588 PolarHBondContact O-N 3.03Å; V1584-S1588 PolarHBondContact O-OG 3.22Å; V1584-S1588 VanDerWaalsContact O-OG 3.11Å; V1584-V1675 HydrophobicContact CG2-CB 4.22Å; V1584-V1675 HydrophobicContact CG2-CG2 3.51Å; V1584-V1675 VanDerWaalsContact CG2-CG2 3.41Å; V1584-A1741 HydrophobicContact CB-CB 4.43Å; V1584-A1741 HydrophobicContact CG1-CB 4.44Å; V1584-N1744 HydrophobicContact CG1-CB 3.48Å; V1584-N1744 VanDerWaalsContact CG1-CB 3.43Å; V1584-A1745 HydrophobicContact CG2-CB 4.17Å
1585S51.9Low49.2Very low54.2 Ų54.275.3 Ų75.338%0.37942%0.415SS..Hα-helixtrans-69.7-32.7-178109.10000112.4L1581 N1582 I1587 S1588 S1589L1581-S1585 PolarHBondContact O-N 2.99Å; N1582-S1585 VanDerWaalsContact O-CB 3.28Å; N1582-S1585 WeakPolarHBondContact O-CB 3.42Å; N1582-S1585 PolarHBondContact O-N 3.1Å; N1582-S1585 VanDerWaalsContact O-N 3.08Å; N1582-S1585 PolarHBondContact O-OG 3.1Å; S1585-I1587 VanDerWaalsContact C-N 3.32Å; S1585-I1587 PolarHBondContact O-N 3.15Å; S1585-S1588 WeakPolarHBondContact O-CB 3.2Å; S1585-S1588 PolarHBondContact O-N 3.29Å; S1585-S1588 VanDerWaalsContact O-N 3.1Å; S1585-S1589 PolarHBondContact O-N 3.29Å; S1585-S1589 VanDerWaalsContact O-N 3.13Å; S1585-S1589 PolarHBondContact O-OG 2.96Å; S1585-S1589 VanDerWaalsContact O-OG 3.05Å
1586E50.8Low47.7Very low146.2 Ų146.280.6 Ų80.668%0.68345%0.445SS*.Hα-helixtrans-66.7-32.8176.1-66-177.5172.200112.4N1582 V1584 S1588 S1589 S1590N1582-E1586 PolarHBondContact O-N 3.27Å; V1584-E1586 VanDerWaalsContact C-N 3.28Å; V1584-E1586 PolarHBondContact O-N 3.05Å; E1586-S1588 VanDerWaalsContact C-N 3.29Å; E1586-S1588 PolarHBondContact O-N 3.1Å; E1586-S1589 PolarHBondContact O-N 3.09Å; E1586-S1589 VanDerWaalsContact O-N 3.08Å; E1586-S1589 PolarHBondContact O-OG 3.45Å; E1586-S1590 PolarHBondContact O-N 3.19Å; E1586-S1590 PolarHBondContact O-OG 3.14Å; E1586-S1590 VanDerWaalsContact O-OG 3.06Å
1587I46.9Very low46Very low58.2 Ų58.286.1 Ų86.130%0.29848%0.478SS..Hα-helixtrans-67-30175.7-55.3170.5000111.2S1583 V1584 S1585 S1589 S1590 N1591S1583-I1587 WeakPolarHBondContact O-CD1 3.19Å; S1583-I1587 WeakPolarHBondContact O-CG1 3.32Å; V1584-I1587 WeakPolarHBondContact O-CB 3.29Å; V1584-I1587 PolarHBondContact O-N 3.22Å; V1584-I1587 VanDerWaalsContact O-N 3.16Å; S1585-I1587 VanDerWaalsContact C-N 3.32Å; S1585-I1587 PolarHBondContact O-N 3.15Å; I1587-S1589 VanDerWaalsContact C-N 3.33Å; I1587-S1590 PolarHBondContact O-N 3.39Å; I1587-S1590 PolarHBondContact O-OG 3.11Å; I1587-S1590 VanDerWaalsContact O-OG 3.09Å; I1587-N1591 PolarHBondContact O-ND2 2.96Å
1588S39.5Very low44Very low58.2 Ų58.290.7 Ų90.741%0.40751%0.508SS..Hα-helixtrans-78.3-24.5179-57.60000112.8V1584 S1585 E1586 N1744V1584-S1588 PolarHBondContact O-N 3.03Å; V1584-S1588 PolarHBondContact O-OG 3.22Å; V1584-S1588 VanDerWaalsContact O-OG 3.11Å; S1585-S1588 WeakPolarHBondContact O-CB 3.2Å; S1585-S1588 PolarHBondContact O-N 3.29Å; S1585-S1588 VanDerWaalsContact O-N 3.1Å; E1586-S1588 VanDerWaalsContact C-N 3.29Å; E1586-S1588 PolarHBondContact O-N 3.1Å; S1588-N1744 PolarHBondContact OG-ND2 3.2Å
1589S35Very low42.2Very low91 Ų9191.4 Ų91.464%0.63652%0.522SS*.Hα-helixtrans-82-22.6-179.4-40.40000113.4S1585 E1586 I1587 N1591S1585-S1589 PolarHBondContact O-N 3.29Å; S1585-S1589 VanDerWaalsContact O-N 3.13Å; S1585-S1589 PolarHBondContact O-OG 2.96Å; S1585-S1589 VanDerWaalsContact O-OG 3.05Å; E1586-S1589 PolarHBondContact O-N 3.09Å; E1586-S1589 VanDerWaalsContact O-N 3.08Å; E1586-S1589 PolarHBondContact O-OG 3.45Å; I1587-S1589 VanDerWaalsContact C-N 3.33Å; S1589-N1591 VanDerWaalsContact C-N 3.31Å; S1589-N1591 PolarHBondContact O-N 3.29Å
1590S33.8Very low40.2Very low84.6 Ų84.693.3 Ų93.359%0.59254%0.543SS*.THydrogen-bonded Turntrans-83.2-9.4-17839.10000114.5E1586 I1587E1586-S1590 PolarHBondContact O-N 3.19Å; E1586-S1590 PolarHBondContact O-OG 3.14Å; E1586-S1590 VanDerWaalsContact O-OG 3.06Å; I1587-S1590 PolarHBondContact O-N 3.39Å; I1587-S1590 PolarHBondContact O-OG 3.11Å; I1587-S1590 VanDerWaalsContact O-OG 3.09Å
1591N30.6Very low38.2Very low125.8 Ų125.899.2 Ų99.267%0.67358%0.579SS**THydrogen-bonded Turntrans-97.78.2-177.8-78.8-25.6000115.3I1587 S1589I1587-N1591 PolarHBondContact O-ND2 2.96Å; S1589-N1591 VanDerWaalsContact C-N 3.31Å; S1589-N1591 PolarHBondContact O-N 3.29Å
1592Y28.1Very low36.1Very low209.6 Ų209.6104.2 Ų104.282%0.82261%0.611SS**  trans-110.932.6178.3-83.4-76.8000114.4
1593I28Very low34.2Very low159 Ų159106.5 Ų106.582%0.81563%0.627SS**  trans-125.577.8160.6-53.5178.4000108.2
1594T24.9Very low32.3Very low118 Ų118110.9 Ų110.972%0.72465%0.654SS**  trans-144.1125.5159.2-70000111.2
1595T24.7Very low30.5Very low120 Ų120116.7 Ų116.774%0.73669%0.69SS**  trans79.191.8156.152.70000117.1T1597T1595-T1597 PolarHBondContact O-N 3.15Å
1596T24.5Very low29.2Very low140 Ų140118.9 Ų118.986%0.85971%0.705SS**  trans-124.698.6131.1330000109.6
1597T25.4Very low27.9Very low124.4 Ų124.4118 Ų11876%0.76371%0.71SS**  175.4111127.829.70000112.3T1595T1595-T1597 PolarHBondContact O-N 3.15Å
1598T25.1Very low26.8Very low130 Ų130120.2 Ų120.280%0.79873%0.73SS**  trans-72.9123.5147.838.10000111.8
1599T24.7Very low26.1Very low135.6 Ų135.6123.4 Ų123.483%0.83275%0.747SS**  122.1106.7109.850.70000113.5
1600A24.2Very low25.6Very low88.4 Ų88.4123.8 Ų123.873%0.73175%0.75SS**  trans-125.9114.5147.200000112.8
1601T24.9Very low25.2Very low123.2 Ų123.2128.5 Ų128.576%0.75676%0.762SS**  54.6123.9116.5530000117.1
1602T24.7Very low24.9Very low122.4 Ų122.4127.8 Ų127.875%0.75177%0.767SS**  trans81.6116.4143.743.90000116.6
1603T24.6Very low24.8Very low118.8 Ų118.8122.4 Ų122.473%0.72977%0.766SS**  134.8134.8106.3380000113
1604T24.2Very low24.6Very low115.6 Ų115.6123.2 Ų123.271%0.70977%0.768SS**  53.4124.4127.1490000117.2
1605T24.1Very low24.9Very low128.4 Ų128.4122.6 Ų122.679%0.78877%0.767SS**  98.6130.5128.844.50000116.1
1606S24.6Very low24.9Very low99.6 Ų99.6124.3 Ų124.370%0.69777%0.771SS**  102112.1127.562.30000113.8
1607T23.7Very low24.9Very low128 Ų128122.5 Ų122.579%0.78576%0.764SS**  62.1131.8118.649.60000115.8
1608S23.8Very low24.9Very low102.8 Ų102.8126.1 Ų126.172%0.71977%0.769SS**  114.7131.9124.457.70000116.8
1609T24.5Very low24.9Very low126 Ų126124.7 Ų124.777%0.77377%0.765SS**  trans46.8118.814247.20000118.9
1610S24.3Very low24.9Very low100.6 Ų100.6126.5 Ų126.570%0.70376%0.763SS**  105.9133.8119.961.40000115.6
1611H25.6Very low24.9Very low182.2 Ų182.2129.8 Ų129.884%0.84477%0.768SS**  trans-114140.3143.8-81.2-76.1000112.5
1612S24Very low24.9Very low111.8 Ų111.8130.2 Ų130.278%0.78277%0.766SS**  trans140.2143.913460.90000115.6
1613A25.5Very low25Very low95.4 Ų95.4130.2 Ų130.279%0.78877%0.765SS**  trans93.4109.815700000116.6
1614M24Very low25Very low176.8 Ų176.8131.6 Ų131.687%0.87177%0.769SS**  trans-41.1156.8139.1-83-93.1-17700112.9
1615P31.5Very low25.2Very low105.6 Ų105.6132 Ų13269%0.68677%0.771SS**  -128.5166.979.332.8-16.4000113.7
1616N25Very low25.4Very low155.4 Ų155.4132.7 Ų132.783%0.83177%0.769SS**  trans-28.6132.7162.8-78-26.2000114.4
1617S24.7Very low25.5Very low101 Ų101134.4 Ų134.471%0.70677%0.769SS**  -153.3132.211854.70000110.4S1619S1617-S1619 PolarHBondContact O-N 3.07Å
1618K24.8Very low25.8Very low201.2 Ų201.2133.8 Ų133.888%0.87576%0.761SS**  trans12.4125.1159.7-70.5172.9178.3178.50113.7
1619S25.1Very low26.2Very low100.8 Ų100.8133 Ų13371%0.70576%0.756SS**  -179.2124.7104.457.20000112.6S1617S1617-S1619 PolarHBondContact O-N 3.07Å
1620Q24.4Very low26.4Very low171.8 Ų171.8133.5 Ų133.580%0.80375%0.753SS**  -62.8131.7120.8-75.4176.1-72.400112.9D1622Q1620-D1622 PolarHBondContact O-N 3.16Å
1621L25.3Very low26.8Very low159.4 Ų159.4135.1 Ų135.184%0.83575%0.753SS**  trans-152.1118.1130.7-104.4146.7000107.4
1622D24.1Very low26.9Very low131.6 Ų131.6133.3 Ų133.370%0.70475%0.748SS**  trans-31.9120.1156.5-66.6-29.2000112Q1620 D1624Q1620-D1622 PolarHBondContact O-N 3.16Å; D1622-D1624 PolarHBondContact O-N 3.42Å
1623T26.1Very low27Very low120.8 Ų120.8133 Ų13374%0.74175%0.746SS**  -145.7119127.642.50000110.8T1625T1623-T1625 VanDerWaalsContact C-N 3.25Å; T1623-T1625 PolarHBondContact O-N 3.35Å
1624D25.9Very low27Very low149.4 Ų149.4133.4 Ų133.480%0.79974%0.743SS**  trans-80.4111.9167.6-66.4-33.7000112.3D1622 I1626D1622-D1624 PolarHBondContact O-N 3.42Å; D1624-I1626 PolarHBondContact O-N 2.82Å
1625T27.2Very low27.2Very low122.8 Ų122.8131 Ų13175%0.75374%0.739SS**  trans-91.3116.6143.237.60000111.9T1623 D1627T1623-T1625 VanDerWaalsContact C-N 3.25Å; T1623-T1625 PolarHBondContact O-N 3.35Å; T1625-D1627 PolarHBondContact O-N 3.24Å
1626I29.4Very low27Very low144.4 Ų144.4131.2 Ų131.274%0.74174%0.739SS**  trans-44.5106.8157.2-55.2171.9000112.4D1624 L1628 K1733D1624-I1626 PolarHBondContact O-N 2.82Å; I1626-L1628 PolarHBondContact O-N 3.25Å; I1626-L1628 VanDerWaalsContact O-N 3.17Å; I1626-K1733 HydrophobicContact CD1-CB 4.41Å
1627D27.5Very low27Very low133.8 Ų133.8132 Ų13272%0.71674%0.738SS**  trans-84.9121.1164.3-102.8-28.2000111.4T1625 S1629 N1630T1625-D1627 PolarHBondContact O-N 3.24Å; D1627-S1629 VanDerWaalsContact C-N 3.29Å; D1627-S1629 PolarHBondContact O-N 3.22Å; D1627-S1629 VanDerWaalsContact O-N 3.08Å; D1627-N1630 PolarHBondContact O-N 3.36Å
1628L30Very low27.1Very low116.8 Ų116.8133.8 Ų133.861%0.61274%0.74SS**  trans-86.222-179.5-87.5151.8000114.1I1626 N1630 Y1719I1626-L1628 PolarHBondContact O-N 3.25Å; I1626-L1628 VanDerWaalsContact O-N 3.17Å; L1628-N1630 VanDerWaalsContact C-N 3.32Å; L1628-N1630 PolarHBondContact O-N 3.16Å; L1628-Y1719 HydrophobicContact CD2-CE1 4.11Å
1629S30.7Very low27.2Very low86.4 Ų86.4131 Ų13160%0.60474%0.735SS**THydrogen-bonded Turntrans-90.8-5.2177.150.20000114.6D1627 I1631 L1632D1627-S1629 VanDerWaalsContact C-N 3.29Å; D1627-S1629 PolarHBondContact O-N 3.22Å; D1627-S1629 VanDerWaalsContact O-N 3.08Å; S1629-I1631 VanDerWaalsContact C-N 3.3Å; S1629-I1631 PolarHBondContact O-N 3.2Å; S1629-L1632 PolarHBondContact O-N 3.11Å
1630N29.6Very low27.1Very low135.8 Ų135.8131.8 Ų131.873%0.72674%0.739SS**THydrogen-bonded Turntrans-10124.9-171.9-83-18.3000115.3D1627 L1628D1627-N1630 PolarHBondContact O-N 3.36Å; L1628-N1630 VanDerWaalsContact C-N 3.32Å; L1628-N1630 PolarHBondContact O-N 3.16Å
1631I31.4Very low27.2Very low134.6 Ų134.6129.5 Ų129.569%0.6974%0.737SS**SBendtrans-116.73.4173.9-67.4172000111.7S1629S1629-I1631 VanDerWaalsContact C-N 3.3Å; S1629-I1631 PolarHBondContact O-N 3.2Å
1632L28.6Very low27.1Very low143.2 Ų143.2126.7 Ų126.775%0.7573%0.731SS**SBendtrans-103.732.6166.6-85.3124.9000114.1S1629 S1634S1629-L1632 PolarHBondContact O-N 3.11Å; L1632-S1634 VanDerWaalsContact C-N 3.34Å; L1632-S1634 PolarHBondContact O-N 3.29Å
1633S26.7Very low27.2Very low105.8 Ų105.8126.4 Ų126.474%0.7473%0.734SS**  trans-102.749.3164.767.90000114V1635S1633-V1635 VanDerWaalsContact C-N 3.34Å
1634S25.8Very low27.2Very low103.2 Ų103.2127.3 Ų127.372%0.72273%0.734SS**  trans-135.188.4166.163.60000111.1L1632 P1636L1632-S1634 VanDerWaalsContact C-N 3.34Å; L1632-S1634 PolarHBondContact O-N 3.29Å; S1634-P1636 WeakPolarHBondContact O-CD 3.49Å
1635V26.9Very low27.2Very low128.2 Ų128.2126.6 Ų126.678%0.77773%0.73SS**  trans-164.3117.2143.1-177.40000109.6S1633 E1637S1633-V1635 VanDerWaalsContact C-N 3.34Å; V1635-E1637 HydrophobicContact CG1-CG 4.49Å; V1635-E1637 PolarHBondContact O-N 3.12Å
1636P27.9Very low27.2Very low107.8 Ų107.8126.3 Ų126.370%0.773%0.728SS**  trans-104.4153.6-158.833.1-21.2000111.2S1634 N1638S1634-P1636 WeakPolarHBondContact O-CD 3.49Å; P1636-N1638 PolarHBondContact O-N 2.9Å
1637E24.3Very low27Very low172.2 Ų172.2126.5 Ų126.581%0.80573%0.731SS**  trans-65109.9162-73.7172.8176.300113.3V1635 N1639V1635-E1637 HydrophobicContact CG1-CG 4.49Å; V1635-E1637 PolarHBondContact O-N 3.12Å; E1637-N1639 VanDerWaalsContact C-N 3.33Å; E1637-N1639 PolarHBondContact O-N 3.47Å; E1637-N1639 VanDerWaalsContact O-N 3.08Å
1638N27.5Very low26.9Very low140.6 Ų140.6126.2 Ų126.275%0.75273%0.734SS**  trans-128.3127.3147.8-86.9-34.5000112.3P1636 C1640P1636-N1638 PolarHBondContact O-N 2.9Å; N1638-C1640 PolarHBondContact O-N 3.27Å; N1638-C1640 VanDerWaalsContact O-N 3.1Å
1639N27.1Very low26.7Very low142.4 Ų142.4124.1 Ų124.176%0.76174%0.74SS**  trans16.1105.9154.8-72.3-24.6000115.4E1637 T1641E1637-N1639 VanDerWaalsContact C-N 3.33Å; E1637-N1639 PolarHBondContact O-N 3.47Å; E1637-N1639 VanDerWaalsContact O-N 3.08Å; N1639-T1641 VanDerWaalsContact C-N 3.25Å; N1639-T1641 PolarHBondContact O-N 3.15Å
1640C22.7Very low26.4Very low117.2 Ų117.2125.8 Ų125.879%0.79275%0.746SS**  10.8115.7116.2-68.80000113.4N1638N1638-C1640 PolarHBondContact O-N 3.27Å; N1638-C1640 VanDerWaalsContact O-N 3.1Å
1641T25.3Very low26.1Very low122.4 Ų122.4125.8 Ų125.875%0.75175%0.745SS**  trans177.6112.5136.2480000113.4N1639 T1643N1639-T1641 VanDerWaalsContact C-N 3.25Å; N1639-T1641 PolarHBondContact O-N 3.15Å; T1641-T1643 PolarHBondContact O-N 3.42Å
1642S24.7Very low25.8Very low101 Ų101127.3 Ų127.371%0.70675%0.749SS**  trans47.7121.3138.161.20000117.5
1643T26.2Very low25.6Very low125.4 Ų125.4126.7 Ų126.777%0.76975%0.751SS**  -173.5121.510544.40000111.1T1641 D1645T1641-T1643 PolarHBondContact O-N 3.42Å; T1643-D1645 PolarHBondContact O-N 3.38Å
1644N26.2Very low25.5Very low139.6 Ų139.6126.8 Ų126.875%0.74775%0.752SS**  trans-9.7129.4131.6-72.2-21.2000114.4
1645D25.8Very low25.4Very low135.2 Ų135.2129.1 Ų129.172%0.72376%0.756SS**  156.5103.8127.1-79.3-20.5000114.7T1643 N1647T1643-D1645 PolarHBondContact O-N 3.38Å; D1645-N1647 PolarHBondContact O-N 3.2Å
1646T26.6Very low25.3Very low115.8 Ų115.8129.5 Ų129.571%0.7176%0.759SS**  50.7108.4124.656.40000116.8V1648T1646-V1648 PolarHBondContact O-N 3.31Å
1647N25.4Very low25.1Very low148.2 Ų148.2129.2 Ų129.279%0.79376%0.76SS**  trans120.2105.4141.6-84.1-17.5000116.4D1645 G1649D1645-N1647 PolarHBondContact O-N 3.2Å; N1647-G1649 VanDerWaalsContact C-N 3.35Å; N1647-G1649 PolarHBondContact O-N 3.06Å
1648V26.1Very low25.1Very low129.2 Ų129.2127.2 Ų127.278%0.78376%0.76SS**  trans26.8107.9143.9179.40000113.5T1646 V1650T1646-V1648 PolarHBondContact O-N 3.31Å; V1648-V1650 PolarHBondContact O-N 3.13Å; V1648-V1650 VanDerWaalsContact O-N 3.14Å
1649G25.1Very low25.1Very low71.2 Ų71.2126.8 Ų126.873%0.73476%0.762SS**  trans-101.5112.5159.900000112.9N1647N1647-G1649 VanDerWaalsContact C-N 3.35Å; N1647-G1649 PolarHBondContact O-N 3.06Å
1650V24.2Very low25.2Very low122.4 Ų122.4125.5 Ų125.574%0.74276%0.761SS**  trans-103.7128.1151.6166.80000110.8V1648V1648-V1650 PolarHBondContact O-N 3.13Å; V1648-V1650 VanDerWaalsContact O-N 3.14Å
1651I24.2Very low25.3Very low135.6 Ų135.6127.9 Ų127.970%0.69577%0.766SS**  trans98.3122.1135.1-67.9171.3000117.7T1653I1651-T1653 HydrophobicContact CG2-CG2 4.02Å
1652Q24.8Very low25.3Very low166.8 Ų166.8125.4 Ų125.478%0.77976%0.764SS**  trans93115.5138.3-77.4169.75.300119.6S1654Q1652-S1654 PolarHBondContact O-N 3.36Å
1653T23.2Very low25.2Very low129.8 Ų129.8128.3 Ų128.380%0.79677%0.771SS**  30.8111.7123.154.20000115.1I1651I1651-T1653 HydrophobicContact CG2-CG2 4.02Å
1654S25.7Very low25.2Very low107.6 Ų107.6129.3 Ų129.375%0.75277%0.772SS**  trans-139.9120148.346.90000108.8Q1652 T1656Q1652-S1654 PolarHBondContact O-N 3.36Å; S1654-T1656 PolarHBondContact O-N 3.24Å
1655N23.9Very low25.2Very low152.2 Ų152.2130.9 Ų130.981%0.81478%0.775SS**  trans31.6124133.9-67.1-16.4000115.3S1657N1655-S1657 VanDerWaalsContact C-N 3.34Å; N1655-S1657 PolarHBondContact O-N 2.7Å; N1655-S1657 VanDerWaalsContact O-N 3.15Å
1656T25.2Very low25.3Very low136.6 Ų136.6132.6 Ų132.684%0.83878%0.778SS**  trans-164.1116.8136.236.80000111.6S1654 T1658S1654-T1656 PolarHBondContact O-N 3.24Å; T1656-T1658 PolarHBondContact O-N 3.43Å
1657S23.6Very low25.3Very low102.8 Ų102.8134.7 Ų134.772%0.71978%0.783SS**  trans-107.7134.6130.760.70000114.8N1655 V1659N1655-S1657 VanDerWaalsContact C-N 3.34Å; N1655-S1657 PolarHBondContact O-N 2.7Å; N1655-S1657 VanDerWaalsContact O-N 3.15Å; S1657-V1659 PolarHBondContact O-N 3.08Å
1658T24.5Very low25.6Very low129.6 Ų129.6133.6 Ų133.680%0.79578%0.777SS**  trans28.3115.4149.447.10000116.7T1656T1656-T1658 PolarHBondContact O-N 3.43Å
1659V26.6Very low25.9Very low132.2 Ų132.2132.3 Ų132.380%0.80177%0.771SS**  176.3133.2118.6-177.90000113.6S1657 N1661S1657-V1659 PolarHBondContact O-N 3.08Å; V1659-N1661 PolarHBondContact O-N 2.85Å
1660P28.8Very low26.6Very low115 Ų115136.2 Ų136.275%0.74778%0.775SS**  trans-104.7144.5-168.936.4-30.4000114.3
1661N24.7Very low27.9Very low168.2 Ų168.2135.4 Ų135.490%0.89976%0.762SS**  trans-128.8137.9158.3-84.7-25.5000110.9V1659V1659-N1661 PolarHBondContact O-N 2.85Å
1662G25.2Very low29.5Very low68.4 Ų68.4131.1 Ų131.171%0.70574%0.742SS**  trans145.690.3157.300000112.7N1664G1662-N1664 PolarHBondContact O-N 3.05Å
1663L24Very low31.4Very low162.2 Ų162.2123.3 Ų123.385%0.84971%0.706SS**  trans65.397.3141-72.5159.9000115.3
1664N24.9Very low33.8Very low146.2 Ų146.2117.5 Ų117.578%0.78267%0.671SS**  trans68.4112.3135-81.1-19000115.8G1662 Q1666G1662-N1664 PolarHBondContact O-N 3.05Å; N1664-Q1666 PolarHBondContact O-N 3.15Å
1665Q27.1Very low36.2Very low174.6 Ų174.6112.4 Ų112.482%0.81664%0.635SS**  trans-110.6116.6141.2-86171.5200112.6I1667Q1665-I1667 PolarHBondContact O-N 3.39Å; Q1665-I1667 VanDerWaalsContact O-N 3.11Å
1666Q26.6Very low38.9Very low170.6 Ų170.6109.6 Ų109.680%0.79762%0.617SS**  trans-83.6117.4159.3-86.3171.6-25.600109.7N1664 L1668N1664-Q1666 PolarHBondContact O-N 3.15Å; Q1666-L1668 VanDerWaalsContact C-N 3.29Å; Q1666-L1668 PolarHBondContact O-N 3.02Å
1667I28.5Very low41.6Very low158.4 Ų158.4103.1 Ų103.181%0.81258%0.577SS**  trans-46.2105.4157.7-60.5165.8000109.1Q1665 P1669Q1665-I1667 PolarHBondContact O-N 3.39Å; Q1665-I1667 VanDerWaalsContact O-N 3.11Å; I1667-P1669 WeakPolarHBondContact O-CD 3.43Å
1668L30.2Very low44.5Very low125.6 Ų125.698.4 Ų98.466%0.65854%0.543SS*.  trans-95.4123.2168.8-116.489.3000108.7A1575 Q1666 D1670 K1671A1575-L1668 HydrophobicContact CB-CD1 4.26Å; A1575-L1668 HydrophobicContact CB-CD2 3.68Å; A1575-L1668 VanDerWaalsContact CB-CD2 3.48Å; A1575-L1668 HydrophobicContact CB-CG 3.83Å; Q1666-L1668 VanDerWaalsContact C-N 3.29Å; Q1666-L1668 PolarHBondContact O-N 3.02Å; L1668-D1670 VanDerWaalsContact C-N 3.34Å; L1668-D1670 PolarHBondContact O-N 2.98Å; L1668-D1670 VanDerWaalsContact O-N 3.13Å; L1668-K1671 HydrophobicContact CD2-CD 4.48Å
1669P34Very low47.4Very low102.8 Ų102.895.4 Ų95.467%0.66852%0.519SS*.  trans-79.6116.1-172.721.5-19.7000113.1I1667 K1671I1667-P1669 WeakPolarHBondContact O-CD 3.43Å; P1669-K1671 VanDerWaalsContact C-N 3.34Å; P1669-K1671 PolarHBondContact O-N 3.05Å
1670D38.9Very low50.1Low152 Ų15289.7 Ų89.781%0.81349%0.486SS*.  trans-3970.6168.3-66-28.6000114.7L1668L1668-D1670 VanDerWaalsContact C-N 3.34Å; L1668-D1670 PolarHBondContact O-N 2.98Å; L1668-D1670 VanDerWaalsContact O-N 3.13Å
1671K51.2Low52.9Low106.8 Ų106.884.2 Ų84.246%0.46445%0.45SS..  trans-114.1111.9171.8-90.2-178.9176.2-175.50111.9S1573 A1575 V1579 L1668 P1669S1573-K1671 PolarHBondContact OG-NZ 2.93Å; A1575-K1671 HydrophobicContact CB-CD 3.95Å; V1579-K1671 HydrophobicContact CG2-CB 4.49Å; L1668-K1671 HydrophobicContact CD2-CD 4.48Å; P1669-K1671 VanDerWaalsContact C-N 3.34Å; P1669-K1671 PolarHBondContact O-N 3.05Å
1672V57.7Low55.9Low45.2 Ų45.276.3 Ų76.327%0.27441%0.408SS..  trans-69.7142.6171.5-160.30000110.6E1534 S1535 E1537 L1540 L1677E1534-V1672 WeakPolarHBondContact O-CG2 3.24Å; S1535-V1672 WeakPolarHBondContact O-CG1 3.31Å; E1537-V1672 HydrophobicContact CB-CG1 4Å; E1537-V1672 HydrophobicContact CG-CB 4.16Å; E1537-V1672 HydrophobicContact CG-CG1 3.85Å; L1540-V1672 HydrophobicContact CD1-CG1 4.38Å; L1540-V1672 HydrophobicContact CD1-CG2 4.47Å; V1672-L1677 HydrophobicContact CB-CD2 4.28Å; V1672-L1677 HydrophobicContact CG1-CD2 3.34Å
1673G64.3Low58.8Low1.8 Ų1.875.7 Ų75.72%0.01939%0.387CS..  trans170.336.5178.300000116.5E1537 L1580 R1678E1537-G1673 PolarHBondContact OE1-N 3.05Å; L1580-G1673 WeakPolarHBondContact CD2-O 3.48Å; G1673-R1678 PolarHBondContact O-NE 3.34Å; G1673-R1678 PolarHBondContact O-NH2 3.15Å; G1673-R1678 VanDerWaalsContact O-NH2 3.11Å
1674S74.3Confident61.8Low8.4 Ų8.468 Ų686%0.05935%0.347CS..  trans-60.7163.5177.776.80000113.7E1537 S1583 H1676 L1677 R1678E1537-S1674 VanDerWaalsContact CD-OG 3.27Å; E1537-S1674 VanDerWaalsContact OE1-CB 3.25Å; E1537-S1674 WeakPolarHBondContact OE1-CB 3.42Å; E1537-S1674 PolarHBondContact OE1-N 3.11Å; E1537-S1674 PolarHBondContact OE1-OG 3.13Å; E1537-S1674 VanDerWaalsContact OE2-CB 3.23Å; E1537-S1674 WeakPolarHBondContact OE2-CB 3.4Å; E1537-S1674 PolarHBondContact OE2-N 3.25Å; E1537-S1674 PolarHBondContact OE2-OG 3.23Å; S1583-S1674 VanDerWaalsContact CB-CB 3.49Å; S1583-S1674 WeakPolarHBondContact OG-CA 3.36Å; S1674-H1676 VanDerWaalsContact C-N 3.26Å; S1674-H1676 PolarHBondContact O-N 3.17Å; S1674-H1676 PolarHBondContact OG-N 3.12Å; S1674-L1677 PolarHBondContact O-N 3.04Å; S1674-L1677 PolarHBondContact OG-N 3.2Å; S1674-L1677 VanDerWaalsContact OG-N 3.13Å; S1674-R1678 WeakPolarHBondContact O-CG 3.43Å; S1674-R1678 PolarHBondContact O-N 3.32Å; S1674-R1678 VanDerWaalsContact O-N 3.12Å
1675V77.1Confident64.8Low1.4 Ų1.461.1 Ų61.11%0.00831%0.31CS..Hα-helixtrans-58.9-37.3173.5176.40000111.4L1580 S1583 V1584 R1678 K1679 A1745 E1748 L1749L1580-V1675 HydrophobicContact CD1-CG2 4.07Å; L1580-V1675 HydrophobicContact CD2-CB 4.4Å; L1580-V1675 HydrophobicContact CD2-CG2 3.83Å; L1580-V1675 HydrophobicContact CG-CG2 3.78Å; S1583-V1675 WeakPolarHBondContact OG-CG2 3.24Å; S1583-V1675 PolarHBondContact OG-N 3.37Å; S1583-V1675 VanDerWaalsContact OG-N 3.16Å; V1584-V1675 HydrophobicContact CG2-CB 4.22Å; V1584-V1675 HydrophobicContact CG2-CG2 3.51Å; V1584-V1675 VanDerWaalsContact CG2-CG2 3.41Å; V1675-R1678 PolarHBondContact O-N 3.37Å; V1675-K1679 VanDerWaalsContact O-CB 3.28Å; V1675-K1679 WeakPolarHBondContact O-CB 3.37Å; V1675-K1679 PolarHBondContact O-N 3.31Å; V1675-A1745 HydrophobicContact CG2-CB 4.08Å; V1675-E1748 HydrophobicContact CG1-CB 4.03Å; V1675-E1748 HydrophobicContact CG1-CG 4.38Å; V1675-E1748 VanDerWaalsContact CG1-OE2 3.32Å; V1675-E1748 WeakPolarHBondContact CG1-OE2 3.4Å; V1675-L1749 HydrophobicContact CG1-CD2 4.36Å; V1675-L1749 HydrophobicContact CG1-CG 4.29Å
1676H79.1Confident67.5Low91.8 Ų91.853 Ų5343%0.42527%0.273SS..Hα-helixtrans-66.8-42.4-179.3-65-47.8000112.7I1541 S1674 R1678 K1679 A1680 E1748I1541-H1676 HydrophobicContact CD1-CB 4.21Å; S1674-H1676 VanDerWaalsContact C-N 3.26Å; S1674-H1676 PolarHBondContact O-N 3.17Å; S1674-H1676 PolarHBondContact OG-N 3.12Å; H1676-R1678 VanDerWaalsContact C-N 3.34Å; H1676-R1678 PolarHBondContact O-N 3.22Å; H1676-K1679 WeakPolarHBondContact O-CB 3.42Å; H1676-K1679 PolarHBondContact O-N 3.14Å; H1676-A1680 WeakPolarHBondContact O-CB 3.26Å; H1676-A1680 PolarHBondContact O-N 3.31Å; H1676-E1748 IonicContact CE1-OE2 3.59Å; H1676-E1748 IonicContact ND1-OE2 3.11Å
1677L83Confident70.3Confident2 Ų246.9 Ų46.91%0.0124%0.243CC..Hα-helixtrans-62.4-46.5174.6179.663.3000111.3E1537 L1540 I1541 L1544 V1672 S1674 K1679 A1680 C1681E1537-L1677 HydrophobicContact CG-CB 3.69Å; E1537-L1677 HydrophobicContact CG-CD1 4.41Å; E1537-L1677 HydrophobicContact CG-CD2 4.32Å; E1537-L1677 HydrophobicContact CG-CG 4.35Å; E1537-L1677 VanDerWaalsContact OE1-CB 3.24Å; E1537-L1677 WeakPolarHBondContact OE1-CB 3.37Å; E1537-L1677 PolarHBondContact OE1-N 2.68Å; L1540-L1677 HydrophobicContact CB-CD1 3.95Å; L1540-L1677 HydrophobicContact CD1-CD1 4.43Å; L1540-L1677 HydrophobicContact CD1-CD2 4.27Å; L1540-L1677 HydrophobicContact CD2-CD1 3.47Å; L1540-L1677 VanDerWaalsContact CD2-CD1 3.47Å; L1540-L1677 HydrophobicContact CD2-CD2 3.63Å; L1540-L1677 HydrophobicContact CD2-CG 4.2Å; L1540-L1677 HydrophobicContact CG-CD1 3.69Å; I1541-L1677 HydrophobicContact CG1-CD1 4.09Å; L1544-L1677 HydrophobicContact CD1-CD1 3.85Å; V1672-L1677 HydrophobicContact CB-CD2 4.28Å; V1672-L1677 HydrophobicContact CG1-CD2 3.34Å; S1674-L1677 PolarHBondContact O-N 3.04Å; S1674-L1677 PolarHBondContact OG-N 3.2Å; S1674-L1677 VanDerWaalsContact OG-N 3.13Å; L1677-K1679 VanDerWaalsContact C-N 3.32Å; L1677-K1679 PolarHBondContact O-N 3.01Å; L1677-A1680 CarbonylContact O-C 3.58Å; L1677-A1680 WeakPolarHBondContact O-CB 3.29Å; L1677-A1680 PolarHBondContact O-N 3.05Å; L1677-A1680 VanDerWaalsContact O-N 3.15Å; L1677-C1681 PolarHBondContact O-N 3.05Å; L1677-C1681 PolarHBondContact O-SG 3.28Å; L1677-C1681 VanDerWaalsContact O-SG 3.39Å
1678R83.5Confident72.9Confident2.4 Ų2.439.6 Ų39.61%0.00921%0.205CC..Hα-helixtrans-64.2-38.3179.3-65.6-176-162.9-157.15.1111.9I1569 I1571 S1576 G1673 S1674 V1675 H1676 C1681 L1682 L1749I1569-R1678 PolarHBondContact O-NH1 2.85Å; I1571-R1678 PolarHBondContact O-NH1 3.47Å; I1571-R1678 PolarHBondContact O-NH2 3.06Å; S1576-R1678 PolarHBondContact O-NH2 3.46Å; G1673-R1678 PolarHBondContact O-NE 3.34Å; G1673-R1678 PolarHBondContact O-NH2 3.15Å; G1673-R1678 VanDerWaalsContact O-NH2 3.11Å; S1674-R1678 WeakPolarHBondContact O-CG 3.43Å; S1674-R1678 PolarHBondContact O-N 3.32Å; S1674-R1678 VanDerWaalsContact O-N 3.12Å; V1675-R1678 PolarHBondContact O-N 3.37Å; H1676-R1678 VanDerWaalsContact C-N 3.34Å; H1676-R1678 PolarHBondContact O-N 3.22Å; R1678-C1681 PolarHBondContact O-N 3.34Å; R1678-L1682 VanDerWaalsContact O-CG 3.27Å; R1678-L1682 WeakPolarHBondContact O-CG 3.36Å; R1678-L1682 PolarHBondContact O-N 3.18Å; R1678-L1682 VanDerWaalsContact O-N 3.08Å; R1678-L1749 HydrophobicContact CB-CD2 3.85Å
1679K85.4Confident75.4Confident66.8 Ų66.834 Ų3429%0.2918%0.176SC..Hα-helixtrans-59.7-48.5171.4178.4177.2179.9178.10111.3V1675 H1676 L1677 C1681 L1682 E1683 E1748 L1749 P1752V1675-K1679 VanDerWaalsContact O-CB 3.28Å; V1675-K1679 WeakPolarHBondContact O-CB 3.37Å; V1675-K1679 PolarHBondContact O-N 3.31Å; H1676-K1679 WeakPolarHBondContact O-CB 3.42Å; H1676-K1679 PolarHBondContact O-N 3.14Å; L1677-K1679 VanDerWaalsContact C-N 3.32Å; L1677-K1679 PolarHBondContact O-N 3.01Å; K1679-C1681 VanDerWaalsContact C-N 3.32Å; K1679-C1681 PolarHBondContact O-N 3.18Å; K1679-L1682 PolarHBondContact O-N 3.14Å; K1679-L1682 VanDerWaalsContact O-N 3.16Å; K1679-E1683 WeakPolarHBondContact CE-OE1 3.24Å; K1679-E1683 HydrophobicContact CG-CG 4.46Å; K1679-E1683 WeakPolarHBondContact O-CG 3.31Å; K1679-E1683 PolarHBondContact O-N 3.32Å; K1679-E1748 IonicContact NZ-OE2 3.23Å; K1679-E1748 PolarHBondContact NZ-OE2 2.95Å; K1679-L1749 HydrophobicContact CB-CD2 4.15Å; K1679-P1752 HydrophobicContact CG-CG 4.19Å
1680A84.7Confident77.5Confident12.2 Ų12.231.3 Ų31.310%0.10116%0.156CC..Hα-helixtrans-61.7-39.5177.600000112.5I1541 L1544 H1676 L1677 L1682 E1683 C1684I1541-A1680 HydrophobicContact CB-CB 4.29Å; I1541-A1680 HydrophobicContact CG1-CB 3.97Å; I1541-A1680 HydrophobicContact CG2-CB 4.03Å; L1544-A1680 HydrophobicContact CB-CB 4.49Å; L1544-A1680 HydrophobicContact CD1-CB 4.11Å; H1676-A1680 WeakPolarHBondContact O-CB 3.26Å; H1676-A1680 PolarHBondContact O-N 3.31Å; L1677-A1680 CarbonylContact O-C 3.58Å; L1677-A1680 WeakPolarHBondContact O-CB 3.29Å; L1677-A1680 PolarHBondContact O-N 3.05Å; L1677-A1680 VanDerWaalsContact O-N 3.15Å; A1680-L1682 PolarHBondContact O-N 3.29Å; A1680-E1683 PolarHBondContact O-N 3.15Å; A1680-C1684 VanDerWaalsContact O-CB 3.27Å; A1680-C1684 WeakPolarHBondContact O-CB 3.37Å; A1680-C1684 PolarHBondContact O-N 3.22Å
1681C86.9Confident79.3Confident0 Ų027.1 Ų27.10%014%0.138CC..Hα-helixtrans-60.5-45.4173.3-68.10000111.9L1544 I1565 I1569 L1677 R1678 K1679 C1684 L1685L1544-C1681 HydrophobicContact CD1-CB 4.47Å; L1544-C1681 VanDerWaalsContact CD1-SG 3.58Å; L1544-C1681 WeakPolarHBondContact CD1-SG 3.48Å; I1565-C1681 HydrophobicContact CG2-CB 3.94Å; I1569-C1681 HydrophobicContact CD1-CB 3.99Å; I1569-C1681 HydrophobicContact CG1-CB 3.76Å; I1569-C1681 VanDerWaalsContact CG1-CB 3.46Å; L1677-C1681 PolarHBondContact O-N 3.05Å; L1677-C1681 PolarHBondContact O-SG 3.28Å; L1677-C1681 VanDerWaalsContact O-SG 3.39Å; R1678-C1681 PolarHBondContact O-N 3.34Å; K1679-C1681 VanDerWaalsContact C-N 3.32Å; K1679-C1681 PolarHBondContact O-N 3.18Å; C1681-C1684 WeakPolarHBondContact O-CB 3.28Å; C1681-C1684 PolarHBondContact O-N 3.17Å; C1681-L1685 WeakPolarHBondContact O-CG 3.43Å; C1681-L1685 PolarHBondContact O-N 3.12Å
1682L87.3Confident80.6Confident2 Ų222.5 Ų22.51%0.0112%0.118CC..Hα-helixtrans-67.1-41.4178.2-67.6169.9000112I1569 R1678 K1679 A1680 C1684 L1685 A1686 I1705 L1749 P1752 A1753 V1756I1569-L1682 HydrophobicContact CD1-CD2 3.99Å; I1569-L1682 HydrophobicContact CD1-CG 4.45Å; I1569-L1682 HydrophobicContact CG2-CD2 4.28Å; R1678-L1682 VanDerWaalsContact O-CG 3.27Å; R1678-L1682 WeakPolarHBondContact O-CG 3.36Å; R1678-L1682 PolarHBondContact O-N 3.18Å; R1678-L1682 VanDerWaalsContact O-N 3.08Å; K1679-L1682 PolarHBondContact O-N 3.14Å; K1679-L1682 VanDerWaalsContact O-N 3.16Å; A1680-L1682 PolarHBondContact O-N 3.29Å; L1682-C1684 VanDerWaalsContact C-N 3.33Å; L1682-C1684 PolarHBondContact O-N 3.01Å; L1682-L1685 PolarHBondContact O-N 3.34Å; L1682-A1686 WeakPolarHBondContact O-CB 3.29Å; L1682-A1686 PolarHBondContact O-N 3Å; L1682-I1705 HydrophobicContact CD2-CD1 3.85Å; L1682-I1705 HydrophobicContact CD2-CG1 3.8Å; L1682-L1749 HydrophobicContact CD1-CB 4.35Å; L1682-L1749 HydrophobicContact CD1-CD2 4Å; L1682-P1752 HydrophobicContact CB-CB 3.59Å; L1682-P1752 VanDerWaalsContact CB-CB 3.43Å; L1682-P1752 HydrophobicContact CB-CG 4.17Å; L1682-P1752 HydrophobicContact CD1-CB 4.11Å; L1682-P1752 HydrophobicContact CD1-CG 4.16Å; L1682-P1752 HydrophobicContact CG-CB 4.35Å; L1682-A1753 HydrophobicContact CD1-CB 4.17Å; L1682-A1753 HydrophobicContact CD2-CB 4.45Å; L1682-V1756 HydrophobicContact CB-CG2 4.48Å; L1682-V1756 HydrophobicContact CD2-CG2 4.48Å; L1682-V1756 WeakPolarHBondContact O-CG2 3.37Å
1683E87Confident81.6Confident56 Ų5624.5 Ų24.526%0.26213%0.127SC..Hα-helixtrans-64.7-38.1174.7-71.3-176.7-17100111.9K1679 A1680 A1686 R1687 P1752 S1817K1679-E1683 WeakPolarHBondContact CE-OE1 3.24Å; K1679-E1683 HydrophobicContact CG-CG 4.46Å; K1679-E1683 WeakPolarHBondContact O-CG 3.31Å; K1679-E1683 PolarHBondContact O-N 3.32Å; A1680-E1683 PolarHBondContact O-N 3.15Å; E1683-A1686 PolarHBondContact O-N 3.41Å; E1683-R1687 VanDerWaalsContact O-CG 3.25Å; E1683-R1687 WeakPolarHBondContact O-CG 3.19Å; E1683-R1687 PolarHBondContact O-N 3.11Å; E1683-R1687 IonicContact OE2-NH2 3.25Å; E1683-R1687 PolarHBondContact OE2-NH2 3.14Å; E1683-P1752 HydrophobicContact CG-CB 3.95Å; E1683-P1752 HydrophobicContact CG-CG 4.17Å; E1683-S1817 WeakPolarHBondContact CG-OG 3.27Å
1684C86.1Confident82.3Confident2 Ų224.5 Ų24.51%0.01413%0.127CC..Hα-helixtrans-62-47.5173-177.50000111.3L1544 P1548 A1680 C1681 L1682 A1686 R1687 F1688L1544-C1684 HydrophobicContact CB-CB 4.21Å; L1544-C1684 HydrophobicContact CD2-CB 4.08Å; L1544-C1684 WeakPolarHBondContact O-CB 3.07Å; L1544-C1684 PolarHBondContact O-SG 3.32Å; L1544-C1684 VanDerWaalsContact O-SG 3.39Å; P1548-C1684 HydrophobicContact CG-CB 4.47Å; A1680-C1684 VanDerWaalsContact O-CB 3.27Å; A1680-C1684 WeakPolarHBondContact O-CB 3.37Å; A1680-C1684 PolarHBondContact O-N 3.22Å; C1681-C1684 WeakPolarHBondContact O-CB 3.28Å; C1681-C1684 PolarHBondContact O-N 3.17Å; L1682-C1684 VanDerWaalsContact C-N 3.33Å; L1682-C1684 PolarHBondContact O-N 3.01Å; C1684-A1686 VanDerWaalsContact C-N 3.33Å; C1684-A1686 PolarHBondContact O-N 3.25Å; C1684-R1687 PolarHBondContact O-N 3.21Å; C1684-F1688 WeakPolarHBondContact O-CG 3.24Å; C1684-F1688 PolarHBondContact O-N 3.05Å
1685L87.2Confident82.7Confident0.4 Ų0.426 Ų260%0.00214%0.135CC..Hα-helixtrans-63-38.2176-72.2175.7000112.1V1562 I1565 I1569 C1681 L1682 R1687 F1688 T1689 I1701 V1756V1562-L1685 HydrophobicContact CG1-CD2 4.46Å; I1565-L1685 HydrophobicContact CB-CD2 4.5Å; I1565-L1685 HydrophobicContact CG2-CD1 4.22Å; I1565-L1685 HydrophobicContact CG2-CD2 4.17Å; I1565-L1685 HydrophobicContact CG2-CG 3.96Å; I1569-L1685 HydrophobicContact CD1-CD1 3.51Å; I1569-L1685 VanDerWaalsContact CD1-CD1 3.44Å; I1569-L1685 HydrophobicContact CD1-CG 4.47Å; C1681-L1685 WeakPolarHBondContact O-CG 3.43Å; C1681-L1685 PolarHBondContact O-N 3.12Å; L1682-L1685 PolarHBondContact O-N 3.34Å; L1685-R1687 VanDerWaalsContact C-N 3.31Å; L1685-R1687 PolarHBondContact O-N 3.22Å; L1685-F1688 HydrophobicContact CD2-CD2 4.33Å; L1685-F1688 WeakPolarHBondContact O-CB 3.28Å; L1685-F1688 PolarHBondContact O-N 3.14Å; L1685-F1688 VanDerWaalsContact O-N 3.15Å; L1685-T1689 WeakPolarHBondContact O-CG2 3.46Å; L1685-T1689 PolarHBondContact O-N 3.18Å; L1685-I1701 HydrophobicContact CD1-CG1 4.44Å; L1685-I1701 HydrophobicContact CD1-CG2 4.1Å; L1685-I1701 HydrophobicContact CD2-CD1 4.38Å; L1685-I1701 HydrophobicContact CD2-CG1 4.44Å; L1685-V1756 HydrophobicContact CB-CG1 4.35Å; L1685-V1756 HydrophobicContact CB-CG2 3.95Å
1686A85.5Confident82.9Confident4.6 Ų4.632.9 Ų32.94%0.03817%0.172CC..Hα-helixtrans-62.2-42.8176.600000110.8L1682 E1683 C1684 F1688 T1689 D1690 D1755 V1756L1682-A1686 WeakPolarHBondContact O-CB 3.29Å; L1682-A1686 PolarHBondContact O-N 3Å; E1683-A1686 PolarHBondContact O-N 3.41Å; C1684-A1686 VanDerWaalsContact C-N 3.33Å; C1684-A1686 PolarHBondContact O-N 3.25Å; A1686-F1688 VanDerWaalsContact C-N 3.27Å; A1686-F1688 PolarHBondContact O-N 3.45Å; A1686-T1689 PolarHBondContact O-N 3.16Å; A1686-T1689 PolarHBondContact O-OG1 3.35Å; A1686-D1690 PolarHBondContact O-N 3.18Å; A1686-D1755 HydrophobicContact CB-CB 4.25Å; A1686-V1756 HydrophobicContact CB-CG2 3.88Å
1687R84.3Confident83.1Confident42.2 Ų42.230.2 Ų30.216%0.15916%0.159CC..Hα-helixtrans-68.5-34.6174.5-65.7179.6149.8178.33.6112.5E1545 P1548 E1683 C1684 L1685 T1689 D1690 C1691 T1818 R1821E1545-R1687 PolarHBondContact O-NH1 3.16Å; P1548-R1687 HydrophobicContact CB-CB 3.82Å; P1548-R1687 HydrophobicContact CG-CB 4Å; E1683-R1687 VanDerWaalsContact O-CG 3.25Å; E1683-R1687 WeakPolarHBondContact O-CG 3.19Å; E1683-R1687 PolarHBondContact O-N 3.11Å; E1683-R1687 IonicContact OE2-NH2 3.25Å; E1683-R1687 PolarHBondContact OE2-NH2 3.14Å; C1684-R1687 PolarHBondContact O-N 3.21Å; L1685-R1687 VanDerWaalsContact C-N 3.31Å; L1685-R1687 PolarHBondContact O-N 3.22Å; R1687-T1689 VanDerWaalsContact C-N 3.29Å; R1687-T1689 PolarHBondContact O-N 3.12Å; R1687-D1690 WeakPolarHBondContact O-CB 3.36Å; R1687-D1690 PolarHBondContact O-N 3.18Å; R1687-D1690 VanDerWaalsContact O-N 3.13Å; R1687-C1691 PolarHBondContact O-N 3.21Å; R1687-C1691 PolarHBondContact O-SG 3.25Å; R1687-T1818 HydrophobicContact CG-CG2 4.25Å; R1687-T1818 WeakPolarHBondContact CG-OG1 3.37Å; R1687-R1821 VanDerWaalsContact CZ-NH1 3.32Å
1688F84.1Confident83.2Confident6.2 Ų6.230.1 Ų30.13%0.02716%0.158CC..Hα-helixtrans-63.7-35.2172-76.1-6.4000112.5L1547 P1548 L1554 I1561 V1562 I1565 C1684 L1685 A1686 D1690 C1691 V1692 L1694 R1763L1547-F1688 HydrophobicContact CB-CE1 4.24Å; L1547-F1688 HydrophobicContact CB-CZ 4.21Å; P1548-F1688 HydrophobicContact CB-CD1 3.99Å; P1548-F1688 HydrophobicContact CB-CE1 4.23Å; P1548-F1688 HydrophobicContact CG-CD1 3.99Å; P1548-F1688 HydrophobicContact CG-CE1 4.12Å; L1554-F1688 HydrophobicContact CD2-CE1 3.71Å; L1554-F1688 HydrophobicContact CD2-CE2 4.02Å; L1554-F1688 HydrophobicContact CD2-CZ 3.31Å; L1554-F1688 VanDerWaalsContact CD2-CZ 3.41Å; I1561-F1688 HydrophobicContact CG2-CE2 4.23Å; I1561-F1688 HydrophobicContact CG2-CZ 4.36Å; V1562-F1688 HydrophobicContact CG2-CD2 4.42Å; I1565-F1688 HydrophobicContact CD1-CD2 4.49Å; I1565-F1688 HydrophobicContact CD1-CE2 3.73Å; I1565-F1688 HydrophobicContact CD1-CZ 4.35Å; C1684-F1688 WeakPolarHBondContact O-CG 3.24Å; C1684-F1688 PolarHBondContact O-N 3.05Å; L1685-F1688 HydrophobicContact CD2-CD2 4.33Å; L1685-F1688 WeakPolarHBondContact O-CB 3.28Å; L1685-F1688 PolarHBondContact O-N 3.14Å; L1685-F1688 VanDerWaalsContact O-N 3.15Å; A1686-F1688 VanDerWaalsContact C-N 3.27Å; A1686-F1688 PolarHBondContact O-N 3.45Å; F1688-D1690 PolarHBondContact O-N 3.11Å; F1688-D1690 VanDerWaalsContact O-N 3.16Å; F1688-C1691 PolarHBondContact O-N 3.14Å; F1688-C1691 VanDerWaalsContact O-N 3.12Å; F1688-V1692 PolarHBondContact O-N 3.13Å; F1688-L1694 HydrophobicContact CB-CD1 3.91Å; F1688-R1763 PolarHBondContact O-NH1 3.27Å
1689T81.2Confident83.2Confident6 Ų630.9 Ų30.94%0.03717%0.167CC..Hα-helixtrans-65.2-20.8174.660.80000113.6L1685 A1686 R1687 L1694 L1760 R1763L1685-T1689 WeakPolarHBondContact O-CG2 3.46Å; L1685-T1689 PolarHBondContact O-N 3.18Å; A1686-T1689 PolarHBondContact O-N 3.16Å; A1686-T1689 PolarHBondContact O-OG1 3.35Å; R1687-T1689 VanDerWaalsContact C-N 3.29Å; R1687-T1689 PolarHBondContact O-N 3.12Å; T1689-L1694 HydrophobicContact CG2-CD1 3.85Å; T1689-L1760 HydrophobicContact CG2-CD2 3.88Å; T1689-L1760 HydrophobicContact CG2-CG 3.95Å; T1689-R1763 WeakPolarHBondContact O-CD 3.37Å; T1689-R1763 PolarHBondContact O-NE 3.29Å; T1689-R1763 PolarHBondContact O-NH1 3.43Å; T1689-R1763 PolarHBondContact O-NH2 3.02Å
1690D79.1Confident83.2Confident47.4 Ų47.432.2 Ų32.225%0.25317%0.174SC..Hα-helixtrans-81.6-31.9173.2-67.9-31.9000111.8A1686 R1687 F1688 R1763 S1815 T1818A1686-D1690 PolarHBondContact O-N 3.18Å; R1687-D1690 WeakPolarHBondContact O-CB 3.36Å; R1687-D1690 PolarHBondContact O-N 3.18Å; R1687-D1690 VanDerWaalsContact O-N 3.13Å; F1688-D1690 PolarHBondContact O-N 3.11Å; F1688-D1690 VanDerWaalsContact O-N 3.16Å; D1690-R1763 PolarHBondContact O-NH2 3.12Å; D1690-S1815 PolarHBondContact OD1-N 3.01Å; D1690-S1815 VanDerWaalsContact OD2-CB 3.32Å; D1690-S1815 WeakPolarHBondContact OD2-CB 3.38Å; D1690-S1815 PolarHBondContact OD2-N 3.32Å; D1690-S1815 VanDerWaalsContact OD2-N 3.11Å; D1690-S1815 PolarHBondContact OD2-OG 3.14Å; D1690-S1815 VanDerWaalsContact OD2-OG 3.05Å; D1690-T1818 WeakPolarHBondContact OD2-CB 3.41Å; D1690-T1818 VanDerWaalsContact OD2-CG2 3.28Å; D1690-T1818 WeakPolarHBondContact OD2-CG2 3.33Å; D1690-T1818 PolarHBondContact OD2-OG1 3.02Å
1691C77Confident83.3Confident64 Ų6431.6 Ų31.643%0.43217%0.169SC..Hα-helixtrans-107.7-23.7-169.6-58.10000115.7R1687 F1688R1687-C1691 PolarHBondContact O-N 3.21Å; R1687-C1691 PolarHBondContact O-SG 3.25Å; F1688-C1691 PolarHBondContact O-N 3.14Å; F1688-C1691 VanDerWaalsContact O-N 3.12Å
1692V78.1Confident83.3Confident9 Ų931.6 Ų31.66%0.05517%0.169CC..SBendtrans-132.4140.6-171.8-175.40000110.5G1551 K1555 A1558 F1688 L1694 R1763G1551-V1692 WeakPolarHBondContact O-CG2 3.46Å; K1555-V1692 HydrophobicContact CB-CG1 4.43Å; K1555-V1692 HydrophobicContact CG-CG1 4.42Å; A1558-V1692 HydrophobicContact CB-CG1 4.38Å; F1688-V1692 PolarHBondContact O-N 3.13Å; V1692-L1694 HydrophobicContact CB-CD2 4.48Å; V1692-L1694 HydrophobicContact CG1-CD2 4.21Å; V1692-L1694 WeakPolarHBondContact O-CG 3.45Å; V1692-L1694 PolarHBondContact O-N 3.17Å; V1692-R1763 PolarHBondContact O-NH1 3.42Å
1693D78.1Confident83.3Confident87 Ų8735.6 Ų35.647%0.46519%0.188SC..  trans-73.2109.2173.8-55.2-46.1000109.6K1555 R1763K1555-D1693 IonicContact NZ-OD2 3.2Å; K1555-D1693 PolarHBondContact NZ-OD2 3.23Å; D1693-R1763 IonicContact OD1-CZ 3Å; D1693-R1763 VanDerWaalsContact OD1-CZ 3.29Å; D1693-R1763 IonicContact OD1-NE 3.19Å; D1693-R1763 IonicContact OD1-NH1 3.65Å; D1693-R1763 PolarHBondContact OD1-NH1 3.38Å; D1693-R1763 IonicContact OD1-NH2 3.77Å
1694L80.2Confident83.2Confident3 Ų333.4 Ų33.42%0.01618%0.178CC..  trans-106.315.8-175.4-66.4178.1000113.9V1562 F1688 T1689 V1692 D1696 F1697 A1698 I1701 L1760V1562-L1694 HydrophobicContact CG2-CD2 3.91Å; F1688-L1694 HydrophobicContact CB-CD1 3.91Å; T1689-L1694 HydrophobicContact CG2-CD1 3.85Å; V1692-L1694 HydrophobicContact CB-CD2 4.48Å; V1692-L1694 HydrophobicContact CG1-CD2 4.21Å; V1692-L1694 WeakPolarHBondContact O-CG 3.45Å; V1692-L1694 PolarHBondContact O-N 3.17Å; L1694-D1696 VanDerWaalsContact C-N 3.27Å; L1694-D1696 PolarHBondContact O-N 3.28Å; L1694-F1697 HydrophobicContact CD2-CD2 3.98Å; L1694-F1697 PolarHBondContact O-N 3.14Å; L1694-F1697 VanDerWaalsContact O-N 3.09Å; L1694-A1698 PolarHBondContact O-N 3.1Å; L1694-A1698 VanDerWaalsContact O-N 3.13Å; L1694-I1701 HydrophobicContact CB-CD1 4.4Å; L1694-I1701 HydrophobicContact CD1-CD1 4.02Å; L1694-L1760 HydrophobicContact CB-CD2 4.17Å
1695D80.7Confident83.2Confident40.4 Ų40.433.5 Ų33.522%0.21618%0.178CC..G310 helixtrans-50.5-44-176.5-8319.7000112.9F1697 A1698 R1763 M1764 K1767D1695-F1697 VanDerWaalsContact C-N 3.32Å; D1695-F1697 PolarHBondContact O-N 3.11Å; D1695-A1698 WeakPolarHBondContact O-CB 3.25Å; D1695-A1698 PolarHBondContact O-N 3.09Å; D1695-R1763 WeakPolarHBondContact OD1-CG 3.44Å; D1695-M1764 WeakPolarHBondContact OD1-CG 3.49Å; D1695-K1767 WeakPolarHBondContact OD2-CD 3.19Å; D1695-K1767 WeakPolarHBondContact OD2-CE 3.05Å; D1695-K1767 IonicContact OD2-NZ 3.36Å; D1695-K1767 PolarHBondContact OD2-NZ 3.23Å
1696D82.6Confident83Confident146 Ų14633.6 Ų33.678%0.78118%0.179SC*.G310 helixtrans-74.5-23.4-175.6-59.5-31.1000112.9L1694L1694-D1696 VanDerWaalsContact C-N 3.27Å; L1694-D1696 PolarHBondContact O-N 3.28Å
1697F83Confident83Confident34.8 Ų34.839.2 Ų39.215%0.15320%0.199CC..G310 helixtrans-98.80.8-178.1-49.7-67000112.9A1558 H1559 V1562 L1694 D1695 G1699 Q1700 I1701A1558-F1697 HydrophobicContact CB-CE2 4.12Å; H1559-F1697 HydrophobicContact CB-CE1 3.69Å; H1559-F1697 HydrophobicContact CB-CZ 3.6Å; V1562-F1697 HydrophobicContact CG1-CB 3.97Å; V1562-F1697 HydrophobicContact CG1-CG 4.41Å; L1694-F1697 HydrophobicContact CD2-CD2 3.98Å; L1694-F1697 PolarHBondContact O-N 3.14Å; L1694-F1697 VanDerWaalsContact O-N 3.09Å; D1695-F1697 VanDerWaalsContact C-N 3.32Å; D1695-F1697 PolarHBondContact O-N 3.11Å; F1697-G1699 VanDerWaalsContact C-N 3.27Å; F1697-G1699 PolarHBondContact O-N 3.2Å; F1697-G1699 VanDerWaalsContact O-N 3.16Å; F1697-Q1700 WeakPolarHBondContact O-CA 3.27Å; F1697-Q1700 WeakPolarHBondContact O-CB 3.43Å; F1697-Q1700 PolarHBondContact O-N 3.25Å; F1697-I1701 HydrophobicContact CB-CD1 4.34Å; F1697-I1701 WeakPolarHBondContact O-CG1 3.46Å; F1697-I1701 PolarHBondContact O-N 3.28Å; F1697-I1701 VanDerWaalsContact O-N 3.12Å
1698A84.3Confident82.9Confident0.6 Ų0.637.3 Ų37.31%0.00519%0.193CC..Hα-helixtrans-53.1-42.1-175.700000112.8L1694 D1695 Q1700 I1701 I1702 L1760 M1764 F1771L1694-A1698 PolarHBondContact O-N 3.1Å; L1694-A1698 VanDerWaalsContact O-N 3.13Å; D1695-A1698 WeakPolarHBondContact O-CB 3.25Å; D1695-A1698 PolarHBondContact O-N 3.09Å; A1698-Q1700 PolarHBondContact O-N 3.05Å; A1698-I1701 PolarHBondContact O-N 3.14Å; A1698-I1702 HydrophobicContact CB-CD1 4.2Å; A1698-I1702 VanDerWaalsContact O-CB 3.29Å; A1698-I1702 WeakPolarHBondContact O-CB 3.37Å; A1698-I1702 WeakPolarHBondContact O-CD1 3.43Å; A1698-I1702 WeakPolarHBondContact O-CG1 3.29Å; A1698-I1702 PolarHBondContact O-N 3.22Å; A1698-L1760 HydrophobicContact CB-CD2 4.32Å; A1698-M1764 HydrophobicContact CB-CE 3.61Å; A1698-M1764 HydrophobicContact CB-SD 3.39Å; A1698-M1764 WeakPolarHBondContact CB-SD 3.36Å; A1698-F1771 HydrophobicContact CB-CE2 4.11Å; A1698-F1771 HydrophobicContact CB-CZ 4.45Å
1699G84.9Confident82.8Confident18.6 Ų18.637.2 Ų37.219%0.19219%0.192CC..Hα-helixtrans-61.9-42175.900000113.1F1697 I1701 H1703F1697-G1699 VanDerWaalsContact C-N 3.27Å; F1697-G1699 PolarHBondContact O-N 3.2Å; F1697-G1699 VanDerWaalsContact O-N 3.16Å; G1699-I1701 VanDerWaalsContact C-N 3.26Å; G1699-I1701 PolarHBondContact O-N 3.15Å; G1699-H1703 WeakPolarHBondContact O-CB 3.36Å; G1699-H1703 PolarHBondContact O-CD2 2.98Å; G1699-H1703 PolarHBondContact O-N 3.14Å; G1699-H1703 VanDerWaalsContact O-N 3.11Å
1700Q84.6Confident82.9Confident93.6 Ų93.638.8 Ų38.844%0.43720%0.201SC..Hα-helixtrans-69.5-21.6179.4-63.1179.1-1.100113.1S1566 F1697 A1698 P1704S1566-Q1700 WeakPolarHBondContact CB-O 3.34Å; S1566-Q1700 PolarHBondContact OG-O 3.17Å; F1697-Q1700 WeakPolarHBondContact O-CA 3.27Å; F1697-Q1700 WeakPolarHBondContact O-CB 3.43Å; F1697-Q1700 PolarHBondContact O-N 3.25Å; A1698-Q1700 PolarHBondContact O-N 3.05Å; Q1700-P1704 WeakPolarHBondContact O-CD 3.37Å; Q1700-P1704 VanDerWaalsContact O-CG 3.22Å; Q1700-P1704 WeakPolarHBondContact O-CG 3.33Å
1701I86.1Confident83Confident0.8 Ų0.838.5 Ų38.50%0.00420%0.2CC..Hα-helixtrans-90.8-48176.6-63.3166.4000110.6V1562 L1685 L1694 F1697 A1698 G1699 H1703 P1704 I1705 V1756 L1760V1562-I1701 HydrophobicContact CG1-CD1 3.85Å; V1562-I1701 HydrophobicContact CG1-CG1 3.76Å; L1685-I1701 HydrophobicContact CD1-CG1 4.44Å; L1685-I1701 HydrophobicContact CD1-CG2 4.1Å; L1685-I1701 HydrophobicContact CD2-CD1 4.38Å; L1685-I1701 HydrophobicContact CD2-CG1 4.44Å; L1694-I1701 HydrophobicContact CB-CD1 4.4Å; L1694-I1701 HydrophobicContact CD1-CD1 4.02Å; F1697-I1701 HydrophobicContact CB-CD1 4.34Å; F1697-I1701 WeakPolarHBondContact O-CG1 3.46Å; F1697-I1701 PolarHBondContact O-N 3.28Å; F1697-I1701 VanDerWaalsContact O-N 3.12Å; A1698-I1701 PolarHBondContact O-N 3.14Å; G1699-I1701 VanDerWaalsContact C-N 3.26Å; G1699-I1701 PolarHBondContact O-N 3.15Å; I1701-H1703 PolarHBondContact O-N 3.42Å; I1701-P1704 WeakPolarHBondContact O-CD 3.43Å; I1701-I1705 HydrophobicContact CG2-CD1 3.72Å; I1701-I1705 WeakPolarHBondContact O-CD1 3.31Å; I1701-I1705 VanDerWaalsContact O-CG1 3.26Å; I1701-I1705 WeakPolarHBondContact O-CG1 3.39Å; I1701-I1705 PolarHBondContact O-N 3.14Å; I1701-V1756 HydrophobicContact CG2-CG1 3.73Å; I1701-L1760 HydrophobicContact CB-CD1 4.33Å; I1701-L1760 HydrophobicContact CD1-CD2 4.47Å; I1701-L1760 HydrophobicContact CG2-CD1 3.94Å
1702I86.9Confident83.1Confident0 Ų035.5 Ų35.50%018%0.18CC..Hα-helixtrans-67.8-40.9-173.8-65.7166.9000111.2A1698 I1705 C1706 L1757 L1760 F1768 F1771 L1774 V1775A1698-I1702 HydrophobicContact CB-CD1 4.2Å; A1698-I1702 VanDerWaalsContact O-CB 3.29Å; A1698-I1702 WeakPolarHBondContact O-CB 3.37Å; A1698-I1702 WeakPolarHBondContact O-CD1 3.43Å; A1698-I1702 WeakPolarHBondContact O-CG1 3.29Å; A1698-I1702 PolarHBondContact O-N 3.22Å; I1702-I1705 PolarHBondContact O-N 3.14Å; I1702-C1706 WeakPolarHBondContact O-CB 3.28Å; I1702-C1706 PolarHBondContact O-N 3.15Å; I1702-C1706 PolarHBondContact O-SG 3.25Å; I1702-C1706 VanDerWaalsContact O-SG 3.37Å; I1702-L1757 HydrophobicContact CB-CD2 4.47Å; I1702-L1757 HydrophobicContact CG1-CD2 4Å; I1702-L1757 HydrophobicContact CG2-CD2 4.28Å; I1702-L1760 HydrophobicContact CD1-CD1 4.24Å; I1702-L1760 HydrophobicContact CG1-CD1 3.92Å; I1702-F1768 HydrophobicContact CD1-CD2 4.44Å; I1702-F1768 HydrophobicContact CD1-CE2 3.81Å; I1702-F1768 HydrophobicContact CD1-CZ 4.37Å; I1702-F1771 HydrophobicContact CD1-CB 3.88Å; I1702-F1771 HydrophobicContact CD1-CD1 4.15Å; I1702-F1771 HydrophobicContact CD1-CD2 3.89Å; I1702-F1771 HydrophobicContact CD1-CE2 4.43Å; I1702-F1771 HydrophobicContact CD1-CG 3.69Å; I1702-F1771 HydrophobicContact CG2-CB 4.48Å; I1702-F1771 HydrophobicContact CG2-CD1 4.41Å; I1702-L1774 HydrophobicContact CG2-CD2 4.1Å; I1702-V1775 HydrophobicContact CG2-CG2 4.07Å
1703H88Confident83.1Confident86 Ų8635.7 Ų35.740%0.39818%0.18SC..Hα-helixtrans-63.2-49.2-177-73.5-56.7000113.4G1699 I1701 I1705 C1706 R1707 L1774G1699-H1703 WeakPolarHBondContact O-CB 3.36Å; G1699-H1703 PolarHBondContact O-CD2 2.98Å; G1699-H1703 PolarHBondContact O-N 3.14Å; G1699-H1703 VanDerWaalsContact O-N 3.11Å; I1701-H1703 PolarHBondContact O-N 3.42Å; H1703-I1705 PolarHBondContact O-N 3.3Å; H1703-C1706 PolarHBondContact O-N 3.22Å; H1703-R1707 WeakPolarHBondContact O-CB 3.32Å; H1703-R1707 VanDerWaalsContact O-CG 3.26Å; H1703-R1707 WeakPolarHBondContact O-CG 3.33Å; H1703-R1707 PolarHBondContact O-N 3.34Å; H1703-L1774 WeakPolarHBondContact ND1-CD2 3.44Å
1704P84.8Confident83.1Confident9.6 Ų9.634.2 Ų34.26%0.06218%0.176CC..Hα-helixtrans-62-39.9175.6-28.839.4000113.5S1566 I1569 D1570 Q1700 I1701 C1706 R1707 L1708S1566-P1704 WeakPolarHBondContact OG-CG 3.39Å; I1569-P1704 HydrophobicContact CB-CB 4.48Å; I1569-P1704 HydrophobicContact CG2-CB 4.25Å; D1570-P1704 HydrophobicContact CB-CB 4.04Å; D1570-P1704 HydrophobicContact CB-CG 4.16Å; Q1700-P1704 WeakPolarHBondContact O-CD 3.37Å; Q1700-P1704 VanDerWaalsContact O-CG 3.22Å; Q1700-P1704 WeakPolarHBondContact O-CG 3.33Å; I1701-P1704 WeakPolarHBondContact O-CD 3.43Å; P1704-C1706 PolarHBondContact O-N 3.07Å; P1704-R1707 PolarHBondContact O-N 3.14Å; P1704-L1708 VanDerWaalsContact O-CB 3.27Å; P1704-L1708 WeakPolarHBondContact O-CB 3.42Å; P1704-L1708 PolarHBondContact O-N 2.96Å
1705I85.3Confident82.8Confident2.4 Ų2.435.1 Ų35.11%0.01218%0.183CC..Hα-helixtrans-61-49176.8-66.3173.5000110.7I1569 L1682 I1701 I1702 H1703 R1707 L1708 L1709 A1753 V1756 L1757I1569-I1705 HydrophobicContact CG2-CG1 4.43Å; L1682-I1705 HydrophobicContact CD2-CD1 3.85Å; L1682-I1705 HydrophobicContact CD2-CG1 3.8Å; I1701-I1705 HydrophobicContact CG2-CD1 3.72Å; I1701-I1705 WeakPolarHBondContact O-CD1 3.31Å; I1701-I1705 VanDerWaalsContact O-CG1 3.26Å; I1701-I1705 WeakPolarHBondContact O-CG1 3.39Å; I1701-I1705 PolarHBondContact O-N 3.14Å; I1702-I1705 PolarHBondContact O-N 3.14Å; H1703-I1705 PolarHBondContact O-N 3.3Å; I1705-R1707 VanDerWaalsContact C-N 3.34Å; I1705-R1707 PolarHBondContact O-N 3.1Å; I1705-L1708 PolarHBondContact O-N 3.15Å; I1705-L1709 HydrophobicContact CG2-CD1 4.17Å; I1705-L1709 WeakPolarHBondContact O-CG 3.33Å; I1705-L1709 PolarHBondContact O-N 3.23Å; I1705-L1709 VanDerWaalsContact O-N 3.08Å; I1705-A1753 HydrophobicContact CG2-CB 3.86Å; I1705-V1756 HydrophobicContact CD1-CB 4.22Å; I1705-V1756 HydrophobicContact CD1-CG1 3.82Å; I1705-V1756 HydrophobicContact CD1-CG2 4.47Å; I1705-L1757 HydrophobicContact CG2-CD1 4.5Å
1706C84.8Confident82.6Confident3.6 Ų3.634.9 Ų34.92%0.02418%0.181CC..Hα-helixtrans-65.3-39178.5-71.70000112I1702 H1703 P1704 L1710 L1774I1702-C1706 WeakPolarHBondContact O-CB 3.28Å; I1702-C1706 PolarHBondContact O-N 3.15Å; I1702-C1706 PolarHBondContact O-SG 3.25Å; I1702-C1706 VanDerWaalsContact O-SG 3.37Å; H1703-C1706 PolarHBondContact O-N 3.22Å; P1704-C1706 PolarHBondContact O-N 3.07Å; C1706-L1710 VanDerWaalsContact O-CB 3.24Å; C1706-L1710 WeakPolarHBondContact O-CB 3.33Å; C1706-L1710 WeakPolarHBondContact O-CD1 3.42Å; C1706-L1710 WeakPolarHBondContact O-CG 3.35Å; C1706-L1710 PolarHBondContact O-N 3.24Å; C1706-L1774 HydrophobicContact CB-CD1 4.49Å; C1706-L1774 HydrophobicContact CB-CD2 4.11Å; C1706-L1774 HydrophobicContact CB-CG 4.42Å; C1706-L1774 WeakPolarHBondContact SG-CD2 3.15Å
1707R84.5Confident82.2Confident121.6 Ų121.631.6 Ų31.646%0.45916%0.16SC..Hα-helixtrans-63.8-46.4175.9-133.6-179.4-99.8158.61.1111.3D1570 T1572 H1703 P1704 I1705 L1709 L1710 T1711D1570-R1707 WeakPolarHBondContact OD1-CD 3.31Å; D1570-R1707 IonicContact OD1-CZ 3Å; D1570-R1707 IonicContact OD1-NE 2.78Å; D1570-R1707 IonicContact OD1-NH1 2.73Å; D1570-R1707 PolarHBondContact OD1-NH1 3.02Å; D1570-R1707 IonicContact OD2-CZ 2.96Å; D1570-R1707 IonicContact OD2-NH1 3.01Å; D1570-R1707 PolarHBondContact OD2-NH1 3.19Å; D1570-R1707 IonicContact OD2-NH2 2.81Å; T1572-R1707 HydrophobicContact CG2-CG 4.48Å; H1703-R1707 WeakPolarHBondContact O-CB 3.32Å; H1703-R1707 VanDerWaalsContact O-CG 3.26Å; H1703-R1707 WeakPolarHBondContact O-CG 3.33Å; H1703-R1707 PolarHBondContact O-N 3.34Å; P1704-R1707 PolarHBondContact O-N 3.14Å; I1705-R1707 VanDerWaalsContact C-N 3.34Å; I1705-R1707 PolarHBondContact O-N 3.1Å; R1707-L1709 PolarHBondContact O-N 3.08Å; R1707-L1710 PolarHBondContact O-N 3.04Å; R1707-T1711 HydrophobicContact CG-CG2 4.21Å; R1707-T1711 VanDerWaalsContact O-CB 3.28Å; R1707-T1711 WeakPolarHBondContact O-CB 3.34Å; R1707-T1711 VanDerWaalsContact O-CG2 3.31Å; R1707-T1711 WeakPolarHBondContact O-CG2 3.38Å; R1707-T1711 PolarHBondContact O-N 3.38Å; R1707-T1711 PolarHBondContact O-OG1 3.19Å
1708L81.9Confident81.7Confident3.2 Ų3.232.6 Ų32.62%0.01717%0.172CC..Hα-helixtrans-57.4-51177.717460000111.5I1569 I1571 L1580 P1704 I1705 T1711 L1712 L1749I1569-L1708 HydrophobicContact CG2-CD2 3.82Å; I1571-L1708 HydrophobicContact CD1-CD1 3.23Å; I1571-L1708 HydrophobicContact CD1-CG 4.46Å; I1571-L1708 HydrophobicContact CG1-CD1 3.67Å; L1580-L1708 HydrophobicContact CD1-CD1 4.37Å; P1704-L1708 VanDerWaalsContact O-CB 3.27Å; P1704-L1708 WeakPolarHBondContact O-CB 3.42Å; P1704-L1708 PolarHBondContact O-N 2.96Å; I1705-L1708 PolarHBondContact O-N 3.15Å; L1708-T1711 PolarHBondContact O-N 3.19Å; L1708-T1711 PolarHBondContact O-OG1 3.04Å; L1708-T1711 VanDerWaalsContact O-OG1 3.07Å; L1708-L1712 HydrophobicContact CD1-CD1 3.98Å; L1708-L1712 HydrophobicContact CD1-CG 4.39Å; L1708-L1712 HydrophobicContact CG-CD1 4.29Å; L1708-L1712 WeakPolarHBondContact O-CB 3.41Å; L1708-L1712 WeakPolarHBondContact O-CD1 3.49Å; L1708-L1712 VanDerWaalsContact O-CG 3.28Å; L1708-L1712 WeakPolarHBondContact O-CG 3.38Å; L1708-L1712 PolarHBondContact O-N 3.03Å; L1708-L1712 VanDerWaalsContact O-N 3.09Å; L1708-L1749 HydrophobicContact CD1-CD1 4.35Å; L1708-L1749 HydrophobicContact CD2-CD1 4.24Å; L1708-L1749 HydrophobicContact CG-CD1 4.47Å
1709L82.8Confident81Confident3.8 Ų3.835.6 Ų35.62%0.0218%0.184CC..Hα-helixtrans-68.9-40.6-178.1-65.7175.8000112.6I1705 R1707 L1712 E1713 L1749 A1753 M1778 L1782I1705-L1709 HydrophobicContact CG2-CD1 4.17Å; I1705-L1709 WeakPolarHBondContact O-CG 3.33Å; I1705-L1709 PolarHBondContact O-N 3.23Å; I1705-L1709 VanDerWaalsContact O-N 3.08Å; R1707-L1709 PolarHBondContact O-N 3.08Å; L1709-L1712 PolarHBondContact O-N 2.7Å; L1709-E1713 WeakPolarHBondContact O-CB 3.39Å; L1709-E1713 PolarHBondContact O-N 3.11Å; L1709-E1713 VanDerWaalsContact O-N 3.1Å; L1709-L1749 HydrophobicContact CD2-CB 4.33Å; L1709-A1753 HydrophobicContact CD1-CB 4.05Å; L1709-M1778 HydrophobicContact CB-CG 4.48Å; L1709-M1778 HydrophobicContact CD1-CE 4.37Å; L1709-M1778 HydrophobicContact CD1-SD 4.07Å; L1709-L1782 HydrophobicContact CB-CD1 3.85Å; L1709-L1782 HydrophobicContact CD1-CD1 4.44Å
1710L83.6Confident80.3Confident40.4 Ų40.439 Ų3921%0.21219%0.194CC..Hα-helixtrans-70.2-33.9178.3-71.1171.8000112.9C1706 R1707 E1713 S1714 M1778 R1781C1706-L1710 VanDerWaalsContact O-CB 3.24Å; C1706-L1710 WeakPolarHBondContact O-CB 3.33Å; C1706-L1710 WeakPolarHBondContact O-CD1 3.42Å; C1706-L1710 WeakPolarHBondContact O-CG 3.35Å; C1706-L1710 PolarHBondContact O-N 3.24Å; R1707-L1710 PolarHBondContact O-N 3.04Å; L1710-E1713 WeakPolarHBondContact CD2-OE2 3.49Å; L1710-E1713 PolarHBondContact O-N 3.3Å; L1710-S1714 WeakPolarHBondContact O-CB 3.42Å; L1710-S1714 PolarHBondContact O-N 3.27Å; L1710-S1714 PolarHBondContact O-OG 3.02Å; L1710-M1778 HydrophobicContact CD2-CB 4.4Å; L1710-M1778 HydrophobicContact CD2-CG 4.42Å; L1710-M1778 HydrophobicContact CG-CB 4.45Å; L1710-M1778 HydrophobicContact CG-CG 4.3Å; L1710-R1781 HydrophobicContact CD2-CB 4.37Å
1711T81.2Confident79.5Confident40.8 Ų40.840.6 Ų40.625%0.2520%0.202SC..Hα-helixtrans-69.6-42.6175.450.20000111.1I1571 R1707 L1708 E1713 S1714 C1715I1571-T1711 WeakPolarHBondContact CD1-OG1 3.36Å; R1707-T1711 HydrophobicContact CG-CG2 4.21Å; R1707-T1711 VanDerWaalsContact O-CB 3.28Å; R1707-T1711 WeakPolarHBondContact O-CB 3.34Å; R1707-T1711 VanDerWaalsContact O-CG2 3.31Å; R1707-T1711 WeakPolarHBondContact O-CG2 3.38Å; R1707-T1711 PolarHBondContact O-N 3.38Å; R1707-T1711 PolarHBondContact O-OG1 3.19Å; L1708-T1711 PolarHBondContact O-N 3.19Å; L1708-T1711 PolarHBondContact O-OG1 3.04Å; L1708-T1711 VanDerWaalsContact O-OG1 3.07Å; T1711-E1713 VanDerWaalsContact C-N 3.3Å; T1711-E1713 PolarHBondContact O-N 2.9Å; T1711-S1714 WeakPolarHBondContact CA-OG 3.41Å; T1711-S1714 PolarHBondContact O-N 3.02Å; T1711-S1714 VanDerWaalsContact O-N 3.15Å; T1711-S1714 PolarHBondContact O-OG 3.2Å; T1711-S1714 VanDerWaalsContact O-OG 3.04Å; T1711-C1715 VanDerWaalsContact O-CB 3.31Å; T1711-C1715 WeakPolarHBondContact O-CB 3.29Å; T1711-C1715 PolarHBondContact O-N 3.22Å; T1711-C1715 PolarHBondContact O-SG 3.42Å; T1711-C1715 VanDerWaalsContact O-SG 3.38Å
1712L78Confident78.4Confident0.4 Ų0.444.9 Ų44.90%0.00222%0.224CC..Hα-helixtrans-60-40.3172.4-71.9170.1000112I1571 L1577 L1580 L1581 L1708 L1709 C1715 H1716 A1745 I1746 L1749I1571-L1712 HydrophobicContact CD1-CG 4.5Å; L1577-L1712 HydrophobicContact CD1-CD2 4.06Å; L1577-L1712 HydrophobicContact CD2-CD2 4.18Å; L1580-L1712 HydrophobicContact CD1-CD2 4.44Å; L1580-L1712 HydrophobicContact CD2-CD2 4.03Å; L1581-L1712 HydrophobicContact CD2-CD2 4.35Å; L1708-L1712 HydrophobicContact CD1-CD1 3.98Å; L1708-L1712 HydrophobicContact CD1-CG 4.39Å; L1708-L1712 HydrophobicContact CG-CD1 4.29Å; L1708-L1712 WeakPolarHBondContact O-CB 3.41Å; L1708-L1712 WeakPolarHBondContact O-CD1 3.49Å; L1708-L1712 VanDerWaalsContact O-CG 3.28Å; L1708-L1712 WeakPolarHBondContact O-CG 3.38Å; L1708-L1712 PolarHBondContact O-N 3.03Å; L1708-L1712 VanDerWaalsContact O-N 3.09Å; L1709-L1712 PolarHBondContact O-N 2.7Å; L1712-C1715 PolarHBondContact O-N 3.3Å; L1712-H1716 WeakPolarHBondContact O-CB 3.39Å; L1712-H1716 PolarHBondContact O-N 3.32Å; L1712-H1716 VanDerWaalsContact O-N 3.07Å; L1712-A1745 HydrophobicContact CD1-CB 4.41Å; L1712-A1745 HydrophobicContact CD2-CB 4.36Å; L1712-I1746 HydrophobicContact CB-CD1 4.01Å; L1712-I1746 HydrophobicContact CB-CG1 3.74Å; L1712-I1746 HydrophobicContact CD1-CG1 4.21Å; L1712-L1749 HydrophobicContact CD1-CD1 3.97Å
1713E77.7Confident77.2Confident13.2 Ų13.247.9 Ų47.96%0.06224%0.24CC..Hα-helixtrans-64.6-44.9175.1-168-155.1142.600112.2L1709 L1710 T1711 C1715 H1716 Q1717 R1781 L1782L1709-E1713 WeakPolarHBondContact O-CB 3.39Å; L1709-E1713 PolarHBondContact O-N 3.11Å; L1709-E1713 VanDerWaalsContact O-N 3.1Å; L1710-E1713 WeakPolarHBondContact CD2-OE2 3.49Å; L1710-E1713 PolarHBondContact O-N 3.3Å; T1711-E1713 VanDerWaalsContact C-N 3.3Å; T1711-E1713 PolarHBondContact O-N 2.9Å; E1713-C1715 VanDerWaalsContact C-N 3.29Å; E1713-C1715 PolarHBondContact O-N 3.14Å; E1713-H1716 WeakPolarHBondContact O-CB 3.31Å; E1713-H1716 PolarHBondContact O-N 3.14Å; E1713-Q1717 WeakPolarHBondContact O-CG 3.38Å; E1713-Q1717 PolarHBondContact O-N 3.24Å; E1713-Q1717 PolarHBondContact OE1-NE2 3.02Å; E1713-Q1717 VanDerWaalsContact OE1-NE2 3.16Å; E1713-R1781 WeakPolarHBondContact OE1-CB 3.31Å; E1713-R1781 IonicContact OE1-CZ 3.16Å; E1713-R1781 IonicContact OE1-NE 3.1Å; E1713-R1781 PolarHBondContact OE1-NE 3.05Å; E1713-R1781 IonicContact OE1-NH2 3.25Å; E1713-R1781 PolarHBondContact OE1-NH2 2.84Å; E1713-R1781 VanDerWaalsContact OE2-CB 3.27Å; E1713-R1781 WeakPolarHBondContact OE2-CB 3.35Å; E1713-R1781 IonicContact OE2-CZ 3.28Å; E1713-R1781 IonicContact OE2-NE 3.52Å; E1713-R1781 PolarHBondContact OE2-NE 3.22Å; E1713-R1781 IonicContact OE2-NH2 3.22Å; E1713-R1781 PolarHBondContact OE2-NH2 2.88Å; E1713-L1782 HydrophobicContact CB-CD2 3.96Å; E1713-L1782 HydrophobicContact CB-CG 4.46Å; E1713-L1782 HydrophobicContact CG-CD2 4.02Å; E1713-L1782 HydrophobicContact CG-CG 4.34Å
1714S78Confident75.8Confident54.6 Ų54.651 Ų5138%0.38225%0.254SS..Hα-helixtrans-63.6-36.7177.466.90000112.2L1710 T1711 Q1717 S1718L1710-S1714 WeakPolarHBondContact O-CB 3.42Å; L1710-S1714 PolarHBondContact O-N 3.27Å; L1710-S1714 PolarHBondContact O-OG 3.02Å; T1711-S1714 WeakPolarHBondContact CA-OG 3.41Å; T1711-S1714 PolarHBondContact O-N 3.02Å; T1711-S1714 VanDerWaalsContact O-N 3.15Å; T1711-S1714 PolarHBondContact O-OG 3.2Å; T1711-S1714 VanDerWaalsContact O-OG 3.04Å; S1714-Q1717 PolarHBondContact O-N 3.22Å; S1714-S1718 PolarHBondContact O-N 3.22Å; S1714-S1718 PolarHBondContact O-OG 3.23Å; S1714-S1718 VanDerWaalsContact O-OG 3.1Å
1715C74.8Confident74.4Confident21.8 Ų21.858.5 Ų58.515%0.14729%0.288CS..Hα-helixtrans-65.4-43.8173.6-132.50000111.3T1711 L1712 E1713 Q1717 S1718 Y1719 C1742T1711-C1715 VanDerWaalsContact O-CB 3.31Å; T1711-C1715 WeakPolarHBondContact O-CB 3.29Å; T1711-C1715 PolarHBondContact O-N 3.22Å; T1711-C1715 PolarHBondContact O-SG 3.42Å; T1711-C1715 VanDerWaalsContact O-SG 3.38Å; L1712-C1715 PolarHBondContact O-N 3.3Å; E1713-C1715 VanDerWaalsContact C-N 3.29Å; E1713-C1715 PolarHBondContact O-N 3.14Å; C1715-Q1717 VanDerWaalsContact C-N 3.33Å; C1715-Q1717 PolarHBondContact O-N 3.19Å; C1715-S1718 WeakPolarHBondContact CA-OG 3Å; C1715-S1718 PolarHBondContact O-N 3.25Å; C1715-S1718 PolarHBondContact O-OG 3.25Å; C1715-S1718 VanDerWaalsContact O-OG 3.05Å; C1715-Y1719 VanDerWaalsContact O-CD2 3.24Å; C1715-Y1719 WeakPolarHBondContact O-CD2 3.31Å; C1715-Y1719 PolarHBondContact O-N 3.21Å; C1715-Y1719 VanDerWaalsContact O-N 3.1Å; C1715-Y1719 VanDerWaalsContact SG-CE2 3.6Å; C1715-Y1719 WeakPolarHBondContact SG-CE2 3.33Å; C1715-C1742 VanDerWaalsContact SG-SG 3.64Å
1716H75.8Confident72.5Confident37.4 Ų37.463.3 Ų63.317%0.17331%0.311CS..Hα-helixtrans-58.3-43.8173.7179.275000111.9L1712 E1713 S1718 Y1719 Q1720 S1739 C1742 I1746L1712-H1716 WeakPolarHBondContact O-CB 3.39Å; L1712-H1716 PolarHBondContact O-N 3.32Å; L1712-H1716 VanDerWaalsContact O-N 3.07Å; E1713-H1716 WeakPolarHBondContact O-CB 3.31Å; E1713-H1716 PolarHBondContact O-N 3.14Å; H1716-S1718 PolarHBondContact O-N 3.21Å; H1716-Y1719 PolarHBondContact O-N 2.95Å; H1716-Q1720 PolarHBondContact NE2-NE2 3.23Å; H1716-Q1720 VanDerWaalsContact NE2-NE2 3.13Å; H1716-Q1720 WeakPolarHBondContact O-CB 3.4Å; H1716-Q1720 WeakPolarHBondContact O-CG 3.34Å; H1716-Q1720 PolarHBondContact O-N 3.2Å; H1716-Q1720 VanDerWaalsContact O-N 3.1Å; H1716-S1739 PolarHBondContact CE1-OG 3.27Å; H1716-S1739 PolarHBondContact ND1-O 3.33Å; H1716-S1739 PolarHBondContact ND1-OG 3.04Å; H1716-S1739 VanDerWaalsContact ND1-OG 3.13Å; H1716-C1742 HydrophobicContact CB-CB 3.95Å; H1716-I1746 HydrophobicContact CB-CD1 4.44Å
1717Q75Confident70.5Confident75.6 Ų75.671.4 Ų71.435%0.35335%0.348SS..Hα-helixtrans-64.4-41.3176.9-74171.81.300112.6E1713 S1714 C1715 Y1719 Q1720 Q1721E1713-Q1717 WeakPolarHBondContact O-CG 3.38Å; E1713-Q1717 PolarHBondContact O-N 3.24Å; E1713-Q1717 PolarHBondContact OE1-NE2 3.02Å; E1713-Q1717 VanDerWaalsContact OE1-NE2 3.16Å; S1714-Q1717 PolarHBondContact O-N 3.22Å; C1715-Q1717 VanDerWaalsContact C-N 3.33Å; C1715-Q1717 PolarHBondContact O-N 3.19Å; Q1717-Y1719 PolarHBondContact O-N 2.84Å; Q1717-Q1720 WeakPolarHBondContact O-CB 3.41Å; Q1717-Q1720 PolarHBondContact O-N 3.02Å; Q1717-Q1720 VanDerWaalsContact O-N 3.15Å; Q1717-Q1721 WeakPolarHBondContact O-CB 3.46Å; Q1717-Q1721 VanDerWaalsContact O-CG 3.28Å; Q1717-Q1721 WeakPolarHBondContact O-CG 3.37Å; Q1717-Q1721 PolarHBondContact O-N 3.14Å
1718S72.8Confident68.3Low56.4 Ų56.473.5 Ų73.539%0.39436%0.363SS..Hα-helixtrans-63.8-41.9176.720.60000112.2S1714 C1715 H1716 Q1720 Q1721 L1722S1714-S1718 PolarHBondContact O-N 3.22Å; S1714-S1718 PolarHBondContact O-OG 3.23Å; S1714-S1718 VanDerWaalsContact O-OG 3.1Å; C1715-S1718 WeakPolarHBondContact CA-OG 3Å; C1715-S1718 PolarHBondContact O-N 3.25Å; C1715-S1718 PolarHBondContact O-OG 3.25Å; C1715-S1718 VanDerWaalsContact O-OG 3.05Å; H1716-S1718 PolarHBondContact O-N 3.21Å; S1718-Q1720 VanDerWaalsContact C-N 3.32Å; S1718-Q1720 PolarHBondContact O-N 3.13Å; S1718-Q1721 PolarHBondContact O-N 3.01Å; S1718-L1722 WeakPolarHBondContact O-CG 3.38Å; S1718-L1722 PolarHBondContact O-N 3.1Å; S1718-L1722 VanDerWaalsContact O-N 3.09Å
1719Y70.5Confident66.1Low64.6 Ų64.680.3 Ų80.325%0.25340%0.398SS..Hα-helixtrans-64.8-36.6173.2-76.3-61.9000112.3L1581 L1628 C1715 H1716 Q1717 L1722 L1723 A1735L1581-Y1719 HydrophobicContact CD1-CE2 4.31Å; L1628-Y1719 HydrophobicContact CD2-CE1 4.11Å; C1715-Y1719 VanDerWaalsContact O-CD2 3.24Å; C1715-Y1719 WeakPolarHBondContact O-CD2 3.31Å; C1715-Y1719 PolarHBondContact O-N 3.21Å; C1715-Y1719 VanDerWaalsContact O-N 3.1Å; C1715-Y1719 VanDerWaalsContact SG-CE2 3.6Å; C1715-Y1719 WeakPolarHBondContact SG-CE2 3.33Å; H1716-Y1719 PolarHBondContact O-N 2.95Å; Q1717-Y1719 PolarHBondContact O-N 2.84Å; Y1719-L1722 HydrophobicContact CD1-CD1 4.46Å; Y1719-L1722 PolarHBondContact O-N 3.27Å; Y1719-L1723 WeakPolarHBondContact O-CD1 3.46Å; Y1719-L1723 WeakPolarHBondContact O-CG 3.38Å; Y1719-L1723 PolarHBondContact O-N 3.15Å; Y1719-L1723 VanDerWaalsContact O-N 3.1Å; Y1719-A1735 HydrophobicContact CD1-CB 4.33Å
1720Q68.8Low64.2Low90 Ų9085.8 Ų85.842%0.42144%0.437SS..Hα-helixtrans-69.3-35.4176.4-149.9-1791.700112.8H1716 Q1717 S1718 L1723 H1724H1716-Q1720 PolarHBondContact NE2-NE2 3.23Å; H1716-Q1720 VanDerWaalsContact NE2-NE2 3.13Å; H1716-Q1720 WeakPolarHBondContact O-CB 3.4Å; H1716-Q1720 WeakPolarHBondContact O-CG 3.34Å; H1716-Q1720 PolarHBondContact O-N 3.2Å; H1716-Q1720 VanDerWaalsContact O-N 3.1Å; Q1717-Q1720 WeakPolarHBondContact O-CB 3.41Å; Q1717-Q1720 PolarHBondContact O-N 3.02Å; Q1717-Q1720 VanDerWaalsContact O-N 3.15Å; S1718-Q1720 VanDerWaalsContact C-N 3.32Å; S1718-Q1720 PolarHBondContact O-N 3.13Å; Q1720-L1723 WeakPolarHBondContact O-CB 3.39Å; Q1720-L1723 PolarHBondContact O-N 3.04Å; Q1720-H1724 PolarHBondContact O-CD2 2.91Å; Q1720-H1724 PolarHBondContact O-N 3.04Å; Q1720-H1724 PolarHBondContact O-ND1 2.85Å
1721Q68.2Low62.5Low126.8 Ų126.886.4 Ų86.459%0.59345%0.445SS*.Hα-helixtrans-68.8-40.2174.4-74.1175.80.200112Q1717 S1718 L1723 H1724 Q1725Q1717-Q1721 WeakPolarHBondContact O-CB 3.46Å; Q1717-Q1721 VanDerWaalsContact O-CG 3.28Å; Q1717-Q1721 WeakPolarHBondContact O-CG 3.37Å; Q1717-Q1721 PolarHBondContact O-N 3.14Å; S1718-Q1721 PolarHBondContact O-N 3.01Å; Q1721-L1723 VanDerWaalsContact C-N 3.3Å; Q1721-L1723 PolarHBondContact O-N 3.04Å; Q1721-H1724 PolarHBondContact O-N 3.15Å; Q1721-H1724 VanDerWaalsContact O-N 3.12Å; Q1721-Q1725 WeakPolarHBondContact O-CG 3.16Å; Q1721-Q1725 PolarHBondContact O-N 3.09Å
1722L63.4Low60.9Low90.6 Ų90.688 Ų8847%0.47445%0.454SS..Hα-helixtrans-60.7-35.3173.1-76.6164.4000112.1S1718 Y1719 H1724 Q1725 Q1726 A1735S1718-L1722 WeakPolarHBondContact O-CG 3.38Å; S1718-L1722 PolarHBondContact O-N 3.1Å; S1718-L1722 VanDerWaalsContact O-N 3.09Å; Y1719-L1722 HydrophobicContact CD1-CD1 4.46Å; Y1719-L1722 PolarHBondContact O-N 3.27Å; L1722-H1724 VanDerWaalsContact C-N 3.32Å; L1722-H1724 PolarHBondContact O-N 3.12Å; L1722-Q1725 PolarHBondContact O-N 3.03Å; L1722-Q1726 WeakPolarHBondContact O-CB 3.23Å; L1722-Q1726 PolarHBondContact O-N 3.44Å; L1722-Q1726 VanDerWaalsContact O-N 3.1Å; L1722-A1735 HydrophobicContact CB-CB 4.41Å
1723L61Low59.6Low63.6 Ų63.695.6 Ų95.633%0.33349%0.488SS..Hα-helixtrans-67.3-28.6173.7-75.1164.3000113.4Y1719 Q1720 Q1721 A1735Y1719-L1723 WeakPolarHBondContact O-CD1 3.46Å; Y1719-L1723 WeakPolarHBondContact O-CG 3.38Å; Y1719-L1723 PolarHBondContact O-N 3.15Å; Y1719-L1723 VanDerWaalsContact O-N 3.1Å; Q1720-L1723 WeakPolarHBondContact O-CB 3.39Å; Q1720-L1723 PolarHBondContact O-N 3.04Å; Q1721-L1723 VanDerWaalsContact C-N 3.3Å; Q1721-L1723 PolarHBondContact O-N 3.04Å; L1723-A1735 HydrophobicContact CD2-CB 3.98Å; L1723-A1735 HydrophobicContact CG-CB 3.98Å
1724H58.7Low58.4Low149.6 Ų149.698 Ų9869%0.69351%0.506SS*.Hα-helixtrans-85.2-22-178.8-8788.9000114.3Q1720 Q1721 L1722Q1720-H1724 PolarHBondContact O-CD2 2.91Å; Q1720-H1724 PolarHBondContact O-N 3.04Å; Q1720-H1724 PolarHBondContact O-ND1 2.85Å; Q1721-H1724 PolarHBondContact O-N 3.15Å; Q1721-H1724 VanDerWaalsContact O-N 3.12Å; L1722-H1724 VanDerWaalsContact C-N 3.32Å; L1722-H1724 PolarHBondContact O-N 3.12Å
1725Q55.2Low57.3Low167.4 Ų167.495.8 Ų95.878%0.78249%0.491SS*.Hα-helixtrans-97.1-12.9-173.2-74.1-172.9-1.700115.7Q1721 L1722 H1727Q1721-Q1725 WeakPolarHBondContact O-CG 3.16Å; Q1721-Q1725 PolarHBondContact O-N 3.09Å; L1722-Q1725 PolarHBondContact O-N 3.03Å; Q1725-H1727 PolarHBondContact O-N 3.21Å
1726Q45.2Very low56.7Low104.8 Ų104.897.3 Ų97.349%0.4950%0.502SS..  trans-123.186.7-174-67-167.7-11.800114.2L1722 H1728 S1731 T1732L1722-Q1726 WeakPolarHBondContact O-CB 3.23Å; L1722-Q1726 PolarHBondContact O-N 3.44Å; L1722-Q1726 VanDerWaalsContact O-N 3.1Å; Q1726-H1728 VanDerWaalsContact C-N 3.31Å; Q1726-H1728 PolarHBondContact O-N 2.77Å; Q1726-S1731 VanDerWaalsContact OE1-CB 3.29Å; Q1726-S1731 PolarHBondContact OE1-OG 3.31Å; Q1726-S1731 VanDerWaalsContact OE1-OG 3.09Å; Q1726-T1732 VanDerWaalsContact O-CG2 3.31Å; Q1726-T1732 WeakPolarHBondContact O-CG2 3.33Å
1727H42.6Very low56.1Low172.6 Ų172.6100.9 Ų100.980%0.79952%0.522SS*.  trans-83.75.6178.1-104.1-72.3000115.2Q1725Q1725-H1727 PolarHBondContact O-N 3.21Å
1728H38.9Very low55.6Low165.2 Ų165.297.8 Ų97.877%0.76551%0.51SS*.SBendtrans-137.4114.9179.5-75.4-73.4000113.6Q1726Q1726-H1728 VanDerWaalsContact C-N 3.31Å; Q1726-H1728 PolarHBondContact O-N 2.77Å
1729L36Very low55.5Low145.8 Ų145.895.9 Ų95.976%0.76350%0.496SS*.SBendtrans88.1128.4170.1-7297.2000117.6S1731L1729-S1731 VanDerWaalsContact C-N 3.31Å; L1729-S1731 PolarHBondContact O-N 3.15Å
1730S43.4Very low55.5Low120.6 Ų120.697.5 Ų97.584%0.84351%0.506SS*.SBendtrans15.4-4.5167.757.90000120.7
1731S46.3Very low55.5Low51.8 Ų51.893.8 Ų93.836%0.36249%0.491SS..THydrogen-bonded Turntrans-87.6-7.4-176.5119.90000114.8Q1726 L1729 K1733 S1734Q1726-S1731 VanDerWaalsContact OE1-CB 3.29Å; Q1726-S1731 PolarHBondContact OE1-OG 3.31Å; Q1726-S1731 VanDerWaalsContact OE1-OG 3.09Å; L1729-S1731 VanDerWaalsContact C-N 3.31Å; L1729-S1731 PolarHBondContact O-N 3.15Å; S1731-K1733 VanDerWaalsContact C-N 3.32Å; S1731-K1733 PolarHBondContact O-N 3Å; S1731-K1733 VanDerWaalsContact O-N 3.15Å; S1731-S1734 PolarHBondContact O-N 3.39Å; S1731-S1734 PolarHBondContact O-OG 3.13Å; S1731-S1734 VanDerWaalsContact O-OG 3.06Å
1732T49.1Very low55.7Low74.8 Ų74.887.8 Ų87.846%0.45946%0.463SS..Hα-helixtrans-65.8-27-170.351.90000115.2Q1726 A1735 S1736Q1726-T1732 VanDerWaalsContact O-CG2 3.31Å; Q1726-T1732 WeakPolarHBondContact O-CG2 3.33Å; T1732-A1735 PolarHBondContact O-N 2.9Å; T1732-S1736 WeakPolarHBondContact O-CB 3.46Å; T1732-S1736 PolarHBondContact O-N 3.3Å; T1732-S1736 PolarHBondContact O-OG 3.09Å
1733K49.8Very low56.4Low160.6 Ų160.686.6 Ų86.670%0.69846%0.457SS*.Hα-helixtrans-69.6-43.6-178.4-73.6-174.1178-178.80113.1I1626 S1731 A1735 S1736 L1737I1626-K1733 HydrophobicContact CD1-CB 4.41Å; S1731-K1733 VanDerWaalsContact C-N 3.32Å; S1731-K1733 PolarHBondContact O-N 3Å; S1731-K1733 VanDerWaalsContact O-N 3.15Å; K1733-A1735 VanDerWaalsContact C-N 3.32Å; K1733-A1735 PolarHBondContact O-N 3.17Å; K1733-S1736 PolarHBondContact O-N 3.26Å; K1733-S1736 PolarHBondContact O-OG 3.34Å; K1733-L1737 WeakPolarHBondContact O-CB 3.31Å; K1733-L1737 VanDerWaalsContact O-CD1 3.28Å; K1733-L1737 WeakPolarHBondContact O-CD1 3.3Å; K1733-L1737 PolarHBondContact O-N 2.99Å
1734S52.1Low57.1Low63 Ų6385.8 Ų85.844%0.44145%0.453SS..Hα-helixtrans-67.9-39-178.155.50000111.9S1731 S1736 L1737 G1738S1731-S1734 PolarHBondContact O-N 3.39Å; S1731-S1734 PolarHBondContact O-OG 3.13Å; S1731-S1734 VanDerWaalsContact O-OG 3.06Å; S1734-S1736 VanDerWaalsContact C-N 3.31Å; S1734-S1736 PolarHBondContact O-N 3.21Å; S1734-L1737 PolarHBondContact O-N 2.99Å; S1734-G1738 PolarHBondContact O-N 3.07Å; S1734-G1738 VanDerWaalsContact O-N 3.12Å
1735A54.7Low57.9Low8.2 Ų8.278.7 Ų78.77%0.06842%0.42CS..Hα-helixtrans-65.1-36.9175.400000112.5Y1719 L1722 L1723 T1732 K1733 G1738 S1739Y1719-A1735 HydrophobicContact CD1-CB 4.33Å; L1722-A1735 HydrophobicContact CB-CB 4.41Å; L1723-A1735 HydrophobicContact CD2-CB 3.98Å; L1723-A1735 HydrophobicContact CG-CB 3.98Å; T1732-A1735 PolarHBondContact O-N 2.9Å; K1733-A1735 VanDerWaalsContact C-N 3.32Å; K1733-A1735 PolarHBondContact O-N 3.17Å; A1735-G1738 PolarHBondContact O-N 3.03Å; A1735-S1739 WeakPolarHBondContact O-CB 3.31Å; A1735-S1739 PolarHBondContact O-N 3.12Å; A1735-S1739 VanDerWaalsContact O-N 3.15Å
1736S63.3Low59Low54 Ų5471.3 Ų71.338%0.37839%0.386SS..Hα-helixtrans-68.6-42.4175.870.20000112.9T1732 K1733 S1734 S1739 Q1740T1732-S1736 WeakPolarHBondContact O-CB 3.46Å; T1732-S1736 PolarHBondContact O-N 3.3Å; T1732-S1736 PolarHBondContact O-OG 3.09Å; K1733-S1736 PolarHBondContact O-N 3.26Å; K1733-S1736 PolarHBondContact O-OG 3.34Å; S1734-S1736 VanDerWaalsContact C-N 3.31Å; S1734-S1736 PolarHBondContact O-N 3.21Å; S1736-S1739 PolarHBondContact O-N 3.1Å; S1736-Q1740 VanDerWaalsContact O-CB 3.3Å; S1736-Q1740 WeakPolarHBondContact O-CB 3.29Å; S1736-Q1740 PolarHBondContact O-N 3.14Å
1737L62Low60.7Low113.8 Ų113.869.3 Ų69.360%0.59638%0.378SS*.Hα-helixtrans-63.8-43.3175.8-96.898.6000111.5K1733 S1734 S1739 Q1740 A1741K1733-L1737 WeakPolarHBondContact O-CB 3.31Å; K1733-L1737 VanDerWaalsContact O-CD1 3.28Å; K1733-L1737 WeakPolarHBondContact O-CD1 3.3Å; K1733-L1737 PolarHBondContact O-N 2.99Å; S1734-L1737 PolarHBondContact O-N 2.99Å; L1737-S1739 VanDerWaalsContact C-N 3.31Å; L1737-S1739 PolarHBondContact O-N 3.08Å; L1737-Q1740 PolarHBondContact O-N 3.07Å; L1737-A1741 VanDerWaalsContact O-CB 3.27Å; L1737-A1741 WeakPolarHBondContact O-CB 3.39Å; L1737-A1741 PolarHBondContact O-N 3.23Å
1738G65.9Low62.4Low9.8 Ų9.864.5 Ų64.510%0.10136%0.356CS..Hα-helixtrans-60.6-44.4176.500000112.5S1734 A1735 Q1740 A1741 C1742S1734-G1738 PolarHBondContact O-N 3.07Å; S1734-G1738 VanDerWaalsContact O-N 3.12Å; A1735-G1738 PolarHBondContact O-N 3.03Å; G1738-Q1740 VanDerWaalsContact C-N 3.34Å; G1738-Q1740 PolarHBondContact O-N 3.21Å; G1738-A1741 PolarHBondContact O-N 3.36Å; G1738-C1742 PolarHBondContact O-N 3.15Å; G1738-C1742 VanDerWaalsContact O-N 3.16Å; G1738-C1742 PolarHBondContact O-SG 3.21Å; G1738-C1742 VanDerWaalsContact O-SG 3.34Å
1739S70.2Confident64.5Low15.4 Ų15.456.7 Ų56.711%0.10832%0.32CS..Hα-helixtrans-61.5-43.4176.6-172.30000112.5H1716 A1735 S1736 L1737 C1742 L1743H1716-S1739 PolarHBondContact CE1-OG 3.27Å; H1716-S1739 PolarHBondContact ND1-O 3.33Å; H1716-S1739 PolarHBondContact ND1-OG 3.04Å; H1716-S1739 VanDerWaalsContact ND1-OG 3.13Å; A1735-S1739 WeakPolarHBondContact O-CB 3.31Å; A1735-S1739 PolarHBondContact O-N 3.12Å; A1735-S1739 VanDerWaalsContact O-N 3.15Å; S1736-S1739 PolarHBondContact O-N 3.1Å; L1737-S1739 VanDerWaalsContact C-N 3.31Å; L1737-S1739 PolarHBondContact O-N 3.08Å; S1739-C1742 PolarHBondContact O-N 2.95Å; S1739-L1743 WeakPolarHBondContact O-CB 3.34Å; S1739-L1743 PolarHBondContact O-N 3.21Å; S1739-L1743 VanDerWaalsContact O-N 3.11Å
1740Q70.8Confident66.7Low98.8 Ų98.854.3 Ų54.346%0.46230%0.301SS..Hα-helixtrans-69.5-40.3179.3-172.563.235.600112.5S1736 L1737 G1738 C1742 L1743 N1744S1736-Q1740 VanDerWaalsContact O-CB 3.3Å; S1736-Q1740 WeakPolarHBondContact O-CB 3.29Å; S1736-Q1740 PolarHBondContact O-N 3.14Å; L1737-Q1740 PolarHBondContact O-N 3.07Å; G1738-Q1740 VanDerWaalsContact C-N 3.34Å; G1738-Q1740 PolarHBondContact O-N 3.21Å; Q1740-C1742 VanDerWaalsContact C-N 3.33Å; Q1740-C1742 PolarHBondContact O-N 2.91Å; Q1740-L1743 WeakPolarHBondContact O-CB 3.31Å; Q1740-L1743 PolarHBondContact O-N 2.97Å; Q1740-L1743 VanDerWaalsContact O-N 3.17Å; Q1740-N1744 PolarHBondContact NE2-OD1 3.19Å; Q1740-N1744 WeakPolarHBondContact O-CB 3.24Å; Q1740-N1744 VanDerWaalsContact O-CG 3.3Å; Q1740-N1744 PolarHBondContact O-N 3.03Å; Q1740-N1744 VanDerWaalsContact O-N 3.11Å; Q1740-N1744 PolarHBondContact O-OD1 2.76Å
1741A68.5Low68.6Low13.6 Ų13.652.2 Ų52.211%0.11228%0.283CS..Hα-helixtrans-62.5-42.117700000111.5L1581 V1584 L1737 G1738 L1743 N1744 A1745L1581-A1741 HydrophobicContact CB-CB 4.26Å; L1581-A1741 HydrophobicContact CD2-CB 3.85Å; L1581-A1741 HydrophobicContact CG-CB 4.48Å; V1584-A1741 HydrophobicContact CB-CB 4.43Å; V1584-A1741 HydrophobicContact CG1-CB 4.44Å; L1737-A1741 VanDerWaalsContact O-CB 3.27Å; L1737-A1741 WeakPolarHBondContact O-CB 3.39Å; L1737-A1741 PolarHBondContact O-N 3.23Å; G1738-A1741 PolarHBondContact O-N 3.36Å; A1741-L1743 VanDerWaalsContact C-N 3.33Å; A1741-L1743 PolarHBondContact O-N 3.05Å; A1741-N1744 PolarHBondContact O-N 3.18Å; A1741-A1745 WeakPolarHBondContact O-CB 3.42Å; A1741-A1745 PolarHBondContact O-N 3.18Å; A1741-A1745 VanDerWaalsContact O-N 3.1Å
1742C73.4Confident70.3Confident0.2 Ų0.250.1 Ų50.10%0.00127%0.268CS..Hα-helixtrans-59.6-45.3173-690000111.7L1581 C1715 H1716 G1738 S1739 Q1740 N1744 A1745 I1746L1581-C1742 HydrophobicContact CD2-CB 4.32Å; L1581-C1742 VanDerWaalsContact CD2-SG 3.54Å; L1581-C1742 WeakPolarHBondContact CD2-SG 3.35Å; C1715-C1742 VanDerWaalsContact SG-SG 3.64Å; H1716-C1742 HydrophobicContact CB-CB 3.95Å; G1738-C1742 PolarHBondContact O-N 3.15Å; G1738-C1742 VanDerWaalsContact O-N 3.16Å; G1738-C1742 PolarHBondContact O-SG 3.21Å; G1738-C1742 VanDerWaalsContact O-SG 3.34Å; S1739-C1742 PolarHBondContact O-N 2.95Å; Q1740-C1742 VanDerWaalsContact C-N 3.33Å; Q1740-C1742 PolarHBondContact O-N 2.91Å; C1742-N1744 PolarHBondContact O-N 2.93Å; C1742-A1745 PolarHBondContact O-N 3.02Å; C1742-I1746 WeakPolarHBondContact O-CB 3.33Å; C1742-I1746 WeakPolarHBondContact O-CD1 3.3Å; C1742-I1746 VanDerWaalsContact O-CG1 3.24Å; C1742-I1746 WeakPolarHBondContact O-CG1 3.32Å; C1742-I1746 PolarHBondContact O-N 3.2Å; C1742-I1746 VanDerWaalsContact O-N 3.12Å
1743L76.2Confident72Confident64.2 Ų64.246.6 Ų46.634%0.33625%0.247SC..Hα-helixtrans-64.2-42.6-178.9-174.865.5000112S1739 Q1740 A1741 I1746 N1747S1739-L1743 WeakPolarHBondContact O-CB 3.34Å; S1739-L1743 PolarHBondContact O-N 3.21Å; S1739-L1743 VanDerWaalsContact O-N 3.11Å; Q1740-L1743 WeakPolarHBondContact O-CB 3.31Å; Q1740-L1743 PolarHBondContact O-N 2.97Å; Q1740-L1743 VanDerWaalsContact O-N 3.17Å; A1741-L1743 VanDerWaalsContact C-N 3.33Å; A1741-L1743 PolarHBondContact O-N 3.05Å; L1743-I1746 PolarHBondContact O-N 3.2Å; L1743-N1747 WeakPolarHBondContact O-CB 3.41Å; L1743-N1747 VanDerWaalsContact O-CG 3.25Å; L1743-N1747 PolarHBondContact O-N 3.12Å; L1743-N1747 VanDerWaalsContact O-N 3.12Å; L1743-N1747 PolarHBondContact O-ND2 3.03Å; L1743-N1747 VanDerWaalsContact O-ND2 3.16Å
1744N75.8Confident73.7Confident47.2 Ų47.239.3 Ų39.325%0.25222%0.215SC..Hα-helixtrans-65.1-43.7176.9-74.2-2.3000111.6V1584 S1588 Q1740 A1741 C1742 I1746 N1747 E1748V1584-N1744 HydrophobicContact CG1-CB 3.48Å; V1584-N1744 VanDerWaalsContact CG1-CB 3.43Å; S1588-N1744 PolarHBondContact OG-ND2 3.2Å; Q1740-N1744 PolarHBondContact NE2-OD1 3.19Å; Q1740-N1744 WeakPolarHBondContact O-CB 3.24Å; Q1740-N1744 VanDerWaalsContact O-CG 3.3Å; Q1740-N1744 PolarHBondContact O-N 3.03Å; Q1740-N1744 VanDerWaalsContact O-N 3.11Å; Q1740-N1744 PolarHBondContact O-OD1 2.76Å; A1741-N1744 PolarHBondContact O-N 3.18Å; C1742-N1744 PolarHBondContact O-N 2.93Å; N1744-I1746 VanDerWaalsContact C-N 3.34Å; N1744-I1746 PolarHBondContact O-N 3.13Å; N1744-N1747 WeakPolarHBondContact O-CB 3.45Å; N1744-N1747 PolarHBondContact O-N 3.03Å; N1744-N1747 VanDerWaalsContact O-N 3.12Å; N1744-E1748 WeakPolarHBondContact O-CG 3.46Å; N1744-E1748 PolarHBondContact O-N 3.25Å; N1744-E1748 VanDerWaalsContact O-N 3.13Å
1745A76Confident75.2Confident0 Ų037.3 Ų37.30%020%0.199CC..Hα-helixtrans-59.8-43.7174.900000112.4L1580 V1584 V1675 L1712 A1741 C1742 N1747 E1748 L1749L1580-A1745 HydrophobicContact CD2-CB 3.63Å; L1580-A1745 VanDerWaalsContact CD2-CB 3.46Å; V1584-A1745 HydrophobicContact CG2-CB 4.17Å; V1675-A1745 HydrophobicContact CG2-CB 4.08Å; L1712-A1745 HydrophobicContact CD1-CB 4.41Å; L1712-A1745 HydrophobicContact CD2-CB 4.36Å; A1741-A1745 WeakPolarHBondContact O-CB 3.42Å; A1741-A1745 PolarHBondContact O-N 3.18Å; A1741-A1745 VanDerWaalsContact O-N 3.1Å; C1742-A1745 PolarHBondContact O-N 3.02Å; A1745-N1747 VanDerWaalsContact C-N 3.3Å; A1745-N1747 PolarHBondContact O-N 2.98Å; A1745-E1748 PolarHBondContact O-N 3.22Å; A1745-L1749 WeakPolarHBondContact O-CB 3.41Å; A1745-L1749 VanDerWaalsContact O-CG 3.27Å; A1745-L1749 WeakPolarHBondContact O-CG 3.41Å; A1745-L1749 PolarHBondContact O-N 2.92Å; A1745-L1749 VanDerWaalsContact O-N 3.13Å
1746I78.9Confident76.6Confident13.6 Ų13.636.9 Ų36.97%0.0720%0.196CC..Hα-helixtrans-60.6-42.4174.8-68.9164.8000110.2L1712 H1716 C1742 L1743 N1744 E1748 L1749 R1750 L1782L1712-I1746 HydrophobicContact CB-CD1 4.01Å; L1712-I1746 HydrophobicContact CB-CG1 3.74Å; L1712-I1746 HydrophobicContact CD1-CG1 4.21Å; H1716-I1746 HydrophobicContact CB-CD1 4.44Å; C1742-I1746 WeakPolarHBondContact O-CB 3.33Å; C1742-I1746 WeakPolarHBondContact O-CD1 3.3Å; C1742-I1746 VanDerWaalsContact O-CG1 3.24Å; C1742-I1746 WeakPolarHBondContact O-CG1 3.32Å; C1742-I1746 PolarHBondContact O-N 3.2Å; C1742-I1746 VanDerWaalsContact O-N 3.12Å; L1743-I1746 PolarHBondContact O-N 3.2Å; N1744-I1746 VanDerWaalsContact C-N 3.34Å; N1744-I1746 PolarHBondContact O-N 3.13Å; I1746-E1748 PolarHBondContact O-N 3.13Å; I1746-L1749 PolarHBondContact O-N 3.17Å; I1746-R1750 VanDerWaalsContact O-CB 3.3Å; I1746-R1750 WeakPolarHBondContact O-CB 3.4Å; I1746-R1750 WeakPolarHBondContact O-CG 3.18Å; I1746-R1750 PolarHBondContact O-N 3.05Å; I1746-L1782 HydrophobicContact CD1-CD2 4.36Å; I1746-L1782 HydrophobicContact CG2-CD2 4.11Å
1747N80Confident77.8Confident62 Ų6234.3 Ų34.333%0.33218%0.178SC..Hα-helixtrans-66.8-34.4-178.5-76.9-33.5000114L1743 N1744 A1745 R1750L1743-N1747 WeakPolarHBondContact O-CB 3.41Å; L1743-N1747 VanDerWaalsContact O-CG 3.25Å; L1743-N1747 PolarHBondContact O-N 3.12Å; L1743-N1747 VanDerWaalsContact O-N 3.12Å; L1743-N1747 PolarHBondContact O-ND2 3.03Å; L1743-N1747 VanDerWaalsContact O-ND2 3.16Å; N1744-N1747 WeakPolarHBondContact O-CB 3.45Å; N1744-N1747 PolarHBondContact O-N 3.03Å; N1744-N1747 VanDerWaalsContact O-N 3.12Å; A1745-N1747 VanDerWaalsContact C-N 3.3Å; A1745-N1747 PolarHBondContact O-N 2.98Å; N1747-R1750 WeakPolarHBondContact O-CD 3.42Å; N1747-R1750 VanDerWaalsContact O-CG 3.28Å; N1747-R1750 WeakPolarHBondContact O-CG 3.28Å; N1747-R1750 PolarHBondContact O-NE 3.34Å; N1747-R1750 PolarHBondContact OD1-NE 3.12Å; N1747-R1750 PolarHBondContact OD1-NH1 3.1Å; N1747-R1750 VanDerWaalsContact OD1-NH1 3.09Å
1748E79.5Confident78.8Confident72.2 Ų72.229.4 Ų29.434%0.33715%0.153SC..Hα-helixtrans-74.2-42.4174.5-73.3-113.7153.700112.4V1675 H1676 K1679 N1744 A1745 I1746 R1750 P1752V1675-E1748 HydrophobicContact CG1-CB 4.03Å; V1675-E1748 HydrophobicContact CG1-CG 4.38Å; V1675-E1748 VanDerWaalsContact CG1-OE2 3.32Å; V1675-E1748 WeakPolarHBondContact CG1-OE2 3.4Å; H1676-E1748 IonicContact CE1-OE2 3.59Å; H1676-E1748 IonicContact ND1-OE2 3.11Å; K1679-E1748 IonicContact NZ-OE2 3.23Å; K1679-E1748 PolarHBondContact NZ-OE2 2.95Å; N1744-E1748 WeakPolarHBondContact O-CG 3.46Å; N1744-E1748 PolarHBondContact O-N 3.25Å; N1744-E1748 VanDerWaalsContact O-N 3.13Å; A1745-E1748 PolarHBondContact O-N 3.22Å; I1746-E1748 PolarHBondContact O-N 3.13Å; E1748-R1750 PolarHBondContact O-N 3.14Å; E1748-P1752 VanDerWaalsContact O-CD 3.25Å; E1748-P1752 WeakPolarHBondContact O-CD 3.3Å
1749L82.6Confident79.7Confident0.4 Ų0.429.5 Ų29.50%0.00215%0.154CC..Hα-helixtrans-79.4-23.9-175.2-65.3169.7000113.2L1580 V1675 R1678 K1679 L1682 L1708 L1709 L1712 A1745 I1746 V1751 P1752 A1753L1580-L1749 HydrophobicContact CD1-CD1 4.3Å; V1675-L1749 HydrophobicContact CG1-CD2 4.36Å; V1675-L1749 HydrophobicContact CG1-CG 4.29Å; R1678-L1749 HydrophobicContact CB-CD2 3.85Å; K1679-L1749 HydrophobicContact CB-CD2 4.15Å; L1682-L1749 HydrophobicContact CD1-CB 4.35Å; L1682-L1749 HydrophobicContact CD1-CD2 4Å; L1708-L1749 HydrophobicContact CD1-CD1 4.35Å; L1708-L1749 HydrophobicContact CD2-CD1 4.24Å; L1708-L1749 HydrophobicContact CG-CD1 4.47Å; L1709-L1749 HydrophobicContact CD2-CB 4.33Å; L1712-L1749 HydrophobicContact CD1-CD1 3.97Å; A1745-L1749 WeakPolarHBondContact O-CB 3.41Å; A1745-L1749 VanDerWaalsContact O-CG 3.27Å; A1745-L1749 WeakPolarHBondContact O-CG 3.41Å; A1745-L1749 PolarHBondContact O-N 2.92Å; A1745-L1749 VanDerWaalsContact O-N 3.13Å; I1746-L1749 PolarHBondContact O-N 3.17Å; L1749-V1751 VanDerWaalsContact C-N 3.34Å; L1749-V1751 PolarHBondContact O-N 3.19Å; L1749-P1752 VanDerWaalsContact O-CD 3.32Å; L1749-P1752 WeakPolarHBondContact O-CD 3.4Å; L1749-P1752 WeakPolarHBondContact O-CG 3.34Å; L1749-A1753 VanDerWaalsContact O-CB 3.24Å; L1749-A1753 WeakPolarHBondContact O-CB 3.26Å; L1749-A1753 PolarHBondContact O-N 3.09Å; L1749-A1753 VanDerWaalsContact O-N 3.11Å
1750R81.6Confident80.3Confident95.2 Ų95.228.9 Ų28.936%0.35915%0.149SC..Hα-helixtrans-59.1-43-177.385.8-170.6176.61686113.3I1746 N1747 E1748 A1753 M1754 L1784I1746-R1750 VanDerWaalsContact O-CB 3.3Å; I1746-R1750 WeakPolarHBondContact O-CB 3.4Å; I1746-R1750 WeakPolarHBondContact O-CG 3.18Å; I1746-R1750 PolarHBondContact O-N 3.05Å; N1747-R1750 WeakPolarHBondContact O-CD 3.42Å; N1747-R1750 VanDerWaalsContact O-CG 3.28Å; N1747-R1750 WeakPolarHBondContact O-CG 3.28Å; N1747-R1750 PolarHBondContact O-NE 3.34Å; N1747-R1750 PolarHBondContact OD1-NE 3.12Å; N1747-R1750 PolarHBondContact OD1-NH1 3.1Å; N1747-R1750 VanDerWaalsContact OD1-NH1 3.09Å; E1748-R1750 PolarHBondContact O-N 3.14Å; R1750-A1753 PolarHBondContact O-N 3.29Å; R1750-M1754 HydrophobicContact CG-CG 4.45Å; R1750-M1754 VanDerWaalsContact O-CB 3.26Å; R1750-M1754 WeakPolarHBondContact O-CB 3.29Å; R1750-M1754 VanDerWaalsContact O-CG 3.26Å; R1750-M1754 WeakPolarHBondContact O-CG 3.3Å; R1750-M1754 PolarHBondContact O-N 3.13Å; R1750-L1784 HydrophobicContact CB-CD1 4.44Å; R1750-L1784 HydrophobicContact CB-CD2 4.34Å; R1750-L1784 HydrophobicContact CG-CD1 4.09Å; R1750-L1784 HydrophobicContact CG-CD2 4.18Å; R1750-L1784 VanDerWaalsContact NE-CD2 3.34Å
1751V83.5Confident81Confident76.6 Ų76.624.2 Ų24.246%0.46413%0.128SC..Hα-helixtrans-68.7-52.8-173-1790000110.9L1749 A1753 M1754 D1755 I1816L1749-V1751 VanDerWaalsContact C-N 3.34Å; L1749-V1751 PolarHBondContact O-N 3.19Å; V1751-A1753 VanDerWaalsContact C-N 3.33Å; V1751-A1753 PolarHBondContact O-N 3.31Å; V1751-M1754 PolarHBondContact O-N 3.12Å; V1751-D1755 PolarHBondContact O-N 3.17Å; V1751-I1816 HydrophobicContact CG1-CD1 4.3Å
1752P82.7Confident81.6Confident8.8 Ų8.825.4 Ų25.46%0.05713%0.129CC..Hα-helixtrans-62.8-38.8175.5-3.27.2000112.7K1679 L1682 E1683 E1748 L1749 M1754 D1755 V1756K1679-P1752 HydrophobicContact CG-CG 4.19Å; L1682-P1752 HydrophobicContact CB-CB 3.59Å; L1682-P1752 VanDerWaalsContact CB-CB 3.43Å; L1682-P1752 HydrophobicContact CB-CG 4.17Å; L1682-P1752 HydrophobicContact CD1-CB 4.11Å; L1682-P1752 HydrophobicContact CD1-CG 4.16Å; L1682-P1752 HydrophobicContact CG-CB 4.35Å; E1683-P1752 HydrophobicContact CG-CB 3.95Å; E1683-P1752 HydrophobicContact CG-CG 4.17Å; E1748-P1752 VanDerWaalsContact O-CD 3.25Å; E1748-P1752 WeakPolarHBondContact O-CD 3.3Å; L1749-P1752 VanDerWaalsContact O-CD 3.32Å; L1749-P1752 WeakPolarHBondContact O-CD 3.4Å; L1749-P1752 WeakPolarHBondContact O-CG 3.34Å; P1752-M1754 VanDerWaalsContact C-N 3.33Å; P1752-M1754 PolarHBondContact O-N 3.03Å; P1752-D1755 WeakPolarHBondContact O-CB 3.29Å; P1752-D1755 PolarHBondContact O-N 3.09Å; P1752-V1756 WeakPolarHBondContact O-CG2 3.41Å; P1752-V1756 PolarHBondContact O-N 3.14Å; P1752-V1756 VanDerWaalsContact O-N 3.09Å
1753A85.3Confident81.8Confident1 Ų129 Ų291%0.00814%0.143CC..Hα-helixtrans-62.1-42.9176.800000112.5L1682 I1705 L1709 L1749 R1750 V1751 D1755 V1756 L1757L1682-A1753 HydrophobicContact CD1-CB 4.17Å; L1682-A1753 HydrophobicContact CD2-CB 4.45Å; I1705-A1753 HydrophobicContact CG2-CB 3.86Å; L1709-A1753 HydrophobicContact CD1-CB 4.05Å; L1749-A1753 VanDerWaalsContact O-CB 3.24Å; L1749-A1753 WeakPolarHBondContact O-CB 3.26Å; L1749-A1753 PolarHBondContact O-N 3.09Å; L1749-A1753 VanDerWaalsContact O-N 3.11Å; R1750-A1753 PolarHBondContact O-N 3.29Å; V1751-A1753 VanDerWaalsContact C-N 3.33Å; V1751-A1753 PolarHBondContact O-N 3.31Å; A1753-D1755 VanDerWaalsContact C-N 3.29Å; A1753-D1755 PolarHBondContact O-N 3.43Å; A1753-V1756 PolarHBondContact O-N 3.02Å; A1753-L1757 WeakPolarHBondContact O-CG 3.33Å; A1753-L1757 PolarHBondContact O-N 3.38Å
1754M84Confident81.9Confident7 Ų726.6 Ų26.63%0.03413%0.13CC..Hα-helixtrans-69.7-31.7176.9-73.2-53.7-52.900112.7R1750 V1751 P1752 L1757 T1758 M1778 L1779 T1786 F1789R1750-M1754 HydrophobicContact CG-CG 4.45Å; R1750-M1754 VanDerWaalsContact O-CB 3.26Å; R1750-M1754 WeakPolarHBondContact O-CB 3.29Å; R1750-M1754 VanDerWaalsContact O-CG 3.26Å; R1750-M1754 WeakPolarHBondContact O-CG 3.3Å; R1750-M1754 PolarHBondContact O-N 3.13Å; V1751-M1754 PolarHBondContact O-N 3.12Å; P1752-M1754 VanDerWaalsContact C-N 3.33Å; P1752-M1754 PolarHBondContact O-N 3.03Å; M1754-L1757 PolarHBondContact O-N 3.31Å; M1754-L1757 HydrophobicContact SD-CD1 4.01Å; M1754-T1758 VanDerWaalsContact O-CB 3.28Å; M1754-T1758 WeakPolarHBondContact O-CB 3.33Å; M1754-T1758 PolarHBondContact O-N 3.35Å; M1754-T1758 PolarHBondContact O-OG1 3.06Å; M1754-M1778 HydrophobicContact SD-CE 4.34Å; M1754-L1779 HydrophobicContact CE-CD1 4.05Å; M1754-L1779 HydrophobicContact CE-CD2 3.77Å; M1754-L1779 HydrophobicContact SD-CD1 4.14Å; M1754-L1779 HydrophobicContact SD-CD2 3.7Å; M1754-T1786 HydrophobicContact CB-CG2 4.32Å; M1754-T1786 HydrophobicContact CE-CG2 4.16Å; M1754-T1786 HydrophobicContact CG-CG2 4.48Å; M1754-F1789 HydrophobicContact CE-CB 3.71Å; M1754-F1789 HydrophobicContact CE-CD1 4.38Å; M1754-F1789 HydrophobicContact CE-CD2 4Å; M1754-F1789 HydrophobicContact CE-CG 3.79Å
1755D83.9Confident82.1Confident20.6 Ų20.624.9 Ų24.911%0.1112%0.124CC..Hα-helixtrans-66.4-42.2172.9-87.7-2000111.3A1686 V1751 P1752 A1753 L1757 T1758 G1759 R1788 I1816A1686-D1755 HydrophobicContact CB-CB 4.25Å; V1751-D1755 PolarHBondContact O-N 3.17Å; P1752-D1755 WeakPolarHBondContact O-CB 3.29Å; P1752-D1755 PolarHBondContact O-N 3.09Å; A1753-D1755 VanDerWaalsContact C-N 3.29Å; A1753-D1755 PolarHBondContact O-N 3.43Å; D1755-L1757 PolarHBondContact O-N 2.8Å; D1755-T1758 PolarHBondContact O-N 3.1Å; D1755-G1759 PolarHBondContact O-N 3.12Å; D1755-R1788 VanDerWaalsContact CG-NH1 3.34Å; D1755-R1788 IonicContact OD1-CZ 3.05Å; D1755-R1788 IonicContact OD1-NH1 3.55Å; D1755-R1788 PolarHBondContact OD1-NH1 3.29Å; D1755-R1788 IonicContact OD2-NH1 3.14Å; D1755-R1788 PolarHBondContact OD2-NH1 2.96Å; D1755-I1816 WeakPolarHBondContact OD2-CA 3.23Å; D1755-I1816 WeakPolarHBondContact OD2-CB 3.25Å; D1755-I1816 VanDerWaalsContact OD2-CG1 3.31Å; D1755-I1816 WeakPolarHBondContact OD2-CG1 3.42Å; D1755-I1816 PolarHBondContact OD2-N 3.32Å
1756V85.3Confident82.3Confident0 Ų029.9 Ų29.90%015%0.147CC..Hα-helixtrans-59.3-48.3172.2177.20000111.3L1682 L1685 A1686 I1701 I1705 P1752 A1753 T1758 G1759 L1760L1682-V1756 HydrophobicContact CB-CG2 4.48Å; L1682-V1756 HydrophobicContact CD2-CG2 4.48Å; L1682-V1756 WeakPolarHBondContact O-CG2 3.37Å; L1685-V1756 HydrophobicContact CB-CG1 4.35Å; L1685-V1756 HydrophobicContact CB-CG2 3.95Å; A1686-V1756 HydrophobicContact CB-CG2 3.88Å; I1701-V1756 HydrophobicContact CG2-CG1 3.73Å; I1705-V1756 HydrophobicContact CD1-CB 4.22Å; I1705-V1756 HydrophobicContact CD1-CG1 3.82Å; I1705-V1756 HydrophobicContact CD1-CG2 4.47Å; P1752-V1756 WeakPolarHBondContact O-CG2 3.41Å; P1752-V1756 PolarHBondContact O-N 3.14Å; P1752-V1756 VanDerWaalsContact O-N 3.09Å; A1753-V1756 PolarHBondContact O-N 3.02Å; V1756-T1758 VanDerWaalsContact C-N 3.32Å; V1756-T1758 PolarHBondContact O-N 3.05Å; V1756-G1759 PolarHBondContact O-N 3.12Å; V1756-L1760 HydrophobicContact CG1-CD1 4.02Å; V1756-L1760 HydrophobicContact CG1-CG 4.42Å; V1756-L1760 WeakPolarHBondContact O-CB 3.26Å; V1756-L1760 WeakPolarHBondContact O-CG 3.33Å; V1756-L1760 PolarHBondContact O-N 3.13Å
1757L86.6Confident82.3Confident0 Ų034.5 Ų34.50%017%0.167CC..Hα-helixtrans-64.8-36.2179.8-69.8173.6000112.3I1702 I1705 A1753 M1754 D1755 L1761 F1768 V1775 M1778 F1789I1702-L1757 HydrophobicContact CB-CD2 4.47Å; I1702-L1757 HydrophobicContact CG1-CD2 4Å; I1702-L1757 HydrophobicContact CG2-CD2 4.28Å; I1705-L1757 HydrophobicContact CG2-CD1 4.5Å; A1753-L1757 WeakPolarHBondContact O-CG 3.33Å; A1753-L1757 PolarHBondContact O-N 3.38Å; M1754-L1757 PolarHBondContact O-N 3.31Å; M1754-L1757 HydrophobicContact SD-CD1 4.01Å; D1755-L1757 PolarHBondContact O-N 2.8Å; L1757-L1761 VanDerWaalsContact O-CB 3.24Å; L1757-L1761 WeakPolarHBondContact O-CB 3.42Å; L1757-L1761 PolarHBondContact O-N 3.24Å; L1757-F1768 HydrophobicContact CD2-CZ 4.43Å; L1757-V1775 HydrophobicContact CD1-CG1 4.19Å; L1757-V1775 HydrophobicContact CD2-CG2 4.28Å; L1757-M1778 HydrophobicContact CD1-CE 3.63Å; L1757-F1789 HydrophobicContact CB-CD2 4.43Å; L1757-F1789 HydrophobicContact CB-CE2 4.33Å
1758T84.7Confident82.5Confident11.6 Ų11.631.6 Ų31.67%0.07115%0.151CC..Hα-helixtrans-70.7-40.3176.5-54.90000111.1M1754 D1755 V1756 L1761 Y1762 R1788 V1792M1754-T1758 VanDerWaalsContact O-CB 3.28Å; M1754-T1758 WeakPolarHBondContact O-CB 3.33Å; M1754-T1758 PolarHBondContact O-N 3.35Å; M1754-T1758 PolarHBondContact O-OG1 3.06Å; D1755-T1758 PolarHBondContact O-N 3.1Å; V1756-T1758 VanDerWaalsContact C-N 3.32Å; V1756-T1758 PolarHBondContact O-N 3.05Å; T1758-L1761 PolarHBondContact O-N 3.07Å; T1758-Y1762 VanDerWaalsContact O-CB 3.32Å; T1758-Y1762 WeakPolarHBondContact O-CB 3.33Å; T1758-Y1762 PolarHBondContact O-N 3.25Å; T1758-R1788 HydrophobicContact CG2-CB 4.39Å; T1758-V1792 HydrophobicContact CG2-CG2 4.04Å
1759G83.3Confident82.6Confident11 Ų1133.2 Ų33.211%0.11316%0.157CC..Hα-helixtrans-63.7-44.4174.800000112.6D1755 V1756 Y1762 R1763D1755-G1759 PolarHBondContact O-N 3.12Å; V1756-G1759 PolarHBondContact O-N 3.12Å; G1759-Y1762 WeakPolarHBondContact O-CB 3.36Å; G1759-Y1762 PolarHBondContact O-N 3.1Å; G1759-R1763 PolarHBondContact O-N 3.19Å
1760L84.4Confident82.6Confident2 Ų241.6 Ų41.61%0.0119%0.194CC..Hα-helixtrans-63-45.1173.3-75.2171.5000112.1T1689 L1694 A1698 I1701 I1702 V1756 Y1762 R1763 M1764 F1768T1689-L1760 HydrophobicContact CG2-CD2 3.88Å; T1689-L1760 HydrophobicContact CG2-CG 3.95Å; L1694-L1760 HydrophobicContact CB-CD2 4.17Å; A1698-L1760 HydrophobicContact CB-CD2 4.32Å; I1701-L1760 HydrophobicContact CB-CD1 4.33Å; I1701-L1760 HydrophobicContact CD1-CD2 4.47Å; I1701-L1760 HydrophobicContact CG2-CD1 3.94Å; I1702-L1760 HydrophobicContact CD1-CD1 4.24Å; I1702-L1760 HydrophobicContact CG1-CD1 3.92Å; V1756-L1760 HydrophobicContact CG1-CD1 4.02Å; V1756-L1760 HydrophobicContact CG1-CG 4.42Å; V1756-L1760 WeakPolarHBondContact O-CB 3.26Å; V1756-L1760 WeakPolarHBondContact O-CG 3.33Å; V1756-L1760 PolarHBondContact O-N 3.13Å; L1760-Y1762 VanDerWaalsContact C-N 3.3Å; L1760-Y1762 PolarHBondContact O-N 3.26Å; L1760-R1763 PolarHBondContact O-N 3.24Å; L1760-M1764 HydrophobicContact CD2-SD 4.37Å; L1760-M1764 VanDerWaalsContact O-CB 3.23Å; L1760-M1764 WeakPolarHBondContact O-CB 3.39Å; L1760-M1764 VanDerWaalsContact O-CG 3.27Å; L1760-M1764 WeakPolarHBondContact O-CG 3.35Å; L1760-M1764 PolarHBondContact O-N 3.19Å; L1760-F1768 HydrophobicContact CB-CD2 4.41Å; L1760-F1768 HydrophobicContact CB-CE2 4.17Å
1761L84.1Confident82.7Confident1.4 Ų1.439.2 Ų39.21%0.00719%0.186CC..Hα-helixtrans-59.4-42.1176.2173.265.5000111.6L1757 T1758 G1765 F1768 F1789 V1792 L1793 V1796L1757-L1761 VanDerWaalsContact O-CB 3.24Å; L1757-L1761 WeakPolarHBondContact O-CB 3.42Å; L1757-L1761 PolarHBondContact O-N 3.24Å; T1758-L1761 PolarHBondContact O-N 3.07Å; L1761-G1765 WeakPolarHBondContact O-CA 3.43Å; L1761-G1765 PolarHBondContact O-N 3.12Å; L1761-G1765 VanDerWaalsContact O-N 3.09Å; L1761-F1768 HydrophobicContact CB-CD1 4.31Å; L1761-F1768 HydrophobicContact CB-CD2 4.21Å; L1761-F1768 HydrophobicContact CB-CE1 4.36Å; L1761-F1768 HydrophobicContact CB-CE2 4.3Å; L1761-F1768 HydrophobicContact CB-CG 4.22Å; L1761-F1768 HydrophobicContact CB-CZ 4.39Å; L1761-F1768 HydrophobicContact CD1-CB 3.77Å; L1761-F1768 HydrophobicContact CD1-CD1 3.53Å; L1761-F1768 VanDerWaalsContact CD1-CD1 3.47Å; L1761-F1768 HydrophobicContact CD1-CD2 4.35Å; L1761-F1768 HydrophobicContact CD1-CE1 4.22Å; L1761-F1768 HydrophobicContact CD1-CG 3.68Å; L1761-F1768 HydrophobicContact CG-CD1 4.41Å; L1761-F1768 HydrophobicContact CG-CG 4.5Å; L1761-F1789 HydrophobicContact CB-CE2 4.27Å; L1761-F1789 HydrophobicContact CD2-CD2 3.79Å; L1761-F1789 HydrophobicContact CD2-CE1 4.49Å; L1761-F1789 HydrophobicContact CD2-CE2 3.62Å; L1761-F1789 HydrophobicContact CD2-CG 4.38Å; L1761-F1789 HydrophobicContact CD2-CZ 4.07Å; L1761-F1789 HydrophobicContact CG-CE2 4.47Å; L1761-V1792 HydrophobicContact CB-CG1 4.48Å; L1761-V1792 HydrophobicContact CD2-CB 4Å; L1761-V1792 HydrophobicContact CD2-CG1 3.87Å; L1761-V1792 HydrophobicContact CG-CB 4.41Å; L1761-V1792 HydrophobicContact CG-CG1 3.84Å; L1761-L1793 HydrophobicContact CD1-CD1 4.18Å; L1761-L1793 HydrophobicContact CD2-CB 3.97Å; L1761-L1793 HydrophobicContact CD2-CD1 4.33Å; L1761-V1796 HydrophobicContact CD1-CG2 4.3Å
1762Y80.7Confident82.7Confident38.2 Ų38.236.4 Ų36.415%0.1517%0.168CC..Hα-helixtrans-63.8-43.3177.9-176.4-94.9000112.1T1758 G1759 L1760 V1792 L1802 P1803 H1810 F1813T1758-Y1762 VanDerWaalsContact O-CB 3.32Å; T1758-Y1762 WeakPolarHBondContact O-CB 3.33Å; T1758-Y1762 PolarHBondContact O-N 3.25Å; G1759-Y1762 WeakPolarHBondContact O-CB 3.36Å; G1759-Y1762 PolarHBondContact O-N 3.1Å; L1760-Y1762 VanDerWaalsContact C-N 3.3Å; L1760-Y1762 PolarHBondContact O-N 3.26Å; Y1762-V1792 HydrophobicContact CD2-CG1 4.24Å; Y1762-L1802 HydrophobicContact CD2-CD2 3.75Å; Y1762-L1802 HydrophobicContact CE2-CB 4.3Å; Y1762-L1802 HydrophobicContact CE2-CD2 3.57Å; Y1762-L1802 HydrophobicContact CE2-CG 4.46Å; Y1762-L1802 HydrophobicContact CG-CD2 4.4Å; Y1762-P1803 WeakPolarHBondContact OH-CB 3.4Å; Y1762-P1803 WeakPolarHBondContact OH-CD 3.47Å; Y1762-P1803 PolarHBondContact OH-O 3.29Å; Y1762-H1810 AromaticContact CE1-CE1 3.65Å; Y1762-H1810 VanDerWaalsContact CE1-CE1 3.42Å; Y1762-H1810 WeakPolarHBondContact CE1-CE1 3.36Å; Y1762-H1810 AromaticContact CE1-ND1 3.77Å; Y1762-H1810 AromaticContact CE1-NE2 3.44Å; Y1762-H1810 WeakPolarHBondContact CE1-NE2 3.26Å; Y1762-H1810 AromaticContact CZ-CE1 3.83Å; Y1762-H1810 AromaticContact CZ-ND1 3.77Å; Y1762-H1810 AromaticContact CZ-NE2 3.88Å; Y1762-H1810 PolarHBondContact OH-CD2 2.98Å; Y1762-H1810 PolarHBondContact OH-CE1 2.66Å; Y1762-H1810 PolarHBondContact OH-ND1 3.2Å; Y1762-H1810 VanDerWaalsContact OH-ND1 3.09Å; Y1762-H1810 PolarHBondContact OH-NE2 2.85Å; Y1762-F1813 HydrophobicContact CD2-CB 4.15Å; Y1762-F1813 AromaticContact CD2-CD1 3.89Å; Y1762-F1813 HydrophobicContact CD2-CD1 4.06Å; Y1762-F1813 HydrophobicContact CD2-CD2 4.32Å; Y1762-F1813 AromaticContact CD2-CG 3.94Å; Y1762-F1813 HydrophobicContact CD2-CG 4.03Å; Y1762-F1813 HydrophobicContact CE1-CB 4.39Å; Y1762-F1813 HydrophobicContact CE2-CB 3.95Å; Y1762-F1813 AromaticContact CE2-CD1 3.73Å; Y1762-F1813 HydrophobicContact CE2-CD1 3.98Å; Y1762-F1813 AromaticContact CE2-CD2 3.67Å; Y1762-F1813 HydrophobicContact CE2-CD2 3.67Å; Y1762-F1813 HydrophobicContact CE2-CE1 4.28Å; Y1762-F1813 HydrophobicContact CE2-CE2 4.2Å; Y1762-F1813 AromaticContact CE2-CG 3.69Å; Y1762-F1813 HydrophobicContact CE2-CG 3.69Å; Y1762-F1813 VanDerWaalsContact CE2-CG 3.41Å; Y1762-F1813 HydrophobicContact CG-CB 4.42Å
1763R77.6Confident82.8Confident75 Ų7540 Ų4028%0.28319%0.192SC..Hα-helixtrans-75.8-44.5-178.9-133.575.7101.7162.11.4113.3F1688 T1689 D1690 V1692 D1693 D1695 G1759 L1760 G1765 T1804 H1810F1688-R1763 PolarHBondContact O-NH1 3.27Å; T1689-R1763 WeakPolarHBondContact O-CD 3.37Å; T1689-R1763 PolarHBondContact O-NE 3.29Å; T1689-R1763 PolarHBondContact O-NH1 3.43Å; T1689-R1763 PolarHBondContact O-NH2 3.02Å; D1690-R1763 PolarHBondContact O-NH2 3.12Å; V1692-R1763 PolarHBondContact O-NH1 3.42Å; D1693-R1763 IonicContact OD1-CZ 3Å; D1693-R1763 VanDerWaalsContact OD1-CZ 3.29Å; D1693-R1763 IonicContact OD1-NE 3.19Å; D1693-R1763 IonicContact OD1-NH1 3.65Å; D1693-R1763 PolarHBondContact OD1-NH1 3.38Å; D1693-R1763 IonicContact OD1-NH2 3.77Å; D1695-R1763 WeakPolarHBondContact OD1-CG 3.44Å; G1759-R1763 PolarHBondContact O-N 3.19Å; L1760-R1763 PolarHBondContact O-N 3.24Å; R1763-G1765 VanDerWaalsContact C-N 3.31Å; R1763-G1765 PolarHBondContact O-N 3.02Å; R1763-T1804 PolarHBondContact NH1-O 3.21Å; R1763-H1810 PolarHBondContact NH2-CE1 3.1Å
1764M79.7Confident82.8Confident15.2 Ų15.242.6 Ų42.68%0.07521%0.205CC..Hα-helixtrans-76.4-25.1-177.1-67.7-175.181.900113.4D1695 A1698 L1760 Q1766 K1767 F1768 F1771D1695-M1764 WeakPolarHBondContact OD1-CG 3.49Å; A1698-M1764 HydrophobicContact CB-CE 3.61Å; A1698-M1764 HydrophobicContact CB-SD 3.39Å; A1698-M1764 WeakPolarHBondContact CB-SD 3.36Å; L1760-M1764 HydrophobicContact CD2-SD 4.37Å; L1760-M1764 VanDerWaalsContact O-CB 3.23Å; L1760-M1764 WeakPolarHBondContact O-CB 3.39Å; L1760-M1764 VanDerWaalsContact O-CG 3.27Å; L1760-M1764 WeakPolarHBondContact O-CG 3.35Å; L1760-M1764 PolarHBondContact O-N 3.19Å; M1764-Q1766 PolarHBondContact O-N 3.06Å; M1764-Q1766 VanDerWaalsContact O-N 3.15Å; M1764-K1767 HydrophobicContact CB-CB 4.25Å; M1764-K1767 HydrophobicContact CE-CB 4.04Å; M1764-K1767 WeakPolarHBondContact O-CB 3.25Å; M1764-K1767 PolarHBondContact O-N 3.19Å; M1764-K1767 VanDerWaalsContact O-N 3.1Å; M1764-F1768 HydrophobicContact CB-CB 4.17Å; M1764-F1768 HydrophobicContact SD-CD2 3.93Å; M1764-F1771 HydrophobicContact CE-CD2 4.29Å; M1764-F1771 HydrophobicContact CE-CE2 4.01Å
1765G79.1Confident82.8Confident12 Ų1242.2 Ų42.212%0.12420%0.204CC..G310 helixtrans52.4-120.5-176.500000112.2L1761 R1763 K1767 F1768 V1796L1761-G1765 WeakPolarHBondContact O-CA 3.43Å; L1761-G1765 PolarHBondContact O-N 3.12Å; L1761-G1765 VanDerWaalsContact O-N 3.09Å; R1763-G1765 VanDerWaalsContact C-N 3.31Å; R1763-G1765 PolarHBondContact O-N 3.02Å; G1765-K1767 VanDerWaalsContact C-N 3.28Å; G1765-K1767 PolarHBondContact O-N 3.2Å; G1765-F1768 VanDerWaalsContact O-CB 3.31Å; G1765-F1768 WeakPolarHBondContact O-CB 3.41Å; G1765-F1768 PolarHBondContact O-N 3.02Å; G1765-F1768 VanDerWaalsContact O-N 3.11Å; G1765-V1796 VanDerWaalsContact C-CG1 3.45Å
1766Q80.4Confident82.7Confident103.4 Ų103.445.5 Ų45.548%0.48322%0.218SC..G310 helixtrans-63.1-27.9-178.4-63.9-102.1-7.200113.8M1764 F1768 K1769 V1796M1764-Q1766 PolarHBondContact O-N 3.06Å; M1764-Q1766 VanDerWaalsContact O-N 3.15Å; Q1766-F1768 PolarHBondContact O-N 3.14Å; Q1766-K1769 WeakPolarHBondContact O-CB 3.32Å; Q1766-K1769 WeakPolarHBondContact O-CG 3.4Å; Q1766-K1769 PolarHBondContact O-N 3.14Å; Q1766-K1769 VanDerWaalsContact O-N 3.12Å; Q1766-V1796 PolarHBondContact NE2-O 3.09Å
1767K80Confident82.6Confident110.8 Ų110.851.7 Ų51.748%0.48225%0.245SC..G310 helixtrans-63.3-23.3178.2-59.3178.4-172.4170.40111.8D1695 M1764 G1765 K1769 F1770D1695-K1767 WeakPolarHBondContact OD2-CD 3.19Å; D1695-K1767 WeakPolarHBondContact OD2-CE 3.05Å; D1695-K1767 IonicContact OD2-NZ 3.36Å; D1695-K1767 PolarHBondContact OD2-NZ 3.23Å; M1764-K1767 HydrophobicContact CB-CB 4.25Å; M1764-K1767 HydrophobicContact CE-CB 4.04Å; M1764-K1767 WeakPolarHBondContact O-CB 3.25Å; M1764-K1767 PolarHBondContact O-N 3.19Å; M1764-K1767 VanDerWaalsContact O-N 3.1Å; G1765-K1767 VanDerWaalsContact C-N 3.28Å; G1765-K1767 PolarHBondContact O-N 3.2Å; K1767-K1769 PolarHBondContact O-N 3.27Å; K1767-F1770 VanDerWaalsContact O-CD2 3.27Å; K1767-F1770 WeakPolarHBondContact O-CD2 3.34Å; K1767-F1770 PolarHBondContact O-N 2.89Å
1768F84Confident82.4Confident1.6 Ų1.651.7 Ų51.71%0.00725%0.245CC..G310 helixtrans-65.9-18.3177.7-162.8-92.2000113.1I1702 L1757 L1760 L1761 M1764 G1765 Q1766 F1770 F1771 L1772 V1775 F1789I1702-F1768 HydrophobicContact CD1-CD2 4.44Å; I1702-F1768 HydrophobicContact CD1-CE2 3.81Å; I1702-F1768 HydrophobicContact CD1-CZ 4.37Å; L1757-F1768 HydrophobicContact CD2-CZ 4.43Å; L1760-F1768 HydrophobicContact CB-CD2 4.41Å; L1760-F1768 HydrophobicContact CB-CE2 4.17Å; L1761-F1768 HydrophobicContact CB-CD1 4.31Å; L1761-F1768 HydrophobicContact CB-CD2 4.21Å; L1761-F1768 HydrophobicContact CB-CE1 4.36Å; L1761-F1768 HydrophobicContact CB-CE2 4.3Å; L1761-F1768 HydrophobicContact CB-CG 4.22Å; L1761-F1768 HydrophobicContact CB-CZ 4.39Å; L1761-F1768 HydrophobicContact CD1-CB 3.77Å; L1761-F1768 HydrophobicContact CD1-CD1 3.53Å; L1761-F1768 VanDerWaalsContact CD1-CD1 3.47Å; L1761-F1768 HydrophobicContact CD1-CD2 4.35Å; L1761-F1768 HydrophobicContact CD1-CE1 4.22Å; L1761-F1768 HydrophobicContact CD1-CG 3.68Å; L1761-F1768 HydrophobicContact CG-CD1 4.41Å; L1761-F1768 HydrophobicContact CG-CG 4.5Å; M1764-F1768 HydrophobicContact CB-CB 4.17Å; M1764-F1768 HydrophobicContact SD-CD2 3.93Å; G1765-F1768 VanDerWaalsContact O-CB 3.31Å; G1765-F1768 WeakPolarHBondContact O-CB 3.41Å; G1765-F1768 PolarHBondContact O-N 3.02Å; G1765-F1768 VanDerWaalsContact O-N 3.11Å; Q1766-F1768 PolarHBondContact O-N 3.14Å; F1768-F1770 PolarHBondContact O-N 3.15Å; F1768-F1770 VanDerWaalsContact O-N 3.1Å; F1768-F1771 PolarHBondContact O-N 2.98Å; F1768-L1772 HydrophobicContact CD1-CB 4.48Å; F1768-L1772 HydrophobicContact CD1-CD1 4.48Å; F1768-L1772 HydrophobicContact CE1-CD1 4.46Å; F1768-L1772 PolarHBondContact O-N 3.1Å; F1768-L1772 VanDerWaalsContact O-N 3.14Å; F1768-V1775 HydrophobicContact CE1-CB 4.37Å; F1768-V1775 HydrophobicContact CE1-CG1 4.48Å; F1768-V1775 HydrophobicContact CE1-CG2 4.28Å; F1768-V1775 HydrophobicContact CZ-CG1 4.5Å; F1768-V1775 HydrophobicContact CZ-CG2 4Å; F1768-F1789 AromaticContact CE1-CE2 3.99Å; F1768-F1789 HydrophobicContact CE1-CE2 4.11Å; F1768-F1789 AromaticContact CE1-CZ 3.93Å; F1768-F1789 HydrophobicContact CE1-CZ 4Å; F1768-F1789 HydrophobicContact CZ-CE2 4.22Å; F1768-F1789 HydrophobicContact CZ-CZ 4.35Å
1769K80.9Confident82.3Confident105.8 Ų105.852.2 Ų52.246%0.4625%0.247SC..G310 helixtrans-56.3-28178.2-75.1-179.1171.5173.50113.5Q1766 K1767 F1771 L1772 P1773Q1766-K1769 WeakPolarHBondContact O-CB 3.32Å; Q1766-K1769 WeakPolarHBondContact O-CG 3.4Å; Q1766-K1769 PolarHBondContact O-N 3.14Å; Q1766-K1769 VanDerWaalsContact O-N 3.12Å; K1767-K1769 PolarHBondContact O-N 3.27Å; K1769-F1771 VanDerWaalsContact C-N 3.29Å; K1769-F1771 PolarHBondContact O-N 2.91Å; K1769-L1772 WeakPolarHBondContact O-CB 3.37Å; K1769-L1772 PolarHBondContact O-N 3.19Å; K1769-P1773 WeakPolarHBondContact O-CD 3.42Å
1770F82.7Confident82.2Confident176.6 Ų176.655.6 Ų55.678%0.77527%0.269SS*.G310 helixtrans-64.8-32.6175.2-62.2-64.2000112.9K1767 F1768K1767-F1770 VanDerWaalsContact O-CD2 3.27Å; K1767-F1770 WeakPolarHBondContact O-CD2 3.34Å; K1767-F1770 PolarHBondContact O-N 2.89Å; F1768-F1770 PolarHBondContact O-N 3.15Å; F1768-F1770 VanDerWaalsContact O-N 3.1Å
1771F84.4Confident81.9Confident43.6 Ų43.660.7 Ų60.719%0.19129%0.289CS..THydrogen-bonded Turntrans-95.5-14.1179.8-60.8-73000113A1698 I1702 M1764 F1768 K1769 P1773 L1774 V1775A1698-F1771 HydrophobicContact CB-CE2 4.11Å; A1698-F1771 HydrophobicContact CB-CZ 4.45Å; I1702-F1771 HydrophobicContact CD1-CB 3.88Å; I1702-F1771 HydrophobicContact CD1-CD1 4.15Å; I1702-F1771 HydrophobicContact CD1-CD2 3.89Å; I1702-F1771 HydrophobicContact CD1-CE2 4.43Å; I1702-F1771 HydrophobicContact CD1-CG 3.69Å; I1702-F1771 HydrophobicContact CG2-CB 4.48Å; I1702-F1771 HydrophobicContact CG2-CD1 4.41Å; M1764-F1771 HydrophobicContact CE-CD2 4.29Å; M1764-F1771 HydrophobicContact CE-CE2 4.01Å; F1768-F1771 PolarHBondContact O-N 2.98Å; K1769-F1771 VanDerWaalsContact C-N 3.29Å; K1769-F1771 PolarHBondContact O-N 2.91Å; F1771-P1773 VanDerWaalsContact C-CD 3.49Å; F1771-L1774 WeakPolarHBondContact O-CB 3.31Å; F1771-L1774 PolarHBondContact O-N 3.19Å; F1771-L1774 VanDerWaalsContact O-N 3.13Å; F1771-V1775 WeakPolarHBondContact O-CG2 3.45Å; F1771-V1775 PolarHBondContact O-N 3.09Å; F1771-V1775 VanDerWaalsContact O-N 3.1Å
1772L83.1Confident81.3Confident18.2 Ų18.261.9 Ų61.910%0.09530%0.295CS..Hα-helixtrans-54.1-43-176.2-172.867.3000113.9F1768 K1769 L1774 V1775 Q1776 F1789 L1793F1768-L1772 HydrophobicContact CD1-CB 4.48Å; F1768-L1772 HydrophobicContact CD1-CD1 4.48Å; F1768-L1772 HydrophobicContact CE1-CD1 4.46Å; F1768-L1772 PolarHBondContact O-N 3.1Å; F1768-L1772 VanDerWaalsContact O-N 3.14Å; K1769-L1772 WeakPolarHBondContact O-CB 3.37Å; K1769-L1772 PolarHBondContact O-N 3.19Å; L1772-L1774 VanDerWaalsContact C-N 3.3Å; L1772-L1774 PolarHBondContact O-N 3.06Å; L1772-V1775 PolarHBondContact O-N 3.27Å; L1772-Q1776 HydrophobicContact CD1-CG 3.99Å; L1772-Q1776 HydrophobicContact CG-CG 4.06Å; L1772-Q1776 VanDerWaalsContact O-CB 3.29Å; L1772-Q1776 WeakPolarHBondContact O-CB 3.29Å; L1772-Q1776 VanDerWaalsContact O-CG 3.29Å; L1772-Q1776 WeakPolarHBondContact O-CG 3.32Å; L1772-Q1776 PolarHBondContact O-N 3.25Å; L1772-F1789 HydrophobicContact CD1-CZ 4.42Å; L1772-L1793 HydrophobicContact CD1-CD1 3.75Å; L1772-L1793 HydrophobicContact CD1-CD2 4.04Å; L1772-L1793 HydrophobicContact CD2-CD1 4.2Å
1773P84.4Confident80.8Confident84.2 Ų84.268.5 Ų68.555%0.54733%0.327SS..Hα-helixtrans-62-36.6178.6-23.734.5000113.3K1769 F1771 K1777K1769-P1773 WeakPolarHBondContact O-CD 3.42Å; F1771-P1773 VanDerWaalsContact C-CD 3.49Å; P1773-K1777 VanDerWaalsContact O-CB 3.3Å; P1773-K1777 WeakPolarHBondContact O-CB 3.37Å; P1773-K1777 PolarHBondContact O-N 3.23Å; P1773-K1777 VanDerWaalsContact O-N 3.07Å
1774L84.7Confident80.3Confident55.8 Ų55.866.4 Ų66.429%0.29232%0.321SS..Hα-helixtrans-69.8-44.7177.8177.995.7000110.8I1702 H1703 C1706 F1771 L1772 K1777 M1778I1702-L1774 HydrophobicContact CG2-CD2 4.1Å; H1703-L1774 WeakPolarHBondContact ND1-CD2 3.44Å; C1706-L1774 HydrophobicContact CB-CD1 4.49Å; C1706-L1774 HydrophobicContact CB-CD2 4.11Å; C1706-L1774 HydrophobicContact CB-CG 4.42Å; C1706-L1774 WeakPolarHBondContact SG-CD2 3.15Å; F1771-L1774 WeakPolarHBondContact O-CB 3.31Å; F1771-L1774 PolarHBondContact O-N 3.19Å; F1771-L1774 VanDerWaalsContact O-N 3.13Å; L1772-L1774 VanDerWaalsContact C-N 3.3Å; L1772-L1774 PolarHBondContact O-N 3.06Å; L1774-K1777 WeakPolarHBondContact O-CB 3.5Å; L1774-K1777 PolarHBondContact O-N 3.27Å; L1774-M1778 PolarHBondContact O-N 3.01Å; L1774-M1778 VanDerWaalsContact O-N 3.08Å
1775V84Confident79.6Confident0 Ų072.8 Ų72.80%035%0.35CS..Hα-helixtrans-67.8-41178.9176.60000111I1702 L1757 F1768 F1771 L1772 K1777 M1778 L1779 F1789I1702-V1775 HydrophobicContact CG2-CG2 4.07Å; L1757-V1775 HydrophobicContact CD1-CG1 4.19Å; L1757-V1775 HydrophobicContact CD2-CG2 4.28Å; F1768-V1775 HydrophobicContact CE1-CB 4.37Å; F1768-V1775 HydrophobicContact CE1-CG1 4.48Å; F1768-V1775 HydrophobicContact CE1-CG2 4.28Å; F1768-V1775 HydrophobicContact CZ-CG1 4.5Å; F1768-V1775 HydrophobicContact CZ-CG2 4Å; F1771-V1775 WeakPolarHBondContact O-CG2 3.45Å; F1771-V1775 PolarHBondContact O-N 3.09Å; F1771-V1775 VanDerWaalsContact O-N 3.1Å; L1772-V1775 PolarHBondContact O-N 3.27Å; V1775-K1777 PolarHBondContact O-N 3.31Å; V1775-M1778 HydrophobicContact CG1-CE 4.18Å; V1775-M1778 WeakPolarHBondContact O-CB 3.34Å; V1775-M1778 PolarHBondContact O-N 3.15Å; V1775-L1779 HydrophobicContact CG1-CD1 3.91Å; V1775-L1779 HydrophobicContact CG1-CG 4.35Å; V1775-L1779 WeakPolarHBondContact O-CB 3.39Å; V1775-L1779 WeakPolarHBondContact O-CD1 3.35Å; V1775-L1779 VanDerWaalsContact O-CG 3.28Å; V1775-L1779 WeakPolarHBondContact O-CG 3.31Å; V1775-L1779 PolarHBondContact O-N 3.19Å; V1775-F1789 HydrophobicContact CG1-CE1 4.37Å; V1775-F1789 HydrophobicContact CG1-CE2 4.3Å; V1775-F1789 HydrophobicContact CG1-CZ 3.77Å
1776Q83.2Confident79.1Confident89 Ų8973.6 Ų73.642%0.41635%0.353SS..Hα-helixtrans-64-39.4174.4-76.7177.4-18.500112.1L1772 M1778 L1779 S1780L1772-Q1776 HydrophobicContact CD1-CG 3.99Å; L1772-Q1776 HydrophobicContact CG-CG 4.06Å; L1772-Q1776 VanDerWaalsContact O-CB 3.29Å; L1772-Q1776 WeakPolarHBondContact O-CB 3.29Å; L1772-Q1776 VanDerWaalsContact O-CG 3.29Å; L1772-Q1776 WeakPolarHBondContact O-CG 3.32Å; L1772-Q1776 PolarHBondContact O-N 3.25Å; Q1776-M1778 VanDerWaalsContact C-N 3.32Å; Q1776-M1778 PolarHBondContact O-N 3.2Å; Q1776-L1779 PolarHBondContact O-N 3.1Å; Q1776-S1780 VanDerWaalsContact O-CB 3.27Å; Q1776-S1780 WeakPolarHBondContact O-CB 3.38Å; Q1776-S1780 PolarHBondContact O-N 3.13Å; Q1776-S1780 PolarHBondContact O-OG 3.07Å; Q1776-S1780 VanDerWaalsContact O-OG 3.09Å
1777K83.3Confident78.7Confident130.4 Ų130.472.7 Ų72.757%0.56736%0.356SS*.Hα-helixtrans-62.9-38.8173.7-175.3176.9-178.9178.70111.9P1773 L1774 V1775 S1780 R1781P1773-K1777 VanDerWaalsContact O-CB 3.3Å; P1773-K1777 WeakPolarHBondContact O-CB 3.37Å; P1773-K1777 PolarHBondContact O-N 3.23Å; P1773-K1777 VanDerWaalsContact O-N 3.07Å; L1774-K1777 WeakPolarHBondContact O-CB 3.5Å; L1774-K1777 PolarHBondContact O-N 3.27Å; V1775-K1777 PolarHBondContact O-N 3.31Å; K1777-S1780 PolarHBondContact O-N 3.43Å; K1777-S1780 PolarHBondContact O-OG 3.08Å; K1777-S1780 VanDerWaalsContact O-OG 3.1Å; K1777-R1781 WeakPolarHBondContact O-CB 3.37Å; K1777-R1781 VanDerWaalsContact O-CG 3.26Å; K1777-R1781 WeakPolarHBondContact O-CG 3.31Å; K1777-R1781 PolarHBondContact O-N 3.2Å; K1777-R1781 VanDerWaalsContact O-N 3.12Å
1778M82.6Confident78.5Confident0.2 Ų0.271.4 Ų71.40%0.00135%0.348CS..Hα-helixtrans-66.2-48.9173.8177.1-81-69.200111.1L1709 L1710 M1754 L1757 L1774 V1775 Q1776 S1780 R1781 L1782 L1784L1709-M1778 HydrophobicContact CB-CG 4.48Å; L1709-M1778 HydrophobicContact CD1-CE 4.37Å; L1709-M1778 HydrophobicContact CD1-SD 4.07Å; L1710-M1778 HydrophobicContact CD2-CB 4.4Å; L1710-M1778 HydrophobicContact CD2-CG 4.42Å; L1710-M1778 HydrophobicContact CG-CB 4.45Å; L1710-M1778 HydrophobicContact CG-CG 4.3Å; M1754-M1778 HydrophobicContact SD-CE 4.34Å; L1757-M1778 HydrophobicContact CD1-CE 3.63Å; L1774-M1778 PolarHBondContact O-N 3.01Å; L1774-M1778 VanDerWaalsContact O-N 3.08Å; V1775-M1778 HydrophobicContact CG1-CE 4.18Å; V1775-M1778 WeakPolarHBondContact O-CB 3.34Å; V1775-M1778 PolarHBondContact O-N 3.15Å; Q1776-M1778 VanDerWaalsContact C-N 3.32Å; Q1776-M1778 PolarHBondContact O-N 3.2Å; M1778-S1780 VanDerWaalsContact C-N 3.33Å; M1778-S1780 PolarHBondContact O-N 3.09Å; M1778-R1781 PolarHBondContact O-N 3.23Å; M1778-L1782 HydrophobicContact CG-CD1 3.68Å; M1778-L1782 WeakPolarHBondContact O-CB 3.39Å; M1778-L1782 WeakPolarHBondContact O-CD1 3.43Å; M1778-L1782 PolarHBondContact O-N 3.26Å; M1778-L1782 HydrophobicContact SD-CD1 3.5Å; M1778-L1782 VanDerWaalsContact SD-CD1 3.6Å; M1778-L1782 WeakPolarHBondContact SD-CD1 3.37Å; M1778-L1784 HydrophobicContact SD-CD1 4.38Å
1779L81.4Confident78.3Confident21.6 Ų21.671.4 Ų71.411%0.11335%0.348CS..Hα-helixtrans-60.1-41.1179.1-87.3153000112.7M1754 V1775 Q1776 Q1783 L1784 F1789M1754-L1779 HydrophobicContact CE-CD1 4.05Å; M1754-L1779 HydrophobicContact CE-CD2 3.77Å; M1754-L1779 HydrophobicContact SD-CD1 4.14Å; M1754-L1779 HydrophobicContact SD-CD2 3.7Å; V1775-L1779 HydrophobicContact CG1-CD1 3.91Å; V1775-L1779 HydrophobicContact CG1-CG 4.35Å; V1775-L1779 WeakPolarHBondContact O-CB 3.39Å; V1775-L1779 WeakPolarHBondContact O-CD1 3.35Å; V1775-L1779 VanDerWaalsContact O-CG 3.28Å; V1775-L1779 WeakPolarHBondContact O-CG 3.31Å; V1775-L1779 PolarHBondContact O-N 3.19Å; Q1776-L1779 PolarHBondContact O-N 3.1Å; L1779-Q1783 WeakPolarHBondContact O-CA 3.12Å; L1779-Q1783 PolarHBondContact O-N 3.02Å; L1779-Q1783 VanDerWaalsContact O-N 3.11Å; L1779-L1784 HydrophobicContact CD1-CB 4Å; L1779-L1784 WeakPolarHBondContact CD1-O 3Å; L1779-L1784 HydrophobicContact CD2-CB 3.95Å; L1779-L1784 WeakPolarHBondContact CD2-O 3.48Å; L1779-L1784 WeakPolarHBondContact CG-O 3.45Å; L1779-L1784 PolarHBondContact O-N 2.92Å; L1779-L1784 VanDerWaalsContact O-N 3.12Å; L1779-F1789 HydrophobicContact CD1-CD1 4.06Å; L1779-F1789 HydrophobicContact CD1-CE1 3.74Å; L1779-F1789 HydrophobicContact CD1-CZ 4.43Å
1780S80.8Confident78.3Confident82.6 Ų82.669.3 Ų69.358%0.57834%0.342SS*.Hα-helixtrans-70.7-38.5-179.565.60000112.6Q1776 K1777 M1778 Q1783Q1776-S1780 VanDerWaalsContact O-CB 3.27Å; Q1776-S1780 WeakPolarHBondContact O-CB 3.38Å; Q1776-S1780 PolarHBondContact O-N 3.13Å; Q1776-S1780 PolarHBondContact O-OG 3.07Å; Q1776-S1780 VanDerWaalsContact O-OG 3.09Å; K1777-S1780 PolarHBondContact O-N 3.43Å; K1777-S1780 PolarHBondContact O-OG 3.08Å; K1777-S1780 VanDerWaalsContact O-OG 3.1Å; M1778-S1780 VanDerWaalsContact C-N 3.33Å; M1778-S1780 PolarHBondContact O-N 3.09Å; S1780-Q1783 PolarHBondContact O-N 3.06Å
1781R78.2Confident78.1Confident109.8 Ų109.864.6 Ų64.641%0.41433%0.328SS..Hα-helixtrans-68.5-42.7176.6-78.3-169.779.2159.99.1112.8L1710 E1713 K1777 M1778 Q1783L1710-R1781 HydrophobicContact CD2-CB 4.37Å; E1713-R1781 WeakPolarHBondContact OE1-CB 3.31Å; E1713-R1781 IonicContact OE1-CZ 3.16Å; E1713-R1781 IonicContact OE1-NE 3.1Å; E1713-R1781 PolarHBondContact OE1-NE 3.05Å; E1713-R1781 IonicContact OE1-NH2 3.25Å; E1713-R1781 PolarHBondContact OE1-NH2 2.84Å; E1713-R1781 VanDerWaalsContact OE2-CB 3.27Å; E1713-R1781 WeakPolarHBondContact OE2-CB 3.35Å; E1713-R1781 IonicContact OE2-CZ 3.28Å; E1713-R1781 IonicContact OE2-NE 3.52Å; E1713-R1781 PolarHBondContact OE2-NE 3.22Å; E1713-R1781 IonicContact OE2-NH2 3.22Å; E1713-R1781 PolarHBondContact OE2-NH2 2.88Å; K1777-R1781 WeakPolarHBondContact O-CB 3.37Å; K1777-R1781 VanDerWaalsContact O-CG 3.26Å; K1777-R1781 WeakPolarHBondContact O-CG 3.31Å; K1777-R1781 PolarHBondContact O-N 3.2Å; K1777-R1781 VanDerWaalsContact O-N 3.12Å; M1778-R1781 PolarHBondContact O-N 3.23Å; R1781-Q1783 VanDerWaalsContact C-N 3.29Å; R1781-Q1783 PolarHBondContact O-N 3.05Å
1782L72.5Confident77.7Confident26.2 Ų26.262.6 Ų62.614%0.13732%0.319CS..THydrogen-bonded Turntrans-83.1-0.9179.6-70.8152.7000113.7L1709 E1713 I1746 M1778 L1784L1709-L1782 HydrophobicContact CB-CD1 3.85Å; L1709-L1782 HydrophobicContact CD1-CD1 4.44Å; E1713-L1782 HydrophobicContact CB-CD2 3.96Å; E1713-L1782 HydrophobicContact CB-CG 4.46Å; E1713-L1782 HydrophobicContact CG-CD2 4.02Å; E1713-L1782 HydrophobicContact CG-CG 4.34Å; I1746-L1782 HydrophobicContact CD1-CD2 4.36Å; I1746-L1782 HydrophobicContact CG2-CD2 4.11Å; M1778-L1782 HydrophobicContact CG-CD1 3.68Å; M1778-L1782 WeakPolarHBondContact O-CB 3.39Å; M1778-L1782 WeakPolarHBondContact O-CD1 3.43Å; M1778-L1782 PolarHBondContact O-N 3.26Å; M1778-L1782 HydrophobicContact SD-CD1 3.5Å; M1778-L1782 VanDerWaalsContact SD-CD1 3.6Å; M1778-L1782 WeakPolarHBondContact SD-CD1 3.37Å; L1782-L1784 HydrophobicContact CB-CD1 3.68Å; L1782-L1784 HydrophobicContact CB-CD2 3.93Å; L1782-L1784 HydrophobicContact CB-CG 3.65Å; L1782-L1784 VanDerWaalsContact CB-CG 3.44Å; L1782-L1784 HydrophobicContact CD1-CD1 4.08Å; L1782-L1784 HydrophobicContact CG-CD1 4.4Å; L1782-L1784 WeakPolarHBondContact O-CD2 3.31Å; L1782-L1784 WeakPolarHBondContact O-CG 3.5Å; L1782-L1784 PolarHBondContact O-N 3.17Å; L1782-L1784 VanDerWaalsContact O-N 3.17Å
1783Q70.7Confident77.6Confident177.4 Ų177.462.6 Ų62.683%0.82932%0.319SS*.THydrogen-bonded Turntrans51.136.5-175.6-59.4-170.9-8.400114L1779 S1780 R1781 H1785L1779-Q1783 WeakPolarHBondContact O-CA 3.12Å; L1779-Q1783 PolarHBondContact O-N 3.02Å; L1779-Q1783 VanDerWaalsContact O-N 3.11Å; S1780-Q1783 PolarHBondContact O-N 3.06Å; R1781-Q1783 VanDerWaalsContact C-N 3.29Å; R1781-Q1783 PolarHBondContact O-N 3.05Å; Q1783-H1785 PolarHBondContact O-N 3.01Å; Q1783-H1785 VanDerWaalsContact O-N 3.15Å
1784L66.3Low77.2Confident30.2 Ų30.259.6 Ų59.616%0.15830%0.304CS..  trans-89105.6-174.5-64172.7000111.4R1750 M1778 L1779 L1782 T1786R1750-L1784 HydrophobicContact CB-CD1 4.44Å; R1750-L1784 HydrophobicContact CB-CD2 4.34Å; R1750-L1784 HydrophobicContact CG-CD1 4.09Å; R1750-L1784 HydrophobicContact CG-CD2 4.18Å; R1750-L1784 VanDerWaalsContact NE-CD2 3.34Å; M1778-L1784 HydrophobicContact SD-CD1 4.38Å; L1779-L1784 HydrophobicContact CD1-CB 4Å; L1779-L1784 WeakPolarHBondContact CD1-O 3Å; L1779-L1784 HydrophobicContact CD2-CB 3.95Å; L1779-L1784 WeakPolarHBondContact CD2-O 3.48Å; L1779-L1784 WeakPolarHBondContact CG-O 3.45Å; L1779-L1784 PolarHBondContact O-N 2.92Å; L1779-L1784 VanDerWaalsContact O-N 3.12Å; L1782-L1784 HydrophobicContact CB-CD1 3.68Å; L1782-L1784 HydrophobicContact CB-CD2 3.93Å; L1782-L1784 HydrophobicContact CB-CG 3.65Å; L1782-L1784 VanDerWaalsContact CB-CG 3.44Å; L1782-L1784 HydrophobicContact CD1-CD1 4.08Å; L1782-L1784 HydrophobicContact CG-CD1 4.4Å; L1782-L1784 WeakPolarHBondContact O-CD2 3.31Å; L1782-L1784 WeakPolarHBondContact O-CG 3.5Å; L1782-L1784 PolarHBondContact O-N 3.17Å; L1782-L1784 VanDerWaalsContact O-N 3.17Å; L1784-T1786 PolarHBondContact O-N 3.12Å
1785H64.4Low76.7Confident149.2 Ų149.260.4 Ų60.469%0.69131%0.306SS*.  trans-93.295.6170.8-167.3-60.6000110.9Q1783 P1787 N1790Q1783-H1785 PolarHBondContact O-N 3.01Å; Q1783-H1785 VanDerWaalsContact O-N 3.15Å; H1785-P1787 WeakPolarHBondContact O-CD 3.43Å; H1785-N1790 PolarHBondContact CE1-ND2 3.13Å; H1785-N1790 PolarHBondContact ND1-ND2 3.1Å; H1785-N1790 PolarHBondContact NE2-ND2 3.45Å
1786T68.2Low76.2Confident28.8 Ų28.860.7 Ų60.718%0.17731%0.308CS..  trans-100.8111178.3-51.30000110.7M1754 L1784 R1788 F1789 N1790M1754-T1786 HydrophobicContact CB-CG2 4.32Å; M1754-T1786 HydrophobicContact CE-CG2 4.16Å; M1754-T1786 HydrophobicContact CG-CG2 4.48Å; L1784-T1786 PolarHBondContact O-N 3.12Å; T1786-R1788 VanDerWaalsContact C-N 3.3Å; T1786-R1788 HydrophobicContact CG2-CB 4.31Å; T1786-R1788 PolarHBondContact O-N 3.12Å; T1786-F1789 HydrophobicContact CG2-CB 4.3Å; T1786-F1789 PolarHBondContact O-N 3.25Å; T1786-N1790 WeakPolarHBondContact O-CB 3.17Å; T1786-N1790 PolarHBondContact O-N 3.2Å; T1786-N1790 VanDerWaalsContact O-N 3.09Å; T1786-N1790 PolarHBondContact O-OD1 2.78Å
1787P73.4Confident75.8Confident84.8 Ų84.861.6 Ų61.655%0.55131%0.312SS*.Hα-helixtrans-65.7-33.3-173.325.1-33.9000113H1785 N1790 T1791H1785-P1787 WeakPolarHBondContact O-CD 3.43Å; P1787-N1790 PolarHBondContact O-N 3.21Å; P1787-T1791 VanDerWaalsContact O-CB 3.31Å; P1787-T1791 WeakPolarHBondContact O-CB 3.35Å; P1787-T1791 PolarHBondContact O-N 3.12Å; P1787-T1791 PolarHBondContact O-OG1 3.05Å
1788R74.5Confident75.1Confident84.2 Ų84.264 Ų6432%0.31832%0.322SS..Hα-helixtrans-62.3-52.6178.2-79.4-177.2136.4-174.22.7111.9D1755 T1758 T1786 N1790 T1791 V1792 K1812 F1813 T1814 I1816D1755-R1788 VanDerWaalsContact CG-NH1 3.34Å; D1755-R1788 IonicContact OD1-CZ 3.05Å; D1755-R1788 IonicContact OD1-NH1 3.55Å; D1755-R1788 PolarHBondContact OD1-NH1 3.29Å; D1755-R1788 IonicContact OD2-NH1 3.14Å; D1755-R1788 PolarHBondContact OD2-NH1 2.96Å; T1758-R1788 HydrophobicContact CG2-CB 4.39Å; T1786-R1788 VanDerWaalsContact C-N 3.3Å; T1786-R1788 HydrophobicContact CG2-CB 4.31Å; T1786-R1788 PolarHBondContact O-N 3.12Å; R1788-N1790 VanDerWaalsContact C-N 3.33Å; R1788-N1790 PolarHBondContact O-N 3.2Å; R1788-T1791 WeakPolarHBondContact O-CB 3.31Å; R1788-T1791 PolarHBondContact O-N 3.2Å; R1788-T1791 VanDerWaalsContact O-N 3.11Å; R1788-V1792 WeakPolarHBondContact O-CG2 3.31Å; R1788-V1792 PolarHBondContact O-N 3.27Å; R1788-V1792 VanDerWaalsContact O-N 3.09Å; R1788-K1812 PolarHBondContact NH2-O 3.18Å; R1788-F1813 PolarHBondContact NH2-O 3.03Å; R1788-T1814 PolarHBondContact NH2-O 3.42Å; R1788-I1816 VanDerWaalsContact NH1-CD1 3.33Å
1789F80.6Confident74.1Confident0.8 Ų0.866.2 Ų66.20%0.00435%0.345CS..Hα-helixtrans-57.7-47.4177.8-176.7-95.2000111.2M1754 L1757 L1761 F1768 L1772 V1775 L1779 T1786 T1791 V1792 L1793M1754-F1789 HydrophobicContact CE-CB 3.71Å; M1754-F1789 HydrophobicContact CE-CD1 4.38Å; M1754-F1789 HydrophobicContact CE-CD2 4Å; M1754-F1789 HydrophobicContact CE-CG 3.79Å; L1757-F1789 HydrophobicContact CB-CD2 4.43Å; L1757-F1789 HydrophobicContact CB-CE2 4.33Å; L1761-F1789 HydrophobicContact CB-CE2 4.27Å; L1761-F1789 HydrophobicContact CD2-CD2 3.79Å; L1761-F1789 HydrophobicContact CD2-CE1 4.49Å; L1761-F1789 HydrophobicContact CD2-CE2 3.62Å; L1761-F1789 HydrophobicContact CD2-CG 4.38Å; L1761-F1789 HydrophobicContact CD2-CZ 4.07Å; L1761-F1789 HydrophobicContact CG-CE2 4.47Å; F1768-F1789 AromaticContact CE1-CE2 3.99Å; F1768-F1789 HydrophobicContact CE1-CE2 4.11Å; F1768-F1789 AromaticContact CE1-CZ 3.93Å; F1768-F1789 HydrophobicContact CE1-CZ 4Å; F1768-F1789 HydrophobicContact CZ-CE2 4.22Å; F1768-F1789 HydrophobicContact CZ-CZ 4.35Å; L1772-F1789 HydrophobicContact CD1-CZ 4.42Å; V1775-F1789 HydrophobicContact CG1-CE1 4.37Å; V1775-F1789 HydrophobicContact CG1-CE2 4.3Å; V1775-F1789 HydrophobicContact CG1-CZ 3.77Å; L1779-F1789 HydrophobicContact CD1-CD1 4.06Å; L1779-F1789 HydrophobicContact CD1-CE1 3.74Å; L1779-F1789 HydrophobicContact CD1-CZ 4.43Å; T1786-F1789 HydrophobicContact CG2-CB 4.3Å; T1786-F1789 PolarHBondContact O-N 3.25Å; F1789-T1791 VanDerWaalsContact C-N 3.32Å; F1789-T1791 PolarHBondContact O-N 3.26Å; F1789-V1792 PolarHBondContact O-N 3.1Å; F1789-L1793 HydrophobicContact CE1-CD2 4.09Å; F1789-L1793 VanDerWaalsContact O-CB 3.27Å; F1789-L1793 WeakPolarHBondContact O-CB 3.24Å; F1789-L1793 PolarHBondContact O-N 2.98Å
1790N80.4Confident72.9Confident62.6 Ų62.667.5 Ų67.534%0.33536%0.359SS..Hα-helixtrans-65.8-33179.3-69.1-6.7000112.9H1785 T1786 P1787 R1788 G1794H1785-N1790 PolarHBondContact CE1-ND2 3.13Å; H1785-N1790 PolarHBondContact ND1-ND2 3.1Å; H1785-N1790 PolarHBondContact NE2-ND2 3.45Å; T1786-N1790 WeakPolarHBondContact O-CB 3.17Å; T1786-N1790 PolarHBondContact O-N 3.2Å; T1786-N1790 VanDerWaalsContact O-N 3.09Å; T1786-N1790 PolarHBondContact O-OD1 2.78Å; P1787-N1790 PolarHBondContact O-N 3.21Å; R1788-N1790 VanDerWaalsContact C-N 3.33Å; R1788-N1790 PolarHBondContact O-N 3.2Å; N1790-G1794 PolarHBondContact O-N 3.04Å
1791T79.8Confident71.7Confident76 Ų7672.9 Ų72.947%0.46637%0.368SS..Hα-helixtrans-67.9-46.6176.2-56.40000111P1787 R1788 F1789 G1794 Q1795P1787-T1791 VanDerWaalsContact O-CB 3.31Å; P1787-T1791 WeakPolarHBondContact O-CB 3.35Å; P1787-T1791 PolarHBondContact O-N 3.12Å; P1787-T1791 PolarHBondContact O-OG1 3.05Å; R1788-T1791 WeakPolarHBondContact O-CB 3.31Å; R1788-T1791 PolarHBondContact O-N 3.2Å; R1788-T1791 VanDerWaalsContact O-N 3.11Å; F1789-T1791 VanDerWaalsContact C-N 3.32Å; F1789-T1791 PolarHBondContact O-N 3.26Å; T1791-G1794 PolarHBondContact O-N 3.06Å; T1791-Q1795 WeakPolarHBondContact O-CG 3.26Å; T1791-Q1795 PolarHBondContact O-N 3.24Å
1792V76.2Confident70.7Confident3.4 Ų3.469.6 Ų69.62%0.02136%0.359CS..Hα-helixtrans-66.6-42.5177.1-179.60000110.2T1758 L1761 Y1762 R1788 F1789 G1794 Q1795 V1796 L1802 F1813T1758-V1792 HydrophobicContact CG2-CG2 4.04Å; L1761-V1792 HydrophobicContact CB-CG1 4.48Å; L1761-V1792 HydrophobicContact CD2-CB 4Å; L1761-V1792 HydrophobicContact CD2-CG1 3.87Å; L1761-V1792 HydrophobicContact CG-CB 4.41Å; L1761-V1792 HydrophobicContact CG-CG1 3.84Å; Y1762-V1792 HydrophobicContact CD2-CG1 4.24Å; R1788-V1792 WeakPolarHBondContact O-CG2 3.31Å; R1788-V1792 PolarHBondContact O-N 3.27Å; R1788-V1792 VanDerWaalsContact O-N 3.09Å; F1789-V1792 PolarHBondContact O-N 3.1Å; V1792-G1794 VanDerWaalsContact C-N 3.33Å; V1792-G1794 PolarHBondContact O-N 3.09Å; V1792-Q1795 WeakPolarHBondContact O-CB 3.38Å; V1792-Q1795 PolarHBondContact O-N 3.3Å; V1792-Q1795 VanDerWaalsContact O-N 3.1Å; V1792-V1796 HydrophobicContact CG1-CG2 4.32Å; V1792-V1796 VanDerWaalsContact O-CG2 3.3Å; V1792-V1796 WeakPolarHBondContact O-CG2 3.24Å; V1792-V1796 PolarHBondContact O-N 3.27Å; V1792-L1802 HydrophobicContact CG1-CD2 4.31Å; V1792-F1813 HydrophobicContact CG2-CD1 3.82Å; V1792-F1813 HydrophobicContact CG2-CE1 3.74Å; V1792-F1813 HydrophobicContact CG2-CZ 4.46Å
1793L79.9Confident69.7Low17.6 Ų17.670.7 Ų70.79%0.09237%0.367CS..Hα-helixtrans-59.1-45.8176.2-176.663.2000111L1761 L1772 F1789 Q1795 V1796 E1797L1761-L1793 HydrophobicContact CD1-CD1 4.18Å; L1761-L1793 HydrophobicContact CD2-CB 3.97Å; L1761-L1793 HydrophobicContact CD2-CD1 4.33Å; L1772-L1793 HydrophobicContact CD1-CD1 3.75Å; L1772-L1793 HydrophobicContact CD1-CD2 4.04Å; L1772-L1793 HydrophobicContact CD2-CD1 4.2Å; F1789-L1793 HydrophobicContact CE1-CD2 4.09Å; F1789-L1793 VanDerWaalsContact O-CB 3.27Å; F1789-L1793 WeakPolarHBondContact O-CB 3.24Å; F1789-L1793 PolarHBondContact O-N 2.98Å; L1793-Q1795 VanDerWaalsContact C-N 3.29Å; L1793-Q1795 PolarHBondContact O-N 3.16Å; L1793-V1796 PolarHBondContact O-N 3.17Å; L1793-V1796 VanDerWaalsContact O-N 3.11Å; L1793-E1797 HydrophobicContact CD1-CG 4.27Å; L1793-E1797 HydrophobicContact CG-CG 4.34Å; L1793-E1797 WeakPolarHBondContact O-CB 3.41Å; L1793-E1797 WeakPolarHBondContact O-CG 3.35Å; L1793-E1797 PolarHBondContact O-N 3.16Å
1794G76.7Confident68.7Low21 Ų2166.6 Ų66.622%0.21635%0.354CS..Hα-helixtrans-64.3-26.6175.900000113.9N1790 T1791 V1792 K1798N1790-G1794 PolarHBondContact O-N 3.04Å; T1791-G1794 PolarHBondContact O-N 3.06Å; V1792-G1794 VanDerWaalsContact C-N 3.33Å; V1792-G1794 PolarHBondContact O-N 3.09Å; G1794-K1798 VanDerWaalsContact O-CB 3.31Å; G1794-K1798 WeakPolarHBondContact O-CB 3.43Å; G1794-K1798 WeakPolarHBondContact O-CD 3.38Å; G1794-K1798 WeakPolarHBondContact O-CE 3.25Å; G1794-K1798 WeakPolarHBondContact O-CG 3.39Å; G1794-K1798 PolarHBondContact O-N 3.19Å; G1794-K1798 VanDerWaalsContact O-N 3.11Å
1795Q74.1Confident67.8Low73 Ų7370.5 Ų70.534%0.34138%0.38SS..Hα-helixtrans-75.2-42171.2-71.2-167.6-7.800111.7T1791 V1792 L1793 K1798 G1799 A1800T1791-Q1795 WeakPolarHBondContact O-CG 3.26Å; T1791-Q1795 PolarHBondContact O-N 3.24Å; V1792-Q1795 WeakPolarHBondContact O-CB 3.38Å; V1792-Q1795 PolarHBondContact O-N 3.3Å; V1792-Q1795 VanDerWaalsContact O-N 3.1Å; L1793-Q1795 VanDerWaalsContact C-N 3.29Å; L1793-Q1795 PolarHBondContact O-N 3.16Å; Q1795-K1798 PolarHBondContact O-N 3.41Å; Q1795-G1799 PolarHBondContact O-N 3.14Å; Q1795-A1800 HydrophobicContact CB-CB 4.34Å; Q1795-A1800 WeakPolarHBondContact O-CB 3.34Å; Q1795-A1800 PolarHBondContact O-N 3.05Å
1796V72.8Confident66.9Low6.2 Ų6.268.2 Ų68.24%0.03838%0.38CS..Hα-helixtrans-65.7-42176.8173.80000111L1761 G1765 Q1766 V1792 L1793 K1798 G1799 L1802L1761-V1796 HydrophobicContact CD1-CG2 4.3Å; G1765-V1796 VanDerWaalsContact C-CG1 3.45Å; Q1766-V1796 PolarHBondContact NE2-O 3.09Å; V1792-V1796 HydrophobicContact CG1-CG2 4.32Å; V1792-V1796 VanDerWaalsContact O-CG2 3.3Å; V1792-V1796 WeakPolarHBondContact O-CG2 3.24Å; V1792-V1796 PolarHBondContact O-N 3.27Å; L1793-V1796 PolarHBondContact O-N 3.17Å; L1793-V1796 VanDerWaalsContact O-N 3.11Å; V1796-K1798 PolarHBondContact O-N 2.97Å; V1796-G1799 PolarHBondContact O-N 3.1Å; V1796-L1802 HydrophobicContact CG2-CD1 3.96Å; V1796-L1802 HydrophobicContact CG2-CD2 4.23Å
1797E74.6Confident65.9Low107.8 Ų107.871.8 Ų71.850%0.50440%0.399SS..Hα-helixtrans-67.3-36.2178.3-75.5-179.9166.600112.9L1793 G1799L1793-E1797 HydrophobicContact CD1-CG 4.27Å; L1793-E1797 HydrophobicContact CG-CG 4.34Å; L1793-E1797 WeakPolarHBondContact O-CB 3.41Å; L1793-E1797 WeakPolarHBondContact O-CG 3.35Å; L1793-E1797 PolarHBondContact O-N 3.16Å; E1797-G1799 PolarHBondContact O-N 3.21Å; E1797-G1799 VanDerWaalsContact O-N 3.11Å
1798K70Confident64.6Low181 Ų18179.2 Ų79.279%0.78742%0.415SS*.THydrogen-bonded Turntrans-71.70.9175.2-73175-174.4179.80113.8G1794 Q1795 V1796 A1800G1794-K1798 VanDerWaalsContact O-CB 3.31Å; G1794-K1798 WeakPolarHBondContact O-CB 3.43Å; G1794-K1798 WeakPolarHBondContact O-CD 3.38Å; G1794-K1798 WeakPolarHBondContact O-CE 3.25Å; G1794-K1798 WeakPolarHBondContact O-CG 3.39Å; G1794-K1798 PolarHBondContact O-N 3.19Å; G1794-K1798 VanDerWaalsContact O-N 3.11Å; Q1795-K1798 PolarHBondContact O-N 3.41Å; V1796-K1798 PolarHBondContact O-N 2.97Å; K1798-A1800 VanDerWaalsContact C-N 3.28Å; K1798-A1800 PolarHBondContact O-N 3.15Å; K1798-A1800 VanDerWaalsContact O-N 3.07Å
1799G61.3Low63.3Low46.2 Ų46.277.5 Ų77.548%0.47642%0.419SS..THydrogen-bonded Turntrans65.922.1-17900000113.4Q1795 V1796 E1797 Y1801Q1795-G1799 PolarHBondContact O-N 3.14Å; V1796-G1799 PolarHBondContact O-N 3.1Å; E1797-G1799 PolarHBondContact O-N 3.21Å; E1797-G1799 VanDerWaalsContact O-N 3.11Å; G1799-Y1801 PolarHBondContact O-N 3.29Å
1800A55.5Low62Low49.6 Ų49.679.6 Ų79.641%0.4143%0.429SS..  trans-66.9129.5176.800000109.6Q1795 K1798 L1802Q1795-A1800 HydrophobicContact CB-CB 4.34Å; Q1795-A1800 WeakPolarHBondContact O-CB 3.34Å; Q1795-A1800 PolarHBondContact O-N 3.05Å; K1798-A1800 VanDerWaalsContact C-N 3.28Å; K1798-A1800 PolarHBondContact O-N 3.15Å; K1798-A1800 VanDerWaalsContact O-N 3.07Å; A1800-L1802 VanDerWaalsContact C-N 3.28Å; A1800-L1802 PolarHBondContact O-N 3.16Å; A1800-L1802 VanDerWaalsContact O-N 3.16Å
1801Y54.8Low60.6Low194.4 Ų194.481.4 Ų81.476%0.76244%0.442SS*.  trans-59.5111.5170.9-140.1-93.2000109.1G1799 P1803 D1807G1799-Y1801 PolarHBondContact O-N 3.29Å; Y1801-P1803 WeakPolarHBondContact O-CD 3.3Å; Y1801-D1807 WeakPolarHBondContact CE1-OD2 3.3Å; Y1801-D1807 PolarHBondContact OH-OD2 2.74Å
1802L57.3Low59.4Low42 Ų4286 Ų8622%0.2246%0.455CS..  trans-79.4120.8170-75.8136.9000107.2Y1762 V1792 V1796 A1800 T1804Y1762-L1802 HydrophobicContact CD2-CD2 3.75Å; Y1762-L1802 HydrophobicContact CE2-CB 4.3Å; Y1762-L1802 HydrophobicContact CE2-CD2 3.57Å; Y1762-L1802 HydrophobicContact CE2-CG 4.46Å; Y1762-L1802 HydrophobicContact CG-CD2 4.4Å; V1792-L1802 HydrophobicContact CG1-CD2 4.31Å; V1796-L1802 HydrophobicContact CG2-CD1 3.96Å; V1796-L1802 HydrophobicContact CG2-CD2 4.23Å; A1800-L1802 VanDerWaalsContact C-N 3.28Å; A1800-L1802 PolarHBondContact O-N 3.16Å; A1800-L1802 VanDerWaalsContact O-N 3.16Å; L1802-T1804 VanDerWaalsContact C-N 3.31Å; L1802-T1804 PolarHBondContact O-N 3.06Å
1803P52Low58.5Low48 Ų4888.5 Ų88.531%0.31247%0.466SS..  trans-59.1125.1-179.9-13.120.5000110.5Y1762 Y1801 T1805 D1807 A1809 H1810 F1813Y1762-P1803 WeakPolarHBondContact OH-CB 3.4Å; Y1762-P1803 WeakPolarHBondContact OH-CD 3.47Å; Y1762-P1803 PolarHBondContact OH-O 3.29Å; Y1801-P1803 WeakPolarHBondContact O-CD 3.3Å; P1803-T1805 PolarHBondContact O-N 3.09Å; P1803-D1807 VanDerWaalsContact CA-OD2 3.31Å; P1803-D1807 WeakPolarHBondContact CA-OD2 3.2Å; P1803-D1807 HydrophobicContact CB-CB 3.93Å; P1803-A1809 HydrophobicContact CB-CB 4.29Å; P1803-A1809 HydrophobicContact CG-CB 4.11Å; P1803-H1810 PolarHBondContact O-CD2 3.37Å; P1803-H1810 PolarHBondContact O-CE1 3.05Å; P1803-H1810 PolarHBondContact O-NE2 3.27Å; P1803-F1813 HydrophobicContact CG-CD2 4.16Å; P1803-F1813 HydrophobicContact CG-CE2 3.86Å
1804T50.3Low57.5Low91.8 Ų91.889.6 Ų89.656%0.56347%0.474SS*.PPolyproline II helixtrans-80.1144.6168.552.30000109.5R1763 L1802 S1806 D1807 H1810R1763-T1804 PolarHBondContact NH1-O 3.21Å; L1802-T1804 VanDerWaalsContact C-N 3.31Å; L1802-T1804 PolarHBondContact O-N 3.06Å; T1804-S1806 PolarHBondContact O-N 2.87Å; T1804-S1806 PolarHBondContact OG1-OG 3.4Å; T1804-D1807 PolarHBondContact N-OD2 3.31Å; T1804-D1807 WeakPolarHBondContact O-CB 3.38Å; T1804-D1807 PolarHBondContact O-N 3.34Å; T1804-H1810 WeakPolarHBondContact O-CB 3.47Å; T1804-H1810 PolarHBondContact O-CD2 2.96Å; T1804-H1810 PolarHBondContact O-NE2 3.31Å
1805T48Very low56.7Low113 Ų11388.9 Ų88.969%0.69347%0.465SS*.SBendtrans-14.355.318056.40000115.1P1803 D1807 H1810P1803-T1805 PolarHBondContact O-N 3.09Å; T1805-D1807 VanDerWaalsContact C-N 3.28Å; T1805-D1807 PolarHBondContact O-N 3.39Å; T1805-H1810 VanDerWaalsContact CA-CD2 3.48Å; T1805-H1810 WeakPolarHBondContact CA-CD2 3.27Å; T1805-H1810 PolarHBondContact N-CD2 2.7Å; T1805-H1810 PolarHBondContact N-NE2 3.24Å; T1805-H1810 VanDerWaalsContact N-NE2 3.13Å
1806S45Very low56.2Low99.6 Ų99.688.9 Ų88.970%0.69747%0.467SS*.THydrogen-bonded Turntrans-131.231.2159.211.30000115.9T1804 R1808T1804-S1806 PolarHBondContact O-N 2.87Å; T1804-S1806 PolarHBondContact OG1-OG 3.4Å; S1806-R1808 VanDerWaalsContact C-N 3.32Å; S1806-R1808 PolarHBondContact O-N 3.13Å
1807D46.3Very low55.5Low105.8 Ų105.889.6 Ų89.657%0.56647%0.472SS*.THydrogen-bonded Turntrans-62.695.5177.5-83.3-27.4000116.7Y1801 P1803 T1804 T1805 A1809 H1810Y1801-D1807 WeakPolarHBondContact CE1-OD2 3.3Å; Y1801-D1807 PolarHBondContact OH-OD2 2.74Å; P1803-D1807 VanDerWaalsContact CA-OD2 3.31Å; P1803-D1807 WeakPolarHBondContact CA-OD2 3.2Å; P1803-D1807 HydrophobicContact CB-CB 3.93Å; T1804-D1807 PolarHBondContact N-OD2 3.31Å; T1804-D1807 WeakPolarHBondContact O-CB 3.38Å; T1804-D1807 PolarHBondContact O-N 3.34Å; T1805-D1807 VanDerWaalsContact C-N 3.28Å; T1805-D1807 PolarHBondContact O-N 3.39Å; D1807-A1809 HydrophobicContact CB-CB 4.5Å; D1807-A1809 PolarHBondContact O-N 3.1Å; D1807-H1810 WeakPolarHBondContact O-CB 3.29Å; D1807-H1810 PolarHBondContact O-N 2.98Å
1808R46.7Very low54.9Low239 Ų23986.6 Ų86.690%0.90246%0.462SS*.THydrogen-bonded Turntrans-82.5-21.5174.7-78.2-175.4176.2178.2-0.8114.5S1806 H1810S1806-R1808 VanDerWaalsContact C-N 3.32Å; S1806-R1808 PolarHBondContact O-N 3.13Å; R1808-H1810 PolarHBondContact O-N 3.12Å
1809A47.7Very low54.4Low47.8 Ų47.884.9 Ų84.940%0.39545%0.45SS..G310 helixtrans-76.6-21.4177.300000113.7P1803 D1807 V1811 K1812 F1813P1803-A1809 HydrophobicContact CB-CB 4.29Å; P1803-A1809 HydrophobicContact CG-CB 4.11Å; D1807-A1809 HydrophobicContact CB-CB 4.5Å; D1807-A1809 PolarHBondContact O-N 3.1Å; A1809-V1811 VanDerWaalsContact C-N 3.27Å; A1809-V1811 PolarHBondContact O-N 3.16Å; A1809-V1811 VanDerWaalsContact O-N 3.11Å; A1809-K1812 WeakPolarHBondContact O-CB 3.48Å; A1809-K1812 PolarHBondContact O-N 3.07Å; A1809-K1812 VanDerWaalsContact O-N 3.15Å; A1809-F1813 WeakPolarHBondContact O-CD2 3.33Å
1810H51.9Low54.3Low45 Ų4587 Ų8721%0.20845%0.45CS..G310 helixtrans-60.5-29.6-178.5-111.4-50.4000113.4Y1762 R1763 P1803 T1804 T1805 D1807 R1808 K1812 F1813 T1814Y1762-H1810 AromaticContact CE1-CE1 3.65Å; Y1762-H1810 VanDerWaalsContact CE1-CE1 3.42Å; Y1762-H1810 WeakPolarHBondContact CE1-CE1 3.36Å; Y1762-H1810 AromaticContact CE1-ND1 3.77Å; Y1762-H1810 AromaticContact CE1-NE2 3.44Å; Y1762-H1810 WeakPolarHBondContact CE1-NE2 3.26Å; Y1762-H1810 AromaticContact CZ-CE1 3.83Å; Y1762-H1810 AromaticContact CZ-ND1 3.77Å; Y1762-H1810 AromaticContact CZ-NE2 3.88Å; Y1762-H1810 PolarHBondContact OH-CD2 2.98Å; Y1762-H1810 PolarHBondContact OH-CE1 2.66Å; Y1762-H1810 PolarHBondContact OH-ND1 3.2Å; Y1762-H1810 VanDerWaalsContact OH-ND1 3.09Å; Y1762-H1810 PolarHBondContact OH-NE2 2.85Å; R1763-H1810 PolarHBondContact NH2-CE1 3.1Å; P1803-H1810 PolarHBondContact O-CD2 3.37Å; P1803-H1810 PolarHBondContact O-CE1 3.05Å; P1803-H1810 PolarHBondContact O-NE2 3.27Å; T1804-H1810 WeakPolarHBondContact O-CB 3.47Å; T1804-H1810 PolarHBondContact O-CD2 2.96Å; T1804-H1810 PolarHBondContact O-NE2 3.31Å; T1805-H1810 VanDerWaalsContact CA-CD2 3.48Å; T1805-H1810 WeakPolarHBondContact CA-CD2 3.27Å; T1805-H1810 PolarHBondContact N-CD2 2.7Å; T1805-H1810 PolarHBondContact N-NE2 3.24Å; T1805-H1810 VanDerWaalsContact N-NE2 3.13Å; D1807-H1810 WeakPolarHBondContact O-CB 3.29Å; D1807-H1810 PolarHBondContact O-N 2.98Å; R1808-H1810 PolarHBondContact O-N 3.12Å; H1810-K1812 VanDerWaalsContact C-N 3.27Å; H1810-K1812 PolarHBondContact O-N 3.19Å; H1810-K1812 VanDerWaalsContact O-N 3.1Å; H1810-F1813 CarbonylContact O-C 3.25Å; H1810-F1813 WeakPolarHBondContact O-CA 3.39Å; H1810-F1813 PolarHBondContact O-N 3.06Å; H1810-F1813 VanDerWaalsContact O-N 3.16Å; H1810-T1814 WeakPolarHBondContact O-CG2 3.47Å; H1810-T1814 PolarHBondContact O-N 3.46Å; H1810-T1814 PolarHBondContact O-OG1 2.88Å
1811V52.9Low54.4Low100.2 Ų100.288.9 Ų88.961%0.60745%0.447SS*.G310 helixtrans-63.5-23.6-179.5-175.50000112.5A1809 F1813 T1814 R1819A1809-V1811 VanDerWaalsContact C-N 3.27Å; A1809-V1811 PolarHBondContact O-N 3.16Å; A1809-V1811 VanDerWaalsContact O-N 3.11Å; V1811-F1813 VanDerWaalsContact C-N 3.3Å; V1811-F1813 PolarHBondContact O-N 2.75Å; V1811-T1814 WeakPolarHBondContact CA-OG1 3.24Å; V1811-T1814 PolarHBondContact O-OG1 3.16Å; V1811-T1814 VanDerWaalsContact O-OG1 3.08Å; V1811-R1819 PolarHBondContact O-NE 2.88Å; V1811-R1819 PolarHBondContact O-NH2 3.04Å
1812K53.6Low54.3Low173.2 Ų173.282.3 Ų82.375%0.75343%0.432SS*.G310 helixtrans-78.5-19.7176.9-69.8-175.3179.1179.30113.5R1788 A1809 H1810 R1819R1788-K1812 PolarHBondContact NH2-O 3.18Å; A1809-K1812 WeakPolarHBondContact O-CB 3.48Å; A1809-K1812 PolarHBondContact O-N 3.07Å; A1809-K1812 VanDerWaalsContact O-N 3.15Å; H1810-K1812 VanDerWaalsContact C-N 3.27Å; H1810-K1812 PolarHBondContact O-N 3.19Å; H1810-K1812 VanDerWaalsContact O-N 3.1Å; K1812-R1819 VanDerWaalsContact CA-NH2 3.25Å; K1812-R1819 PolarHBondContact O-NH2 3.11Å
1813F56.3Low54Low57.2 Ų57.286.2 Ų86.225%0.25145%0.45SS..THydrogen-bonded Turntrans-112-7.8-174.4-65.3-74.1000114.2Y1762 R1788 V1792 P1803 A1809 H1810 V1811Y1762-F1813 HydrophobicContact CD2-CB 4.15Å; Y1762-F1813 AromaticContact CD2-CD1 3.89Å; Y1762-F1813 HydrophobicContact CD2-CD1 4.06Å; Y1762-F1813 HydrophobicContact CD2-CD2 4.32Å; Y1762-F1813 AromaticContact CD2-CG 3.94Å; Y1762-F1813 HydrophobicContact CD2-CG 4.03Å; Y1762-F1813 HydrophobicContact CE1-CB 4.39Å; Y1762-F1813 HydrophobicContact CE2-CB 3.95Å; Y1762-F1813 AromaticContact CE2-CD1 3.73Å; Y1762-F1813 HydrophobicContact CE2-CD1 3.98Å; Y1762-F1813 AromaticContact CE2-CD2 3.67Å; Y1762-F1813 HydrophobicContact CE2-CD2 3.67Å; Y1762-F1813 HydrophobicContact CE2-CE1 4.28Å; Y1762-F1813 HydrophobicContact CE2-CE2 4.2Å; Y1762-F1813 AromaticContact CE2-CG 3.69Å; Y1762-F1813 HydrophobicContact CE2-CG 3.69Å; Y1762-F1813 VanDerWaalsContact CE2-CG 3.41Å; Y1762-F1813 HydrophobicContact CG-CB 4.42Å; R1788-F1813 PolarHBondContact NH2-O 3.03Å; V1792-F1813 HydrophobicContact CG2-CD1 3.82Å; V1792-F1813 HydrophobicContact CG2-CE1 3.74Å; V1792-F1813 HydrophobicContact CG2-CZ 4.46Å; P1803-F1813 HydrophobicContact CG-CD2 4.16Å; P1803-F1813 HydrophobicContact CG-CE2 3.86Å; A1809-F1813 WeakPolarHBondContact O-CD2 3.33Å; H1810-F1813 CarbonylContact O-C 3.25Å; H1810-F1813 WeakPolarHBondContact O-CA 3.39Å; H1810-F1813 PolarHBondContact O-N 3.06Å; H1810-F1813 VanDerWaalsContact O-N 3.16Å; V1811-F1813 VanDerWaalsContact C-N 3.3Å; V1811-F1813 PolarHBondContact O-N 2.75Å
1814T59.6Low53.8Low40 Ų4092.2 Ų92.225%0.24547%0.471CS..SBendtrans-61.6142.2174.430.80000111.8R1788 H1810 V1811 T1818 R1819R1788-T1814 PolarHBondContact NH2-O 3.42Å; H1810-T1814 WeakPolarHBondContact O-CG2 3.47Å; H1810-T1814 PolarHBondContact O-N 3.46Å; H1810-T1814 PolarHBondContact O-OG1 2.88Å; V1811-T1814 WeakPolarHBondContact CA-OG1 3.24Å; V1811-T1814 PolarHBondContact O-OG1 3.16Å; V1811-T1814 VanDerWaalsContact O-OG1 3.08Å; T1814-T1818 HydrophobicContact CG2-CG2 3.75Å; T1814-R1819 PolarHBondContact O-NH2 2.88Å
1815S60.9Low53.7Low6.4 Ų6.493.5 Ų93.55%0.04547%0.473CS..  trans-53.9146.7-179.366.40000112.8D1690 S1817 T1818 R1819D1690-S1815 PolarHBondContact OD1-N 3.01Å; D1690-S1815 VanDerWaalsContact OD2-CB 3.32Å; D1690-S1815 WeakPolarHBondContact OD2-CB 3.38Å; D1690-S1815 PolarHBondContact OD2-N 3.32Å; D1690-S1815 VanDerWaalsContact OD2-N 3.11Å; D1690-S1815 PolarHBondContact OD2-OG 3.14Å; D1690-S1815 VanDerWaalsContact OD2-OG 3.05Å; S1815-S1817 PolarHBondContact O-N 3.01Å; S1815-T1818 PolarHBondContact O-N 3.04Å; S1815-T1818 PolarHBondContact O-OG1 3.06Å; S1815-T1818 WeakPolarHBondContact OG-CB 3.26Å; S1815-T1818 PolarHBondContact OG-N 3.18Å; S1815-T1818 VanDerWaalsContact OG-N 3.15Å; S1815-T1818 PolarHBondContact OG-OG1 3.34Å; S1815-R1819 PolarHBondContact O-N 3.03Å; S1815-R1819 VanDerWaalsContact O-N 3.15Å
1816I62Low53.3Low71.8 Ų71.894.4 Ų94.437%0.36847%0.474SS..Hα-helixtrans-58.8-32.7176.2-67162.3000109.9V1751 D1755 R1788 T1818 R1819 N1820V1751-I1816 HydrophobicContact CG1-CD1 4.3Å; D1755-I1816 WeakPolarHBondContact OD2-CA 3.23Å; D1755-I1816 WeakPolarHBondContact OD2-CB 3.25Å; D1755-I1816 VanDerWaalsContact OD2-CG1 3.31Å; D1755-I1816 WeakPolarHBondContact OD2-CG1 3.42Å; D1755-I1816 PolarHBondContact OD2-N 3.32Å; R1788-I1816 VanDerWaalsContact NH1-CD1 3.33Å; I1816-T1818 VanDerWaalsContact C-N 3.29Å; I1816-T1818 PolarHBondContact O-N 2.97Å; I1816-R1819 PolarHBondContact O-N 3.2Å; I1816-N1820 WeakPolarHBondContact CG2-ND2 3.2Å; I1816-N1820 WeakPolarHBondContact O-CB 3.29Å; I1816-N1820 VanDerWaalsContact O-CG 3.27Å; I1816-N1820 PolarHBondContact O-N 3.21Å
1817S59.8Low53.1Low22.6 Ų22.695.1 Ų95.116%0.15847%0.474CS..Hα-helixtrans-62.9-36177.7-52.80000113.4E1683 S1815 R1819 R1821E1683-S1817 WeakPolarHBondContact CG-OG 3.27Å; S1815-S1817 PolarHBondContact O-N 3.01Å; S1817-R1819 VanDerWaalsContact C-N 3.35Å; S1817-R1819 PolarHBondContact O-N 2.89Å; S1817-R1821 PolarHBondContact O-N 3Å; S1817-R1821 VanDerWaalsContact O-N 3.09Å
1818T61.3Low52.6Low44.8 Ų44.897 Ų9728%0.27548%0.484SS..Hα-helixtrans-73-37.2174.8-21.40000111.8R1687 D1690 T1814 S1815 I1816 R1821 A1822R1687-T1818 HydrophobicContact CG-CG2 4.25Å; R1687-T1818 WeakPolarHBondContact CG-OG1 3.37Å; D1690-T1818 WeakPolarHBondContact OD2-CB 3.41Å; D1690-T1818 VanDerWaalsContact OD2-CG2 3.28Å; D1690-T1818 WeakPolarHBondContact OD2-CG2 3.33Å; D1690-T1818 PolarHBondContact OD2-OG1 3.02Å; T1814-T1818 HydrophobicContact CG2-CG2 3.75Å; S1815-T1818 PolarHBondContact O-N 3.04Å; S1815-T1818 PolarHBondContact O-OG1 3.06Å; S1815-T1818 WeakPolarHBondContact OG-CB 3.26Å; S1815-T1818 PolarHBondContact OG-N 3.18Å; S1815-T1818 VanDerWaalsContact OG-N 3.15Å; S1815-T1818 PolarHBondContact OG-OG1 3.34Å; I1816-T1818 VanDerWaalsContact C-N 3.29Å; I1816-T1818 PolarHBondContact O-N 2.97Å; T1818-R1821 PolarHBondContact O-N 3.24Å; T1818-A1822 PolarHBondContact O-N 3.17Å
1819R58.3Low51.9Low143.6 Ų143.692.4 Ų92.454%0.54248%0.477SS..Hα-helixtrans-67-40.9179.7-149.2176.9-176.41481.7112.9V1811 K1812 T1814 S1815 I1816 S1817 R1821 A1822 Q1823V1811-R1819 PolarHBondContact O-NE 2.88Å; V1811-R1819 PolarHBondContact O-NH2 3.04Å; K1812-R1819 VanDerWaalsContact CA-NH2 3.25Å; K1812-R1819 PolarHBondContact O-NH2 3.11Å; T1814-R1819 PolarHBondContact O-NH2 2.88Å; S1815-R1819 PolarHBondContact O-N 3.03Å; S1815-R1819 VanDerWaalsContact O-N 3.15Å; I1816-R1819 PolarHBondContact O-N 3.2Å; S1817-R1819 VanDerWaalsContact C-N 3.35Å; S1817-R1819 PolarHBondContact O-N 2.89Å; R1819-R1821 VanDerWaalsContact C-N 3.26Å; R1819-R1821 PolarHBondContact O-N 3Å; R1819-A1822 PolarHBondContact O-N 3.18Å; R1819-Q1823 WeakPolarHBondContact O-CG 3.34Å; R1819-Q1823 PolarHBondContact O-N 3.2Å
1820N59.9Low51.2Low90.8 Ų90.895.6 Ų95.649%0.48650%0.497SS..Hα-helixtrans-67.4-29.6178.5-73.6-8.6000112.4I1816 Q1823 K1824I1816-N1820 WeakPolarHBondContact CG2-ND2 3.2Å; I1816-N1820 WeakPolarHBondContact O-CB 3.29Å; I1816-N1820 VanDerWaalsContact O-CG 3.27Å; I1816-N1820 PolarHBondContact O-N 3.21Å; N1820-Q1823 PolarHBondContact O-N 3.11Å; N1820-K1824 WeakPolarHBondContact O-CG 3.19Å; N1820-K1824 PolarHBondContact O-N 3.17Å; N1820-K1824 VanDerWaalsContact O-N 3.1Å
1821R57.4Low50.3Low90.8 Ų90.8101.2 Ų101.234%0.34352%0.523SS..Hα-helixtrans-78-39176.2-156.3175.4-170.9-162.1-0.4112.1E1545 E1549 R1687 S1817 T1818 R1819 Q1823 K1824 L1825E1545-R1821 PolarHBondContact O-NH1 3.27Å; E1545-R1821 PolarHBondContact O-NH2 2.98Å; E1549-R1821 VanDerWaalsContact CG-NH1 3.28Å; E1549-R1821 IonicContact OE1-CZ 3.27Å; E1549-R1821 IonicContact OE1-NE 3.8Å; E1549-R1821 IonicContact OE1-NH1 2.76Å; E1549-R1821 PolarHBondContact OE1-NH1 2.8Å; E1549-R1821 IonicContact OE1-NH2 2.8Å; E1549-R1821 PolarHBondContact OE1-NH2 3.16Å; R1687-R1821 VanDerWaalsContact CZ-NH1 3.32Å; S1817-R1821 PolarHBondContact O-N 3Å; S1817-R1821 VanDerWaalsContact O-N 3.09Å; T1818-R1821 PolarHBondContact O-N 3.24Å; R1819-R1821 VanDerWaalsContact C-N 3.26Å; R1819-R1821 PolarHBondContact O-N 3Å; R1821-Q1823 VanDerWaalsContact C-N 3.32Å; R1821-Q1823 PolarHBondContact O-N 3.11Å; R1821-K1824 PolarHBondContact O-N 3.2Å; R1821-K1824 VanDerWaalsContact O-N 3.11Å; R1821-L1825 HydrophobicContact CG-CD1 4.27Å; R1821-L1825 PolarHBondContact O-N 3.11Å
1822A53.1Low49.4Very low54.4 Ų54.4102.3 Ų102.345%0.4553%0.53SS..Hα-helixtrans-62.5-32.5173.900000112.6T1818 R1819 K1824 N1826T1818-A1822 PolarHBondContact O-N 3.17Å; R1819-A1822 PolarHBondContact O-N 3.18Å; A1822-K1824 VanDerWaalsContact C-N 3.34Å; A1822-N1826 PolarHBondContact O-N 3.36Å
1823Q50.5Low48.7Very low125.2 Ų125.2100.3 Ų100.359%0.58554%0.535SS*.Hα-helixtrans-74.6-29.2173.8-79.2178.7-3300113.7R1819 N1820 R1821 N1826 V1827R1819-Q1823 WeakPolarHBondContact O-CG 3.34Å; R1819-Q1823 PolarHBondContact O-N 3.2Å; N1820-Q1823 PolarHBondContact O-N 3.11Å; R1821-Q1823 VanDerWaalsContact C-N 3.32Å; R1821-Q1823 PolarHBondContact O-N 3.11Å; Q1823-N1826 PolarHBondContact O-N 2.91Å; Q1823-V1827 WeakPolarHBondContact O-CG2 3.18Å
1824K49.2Very low48.1Very low173 Ų173100.8 Ų100.875%0.75256%0.557SS**Hα-helixtrans-75-26.6175.1-91.4-178177.4-178.20113.4N1820 R1821 A1822 N1826N1820-K1824 WeakPolarHBondContact O-CG 3.19Å; N1820-K1824 PolarHBondContact O-N 3.17Å; N1820-K1824 VanDerWaalsContact O-N 3.1Å; R1821-K1824 PolarHBondContact O-N 3.2Å; R1821-K1824 VanDerWaalsContact O-N 3.11Å; A1822-K1824 VanDerWaalsContact C-N 3.34Å; K1824-N1826 VanDerWaalsContact C-N 3.34Å; K1824-N1826 PolarHBondContact O-N 2.98Å
1825L47.1Very low47.2Very low118.8 Ų118.8104.5 Ų104.562%0.62258%0.579SS**Hα-helixtrans-78.6-18178.4-77158.7000113.2R1821 V1827R1821-L1825 HydrophobicContact CG-CD1 4.27Å; R1821-L1825 PolarHBondContact O-N 3.11Å; L1825-V1827 VanDerWaalsContact C-N 3.3Å; L1825-V1827 PolarHBondContact O-N 3.06Å
1826N40.1Very low46.7Very low133.2 Ų133.2108.2 Ų108.271%0.71260%0.601SS**THydrogen-bonded Turntrans-89.17.7-178.6-81.3-11.8000114.5A1822 Q1823 K1824A1822-N1826 PolarHBondContact O-N 3.36Å; Q1823-N1826 PolarHBondContact O-N 2.91Å; K1824-N1826 VanDerWaalsContact C-N 3.34Å; K1824-N1826 PolarHBondContact O-N 2.98Å
1827V40.5Very low46.1Very low113.8 Ų113.8112.4 Ų112.469%0.6962%0.617SS**SBendtrans-99.126.5-179.8-179.70000111Q1823 L1825Q1823-V1827 WeakPolarHBondContact O-CG2 3.18Å; L1825-V1827 VanDerWaalsContact C-N 3.3Å; L1825-V1827 PolarHBondContact O-N 3.06Å
1828D36.2Very low45.9Very low144.6 Ų144.6117.1 Ų117.177%0.77364%0.639SS**SBendtrans-125.923.8-176.8-71-20.7000117.2S1830D1828-S1830 VanDerWaalsContact C-N 3.3Å; D1828-S1830 PolarHBondContact O-N 3.18Å; D1828-S1830 VanDerWaalsContact O-N 3.16Å
1829D31.7Very low46Very low142.6 Ų142.6118.4 Ų118.476%0.76365%0.645SS**  trans-101.962.8167.2-87.9-18.7000113.5E1831D1829-E1831 VanDerWaalsContact C-N 3.27Å; D1829-E1831 PolarHBondContact O-N 3.18Å; D1829-E1831 VanDerWaalsContact O-N 3.16Å
1830S33Very low46.2Very low114.8 Ų114.8121 Ų12180%0.80366%0.66SS**  trans-110.153.7170.9117.10000112.7D1828D1828-S1830 VanDerWaalsContact C-N 3.3Å; D1828-S1830 PolarHBondContact O-N 3.18Å; D1828-S1830 VanDerWaalsContact O-N 3.16Å
1831E33Very low46.8Very low163.4 Ų163.4118 Ų11876%0.76464%0.644SS**  trans-134.4107.4163.2-69.4-163.6159.600110.3D1829 P1833 K1837D1829-E1831 VanDerWaalsContact C-N 3.27Å; D1829-E1831 PolarHBondContact O-N 3.18Å; D1829-E1831 VanDerWaalsContact O-N 3.16Å; E1831-P1833 VanDerWaalsContact O-CD 3.28Å; E1831-P1833 WeakPolarHBondContact O-CD 3.4Å; E1831-K1837 IonicContact OE1-NZ 3.29Å; E1831-K1837 PolarHBondContact OE1-NZ 3.32Å; E1831-K1837 IonicContact OE2-NZ 2.81Å; E1831-K1837 PolarHBondContact OE2-NZ 2.68Å
1832T33.9Very low47.6Very low122.6 Ų122.6117 Ų11775%0.75265%0.645SS**  trans-62.2123.4173.243.50000110.3G1834T1832-G1834 PolarHBondContact O-N 2.93Å
1833P38.3Very low48.6Very low131.6 Ų131.6116.5 Ų116.586%0.85563%0.634SS**THydrogen-bonded Turntrans-77.7112179.230.3-30.7000109.4E1831E1831-P1833 VanDerWaalsContact O-CD 3.28Å; E1831-P1833 WeakPolarHBondContact O-CD 3.4Å
1834G44Very low49.7Very low69 Ų69113.6 Ų113.671%0.71163%0.626SS**THydrogen-bonded Turntrans164.8-10.8172.700000117.7T1832 V1836T1832-G1834 PolarHBondContact O-N 2.93Å; G1834-V1836 PolarHBondContact O-N 3.21Å
1835T40.7Very low51Low117 Ų117107.5 Ų107.572%0.71860%0.601SS**  trans-94.899.1172.228.80000110.7K1837T1835-K1837 VanDerWaalsContact C-N 3.33Å; T1835-K1837 PolarHBondContact O-N 3.03Å
1836V50.5Low52.5Low82.8 Ų82.8101.8 Ų101.850%0.50257%0.572SS.*  trans-62.8103.2170.2-178.10000107.7G1834 L1838 P1879G1834-V1836 PolarHBondContact O-N 3.21Å; V1836-L1838 PolarHBondContact O-N 3.23Å; V1836-P1879 HydrophobicContact CG1-CG 3.84Å
1837K48.9Very low54.3Low161.8 Ų161.898.6 Ų98.670%0.70355%0.552SS**PPolyproline II helixtrans-67.7116.2172-71.7178.4-179.3169.50108E1831 T1835 L1839E1831-K1837 IonicContact OE1-NZ 3.29Å; E1831-K1837 PolarHBondContact OE1-NZ 3.32Å; E1831-K1837 IonicContact OE2-NZ 2.81Å; E1831-K1837 PolarHBondContact OE2-NZ 2.68Å; T1835-K1837 VanDerWaalsContact C-N 3.33Å; T1835-K1837 PolarHBondContact O-N 3.03Å; K1837-L1839 PolarHBondContact O-N 3.14Å
1838L56.4Low56.1Low120 Ų120100.9 Ų100.963%0.62855%0.548SS*.PPolyproline II helixtrans-54.3130172.3-73.3158.5000109.1V1836 P1877V1836-L1838 PolarHBondContact O-N 3.23Å; L1838-P1877 HydrophobicContact CB-CB 4.44Å; L1838-P1877 HydrophobicContact CD2-CB 4.14Å; L1838-P1877 HydrophobicContact CD2-CG 4.45Å
1839L63.1Low58.2Low73.6 Ų73.694.4 Ų94.439%0.38552%0.515SS..PPolyproline II helixtrans-79.8136.3179.1-67.8169.9000109.4K1837 I1841 P1877 P1879 R1882K1837-L1839 PolarHBondContact O-N 3.14Å; L1839-I1841 PolarHBondContact O-N 2.97Å; L1839-P1877 PolarHBondContact N-O 2.95Å; L1839-P1877 WeakPolarHBondContact O-CA 3.43Å; L1839-P1877 WeakPolarHBondContact O-CB 3.35Å; L1839-P1879 HydrophobicContact CD1-CB 4.15Å; L1839-P1879 HydrophobicContact CD1-CG 4.05Å; L1839-P1879 HydrophobicContact CG-CG 4.22Å; L1839-R1882 VanDerWaalsContact CB-CZ 3.41Å; L1839-R1882 VanDerWaalsContact CB-NH1 3.31Å; L1839-R1882 HydrophobicContact CD1-CB 4.33Å; L1839-R1882 VanDerWaalsContact CD1-CD 3.5Å; L1839-R1882 HydrophobicContact CD1-CG 4.46Å; L1839-R1882 VanDerWaalsContact CD1-CZ 3.48Å
1840K63.4Low60.6Low198 Ų19888 Ų8886%0.86148%0.48SS*.PPolyproline II helixtrans-66.1131.8176.3-110.8-179.7177.8-178.70110.2R1882K1840-R1882 PolarHBondContact O-NH1 2.92Å; K1840-R1882 VanDerWaalsContact O-NH1 3.13Å; K1840-R1882 PolarHBondContact O-NH2 3.44Å
1841I71.3Confident62.6Low27.8 Ų27.887.3 Ų87.314%0.14346%0.464CS..PPolyproline II helixtrans-80.8138.1178.7-57-172000110L1839 N1843 L1846 E1875 P1877 C1906 E1909L1839-I1841 PolarHBondContact O-N 2.97Å; I1841-N1843 VanDerWaalsContact CG2-OD1 3.31Å; I1841-N1843 WeakPolarHBondContact CG2-OD1 3.38Å; I1841-N1843 PolarHBondContact O-N 3.3Å; I1841-L1846 HydrophobicContact CG2-CD1 3.74Å; I1841-E1875 WeakPolarHBondContact CG1-O 3.25Å; I1841-E1875 HydrophobicContact CG2-CB 4.3Å; I1841-P1877 HydrophobicContact CD1-CB 4.01Å; I1841-P1877 HydrophobicContact CD1-CG 4.02Å; I1841-P1877 HydrophobicContact CG1-CB 4.22Å; I1841-C1906 HydrophobicContact CD1-CB 4.39Å; I1841-E1909 HydrophobicContact CD1-CB 3.39Å; I1841-E1909 VanDerWaalsContact CD1-CB 3.47Å; I1841-E1909 HydrophobicContact CD1-CG 3.75Å; I1841-E1909 HydrophobicContact CG1-CB 4.34Å
1842N73.8Confident64.2Low68.4 Ų68.481.6 Ų81.637%0.36644%0.442SS..  trans-93.190.7167.8-170-10.3000111.2T1844 N1845 E1875N1842-T1844 PolarHBondContact O-N 3.29Å; N1842-T1844 VanDerWaalsContact O-N 3.1Å; N1842-T1844 PolarHBondContact OD1-N 2.94Å; N1842-T1844 PolarHBondContact OD1-OG1 3.18Å; N1842-N1845 HydrophobicContact CB-CB 4.47Å; N1842-N1845 PolarHBondContact ND2-ND2 3.27Å; N1842-N1845 PolarHBondContact O-N 3.08Å; N1842-N1845 VanDerWaalsContact O-N 3.09Å; N1842-E1875 VanDerWaalsContact CB-OE2 3.27Å; N1842-E1875 WeakPolarHBondContact CB-OE2 3.41Å; N1842-E1875 PolarHBondContact N-OE2 3.22Å; N1842-E1875 VanDerWaalsContact N-OE2 3.15Å
1843N74.1Confident65.2Low44 Ų4481.2 Ų81.224%0.23544%0.444CS..Hα-helixtrans-55.7-29.9-177.2-66.9-17.3000113.8I1841 N1845 L1846 E1847I1841-N1843 VanDerWaalsContact CG2-OD1 3.31Å; I1841-N1843 WeakPolarHBondContact CG2-OD1 3.38Å; I1841-N1843 PolarHBondContact O-N 3.3Å; N1843-N1845 VanDerWaalsContact C-N 3.31Å; N1843-N1845 PolarHBondContact O-N 3.27Å; N1843-L1846 WeakPolarHBondContact O-CB 3.16Å; N1843-L1846 PolarHBondContact O-N 3.07Å; N1843-E1847 WeakPolarHBondContact O-CG 3.42Å; N1843-E1847 PolarHBondContact O-N 3.17Å; N1843-E1847 VanDerWaalsContact O-N 3.08Å
1844T74.6Confident66.4Low65 Ų6586.3 Ų86.340%0.39945%0.446SS..Hα-helixtrans-69-28.7-17968.80000113.6N1842 L1846 R1848N1842-T1844 PolarHBondContact O-N 3.29Å; N1842-T1844 VanDerWaalsContact O-N 3.1Å; N1842-T1844 PolarHBondContact OD1-N 2.94Å; N1842-T1844 PolarHBondContact OD1-OG1 3.18Å; T1844-L1846 VanDerWaalsContact C-N 3.34Å; T1844-R1848 WeakPolarHBondContact O-CB 3.3Å; T1844-R1848 WeakPolarHBondContact O-CG 3.33Å; T1844-R1848 PolarHBondContact O-N 3.07Å; T1844-R1848 PolarHBondContact O-NE 3.01Å; T1844-R1848 PolarHBondContact OG1-NH2 3.21Å; T1844-R1848 VanDerWaalsContact OG1-NH2 3.16Å
1845N75.9Confident67.6Low44.4 Ų44.485.1 Ų85.124%0.23742%0.423CS..Hα-helixtrans-75.3-37.2177.2-74.3-16.1000111N1842 N1843 R1848 A1849 E1875N1842-N1845 HydrophobicContact CB-CB 4.47Å; N1842-N1845 PolarHBondContact ND2-ND2 3.27Å; N1842-N1845 PolarHBondContact O-N 3.08Å; N1842-N1845 VanDerWaalsContact O-N 3.09Å; N1843-N1845 VanDerWaalsContact C-N 3.31Å; N1843-N1845 PolarHBondContact O-N 3.27Å; N1845-R1848 PolarHBondContact O-N 3.23Å; N1845-R1848 VanDerWaalsContact OD1-CZ 3.32Å; N1845-R1848 PolarHBondContact OD1-NH1 3.2Å; N1845-R1848 PolarHBondContact OD1-NH2 3.22Å; N1845-R1848 VanDerWaalsContact OD1-NH2 3.09Å; N1845-A1849 WeakPolarHBondContact O-CB 3.46Å; N1845-A1849 PolarHBondContact O-N 3.22Å; N1845-A1849 VanDerWaalsContact O-N 3.12Å; N1845-E1875 HydrophobicContact CB-CG 4.3Å; N1845-E1875 PolarHBondContact ND2-OE1 3.25Å
1846L79Confident69.1Low0.4 Ų0.485.5 Ų85.50%0.00243%0.425CS..Hα-helixtrans-65.4-47175.8-84.2160.1000110.9I1841 N1843 T1844 R1848 A1849 W1850 A1871 L1872 E1875 C1906 L1910I1841-L1846 HydrophobicContact CG2-CD1 3.74Å; N1843-L1846 WeakPolarHBondContact O-CB 3.16Å; N1843-L1846 PolarHBondContact O-N 3.07Å; T1844-L1846 VanDerWaalsContact C-N 3.34Å; L1846-R1848 VanDerWaalsContact C-N 3.31Å; L1846-R1848 PolarHBondContact O-N 2.97Å; L1846-A1849 WeakPolarHBondContact O-CB 3.42Å; L1846-A1849 PolarHBondContact O-N 3.08Å; L1846-A1849 VanDerWaalsContact O-N 3.07Å; L1846-W1850 HydrophobicContact CB-CE3 4.22Å; L1846-W1850 HydrophobicContact CB-CH2 3.9Å; L1846-W1850 HydrophobicContact CB-CZ2 4.07Å; L1846-W1850 HydrophobicContact CB-CZ3 3.6Å; L1846-W1850 HydrophobicContact CD1-CZ2 3.99Å; L1846-W1850 HydrophobicContact CD2-CH2 3.24Å; L1846-W1850 HydrophobicContact CD2-CZ2 3.65Å; L1846-W1850 HydrophobicContact CD2-CZ3 4.05Å; L1846-W1850 HydrophobicContact CG-CD2 4.33Å; L1846-W1850 VanDerWaalsContact CG-CE2 3.48Å; L1846-W1850 HydrophobicContact CG-CH2 3.87Å; L1846-W1850 HydrophobicContact CG-CZ2 3.29Å; L1846-W1850 VanDerWaalsContact O-CD2 3.24Å; L1846-W1850 VanDerWaalsContact O-CE3 3.26Å; L1846-W1850 VanDerWaalsContact O-CG 3.23Å; L1846-W1850 PolarHBondContact O-N 3.2Å; L1846-W1850 VanDerWaalsContact O-N 3.13Å; L1846-W1850 PolarHBondContact O-NE1 3.22Å; L1846-A1871 HydrophobicContact CD2-CB 4.27Å; L1846-L1872 HydrophobicContact CD1-CD2 4.05Å; L1846-L1872 HydrophobicContact CD2-CD2 3.98Å; L1846-L1872 HydrophobicContact CD2-CG 4.42Å; L1846-E1875 HydrophobicContact CD1-CB 4.33Å; L1846-E1875 HydrophobicContact CD2-CB 4.16Å; L1846-E1875 HydrophobicContact CD2-CG 4.38Å; L1846-E1875 HydrophobicContact CG-CB 4.15Å; L1846-E1875 HydrophobicContact CG-CG 4.35Å; L1846-C1906 HydrophobicContact CD1-CB 4.49Å; L1846-L1910 HydrophobicContact CD1-CD2 4.19Å; L1846-L1910 HydrophobicContact CD2-CD1 4.28Å; L1846-L1910 HydrophobicContact CD2-CD2 3.53Å; L1846-L1910 HydrophobicContact CD2-CG 4.4Å
1847E77.9Confident70.3Confident65.6 Ų65.683.8 Ų83.831%0.30742%0.417SS..Hα-helixtrans-56.4-44.8175.1-77.1174.5-179.100112.7N1843 A1849 W1850 H1851 Q1914N1843-E1847 WeakPolarHBondContact O-CG 3.42Å; N1843-E1847 PolarHBondContact O-N 3.17Å; N1843-E1847 VanDerWaalsContact O-N 3.08Å; E1847-A1849 VanDerWaalsContact C-N 3.3Å; E1847-A1849 PolarHBondContact O-N 3.11Å; E1847-W1850 VanDerWaalsContact CA-CE2 3.43Å; E1847-W1850 HydrophobicContact CB-CZ2 4.15Å; E1847-W1850 HydrophobicContact CG-CH2 4.28Å; E1847-W1850 HydrophobicContact CG-CZ2 3.44Å; E1847-W1850 VanDerWaalsContact CG-CZ2 3.47Å; E1847-W1850 VanDerWaalsContact O-CD1 3.29Å; E1847-W1850 PolarHBondContact O-N 3.25Å; E1847-H1851 VanDerWaalsContact O-CB 3.31Å; E1847-H1851 WeakPolarHBondContact O-CB 3.35Å; E1847-H1851 PolarHBondContact O-CD2 3.11Å; E1847-H1851 VanDerWaalsContact O-CD2 3.28Å; E1847-H1851 PolarHBondContact O-N 3.17Å; E1847-H1851 VanDerWaalsContact O-N 3.09Å; E1847-Q1914 WeakPolarHBondContact OE1-CG 3.27Å; E1847-Q1914 PolarHBondContact OE1-NE2 3.13Å
1848R79.3Confident71.5Confident160.8 Ų160.880.6 Ų80.661%0.60740%0.404SS*.Hα-helixtrans-63.3-33.3176.3-78.6-174.4-113.2119.54.2113.1T1844 N1845 L1846 W1850T1844-R1848 WeakPolarHBondContact O-CB 3.3Å; T1844-R1848 WeakPolarHBondContact O-CG 3.33Å; T1844-R1848 PolarHBondContact O-N 3.07Å; T1844-R1848 PolarHBondContact O-NE 3.01Å; T1844-R1848 PolarHBondContact OG1-NH2 3.21Å; T1844-R1848 VanDerWaalsContact OG1-NH2 3.16Å; N1845-R1848 PolarHBondContact O-N 3.23Å; N1845-R1848 VanDerWaalsContact OD1-CZ 3.32Å; N1845-R1848 PolarHBondContact OD1-NH1 3.2Å; N1845-R1848 PolarHBondContact OD1-NH2 3.22Å; N1845-R1848 VanDerWaalsContact OD1-NH2 3.09Å; L1846-R1848 VanDerWaalsContact C-N 3.31Å; L1846-R1848 PolarHBondContact O-N 2.97Å; R1848-W1850 VanDerWaalsContact C-N 3.29Å
1849A79Confident72.6Confident9 Ų979.5 Ų79.57%0.07440%0.399CS..Hα-helixtrans-73.9-33.1-179.300000112.6N1845 L1846 E1847 W1864 T1867 A1871N1845-A1849 WeakPolarHBondContact O-CB 3.46Å; N1845-A1849 PolarHBondContact O-N 3.22Å; N1845-A1849 VanDerWaalsContact O-N 3.12Å; L1846-A1849 WeakPolarHBondContact O-CB 3.42Å; L1846-A1849 PolarHBondContact O-N 3.08Å; L1846-A1849 VanDerWaalsContact O-N 3.07Å; E1847-A1849 VanDerWaalsContact C-N 3.3Å; E1847-A1849 PolarHBondContact O-N 3.11Å; A1849-W1864 PolarHBondContact O-NE1 3.19Å; A1849-T1867 HydrophobicContact CB-CG2 4.47Å; A1849-A1871 HydrophobicContact CB-CB 3.5Å; A1849-A1871 VanDerWaalsContact CB-CB 3.46Å
1850W81.8Confident73.5Confident7.2 Ų7.278.6 Ų78.63%0.02739%0.394CS..Hα-helixtrans-86.1-28.4179.219.436.8000112.6L1846 E1847 R1848 S1852 W1864 L1868 L1872 L1910 Q1914 L1918 T1921L1846-W1850 HydrophobicContact CB-CE3 4.22Å; L1846-W1850 HydrophobicContact CB-CH2 3.9Å; L1846-W1850 HydrophobicContact CB-CZ2 4.07Å; L1846-W1850 HydrophobicContact CB-CZ3 3.6Å; L1846-W1850 HydrophobicContact CD1-CZ2 3.99Å; L1846-W1850 HydrophobicContact CD2-CH2 3.24Å; L1846-W1850 HydrophobicContact CD2-CZ2 3.65Å; L1846-W1850 HydrophobicContact CD2-CZ3 4.05Å; L1846-W1850 HydrophobicContact CG-CD2 4.33Å; L1846-W1850 VanDerWaalsContact CG-CE2 3.48Å; L1846-W1850 HydrophobicContact CG-CH2 3.87Å; L1846-W1850 HydrophobicContact CG-CZ2 3.29Å; L1846-W1850 VanDerWaalsContact O-CD2 3.24Å; L1846-W1850 VanDerWaalsContact O-CE3 3.26Å; L1846-W1850 VanDerWaalsContact O-CG 3.23Å; L1846-W1850 PolarHBondContact O-N 3.2Å; L1846-W1850 VanDerWaalsContact O-N 3.13Å; L1846-W1850 PolarHBondContact O-NE1 3.22Å; E1847-W1850 VanDerWaalsContact CA-CE2 3.43Å; E1847-W1850 HydrophobicContact CB-CZ2 4.15Å; E1847-W1850 HydrophobicContact CG-CH2 4.28Å; E1847-W1850 HydrophobicContact CG-CZ2 3.44Å; E1847-W1850 VanDerWaalsContact CG-CZ2 3.47Å; E1847-W1850 VanDerWaalsContact O-CD1 3.29Å; E1847-W1850 PolarHBondContact O-N 3.25Å; R1848-W1850 VanDerWaalsContact C-N 3.29Å; W1850-S1852 VanDerWaalsContact C-N 3.32Å; W1850-S1852 PolarHBondContact O-N 3.24Å; W1850-S1852 VanDerWaalsContact O-N 3.1Å; W1850-W1864 PolarHBondContact O-NE1 3.19Å; W1850-L1868 HydrophobicContact CB-CD1 4.15Å; W1850-L1868 HydrophobicContact CE3-CD1 4.44Å; W1850-L1868 HydrophobicContact CG-CD1 4.07Å; W1850-L1872 HydrophobicContact CZ2-CD2 4.25Å; W1850-L1910 HydrophobicContact CH2-CD1 3.91Å; W1850-L1910 HydrophobicContact CH2-CD2 3.91Å; W1850-L1910 HydrophobicContact CH2-CG 4.32Å; W1850-L1910 HydrophobicContact CZ3-CD1 4.24Å; W1850-L1910 HydrophobicContact CZ3-CD2 4.36Å; W1850-Q1914 HydrophobicContact CH2-CB 4.34Å; W1850-Q1914 HydrophobicContact CZ2-CB 4.19Å; W1850-Q1914 HydrophobicContact CZ2-CG 4.49Å; W1850-L1918 HydrophobicContact CB-CD1 3.99Å; W1850-L1918 HydrophobicContact CD2-CD1 3.93Å; W1850-L1918 HydrophobicContact CD2-CD2 4.37Å; W1850-L1918 HydrophobicContact CD2-CG 4.48Å; W1850-L1918 HydrophobicContact CE3-CB 3.69Å; W1850-L1918 HydrophobicContact CE3-CD1 3.77Å; W1850-L1918 HydrophobicContact CE3-CD2 4Å; W1850-L1918 HydrophobicContact CE3-CG 4.21Å; W1850-L1918 HydrophobicContact CG-CD1 4.21Å; W1850-L1918 HydrophobicContact CH2-CB 4.2Å; W1850-L1918 HydrophobicContact CH2-CD1 4.24Å; W1850-L1918 HydrophobicContact CH2-CD2 3.26Å; W1850-L1918 HydrophobicContact CH2-CG 4.07Å; W1850-L1918 HydrophobicContact CZ2-CD1 4.06Å; W1850-L1918 HydrophobicContact CZ2-CD2 3.79Å; W1850-L1918 HydrophobicContact CZ2-CG 4.38Å; W1850-L1918 HydrophobicContact CZ3-CB 3.45Å; W1850-L1918 HydrophobicContact CZ3-CD1 3.9Å; W1850-L1918 HydrophobicContact CZ3-CD2 3.75Å; W1850-L1918 HydrophobicContact CZ3-CG 3.75Å; W1850-T1921 WeakPolarHBondContact O-CG2 3.41Å
1851H76.4Confident74.5Confident100.8 Ų100.870.2 Ų70.247%0.46736%0.357SS..  trans-84.260.1175.3-69.8-56.9000113.5E1847 S1853E1847-H1851 VanDerWaalsContact O-CB 3.31Å; E1847-H1851 WeakPolarHBondContact O-CB 3.35Å; E1847-H1851 PolarHBondContact O-CD2 3.11Å; E1847-H1851 VanDerWaalsContact O-CD2 3.28Å; E1847-H1851 PolarHBondContact O-N 3.17Å; E1847-H1851 VanDerWaalsContact O-N 3.09Å; H1851-S1853 PolarHBondContact O-N 3.26Å; H1851-S1853 VanDerWaalsContact O-N 3.1Å
1852S65.3Low75Confident44.4 Ų44.469.8 Ų69.831%0.3136%0.357SS..  trans-78.6121.1174.451.20000111.4W1850 M1855W1850-S1852 VanDerWaalsContact C-N 3.32Å; W1850-S1852 PolarHBondContact O-N 3.24Å; W1850-S1852 VanDerWaalsContact O-N 3.1Å; S1852-M1855 VanDerWaalsContact CB-CE 3.43Å; S1852-M1855 VanDerWaalsContact CB-SD 3.51Å; S1852-M1855 VanDerWaalsContact OG-CE 3.23Å; S1852-M1855 WeakPolarHBondContact OG-CE 3.39Å; S1852-M1855 PolarHBondContact OG-SD 3.2Å; S1852-M1855 VanDerWaalsContact OG-SD 3.37Å
1853S55.8Low75.4Confident112.8 Ų112.871.6 Ų71.679%0.78936%0.363SS*.SBendtrans-83.5128.3-178.5-46.90000111.9H1851H1851-S1853 PolarHBondContact O-N 3.26Å; H1851-S1853 VanDerWaalsContact O-N 3.1Å
1854R64Low76Confident239 Ų23969.8 Ų69.890%0.90235%0.353SS*.  trans60.376.5173.8-64.3-175.7177.9-171.2-0.4115.8
1855M68.3Low76.5Confident43.6 Ų43.667.5 Ų67.522%0.21534%0.338CS..  trans-101.6117.8171.3-63.4-177144.700109.6S1852 D1860 W1861 W1864S1852-M1855 VanDerWaalsContact CB-CE 3.43Å; S1852-M1855 VanDerWaalsContact CB-SD 3.51Å; S1852-M1855 VanDerWaalsContact OG-CE 3.23Å; S1852-M1855 WeakPolarHBondContact OG-CE 3.39Å; S1852-M1855 PolarHBondContact OG-SD 3.2Å; S1852-M1855 VanDerWaalsContact OG-SD 3.37Å; M1855-D1860 HydrophobicContact CB-CB 4.16Å; M1855-D1860 HydrophobicContact CE-CB 3.95Å; M1855-D1860 WeakPolarHBondContact CE-O 3.35Å; M1855-D1860 HydrophobicContact CG-CB 4.16Å; M1855-W1861 HydrophobicContact CB-CD2 4.2Å; M1855-W1861 HydrophobicContact CB-CE3 4.32Å; M1855-W1861 HydrophobicContact CB-CH2 3.92Å; M1855-W1861 HydrophobicContact CB-CZ2 3.77Å; M1855-W1861 HydrophobicContact CB-CZ3 4.17Å; M1855-W1861 VanDerWaalsContact CE-CA 3.44Å; M1855-W1861 HydrophobicContact CE-CB 4.41Å; M1855-W1861 HydrophobicContact CE-CD2 3.76Å; M1855-W1861 HydrophobicContact CE-CE3 3.42Å; M1855-W1861 VanDerWaalsContact CE-CE3 3.42Å; M1855-W1861 HydrophobicContact CE-CG 4.2Å; M1855-W1861 HydrophobicContact CE-CZ3 3.87Å; M1855-W1861 HydrophobicContact CG-CZ3 4.4Å; M1855-W1861 HydrophobicContact SD-CD2 4.38Å; M1855-W1861 HydrophobicContact SD-CE3 3.74Å; M1855-W1861 HydrophobicContact SD-CH2 4.22Å; M1855-W1861 HydrophobicContact SD-CZ3 3.61Å; M1855-W1861 VanDerWaalsContact SD-CZ3 3.56Å; M1855-W1861 WeakPolarHBondContact SD-CZ3 2.83Å; M1855-W1864 HydrophobicContact CE-CB 3.3Å; M1855-W1864 VanDerWaalsContact CE-CB 3.49Å; M1855-W1864 HydrophobicContact CE-CG 3.75Å; M1855-W1864 HydrophobicContact SD-CB 3.56Å; M1855-W1864 VanDerWaalsContact SD-CB 3.55Å; M1855-W1864 WeakPolarHBondContact SD-CB 3.34Å; M1855-W1864 HydrophobicContact SD-CD2 4.42Å; M1855-W1864 HydrophobicContact SD-CG 3.66Å
1856V71.2Confident76.9Confident126.2 Ų126.270.5 Ų70.577%0.76535%0.349SS*.  trans-124.1-36.1-178.4-172.90000110.6D1860V1856-D1860 PolarHBondContact N-OD2 3.41Å; V1856-D1860 VanDerWaalsContact N-OD2 3.09Å
1857S76.1Confident77.2Confident47 Ų4773.7 Ų73.733%0.32937%0.369SS..SBendtrans-87.4156.8-176.790.80000112.8D1859 D1860 W1861S1857-D1859 VanDerWaalsContact C-N 3.28Å; S1857-D1859 PolarHBondContact O-N 3.39Å; S1857-D1859 PolarHBondContact OG-N 3.32Å; S1857-D1860 WeakPolarHBondContact CB-OD2 3.37Å; S1857-D1860 PolarHBondContact N-OD2 3.16Å; S1857-D1860 WeakPolarHBondContact O-CB 3.35Å; S1857-D1860 PolarHBondContact O-N 2.97Å; S1857-D1860 PolarHBondContact OG-N 3.27Å; S1857-D1860 VanDerWaalsContact OG-N 3.13Å; S1857-D1860 PolarHBondContact OG-OD1 3.24Å; S1857-D1860 PolarHBondContact OG-OD2 3.17Å; S1857-W1861 VanDerWaalsContact O-CD1 3.22Å; S1857-W1861 PolarHBondContact O-N 3.19Å
1858H75.4Confident77.6Confident93.8 Ų93.870.6 Ų70.643%0.43436%0.355SS..Hα-helixtrans-57.8-39.1171.5176.6-78.8000112D1860 W1861 S1862 S1932H1858-D1860 VanDerWaalsContact C-N 3.33Å; H1858-W1861 PolarHBondContact O-N 3.19Å; H1858-S1862 PolarHBondContact O-N 3.29Å; H1858-S1862 VanDerWaalsContact O-N 3.17Å; H1858-S1862 PolarHBondContact O-OG 2.96Å; H1858-S1932 WeakPolarHBondContact CD2-CA 3.42Å; H1858-S1932 VanDerWaalsContact CD2-CB 3.49Å; H1858-S1932 WeakPolarHBondContact CD2-CB 3.29Å; H1858-S1932 VanDerWaalsContact CE1-CB 3.45Å; H1858-S1932 WeakPolarHBondContact CE1-CB 3.37Å; H1858-S1932 PolarHBondContact CE1-OG 3.4Å; H1858-S1932 VanDerWaalsContact CE1-OG 3.32Å; H1858-S1932 VanDerWaalsContact NE2-CA 3.28Å; H1858-S1932 WeakPolarHBondContact NE2-CA 3.34Å; H1858-S1932 WeakPolarHBondContact NE2-CB 3.37Å; H1858-S1932 PolarHBondContact NE2-OG 3.06Å
1859D78.4Confident78Confident98.4 Ų98.463.6 Ų63.653%0.52633%0.329SS..Hα-helixtrans-70.1-34.8-179.9-103.28.4000111.6S1857 W1861 S1862 Q1863S1857-D1859 VanDerWaalsContact C-N 3.28Å; S1857-D1859 PolarHBondContact O-N 3.39Å; S1857-D1859 PolarHBondContact OG-N 3.32Å; D1859-W1861 VanDerWaalsContact C-N 3.27Å; D1859-W1861 PolarHBondContact O-N 3.21Å; D1859-S1862 WeakPolarHBondContact O-CB 3.43Å; D1859-S1862 PolarHBondContact O-N 3.21Å; D1859-S1862 VanDerWaalsContact O-N 3.13Å; D1859-S1862 PolarHBondContact O-OG 3.2Å; D1859-Q1863 WeakPolarHBondContact O-CB 3.28Å; D1859-Q1863 WeakPolarHBondContact O-CG 3.33Å; D1859-Q1863 PolarHBondContact O-N 3.1Å; D1859-Q1863 PolarHBondContact OD2-NE2 3.18Å
1860D83Confident78.3Confident54.2 Ų54.267.6 Ų67.629%0.2935%0.347SS..Hα-helixtrans-58.1-42.6175.1-57.2-17.9000110.6M1855 V1856 S1857 H1858 S1862 Q1863 W1864M1855-D1860 HydrophobicContact CB-CB 4.16Å; M1855-D1860 HydrophobicContact CE-CB 3.95Å; M1855-D1860 WeakPolarHBondContact CE-O 3.35Å; M1855-D1860 HydrophobicContact CG-CB 4.16Å; V1856-D1860 PolarHBondContact N-OD2 3.41Å; V1856-D1860 VanDerWaalsContact N-OD2 3.09Å; S1857-D1860 WeakPolarHBondContact CB-OD2 3.37Å; S1857-D1860 PolarHBondContact N-OD2 3.16Å; S1857-D1860 WeakPolarHBondContact O-CB 3.35Å; S1857-D1860 PolarHBondContact O-N 2.97Å; S1857-D1860 PolarHBondContact OG-N 3.27Å; S1857-D1860 VanDerWaalsContact OG-N 3.13Å; S1857-D1860 PolarHBondContact OG-OD1 3.24Å; S1857-D1860 PolarHBondContact OG-OD2 3.17Å; H1858-D1860 VanDerWaalsContact C-N 3.33Å; D1860-S1862 VanDerWaalsContact C-N 3.32Å; D1860-S1862 PolarHBondContact O-N 2.91Å; D1860-Q1863 PolarHBondContact O-N 3.2Å; D1860-Q1863 VanDerWaalsContact O-N 3.1Å; D1860-W1864 WeakPolarHBondContact O-CB 3.34Å; D1860-W1864 PolarHBondContact O-N 3.16Å
1861W83.1Confident78.4Confident22 Ų2268.1 Ų68.18%0.08335%0.353CS..Hα-helixtrans-66.4-37.7177.4-70.1114.6000112.8M1855 S1857 H1858 D1859 Q1863 W1864 L1865 V1925 V1928 Q1931 V1935M1855-W1861 HydrophobicContact CB-CD2 4.2Å; M1855-W1861 HydrophobicContact CB-CE3 4.32Å; M1855-W1861 HydrophobicContact CB-CH2 3.92Å; M1855-W1861 HydrophobicContact CB-CZ2 3.77Å; M1855-W1861 HydrophobicContact CB-CZ3 4.17Å; M1855-W1861 VanDerWaalsContact CE-CA 3.44Å; M1855-W1861 HydrophobicContact CE-CB 4.41Å; M1855-W1861 HydrophobicContact CE-CD2 3.76Å; M1855-W1861 HydrophobicContact CE-CE3 3.42Å; M1855-W1861 VanDerWaalsContact CE-CE3 3.42Å; M1855-W1861 HydrophobicContact CE-CG 4.2Å; M1855-W1861 HydrophobicContact CE-CZ3 3.87Å; M1855-W1861 HydrophobicContact CG-CZ3 4.4Å; M1855-W1861 HydrophobicContact SD-CD2 4.38Å; M1855-W1861 HydrophobicContact SD-CE3 3.74Å; M1855-W1861 HydrophobicContact SD-CH2 4.22Å; M1855-W1861 HydrophobicContact SD-CZ3 3.61Å; M1855-W1861 VanDerWaalsContact SD-CZ3 3.56Å; M1855-W1861 WeakPolarHBondContact SD-CZ3 2.83Å; S1857-W1861 VanDerWaalsContact O-CD1 3.22Å; S1857-W1861 PolarHBondContact O-N 3.19Å; H1858-W1861 PolarHBondContact O-N 3.19Å; D1859-W1861 VanDerWaalsContact C-N 3.27Å; D1859-W1861 PolarHBondContact O-N 3.21Å; W1861-Q1863 VanDerWaalsContact C-N 3.33Å; W1861-Q1863 PolarHBondContact O-N 3.34Å; W1861-W1864 HydrophobicContact CE3-CB 4.43Å; W1861-W1864 HydrophobicContact CE3-CD2 4.36Å; W1861-W1864 HydrophobicContact CE3-CE3 4.18Å; W1861-W1864 HydrophobicContact CE3-CG 4.45Å; W1861-W1864 HydrophobicContact CZ3-CD2 4.38Å; W1861-W1864 HydrophobicContact CZ3-CE3 4.34Å; W1861-W1864 WeakPolarHBondContact O-CB 3.33Å; W1861-W1864 PolarHBondContact O-N 3.18Å; W1861-L1865 PolarHBondContact O-N 3.16Å; W1861-L1865 VanDerWaalsContact O-N 3.1Å; W1861-V1925 HydrophobicContact CE3-CG1 4.48Å; W1861-V1925 HydrophobicContact CE3-CG2 4.36Å; W1861-V1925 HydrophobicContact CH2-CG2 4.11Å; W1861-V1925 HydrophobicContact CZ3-CB 4.48Å; W1861-V1925 HydrophobicContact CZ3-CG1 4.4Å; W1861-V1925 HydrophobicContact CZ3-CG2 3.64Å; W1861-V1928 HydrophobicContact CH2-CG2 4.37Å; W1861-V1928 HydrophobicContact CZ2-CB 4.44Å; W1861-V1928 HydrophobicContact CZ2-CG1 4.32Å; W1861-V1928 HydrophobicContact CZ2-CG2 4.02Å; W1861-Q1931 HydrophobicContact CG-CG 4.43Å; W1861-V1935 HydrophobicContact CB-CG2 4.17Å; W1861-V1935 WeakPolarHBondContact O-CG2 3.27Å
1862S81.8Confident78.9Confident18.8 Ų18.863.4 Ų63.413%0.13133%0.331CS..Hα-helixtrans-66.3-38.6174.3440000111.5H1858 D1859 D1860 L1865 K1866H1858-S1862 PolarHBondContact O-N 3.29Å; H1858-S1862 VanDerWaalsContact O-N 3.17Å; H1858-S1862 PolarHBondContact O-OG 2.96Å; D1859-S1862 WeakPolarHBondContact O-CB 3.43Å; D1859-S1862 PolarHBondContact O-N 3.21Å; D1859-S1862 VanDerWaalsContact O-N 3.13Å; D1859-S1862 PolarHBondContact O-OG 3.2Å; D1860-S1862 VanDerWaalsContact C-N 3.32Å; D1860-S1862 PolarHBondContact O-N 2.91Å; S1862-L1865 PolarHBondContact O-N 3.02Å; S1862-K1866 WeakPolarHBondContact O-CG 3.38Å; S1862-K1866 PolarHBondContact O-N 3.15Å; S1862-K1866 VanDerWaalsContact O-N 3.11Å
1863Q81.8Confident80Confident106.8 Ų106.861.3 Ų61.350%0.49932%0.316SS..Hα-helixtrans-71.4-36.8177.2-83.9-141.30.600112.2D1859 D1860 W1861 K1866 T1867D1859-Q1863 WeakPolarHBondContact O-CB 3.28Å; D1859-Q1863 WeakPolarHBondContact O-CG 3.33Å; D1859-Q1863 PolarHBondContact O-N 3.1Å; D1859-Q1863 PolarHBondContact OD2-NE2 3.18Å; D1860-Q1863 PolarHBondContact O-N 3.2Å; D1860-Q1863 VanDerWaalsContact O-N 3.1Å; W1861-Q1863 VanDerWaalsContact C-N 3.33Å; W1861-Q1863 PolarHBondContact O-N 3.34Å; Q1863-K1866 PolarHBondContact O-N 3.38Å; Q1863-T1867 WeakPolarHBondContact O-CB 3.4Å; Q1863-T1867 PolarHBondContact O-N 3.21Å; Q1863-T1867 PolarHBondContact O-OG1 3.25Å
1864W86.9Confident81.4Confident6.2 Ų6.263.8 Ų63.82%0.02331%0.308CS..Hα-helixtrans-56.7-51.6170.4176.664.1000111.4A1849 W1850 M1855 D1860 W1861 K1866 T1867 L1868 T1921 L1922 V1925 V1935A1849-W1864 PolarHBondContact O-NE1 3.19Å; W1850-W1864 PolarHBondContact O-NE1 3.19Å; M1855-W1864 HydrophobicContact CE-CB 3.3Å; M1855-W1864 VanDerWaalsContact CE-CB 3.49Å; M1855-W1864 HydrophobicContact CE-CG 3.75Å; M1855-W1864 HydrophobicContact SD-CB 3.56Å; M1855-W1864 VanDerWaalsContact SD-CB 3.55Å; M1855-W1864 WeakPolarHBondContact SD-CB 3.34Å; M1855-W1864 HydrophobicContact SD-CD2 4.42Å; M1855-W1864 HydrophobicContact SD-CG 3.66Å; D1860-W1864 WeakPolarHBondContact O-CB 3.34Å; D1860-W1864 PolarHBondContact O-N 3.16Å; W1861-W1864 HydrophobicContact CE3-CB 4.43Å; W1861-W1864 HydrophobicContact CE3-CD2 4.36Å; W1861-W1864 HydrophobicContact CE3-CE3 4.18Å; W1861-W1864 HydrophobicContact CE3-CG 4.45Å; W1861-W1864 HydrophobicContact CZ3-CD2 4.38Å; W1861-W1864 HydrophobicContact CZ3-CE3 4.34Å; W1861-W1864 WeakPolarHBondContact O-CB 3.33Å; W1861-W1864 PolarHBondContact O-N 3.18Å; W1864-K1866 VanDerWaalsContact C-N 3.31Å; W1864-K1866 PolarHBondContact O-N 3.31Å; W1864-T1867 WeakPolarHBondContact O-CB 3.33Å; W1864-T1867 PolarHBondContact O-N 2.99Å; W1864-T1867 VanDerWaalsContact O-N 3.12Å; W1864-L1868 HydrophobicContact CH2-CD2 3.9Å; W1864-L1868 HydrophobicContact CZ2-CD2 3.91Å; W1864-L1868 HydrophobicContact CZ3-CD2 4.37Å; W1864-L1868 VanDerWaalsContact O-CB 3.25Å; W1864-L1868 WeakPolarHBondContact O-CB 3.4Å; W1864-L1868 PolarHBondContact O-N 3.15Å; W1864-T1921 HydrophobicContact CZ2-CG2 4.15Å; W1864-L1922 HydrophobicContact CH2-CD2 4.21Å; W1864-V1925 HydrophobicContact CH2-CB 4.48Å; W1864-V1925 HydrophobicContact CH2-CG1 4.34Å; W1864-V1925 HydrophobicContact CH2-CG2 3.87Å; W1864-V1925 HydrophobicContact CZ2-CG2 4.17Å; W1864-V1925 HydrophobicContact CZ3-CG1 4.09Å; W1864-V1925 HydrophobicContact CZ3-CG2 4.19Å; W1864-V1935 HydrophobicContact CE3-CG1 4.09Å; W1864-V1935 HydrophobicContact CZ3-CG1 3.8Å
1865L85.4Confident82.3Confident16.8 Ų16.853.2 Ų53.29%0.08827%0.269CS..Hα-helixtrans-61.5-41.4-179.7-179.666.3000111.2W1861 S1862 T1867 L1868 N1869 F1899 V1935 T1938W1861-L1865 PolarHBondContact O-N 3.16Å; W1861-L1865 VanDerWaalsContact O-N 3.1Å; S1862-L1865 PolarHBondContact O-N 3.02Å; L1865-T1867 VanDerWaalsContact C-N 3.34Å; L1865-T1867 PolarHBondContact O-N 2.74Å; L1865-L1868 HydrophobicContact CD1-CD2 4.43Å; L1865-L1868 PolarHBondContact O-N 3.31Å; L1865-N1869 VanDerWaalsContact O-CB 3.22Å; L1865-N1869 WeakPolarHBondContact O-CB 3.41Å; L1865-N1869 PolarHBondContact O-N 3.11Å; L1865-F1899 HydrophobicContact CD1-CE2 3.98Å; L1865-F1899 HydrophobicContact CD1-CZ 4.02Å; L1865-V1935 HydrophobicContact CB-CG1 4.47Å; L1865-V1935 HydrophobicContact CB-CG2 4.12Å; L1865-V1935 HydrophobicContact CD2-CB 4.47Å; L1865-V1935 HydrophobicContact CD2-CG1 4.42Å; L1865-V1935 HydrophobicContact CD2-CG2 4.02Å; L1865-T1938 HydrophobicContact CD1-CG2 4.16Å; L1865-T1938 HydrophobicContact CD2-CG2 3.92Å; L1865-T1938 VanDerWaalsContact CD2-OG1 3.32Å; L1865-T1938 WeakPolarHBondContact CD2-OG1 3.45Å
1866K84.2Confident83.2Confident106.2 Ų106.251.2 Ų51.246%0.46226%0.259SS..Hα-helixtrans-60.5-45.4173.8-74172.9-176.9173.30111.6S1862 Q1863 W1864 N1869 M1870S1862-K1866 WeakPolarHBondContact O-CG 3.38Å; S1862-K1866 PolarHBondContact O-N 3.15Å; S1862-K1866 VanDerWaalsContact O-N 3.11Å; Q1863-K1866 PolarHBondContact O-N 3.38Å; W1864-K1866 VanDerWaalsContact C-N 3.31Å; W1864-K1866 PolarHBondContact O-N 3.31Å; K1866-N1869 PolarHBondContact O-N 3.17Å; K1866-M1870 WeakPolarHBondContact O-CB 3.22Å; K1866-M1870 WeakPolarHBondContact O-CE 3.43Å; K1866-M1870 VanDerWaalsContact O-CG 3.29Å; K1866-M1870 WeakPolarHBondContact O-CG 3.37Å; K1866-M1870 PolarHBondContact O-N 3.36Å
1867T85.4Confident83.7Confident67.4 Ų67.445.6 Ų45.641%0.41323%0.226SC..Hα-helixtrans-64.6-45.8179.7-55.50000111.4A1849 Q1863 W1864 L1865 N1869 M1870 A1871A1849-T1867 HydrophobicContact CB-CG2 4.47Å; Q1863-T1867 WeakPolarHBondContact O-CB 3.4Å; Q1863-T1867 PolarHBondContact O-N 3.21Å; Q1863-T1867 PolarHBondContact O-OG1 3.25Å; W1864-T1867 WeakPolarHBondContact O-CB 3.33Å; W1864-T1867 PolarHBondContact O-N 2.99Å; W1864-T1867 VanDerWaalsContact O-N 3.12Å; L1865-T1867 VanDerWaalsContact C-N 3.34Å; L1865-T1867 PolarHBondContact O-N 2.74Å; T1867-N1869 VanDerWaalsContact C-N 3.34Å; T1867-N1869 PolarHBondContact O-N 3.16Å; T1867-M1870 PolarHBondContact O-N 3.32Å; T1867-A1871 WeakPolarHBondContact O-CB 3.37Å; T1867-A1871 PolarHBondContact O-N 3.16Å
1868L86.7Confident84Confident2.2 Ų2.244.1 Ų44.11%0.01222%0.215CC..Hα-helixtrans-57.7-48.1174.5176.763.4000110.9W1850 W1864 L1865 A1871 L1872 F1899W1850-L1868 HydrophobicContact CB-CD1 4.15Å; W1850-L1868 HydrophobicContact CE3-CD1 4.44Å; W1850-L1868 HydrophobicContact CG-CD1 4.07Å; W1864-L1868 HydrophobicContact CH2-CD2 3.9Å; W1864-L1868 HydrophobicContact CZ2-CD2 3.91Å; W1864-L1868 HydrophobicContact CZ3-CD2 4.37Å; W1864-L1868 VanDerWaalsContact O-CB 3.25Å; W1864-L1868 WeakPolarHBondContact O-CB 3.4Å; W1864-L1868 PolarHBondContact O-N 3.15Å; L1865-L1868 HydrophobicContact CD1-CD2 4.43Å; L1865-L1868 PolarHBondContact O-N 3.31Å; L1868-A1871 PolarHBondContact O-N 3.25Å; L1868-L1872 HydrophobicContact CD1-CD1 4.19Å; L1868-L1872 HydrophobicContact CD1-CG 4.35Å; L1868-L1872 HydrophobicContact CG-CD1 4.03Å; L1868-L1872 HydrophobicContact CG-CG 4.49Å; L1868-L1872 WeakPolarHBondContact O-CB 3.37Å; L1868-L1872 VanDerWaalsContact O-CG 3.29Å; L1868-L1872 WeakPolarHBondContact O-CG 3.4Å; L1868-L1872 PolarHBondContact O-N 3.09Å; L1868-F1899 HydrophobicContact CD2-CE2 4.21Å; L1868-F1899 HydrophobicContact CD2-CZ 4.36Å; L1868-F1899 HydrophobicContact CG-CE2 4.38Å
1869N87.5Confident84.4Confident13 Ų1340.8 Ų40.87%0.0720%0.202CC..Hα-helixtrans-63.5-46.6179.9-169.76.1000112.3L1865 K1866 T1867 A1871 L1872 L1873 G1895 R1896 F1899L1865-N1869 VanDerWaalsContact O-CB 3.22Å; L1865-N1869 WeakPolarHBondContact O-CB 3.41Å; L1865-N1869 PolarHBondContact O-N 3.11Å; K1866-N1869 PolarHBondContact O-N 3.17Å; T1867-N1869 VanDerWaalsContact C-N 3.34Å; T1867-N1869 PolarHBondContact O-N 3.16Å; N1869-A1871 VanDerWaalsContact C-N 3.3Å; N1869-A1871 PolarHBondContact O-N 3.32Å; N1869-L1872 PolarHBondContact O-N 3.16Å; N1869-L1873 WeakPolarHBondContact O-CB 3.46Å; N1869-L1873 VanDerWaalsContact O-CG 3.29Å; N1869-L1873 WeakPolarHBondContact O-CG 3.29Å; N1869-L1873 PolarHBondContact O-N 3.06Å; N1869-L1873 WeakPolarHBondContact OD1-CD1 3.27Å; N1869-G1895 WeakPolarHBondContact ND2-CA 3.34Å; N1869-G1895 PolarHBondContact ND2-O 3.12Å; N1869-G1895 PolarHBondContact OD1-O 2.95Å; N1869-R1896 PolarHBondContact ND2-N 3.2Å; N1869-F1899 HydrophobicContact CB-CD2 3.96Å; N1869-F1899 HydrophobicContact CB-CE2 4.43Å
1870M84.9Confident84.6Confident93.8 Ų93.837.1 Ų37.146%0.46219%0.185SC..Hα-helixtrans-60.1-40.5175.5-73.7-176.8-4900112.1K1866 T1867 L1873 R1874 T1888K1866-M1870 WeakPolarHBondContact O-CB 3.22Å; K1866-M1870 WeakPolarHBondContact O-CE 3.43Å; K1866-M1870 VanDerWaalsContact O-CG 3.29Å; K1866-M1870 WeakPolarHBondContact O-CG 3.37Å; K1866-M1870 PolarHBondContact O-N 3.36Å; T1867-M1870 PolarHBondContact O-N 3.32Å; M1870-L1873 PolarHBondContact O-N 3.27Å; M1870-R1874 VanDerWaalsContact O-CB 3.25Å; M1870-R1874 WeakPolarHBondContact O-CB 3.39Å; M1870-R1874 PolarHBondContact O-N 3.08Å; M1870-T1888 HydrophobicContact CG-CG2 4.17Å
1871A85.5Confident84.7Confident16.2 Ų16.235 Ų3513%0.13417%0.173CC..Hα-helixtrans-65-45176.300000111.8L1846 A1849 T1867 L1868 N1869 L1873 R1874 E1875L1846-A1871 HydrophobicContact CD2-CB 4.27Å; A1849-A1871 HydrophobicContact CB-CB 3.5Å; A1849-A1871 VanDerWaalsContact CB-CB 3.46Å; T1867-A1871 WeakPolarHBondContact O-CB 3.37Å; T1867-A1871 PolarHBondContact O-N 3.16Å; L1868-A1871 PolarHBondContact O-N 3.25Å; N1869-A1871 VanDerWaalsContact C-N 3.3Å; N1869-A1871 PolarHBondContact O-N 3.32Å; A1871-L1873 PolarHBondContact O-N 3.17Å; A1871-R1874 PolarHBondContact O-N 3.22Å; A1871-E1875 WeakPolarHBondContact O-CB 3.31Å; A1871-E1875 WeakPolarHBondContact O-CG 3.25Å; A1871-E1875 PolarHBondContact O-N 3.07Å; A1871-E1875 VanDerWaalsContact O-N 3.08Å
1872L87.2Confident84.8Confident2.2 Ų2.236.8 Ų36.81%0.01218%0.18CC..Hα-helixtrans-60.6-42.3176.5-74169.7000112.1L1846 W1850 L1868 N1869 S1876 F1899 A1902 F1903 C1906L1846-L1872 HydrophobicContact CD1-CD2 4.05Å; L1846-L1872 HydrophobicContact CD2-CD2 3.98Å; L1846-L1872 HydrophobicContact CD2-CG 4.42Å; W1850-L1872 HydrophobicContact CZ2-CD2 4.25Å; L1868-L1872 HydrophobicContact CD1-CD1 4.19Å; L1868-L1872 HydrophobicContact CD1-CG 4.35Å; L1868-L1872 HydrophobicContact CG-CD1 4.03Å; L1868-L1872 HydrophobicContact CG-CG 4.49Å; L1868-L1872 WeakPolarHBondContact O-CB 3.37Å; L1868-L1872 VanDerWaalsContact O-CG 3.29Å; L1868-L1872 WeakPolarHBondContact O-CG 3.4Å; L1868-L1872 PolarHBondContact O-N 3.09Å; N1869-L1872 PolarHBondContact O-N 3.16Å; L1872-S1876 WeakPolarHBondContact O-CA 3.36Å; L1872-S1876 VanDerWaalsContact O-CB 3.31Å; L1872-S1876 WeakPolarHBondContact O-CB 3.26Å; L1872-S1876 PolarHBondContact O-N 3.11Å; L1872-S1876 VanDerWaalsContact O-N 3.13Å; L1872-F1899 HydrophobicContact CD1-CD2 4.21Å; L1872-F1899 HydrophobicContact CD1-CE2 3.78Å; L1872-F1899 HydrophobicContact CD1-CZ 4.44Å; L1872-A1902 HydrophobicContact CB-CB 4.08Å; L1872-F1903 HydrophobicContact CD1-CB 4.33Å; L1872-F1903 HydrophobicContact CD1-CD2 4.09Å; L1872-C1906 HydrophobicContact CD2-CB 4.01Å
1873L86.6Confident84.9Confident0 Ų037.2 Ų37.20%018%0.184CC..Hα-helixtrans-68-43.4177.6-67.8169.5000112N1869 M1870 A1871 E1875 S1876 I1881 R1882 T1888 L1898 A1902N1869-L1873 WeakPolarHBondContact O-CB 3.46Å; N1869-L1873 VanDerWaalsContact O-CG 3.29Å; N1869-L1873 WeakPolarHBondContact O-CG 3.29Å; N1869-L1873 PolarHBondContact O-N 3.06Å; N1869-L1873 WeakPolarHBondContact OD1-CD1 3.27Å; M1870-L1873 PolarHBondContact O-N 3.27Å; A1871-L1873 PolarHBondContact O-N 3.17Å; L1873-E1875 VanDerWaalsContact C-N 3.34Å; L1873-E1875 PolarHBondContact O-N 3.1Å; L1873-S1876 PolarHBondContact O-N 3.49Å; L1873-S1876 PolarHBondContact O-OG 3.32Å; L1873-I1881 HydrophobicContact CB-CG2 4.49Å; L1873-I1881 HydrophobicContact CD2-CG2 3.42Å; L1873-I1881 VanDerWaalsContact CD2-CG2 3.44Å; L1873-I1881 HydrophobicContact CG-CG2 4.49Å; L1873-R1882 VanDerWaalsContact O-CA 3.3Å; L1873-R1882 WeakPolarHBondContact O-CA 3.35Å; L1873-T1888 HydrophobicContact CD1-CG2 3.85Å; L1873-T1888 VanDerWaalsContact CD1-OG1 3.28Å; L1873-T1888 WeakPolarHBondContact CD1-OG1 3.44Å; L1873-L1898 HydrophobicContact CD2-CB 3.82Å; L1873-L1898 HydrophobicContact CD2-CD1 4.29Å; L1873-A1902 HydrophobicContact CD2-CB 3.7Å; L1873-A1902 HydrophobicContact CG-CB 4.27Å
1874R85.6Confident85Confident166.2 Ų166.232.5 Ų32.563%0.62716%0.163SC*.Hα-helixtrans-68.7-35.4-177.5-175.3178.3179.4177.51.1112.9M1870 A1871 R1882M1870-R1874 VanDerWaalsContact O-CB 3.25Å; M1870-R1874 WeakPolarHBondContact O-CB 3.39Å; M1870-R1874 PolarHBondContact O-N 3.08Å; A1871-R1874 PolarHBondContact O-N 3.22Å; R1874-R1882 WeakPolarHBondContact O-CD 3.41Å; R1874-R1882 VanDerWaalsContact O-CG 3.23Å; R1874-R1882 WeakPolarHBondContact O-CG 3.32Å; R1874-R1882 PolarHBondContact O-NE 3.35Å; R1874-R1882 PolarHBondContact O-NH2 3.38Å
1875E84.2Confident84.9Confident17 Ų1733.5 Ų33.58%0.07917%0.172CC..THydrogen-bonded Turntrans-98.22.3-177.5-60-64.5164.800112.9I1841 N1842 N1845 L1846 A1871 L1873 R1882I1841-E1875 WeakPolarHBondContact CG1-O 3.25Å; I1841-E1875 HydrophobicContact CG2-CB 4.3Å; N1842-E1875 VanDerWaalsContact CB-OE2 3.27Å; N1842-E1875 WeakPolarHBondContact CB-OE2 3.41Å; N1842-E1875 PolarHBondContact N-OE2 3.22Å; N1842-E1875 VanDerWaalsContact N-OE2 3.15Å; N1845-E1875 HydrophobicContact CB-CG 4.3Å; N1845-E1875 PolarHBondContact ND2-OE1 3.25Å; L1846-E1875 HydrophobicContact CD1-CB 4.33Å; L1846-E1875 HydrophobicContact CD2-CB 4.16Å; L1846-E1875 HydrophobicContact CD2-CG 4.38Å; L1846-E1875 HydrophobicContact CG-CB 4.15Å; L1846-E1875 HydrophobicContact CG-CG 4.35Å; A1871-E1875 WeakPolarHBondContact O-CB 3.31Å; A1871-E1875 WeakPolarHBondContact O-CG 3.25Å; A1871-E1875 PolarHBondContact O-N 3.07Å; A1871-E1875 VanDerWaalsContact O-N 3.08Å; L1873-E1875 VanDerWaalsContact C-N 3.34Å; L1873-E1875 PolarHBondContact O-N 3.1Å; E1875-R1882 PolarHBondContact O-NH2 3.17Å; E1875-R1882 IonicContact OE2-NH2 3.35Å; E1875-R1882 PolarHBondContact OE2-NH2 2.91Å
1876S85.4Confident84.6Confident0.4 Ų0.439.4 Ų39.40%0.00320%0.199CC..  trans-57.7136.1179.1103.10000111.9L1872 L1873 S1878 I1881 R1882 S1905L1872-S1876 WeakPolarHBondContact O-CA 3.36Å; L1872-S1876 VanDerWaalsContact O-CB 3.31Å; L1872-S1876 WeakPolarHBondContact O-CB 3.26Å; L1872-S1876 PolarHBondContact O-N 3.11Å; L1872-S1876 VanDerWaalsContact O-N 3.13Å; L1873-S1876 PolarHBondContact O-N 3.49Å; L1873-S1876 PolarHBondContact O-OG 3.32Å; S1876-S1878 PolarHBondContact O-N 3.27Å; S1876-S1878 PolarHBondContact OG-N 3.15Å; S1876-S1878 PolarHBondContact OG-O 3.42Å; S1876-I1881 WeakPolarHBondContact OG-CB 3.46Å; S1876-I1881 WeakPolarHBondContact OG-CG2 3.34Å; S1876-R1882 WeakPolarHBondContact O-CD 3.41Å; S1876-R1882 WeakPolarHBondContact O-CG 3.27Å; S1876-R1882 VanDerWaalsContact O-CZ 3.3Å; S1876-R1882 PolarHBondContact O-NE 3.16Å; S1876-R1882 PolarHBondContact O-NH2 3.06Å; S1876-R1882 VanDerWaalsContact OG-CG 3.28Å; S1876-R1882 WeakPolarHBondContact OG-CG 3.25Å; S1876-R1882 PolarHBondContact OG-N 3.3Å; S1876-S1905 WeakPolarHBondContact CB-OG 3.37Å; S1876-S1905 WeakPolarHBondContact OG-CB 3.46Å; S1876-S1905 PolarHBondContact OG-OG 3.23Å
1877P82.1Confident84.5Confident9 Ų935.3 Ų35.36%0.05818%0.182CC..SBendtrans-69.9-19.9178.527.6-33.5000112.6L1838 L1839 I1841 P1879 S1905 E1909L1838-P1877 HydrophobicContact CB-CB 4.44Å; L1838-P1877 HydrophobicContact CD2-CB 4.14Å; L1838-P1877 HydrophobicContact CD2-CG 4.45Å; L1839-P1877 PolarHBondContact N-O 2.95Å; L1839-P1877 WeakPolarHBondContact O-CA 3.43Å; L1839-P1877 WeakPolarHBondContact O-CB 3.35Å; I1841-P1877 HydrophobicContact CD1-CB 4.01Å; I1841-P1877 HydrophobicContact CD1-CG 4.02Å; I1841-P1877 HydrophobicContact CG1-CB 4.22Å; P1877-P1879 VanDerWaalsContact O-CD 3.32Å; P1877-P1879 WeakPolarHBondContact O-CD 3.2Å; P1877-S1905 WeakPolarHBondContact CD-O 3.45Å; P1877-S1905 VanDerWaalsContact CG-O 3.31Å; P1877-S1905 WeakPolarHBondContact CG-O 3.35Å; P1877-E1909 HydrophobicContact CB-CG 4.43Å; P1877-E1909 HydrophobicContact CG-CG 4.29Å
1878S83.3Confident84.2Confident16.4 Ų16.432.8 Ų32.812%0.11517%0.166CC..SBendtrans-77.9121.1177.4136.50000111S1876 A1880 I1881 R1882S1876-S1878 PolarHBondContact O-N 3.27Å; S1876-S1878 PolarHBondContact OG-N 3.15Å; S1876-S1878 PolarHBondContact OG-O 3.42Å; S1878-A1880 VanDerWaalsContact C-N 3.28Å; S1878-A1880 PolarHBondContact O-N 3.2Å; S1878-A1880 VanDerWaalsContact O-N 3.17Å; S1878-I1881 PolarHBondContact O-N 3.15Å; S1878-I1881 VanDerWaalsContact OG-CB 3.28Å; S1878-I1881 WeakPolarHBondContact OG-CB 3.14Å; S1878-I1881 VanDerWaalsContact OG-CD1 3.29Å; S1878-I1881 WeakPolarHBondContact OG-CD1 3.48Å; S1878-I1881 VanDerWaalsContact OG-CG1 3.23Å; S1878-I1881 WeakPolarHBondContact OG-CG1 3.24Å; S1878-R1882 WeakPolarHBondContact O-CB 3.44Å; S1878-R1882 WeakPolarHBondContact O-CG 3.34Å; S1878-R1882 PolarHBondContact O-N 3.19Å; S1878-R1882 VanDerWaalsContact O-N 3.08Å; S1878-R1882 PolarHBondContact O-NE 3.07Å
1879P82.7Confident83.7Confident24.6 Ų24.636.8 Ų36.816%0.1620%0.2CC..Hα-helixtrans-60.4-31.8178.7-24.134.3000113.5Y1425 L1429 V1836 L1839 P1877 R1882 A1883Y1425-P1879 HydrophobicContact CE1-CB 4.47Å; L1429-P1879 HydrophobicContact CD1-CB 3.91Å; L1429-P1879 HydrophobicContact CD2-CB 4.43Å; V1836-P1879 HydrophobicContact CG1-CG 3.84Å; L1839-P1879 HydrophobicContact CD1-CB 4.15Å; L1839-P1879 HydrophobicContact CD1-CG 4.05Å; L1839-P1879 HydrophobicContact CG-CG 4.22Å; P1877-P1879 VanDerWaalsContact O-CD 3.32Å; P1877-P1879 WeakPolarHBondContact O-CD 3.2Å; P1879-R1882 PolarHBondContact O-N 3.19Å; P1879-A1883 WeakPolarHBondContact O-CB 3.35Å; P1879-A1883 PolarHBondContact O-N 3.33Å; P1879-A1883 VanDerWaalsContact O-N 3.09Å
1880A82.7Confident83.1Confident19.6 Ų19.640.1 Ų40.116%0.16222%0.217CC..Hα-helixtrans-67.4-44.7179.500000112.4A1399 V1426 L1429 S1878 R1882 A1883 C1884A1399-A1880 HydrophobicContact CB-CB 4.14Å; V1426-A1880 HydrophobicContact CG1-CB 4.4Å; V1426-A1880 HydrophobicContact CG2-CB 4.18Å; L1429-A1880 HydrophobicContact CD1-CB 4.12Å; S1878-A1880 VanDerWaalsContact C-N 3.28Å; S1878-A1880 PolarHBondContact O-N 3.2Å; S1878-A1880 VanDerWaalsContact O-N 3.17Å; A1880-R1882 VanDerWaalsContact C-N 3.35Å; A1880-A1883 PolarHBondContact O-N 3.19Å; A1880-C1884 PolarHBondContact O-N 2.91Å; A1880-C1884 PolarHBondContact O-SG 3.37Å
1881I85.3Confident82.7Confident9.4 Ų9.436.7 Ų36.75%0.04820%0.202CC..Hα-helixtrans-68.4-40.6177.3-62.4-179.8000110F1395 L1873 S1876 S1878 A1883 C1884 S1885 A1901 A1902F1395-I1881 HydrophobicContact CB-CD1 3.91Å; F1395-I1881 HydrophobicContact CB-CG1 4.19Å; F1395-I1881 HydrophobicContact CD1-CD1 3.68Å; F1395-I1881 HydrophobicContact CE1-CD1 4.46Å; F1395-I1881 HydrophobicContact CG-CD1 3.98Å; L1873-I1881 HydrophobicContact CB-CG2 4.49Å; L1873-I1881 HydrophobicContact CD2-CG2 3.42Å; L1873-I1881 VanDerWaalsContact CD2-CG2 3.44Å; L1873-I1881 HydrophobicContact CG-CG2 4.49Å; S1876-I1881 WeakPolarHBondContact OG-CB 3.46Å; S1876-I1881 WeakPolarHBondContact OG-CG2 3.34Å; S1878-I1881 PolarHBondContact O-N 3.15Å; S1878-I1881 VanDerWaalsContact OG-CB 3.28Å; S1878-I1881 WeakPolarHBondContact OG-CB 3.14Å; S1878-I1881 VanDerWaalsContact OG-CD1 3.29Å; S1878-I1881 WeakPolarHBondContact OG-CD1 3.48Å; S1878-I1881 VanDerWaalsContact OG-CG1 3.23Å; S1878-I1881 WeakPolarHBondContact OG-CG1 3.24Å; I1881-A1883 VanDerWaalsContact C-N 3.31Å; I1881-A1883 PolarHBondContact O-N 3.27Å; I1881-C1884 WeakPolarHBondContact O-CA 3.3Å; I1881-C1884 VanDerWaalsContact O-CB 3.32Å; I1881-C1884 WeakPolarHBondContact O-CB 3.32Å; I1881-C1884 PolarHBondContact O-N 3.2Å; I1881-C1884 VanDerWaalsContact O-N 3.09Å; I1881-S1885 PolarHBondContact O-N 2.95Å; I1881-A1901 HydrophobicContact CD1-CB 4.33Å; I1881-A1902 HydrophobicContact CG2-CB 4.13Å
1882R86.1Confident82.3Confident60.2 Ų60.240 Ų4023%0.22722%0.221CC..Hα-helixtrans-61.5-38177.9-148.4177.1-99.8177.73.1112.9L1839 K1840 L1873 R1874 E1875 S1876 S1878 P1879 A1880 C1884 S1885L1839-R1882 VanDerWaalsContact CB-CZ 3.41Å; L1839-R1882 VanDerWaalsContact CB-NH1 3.31Å; L1839-R1882 HydrophobicContact CD1-CB 4.33Å; L1839-R1882 VanDerWaalsContact CD1-CD 3.5Å; L1839-R1882 HydrophobicContact CD1-CG 4.46Å; L1839-R1882 VanDerWaalsContact CD1-CZ 3.48Å; K1840-R1882 PolarHBondContact O-NH1 2.92Å; K1840-R1882 VanDerWaalsContact O-NH1 3.13Å; K1840-R1882 PolarHBondContact O-NH2 3.44Å; L1873-R1882 VanDerWaalsContact O-CA 3.3Å; L1873-R1882 WeakPolarHBondContact O-CA 3.35Å; R1874-R1882 WeakPolarHBondContact O-CD 3.41Å; R1874-R1882 VanDerWaalsContact O-CG 3.23Å; R1874-R1882 WeakPolarHBondContact O-CG 3.32Å; R1874-R1882 PolarHBondContact O-NE 3.35Å; R1874-R1882 PolarHBondContact O-NH2 3.38Å; E1875-R1882 PolarHBondContact O-NH2 3.17Å; E1875-R1882 IonicContact OE2-NH2 3.35Å; E1875-R1882 PolarHBondContact OE2-NH2 2.91Å; S1876-R1882 WeakPolarHBondContact O-CD 3.41Å; S1876-R1882 WeakPolarHBondContact O-CG 3.27Å; S1876-R1882 VanDerWaalsContact O-CZ 3.3Å; S1876-R1882 PolarHBondContact O-NE 3.16Å; S1876-R1882 PolarHBondContact O-NH2 3.06Å; S1876-R1882 VanDerWaalsContact OG-CG 3.28Å; S1876-R1882 WeakPolarHBondContact OG-CG 3.25Å; S1876-R1882 PolarHBondContact OG-N 3.3Å; S1878-R1882 WeakPolarHBondContact O-CB 3.44Å; S1878-R1882 WeakPolarHBondContact O-CG 3.34Å; S1878-R1882 PolarHBondContact O-N 3.19Å; S1878-R1882 VanDerWaalsContact O-N 3.08Å; S1878-R1882 PolarHBondContact O-NE 3.07Å; P1879-R1882 PolarHBondContact O-N 3.19Å; A1880-R1882 VanDerWaalsContact C-N 3.35Å; R1882-C1884 VanDerWaalsContact C-N 3.27Å; R1882-C1884 PolarHBondContact O-N 3.12Å; R1882-S1885 VanDerWaalsContact O-CB 3.27Å; R1882-S1885 WeakPolarHBondContact O-CB 3.41Å; R1882-S1885 PolarHBondContact O-N 3.2Å; R1882-S1885 VanDerWaalsContact O-N 3.11Å; R1882-S1885 PolarHBondContact O-OG 3.19Å
1883A83.2Confident82Confident26.6 Ų26.641.6 Ų41.622%0.2224%0.238CC..Hα-helixtrans-61.4-35174.300000112.2T1422 Y1425 P1879 A1880 I1881 S1885T1422-A1883 HydrophobicContact CG2-CB 3.9Å; Y1425-A1883 HydrophobicContact CD1-CB 3.75Å; Y1425-A1883 HydrophobicContact CE1-CB 3.95Å; P1879-A1883 WeakPolarHBondContact O-CB 3.35Å; P1879-A1883 PolarHBondContact O-N 3.33Å; P1879-A1883 VanDerWaalsContact O-N 3.09Å; A1880-A1883 PolarHBondContact O-N 3.19Å; I1881-A1883 VanDerWaalsContact C-N 3.31Å; I1881-A1883 PolarHBondContact O-N 3.27Å; A1883-S1885 VanDerWaalsContact C-N 3.27Å; A1883-S1885 PolarHBondContact O-N 3.23Å
1884C84.5Confident81.7Confident8.2 Ų8.242.1 Ų42.16%0.05524%0.241CC..Hα-helixtrans-70.8-16.3176.5-60.90000113.7A1880 I1881 R1882 Q1886 L1887 T1888 I1894 L1898A1880-C1884 PolarHBondContact O-N 2.91Å; A1880-C1884 PolarHBondContact O-SG 3.37Å; I1881-C1884 WeakPolarHBondContact O-CA 3.3Å; I1881-C1884 VanDerWaalsContact O-CB 3.32Å; I1881-C1884 WeakPolarHBondContact O-CB 3.32Å; I1881-C1884 PolarHBondContact O-N 3.2Å; I1881-C1884 VanDerWaalsContact O-N 3.09Å; R1882-C1884 VanDerWaalsContact C-N 3.27Å; R1882-C1884 PolarHBondContact O-N 3.12Å; C1884-Q1886 VanDerWaalsContact C-N 3.28Å; C1884-Q1886 PolarHBondContact O-N 3.15Å; C1884-L1887 WeakPolarHBondContact O-CB 3.4Å; C1884-L1887 PolarHBondContact O-N 3.08Å; C1884-L1887 VanDerWaalsContact O-N 3.13Å; C1884-T1888 PolarHBondContact O-N 3.15Å; C1884-T1888 VanDerWaalsContact O-N 3.13Å; C1884-T1888 PolarHBondContact O-OG1 3.09Å; C1884-T1888 VanDerWaalsContact O-OG1 3.04Å; C1884-I1894 HydrophobicContact CB-CG2 4.21Å; C1884-L1898 HydrophobicContact CB-CD1 3.68Å
1885S83.9Confident81.5Confident28.6 Ų28.634.2 Ų34.220%0.221%0.211CC..Hα-helixtrans-60.9-34.8178.770.80000112.8I1881 R1882 A1883 L1887 T1888I1881-S1885 PolarHBondContact O-N 2.95Å; R1882-S1885 VanDerWaalsContact O-CB 3.27Å; R1882-S1885 WeakPolarHBondContact O-CB 3.41Å; R1882-S1885 PolarHBondContact O-N 3.2Å; R1882-S1885 VanDerWaalsContact O-N 3.11Å; R1882-S1885 PolarHBondContact O-OG 3.19Å; A1883-S1885 VanDerWaalsContact C-N 3.27Å; A1883-S1885 PolarHBondContact O-N 3.23Å; S1885-L1887 VanDerWaalsContact C-N 3.29Å; S1885-L1887 PolarHBondContact O-N 3.28Å; S1885-T1888 WeakPolarHBondContact O-CB 3.23Å; S1885-T1888 PolarHBondContact O-N 3.21Å; S1885-T1888 VanDerWaalsContact O-N 3.14Å; S1885-T1888 PolarHBondContact O-OG1 3.2Å
1886Q80.9Confident81.3Confident141 Ų14140 Ų4066%0.65923%0.233SC*.Hα-helixtrans-69.4-31177.3-64.1-178.9-2.800112.1C1884 T1888C1884-Q1886 VanDerWaalsContact C-N 3.28Å; C1884-Q1886 PolarHBondContact O-N 3.15Å; Q1886-T1888 VanDerWaalsContact C-N 3.33Å
1887L81.6Confident81.2Confident20 Ų2043.3 Ų43.311%0.10525%0.253CS..Hα-helixtrans-77.7-21.5177.8-63.9176.8000112.7L1403 I1419 T1422 C1884 S1885 A1889 I1890 T1891 I1894L1403-L1887 HydrophobicContact CD2-CD1 3.38Å; I1419-L1887 HydrophobicContact CG1-CD1 4.45Å; I1419-L1887 HydrophobicContact CG1-CD2 4.37Å; T1422-L1887 HydrophobicContact CG2-CD1 3.93Å; T1422-L1887 WeakPolarHBondContact OG1-CD1 3.45Å; C1884-L1887 WeakPolarHBondContact O-CB 3.4Å; C1884-L1887 PolarHBondContact O-N 3.08Å; C1884-L1887 VanDerWaalsContact O-N 3.13Å; S1885-L1887 VanDerWaalsContact C-N 3.29Å; S1885-L1887 PolarHBondContact O-N 3.28Å; L1887-A1889 VanDerWaalsContact C-N 3.27Å; L1887-A1889 PolarHBondContact O-N 3.15Å; L1887-I1890 CarbonylContact O-C 3.55Å; L1887-I1890 WeakPolarHBondContact O-CA 3.32Å; L1887-I1890 WeakPolarHBondContact O-CB 3.39Å; L1887-I1890 PolarHBondContact O-N 3.05Å; L1887-T1891 PolarHBondContact O-N 3.35Å; L1887-I1894 HydrophobicContact CB-CD1 4.07Å; L1887-I1894 HydrophobicContact CD1-CD1 4.2Å
1888T78.6Confident81.3Confident13.4 Ų13.443.6 Ų43.68%0.08225%0.254CS..Hα-helixtrans-67.4-28.5-177-41.30000112.6M1870 L1873 C1884 S1885 Q1886 I1890 T1891 I1894 G1895M1870-T1888 HydrophobicContact CG-CG2 4.17Å; L1873-T1888 HydrophobicContact CD1-CG2 3.85Å; L1873-T1888 VanDerWaalsContact CD1-OG1 3.28Å; L1873-T1888 WeakPolarHBondContact CD1-OG1 3.44Å; C1884-T1888 PolarHBondContact O-N 3.15Å; C1884-T1888 VanDerWaalsContact O-N 3.13Å; C1884-T1888 PolarHBondContact O-OG1 3.09Å; C1884-T1888 VanDerWaalsContact O-OG1 3.04Å; S1885-T1888 WeakPolarHBondContact O-CB 3.23Å; S1885-T1888 PolarHBondContact O-N 3.21Å; S1885-T1888 VanDerWaalsContact O-N 3.14Å; S1885-T1888 PolarHBondContact O-OG1 3.2Å; Q1886-T1888 VanDerWaalsContact C-N 3.33Å; T1888-I1890 PolarHBondContact O-N 3.25Å; T1888-T1891 CarbonylContact O-C 3.59Å; T1888-I1894 HydrophobicContact CG2-CB 4.44Å; T1888-I1894 HydrophobicContact CG2-CG2 4.3Å; T1888-G1895 VanDerWaalsContact CG2-CA 3.47Å
1889A76.4Confident81.5Confident88 Ų8843.2 Ų43.273%0.72725%0.25SC*.THydrogen-bonded Turntrans-64.7-25.517200000112.6L1887L1887-A1889 VanDerWaalsContact C-N 3.27Å; L1887-A1889 PolarHBondContact O-N 3.15Å
1890I74.5Confident81.7Confident80.4 Ų80.443.4 Ų43.441%0.41225%0.249SC..THydrogen-bonded Turntrans-98.1-44.1-174-54.5178.2000110.3Q1415 L1887 T1888Q1415-I1890 HydrophobicContact CB-CG2 4.37Å; Q1415-I1890 HydrophobicContact CG-CG2 3.71Å; Q1415-I1890 VanDerWaalsContact NE2-CG2 3.25Å; L1887-I1890 CarbonylContact O-C 3.55Å; L1887-I1890 WeakPolarHBondContact O-CA 3.32Å; L1887-I1890 WeakPolarHBondContact O-CB 3.39Å; L1887-I1890 PolarHBondContact O-N 3.05Å; T1888-I1890 PolarHBondContact O-N 3.25Å
1891T76.7Confident81.8Confident23.8 Ų23.843.2 Ų43.215%0.14625%0.248CC..  trans-12592.7-179.4-49.10000109.5L1412 L1887 T1888 G1893 I1894L1412-T1891 HydrophobicContact CD1-CG2 3.7Å; L1412-T1891 HydrophobicContact CD2-CG2 4.28Å; L1412-T1891 WeakPolarHBondContact CD2-OG1 3.31Å; L1887-T1891 PolarHBondContact O-N 3.35Å; T1888-T1891 CarbonylContact O-C 3.59Å; T1891-G1893 PolarHBondContact O-N 3.3Å; T1891-G1893 VanDerWaalsContact O-N 3.11Å; T1891-I1894 HydrophobicContact CG2-CD1 4.12Å; T1891-I1894 HydrophobicContact CG2-CG1 3.97Å; T1891-I1894 PolarHBondContact O-N 3.13Å; T1891-I1894 VanDerWaalsContact O-N 3.14Å
1892P77.3Confident81.8Confident84 Ų8442.8 Ų42.855%0.54525%0.246SC..Hα-helixtrans-63.4-20.3-178.224.7-33.9000113.1I1894 G1895 R1896P1892-I1894 VanDerWaalsContact C-N 3.34Å; P1892-I1894 PolarHBondContact O-N 3.18Å; P1892-G1895 PolarHBondContact O-N 2.96Å; P1892-R1896 PolarHBondContact O-N 3.21Å
1893G80.2Confident81.8Confident35.8 Ų35.840.1 Ų40.137%0.36924%0.236SC..Hα-helixtrans-60.8-39.117500000113.5T1891 G1895 R1896 T1897T1891-G1893 PolarHBondContact O-N 3.3Å; T1891-G1893 VanDerWaalsContact O-N 3.11Å; G1893-G1895 VanDerWaalsContact C-N 3.27Å; G1893-G1895 PolarHBondContact O-N 3.05Å; G1893-R1896 PolarHBondContact O-N 3.13Å; G1893-R1896 VanDerWaalsContact O-N 3.15Å; G1893-T1897 WeakPolarHBondContact O-CG2 3.5Å; G1893-T1897 PolarHBondContact O-N 2.99Å; G1893-T1897 VanDerWaalsContact O-N 3.13Å; G1893-T1897 PolarHBondContact O-OG1 3.26Å
1894I81.1Confident81.9Confident11.2 Ų11.240.3 Ų40.36%0.05723%0.233CC..Hα-helixtrans-60.1-42177.3-66.5171.8000110.1A1402 L1403 S1406 C1884 L1887 T1888 T1891 P1892 R1896 T1897 L1898A1402-I1894 HydrophobicContact CB-CG2 4.41Å; L1403-I1894 HydrophobicContact CD2-CD1 4.32Å; S1406-I1894 VanDerWaalsContact OG-CD1 3.3Å; S1406-I1894 WeakPolarHBondContact OG-CD1 3.36Å; S1406-I1894 WeakPolarHBondContact OG-CG1 3.39Å; C1884-I1894 HydrophobicContact CB-CG2 4.21Å; L1887-I1894 HydrophobicContact CB-CD1 4.07Å; L1887-I1894 HydrophobicContact CD1-CD1 4.2Å; T1888-I1894 HydrophobicContact CG2-CB 4.44Å; T1888-I1894 HydrophobicContact CG2-CG2 4.3Å; T1891-I1894 HydrophobicContact CG2-CD1 4.12Å; T1891-I1894 HydrophobicContact CG2-CG1 3.97Å; T1891-I1894 PolarHBondContact O-N 3.13Å; T1891-I1894 VanDerWaalsContact O-N 3.14Å; P1892-I1894 VanDerWaalsContact C-N 3.34Å; P1892-I1894 PolarHBondContact O-N 3.18Å; I1894-R1896 VanDerWaalsContact C-N 3.33Å; I1894-R1896 PolarHBondContact O-N 3.41Å; I1894-T1897 WeakPolarHBondContact CA-OG1 3.45Å; I1894-T1897 PolarHBondContact O-N 3.23Å; I1894-T1897 PolarHBondContact O-OG1 2.85Å; I1894-L1898 HydrophobicContact CG2-CD1 3.65Å; I1894-L1898 HydrophobicContact CG2-CG 4.25Å; I1894-L1898 WeakPolarHBondContact O-CB 3.32Å; I1894-L1898 WeakPolarHBondContact O-CG 3.27Å; I1894-L1898 PolarHBondContact O-N 3.32Å
1895G80.6Confident81.7Confident0.6 Ų0.640.5 Ų40.51%0.00623%0.234CC..Hα-helixtrans-58.8-48.2177.100000111.5N1869 T1888 P1892 G1893 T1897 L1898 F1899N1869-G1895 WeakPolarHBondContact ND2-CA 3.34Å; N1869-G1895 PolarHBondContact ND2-O 3.12Å; N1869-G1895 PolarHBondContact OD1-O 2.95Å; T1888-G1895 VanDerWaalsContact CG2-CA 3.47Å; P1892-G1895 PolarHBondContact O-N 2.96Å; G1893-G1895 VanDerWaalsContact C-N 3.27Å; G1893-G1895 PolarHBondContact O-N 3.05Å; G1895-T1897 VanDerWaalsContact C-N 3.32Å; G1895-T1897 PolarHBondContact O-N 3.03Å; G1895-L1898 PolarHBondContact O-N 3.2Å; G1895-F1899 PolarHBondContact O-N 3.19Å
1896R81.1Confident81.6Confident139.6 Ų139.639.2 Ų39.253%0.52723%0.225SC..Hα-helixtrans-60.7-40.3-179.3-72.8179.3171.4157.3-7.1112.2Y1212 N1869 P1892 G1893 I1894 F1899 E1934Y1212-R1896 PolarHBondContact OH-NH2 3.41Å; N1869-R1896 PolarHBondContact ND2-N 3.2Å; P1892-R1896 PolarHBondContact O-N 3.21Å; G1893-R1896 PolarHBondContact O-N 3.13Å; G1893-R1896 VanDerWaalsContact O-N 3.15Å; I1894-R1896 VanDerWaalsContact C-N 3.33Å; I1894-R1896 PolarHBondContact O-N 3.41Å; R1896-F1899 WeakPolarHBondContact O-CB 3.3Å; R1896-E1934 IonicContact CZ-OE1 3.51Å; R1896-E1934 IonicContact CZ-OE2 3.29Å; R1896-E1934 IonicContact NE-OE1 3.44Å; R1896-E1934 PolarHBondContact NE-OE1 2.89Å; R1896-E1934 IonicContact NH2-OE1 3.18Å; R1896-E1934 PolarHBondContact NH2-OE1 3.41Å; R1896-E1934 IonicContact NH2-OE2 3.16Å; R1896-E1934 PolarHBondContact NH2-OE2 3.26Å
1897T81.6Confident81.8Confident69 Ų6933.1 Ų33.142%0.42320%0.196SC..Hα-helixtrans-71.1-38.3178.757.60000112.5Q1379 A1402 G1893 I1894 G1895 F1899Q1379-T1897 PolarHBondContact NE2-O 3.27Å; Q1379-T1897 PolarHBondContact OE1-O 2.9Å; A1402-T1897 WeakPolarHBondContact CB-OG1 3.39Å; G1893-T1897 WeakPolarHBondContact O-CG2 3.5Å; G1893-T1897 PolarHBondContact O-N 2.99Å; G1893-T1897 VanDerWaalsContact O-N 3.13Å; G1893-T1897 PolarHBondContact O-OG1 3.26Å; I1894-T1897 WeakPolarHBondContact CA-OG1 3.45Å; I1894-T1897 PolarHBondContact O-N 3.23Å; I1894-T1897 PolarHBondContact O-OG1 2.85Å; G1895-T1897 VanDerWaalsContact C-N 3.32Å; G1895-T1897 PolarHBondContact O-N 3.03Å; T1897-F1899 VanDerWaalsContact C-N 3.3Å; T1897-F1899 PolarHBondContact O-N 3.05Å
1898L85.5Confident81.7Confident15.6 Ų15.635.4 Ų35.48%0.08221%0.213CC..Hα-helixtrans-84.2-6.8-177.9-68-179.7000114.1C1398 A1402 L1873 C1884 I1894 G1895 N1900 A1901 A1902C1398-L1898 HydrophobicContact CB-CD2 4.12Å; C1398-L1898 WeakPolarHBondContact O-CD2 3.44Å; A1402-L1898 HydrophobicContact CB-CD1 4.31Å; A1402-L1898 HydrophobicContact CB-CD2 3.98Å; A1402-L1898 HydrophobicContact CB-CG 3.95Å; L1873-L1898 HydrophobicContact CD2-CB 3.82Å; L1873-L1898 HydrophobicContact CD2-CD1 4.29Å; C1884-L1898 HydrophobicContact CB-CD1 3.68Å; I1894-L1898 HydrophobicContact CG2-CD1 3.65Å; I1894-L1898 HydrophobicContact CG2-CG 4.25Å; I1894-L1898 WeakPolarHBondContact O-CB 3.32Å; I1894-L1898 WeakPolarHBondContact O-CG 3.27Å; I1894-L1898 PolarHBondContact O-N 3.32Å; G1895-L1898 PolarHBondContact O-N 3.2Å; L1898-N1900 PolarHBondContact O-N 3.21Å; L1898-A1901 PolarHBondContact O-N 3.1Å; L1898-A1901 VanDerWaalsContact O-N 3.16Å; L1898-A1902 VanDerWaalsContact O-CB 3.3Å; L1898-A1902 WeakPolarHBondContact O-CB 3.39Å; L1898-A1902 PolarHBondContact O-N 3.28Å
1899F87.6Confident81.7Confident7 Ų739.4 Ų39.43%0.03123%0.23CC..Hα-helixtrans-51.8-50.4-176178.3-104.8000113.1L1865 L1868 N1869 L1872 G1895 R1896 T1897 A1901 A1902 F1903 T1938 L1942L1865-F1899 HydrophobicContact CD1-CE2 3.98Å; L1865-F1899 HydrophobicContact CD1-CZ 4.02Å; L1868-F1899 HydrophobicContact CD2-CE2 4.21Å; L1868-F1899 HydrophobicContact CD2-CZ 4.36Å; L1868-F1899 HydrophobicContact CG-CE2 4.38Å; N1869-F1899 HydrophobicContact CB-CD2 3.96Å; N1869-F1899 HydrophobicContact CB-CE2 4.43Å; L1872-F1899 HydrophobicContact CD1-CD2 4.21Å; L1872-F1899 HydrophobicContact CD1-CE2 3.78Å; L1872-F1899 HydrophobicContact CD1-CZ 4.44Å; G1895-F1899 PolarHBondContact O-N 3.19Å; R1896-F1899 WeakPolarHBondContact O-CB 3.3Å; T1897-F1899 VanDerWaalsContact C-N 3.3Å; T1897-F1899 PolarHBondContact O-N 3.05Å; F1899-A1901 PolarHBondContact O-N 3.1Å; F1899-A1902 PolarHBondContact O-N 3.34Å; F1899-F1903 WeakPolarHBondContact O-CB 3.31Å; F1899-F1903 PolarHBondContact O-N 3.2Å; F1899-T1938 HydrophobicContact CD1-CG2 3.47Å; F1899-T1938 VanDerWaalsContact CD1-CG2 3.47Å; F1899-T1938 HydrophobicContact CE1-CG2 3.6Å; F1899-T1938 HydrophobicContact CG-CG2 4.17Å; F1899-T1938 HydrophobicContact CZ-CG2 4.36Å; F1899-L1942 HydrophobicContact CE1-CB 4.25Å; F1899-L1942 HydrophobicContact CE1-CD1 4.47Å; F1899-L1942 HydrophobicContact CE1-CD2 4Å; F1899-L1942 HydrophobicContact CE1-CG 4.46Å; F1899-L1942 HydrophobicContact CZ-CD2 4.4Å
1900N86.8Confident81.9Confident28.8 Ų28.835.8 Ų35.815%0.15420%0.199CC..Hα-helixtrans-63.3-42.9-179.4-71.7-4.5000112.4L1898 F1903 L1904 N1941 L1942 F1945L1898-N1900 PolarHBondContact O-N 3.21Å; N1900-F1903 PolarHBondContact O-N 2.95Å; N1900-L1904 WeakPolarHBondContact O-CB 3.45Å; N1900-L1904 PolarHBondContact O-N 3.08Å; N1900-N1941 PolarHBondContact ND2-O 3.22Å; N1900-L1942 HydrophobicContact CB-CD1 4.46Å; N1900-L1942 WeakPolarHBondContact OD1-CA 3.21Å; N1900-F1945 HydrophobicContact CB-CB 4.29Å; N1900-F1945 HydrophobicContact CB-CD1 3.74Å; N1900-F1945 HydrophobicContact CB-CD2 4.23Å; N1900-F1945 HydrophobicContact CB-CE1 4.01Å; N1900-F1945 HydrophobicContact CB-CE2 4.42Å; N1900-F1945 HydrophobicContact CB-CG 3.85Å; N1900-F1945 HydrophobicContact CB-CZ 4.37Å
1901A84.3Confident82.2Confident16.6 Ų16.636.7 Ų36.714%0.13721%0.205CC..Hα-helixtrans-68.6-39.2178.400000111.9F1395 C1398 I1881 L1898 F1899 L1904 S1905F1395-A1901 HydrophobicContact CD1-CB 4.36Å; F1395-A1901 WeakPolarHBondContact CE1-O 3.26Å; C1398-A1901 HydrophobicContact CB-CB 4.23Å; I1881-A1901 HydrophobicContact CD1-CB 4.33Å; L1898-A1901 PolarHBondContact O-N 3.1Å; L1898-A1901 VanDerWaalsContact O-N 3.16Å; F1899-A1901 PolarHBondContact O-N 3.1Å; A1901-L1904 PolarHBondContact O-N 3.25Å; A1901-S1905 WeakPolarHBondContact O-CB 3.36Å; A1901-S1905 PolarHBondContact O-N 3.18Å; A1901-S1905 PolarHBondContact O-OG 3.48Å
1902A85.6Confident82.4Confident0 Ų043.1 Ų43.10%023%0.227CC..Hα-helixtrans-65.2-45.4176.400000111.1L1872 L1873 I1881 L1898 F1899 L1904 S1905 C1906L1872-A1902 HydrophobicContact CB-CB 4.08Å; L1873-A1902 HydrophobicContact CD2-CB 3.7Å; L1873-A1902 HydrophobicContact CG-CB 4.27Å; I1881-A1902 HydrophobicContact CG2-CB 4.13Å; L1898-A1902 VanDerWaalsContact O-CB 3.3Å; L1898-A1902 WeakPolarHBondContact O-CB 3.39Å; L1898-A1902 PolarHBondContact O-N 3.28Å; F1899-A1902 PolarHBondContact O-N 3.34Å; A1902-L1904 PolarHBondContact O-N 3.14Å; A1902-S1905 PolarHBondContact O-N 3.09Å; A1902-S1905 VanDerWaalsContact O-N 3.13Å; A1902-S1905 PolarHBondContact O-OG 3.18Å; A1902-C1906 PolarHBondContact O-N 3.19Å; A1902-C1906 VanDerWaalsContact O-N 3.11Å; A1902-C1906 PolarHBondContact O-SG 3.34Å; A1902-C1906 VanDerWaalsContact O-SG 3.38Å
1903F86.9Confident82.7Confident4.4 Ų4.445.9 Ų45.92%0.01923%0.233CC..Hα-helixtrans-58-50.5174.9-170.6-82.3000111.4L1872 F1899 N1900 S1905 C1906 W1907 L1918 L1922 L1942 M1946 L1961L1872-F1903 HydrophobicContact CD1-CB 4.33Å; L1872-F1903 HydrophobicContact CD1-CD2 4.09Å; F1899-F1903 WeakPolarHBondContact O-CB 3.31Å; F1899-F1903 PolarHBondContact O-N 3.2Å; N1900-F1903 PolarHBondContact O-N 2.95Å; F1903-S1905 VanDerWaalsContact C-N 3.27Å; F1903-S1905 PolarHBondContact O-N 3.31Å; F1903-C1906 PolarHBondContact O-N 3.06Å; F1903-C1906 VanDerWaalsContact O-N 3.15Å; F1903-W1907 HydrophobicContact CD1-CB 4.46Å; F1903-W1907 HydrophobicContact CD1-CE3 4.35Å; F1903-W1907 HydrophobicContact CE1-CB 4.43Å; F1903-W1907 AromaticContact CE1-CD2 3.91Å; F1903-W1907 HydrophobicContact CE1-CD2 3.94Å; F1903-W1907 AromaticContact CE1-CE3 3.37Å; F1903-W1907 HydrophobicContact CE1-CE3 3.37Å; F1903-W1907 VanDerWaalsContact CE1-CE3 3.47Å; F1903-W1907 HydrophobicContact CE1-CG 4.41Å; F1903-W1907 AromaticContact CE1-CZ3 3.82Å; F1903-W1907 HydrophobicContact CE1-CZ3 3.92Å; F1903-W1907 HydrophobicContact CE2-CE3 4.46Å; F1903-W1907 HydrophobicContact CZ-CD2 4.45Å; F1903-W1907 AromaticContact CZ-CE3 3.47Å; F1903-W1907 HydrophobicContact CZ-CE3 3.47Å; F1903-W1907 VanDerWaalsContact CZ-CE3 3.44Å; F1903-W1907 AromaticContact CZ-CZ3 3.62Å; F1903-W1907 HydrophobicContact CZ-CZ3 3.62Å; F1903-W1907 VanDerWaalsContact CZ-CZ3 3.47Å; F1903-W1907 WeakPolarHBondContact O-CB 3.36Å; F1903-W1907 PolarHBondContact O-N 3.01Å; F1903-L1918 HydrophobicContact CE2-CD2 3.59Å; F1903-L1918 HydrophobicContact CE2-CG 4.26Å; F1903-L1918 HydrophobicContact CZ-CD2 3.77Å; F1903-L1918 HydrophobicContact CZ-CG 4.34Å; F1903-L1922 HydrophobicContact CE2-CD1 4.4Å; F1903-L1922 HydrophobicContact CZ-CD1 4.32Å; F1903-L1942 HydrophobicContact CB-CD1 3.82Å; F1903-L1942 HydrophobicContact CB-CD2 4.46Å; F1903-L1942 HydrophobicContact CD1-CD1 3.71Å; F1903-L1942 HydrophobicContact CD1-CD2 4.07Å; F1903-L1942 HydrophobicContact CD1-CG 4.36Å; F1903-L1942 HydrophobicContact CD2-CD1 4.37Å; F1903-L1942 HydrophobicContact CD2-CD2 3.75Å; F1903-L1942 HydrophobicContact CE1-CD1 4.38Å; F1903-L1942 HydrophobicContact CE1-CD2 4.11Å; F1903-L1942 HydrophobicContact CE2-CD2 3.78Å; F1903-L1942 HydrophobicContact CG-CD1 3.73Å; F1903-L1942 HydrophobicContact CG-CD2 3.89Å; F1903-L1942 HydrophobicContact CG-CG 4.37Å; F1903-L1942 HydrophobicContact CZ-CD2 3.96Å; F1903-M1946 HydrophobicContact CD1-CE 4.5Å; F1903-M1946 HydrophobicContact CD1-SD 3.87Å; F1903-M1946 HydrophobicContact CE1-CE 4.05Å; F1903-M1946 HydrophobicContact CE1-SD 3.49Å; F1903-M1946 VanDerWaalsContact CE1-SD 3.55Å; F1903-M1946 WeakPolarHBondContact CE1-SD 3.34Å; F1903-M1946 HydrophobicContact CZ-SD 4.46Å; F1903-L1961 HydrophobicContact CE1-CD2 4.43Å; F1903-L1961 HydrophobicContact CZ-CD1 4.34Å; F1903-L1961 HydrophobicContact CZ-CD2 4.1Å
1904L83.4Confident82.7Confident31.2 Ų31.244.9 Ų44.916%0.16322%0.218CC..Hα-helixtrans-61.4-34.4178-177.865.9000112.5W1388 F1394 N1900 A1901 A1902 C1906 P1908 F1945 M1949 V1959W1388-L1904 HydrophobicContact CH2-CD2 3.46Å; W1388-L1904 VanDerWaalsContact CH2-CD2 3.46Å; W1388-L1904 HydrophobicContact CZ2-CD2 4.48Å; W1388-L1904 HydrophobicContact CZ3-CD2 4.03Å; F1394-L1904 HydrophobicContact CE1-CD2 4.49Å; N1900-L1904 WeakPolarHBondContact O-CB 3.45Å; N1900-L1904 PolarHBondContact O-N 3.08Å; A1901-L1904 PolarHBondContact O-N 3.25Å; A1902-L1904 PolarHBondContact O-N 3.14Å; L1904-C1906 VanDerWaalsContact C-N 3.34Å; L1904-P1908 WeakPolarHBondContact O-CD 3.3Å; L1904-F1945 HydrophobicContact CB-CE1 4.19Å; L1904-F1945 HydrophobicContact CD2-CE1 3.9Å; L1904-F1945 HydrophobicContact CD2-CZ 4.37Å; L1904-M1949 HydrophobicContact CD1-CG 4.44Å; L1904-M1949 HydrophobicContact CD2-CE 4.18Å; L1904-M1949 HydrophobicContact CD2-CG 4.07Å; L1904-M1949 HydrophobicContact CD2-SD 4.31Å; L1904-V1959 HydrophobicContact CD1-CG1 4.29Å
1905S80.5Confident82.8Confident11.2 Ų11.245.3 Ų45.38%0.07822%0.22CC..Hα-helixtrans-68.1-36.5177.575.50000112.6S1876 P1877 A1901 A1902 F1903S1876-S1905 WeakPolarHBondContact CB-OG 3.37Å; S1876-S1905 WeakPolarHBondContact OG-CB 3.46Å; S1876-S1905 PolarHBondContact OG-OG 3.23Å; P1877-S1905 WeakPolarHBondContact CD-O 3.45Å; P1877-S1905 VanDerWaalsContact CG-O 3.31Å; P1877-S1905 WeakPolarHBondContact CG-O 3.35Å; A1901-S1905 WeakPolarHBondContact O-CB 3.36Å; A1901-S1905 PolarHBondContact O-N 3.18Å; A1901-S1905 PolarHBondContact O-OG 3.48Å; A1902-S1905 PolarHBondContact O-N 3.09Å; A1902-S1905 VanDerWaalsContact O-N 3.13Å; A1902-S1905 PolarHBondContact O-OG 3.18Å; F1903-S1905 VanDerWaalsContact C-N 3.27Å; F1903-S1905 PolarHBondContact O-N 3.31Å
1906C83.6Confident82.9Confident1.2 Ų1.248.6 Ų48.61%0.00824%0.237CC..Hα-helixtrans-82.2-30.4179.6-62.40000112.4I1841 L1846 L1872 A1902 F1903 L1904 E1909 L1910I1841-C1906 HydrophobicContact CD1-CB 4.39Å; L1846-C1906 HydrophobicContact CD1-CB 4.49Å; L1872-C1906 HydrophobicContact CD2-CB 4.01Å; A1902-C1906 PolarHBondContact O-N 3.19Å; A1902-C1906 VanDerWaalsContact O-N 3.11Å; A1902-C1906 PolarHBondContact O-SG 3.34Å; A1902-C1906 VanDerWaalsContact O-SG 3.38Å; F1903-C1906 PolarHBondContact O-N 3.06Å; F1903-C1906 VanDerWaalsContact O-N 3.15Å; L1904-C1906 VanDerWaalsContact C-N 3.34Å; C1906-E1909 PolarHBondContact O-N 2.96Å; C1906-E1909 VanDerWaalsContact O-N 3.14Å; C1906-L1910 WeakPolarHBondContact O-CG 3.35Å; C1906-L1910 PolarHBondContact O-N 3.35Å
1907W84Confident83.1Confident12.4 Ų12.444.9 Ų44.95%0.04723%0.228CC..G310 helixtrans-54-48.2-172.1-173-101.3000115.5F1903 E1909 L1910 Q1915 L1918 I1919 M1946 R1958 L1961F1903-W1907 HydrophobicContact CD1-CB 4.46Å; F1903-W1907 HydrophobicContact CD1-CE3 4.35Å; F1903-W1907 HydrophobicContact CE1-CB 4.43Å; F1903-W1907 AromaticContact CE1-CD2 3.91Å; F1903-W1907 HydrophobicContact CE1-CD2 3.94Å; F1903-W1907 AromaticContact CE1-CE3 3.37Å; F1903-W1907 HydrophobicContact CE1-CE3 3.37Å; F1903-W1907 VanDerWaalsContact CE1-CE3 3.47Å; F1903-W1907 HydrophobicContact CE1-CG 4.41Å; F1903-W1907 AromaticContact CE1-CZ3 3.82Å; F1903-W1907 HydrophobicContact CE1-CZ3 3.92Å; F1903-W1907 HydrophobicContact CE2-CE3 4.46Å; F1903-W1907 HydrophobicContact CZ-CD2 4.45Å; F1903-W1907 AromaticContact CZ-CE3 3.47Å; F1903-W1907 HydrophobicContact CZ-CE3 3.47Å; F1903-W1907 VanDerWaalsContact CZ-CE3 3.44Å; F1903-W1907 AromaticContact CZ-CZ3 3.62Å; F1903-W1907 HydrophobicContact CZ-CZ3 3.62Å; F1903-W1907 VanDerWaalsContact CZ-CZ3 3.47Å; F1903-W1907 WeakPolarHBondContact O-CB 3.36Å; F1903-W1907 PolarHBondContact O-N 3.01Å; W1907-E1909 VanDerWaalsContact C-N 3.27Å; W1907-E1909 PolarHBondContact O-N 3.13Å; W1907-L1910 HydrophobicContact CE3-CD1 4.36Å; W1907-L1910 PolarHBondContact O-N 3.01Å; W1907-Q1915 HydrophobicContact CD2-CG 4.39Å; W1907-Q1915 HydrophobicContact CE3-CG 4.42Å; W1907-Q1915 HydrophobicContact CH2-CB 3.79Å; W1907-Q1915 HydrophobicContact CH2-CG 4.03Å; W1907-Q1915 HydrophobicContact CZ2-CB 4.02Å; W1907-Q1915 HydrophobicContact CZ2-CG 4.02Å; W1907-Q1915 HydrophobicContact CZ3-CB 4.32Å; W1907-Q1915 HydrophobicContact CZ3-CG 4.26Å; W1907-Q1915 PolarHBondContact O-NE2 3.1Å; W1907-L1918 HydrophobicContact CE3-CD2 4.24Å; W1907-L1918 HydrophobicContact CZ3-CB 4.47Å; W1907-L1918 HydrophobicContact CZ3-CD2 3.82Å; W1907-L1918 HydrophobicContact CZ3-CG 4.36Å; W1907-I1919 HydrophobicContact CH2-CD1 3.87Å; W1907-I1919 HydrophobicContact CH2-CG1 3.88Å; W1907-I1919 HydrophobicContact CZ2-CD1 4.3Å; W1907-M1946 HydrophobicContact CD2-CE 4.16Å; W1907-M1946 HydrophobicContact CG-CE 4.28Å; W1907-M1946 HydrophobicContact CZ2-CE 4.43Å; W1907-R1958 PolarHBondContact NE1-O 3.05Å; W1907-R1958 VanDerWaalsContact NE1-O 3.11Å; W1907-L1961 HydrophobicContact CH2-CD1 3.9Å; W1907-L1961 HydrophobicContact CH2-CD2 4.07Å; W1907-L1961 HydrophobicContact CZ2-CD1 4.37Å; W1907-L1961 HydrophobicContact CZ3-CD1 4.35Å; W1907-L1961 HydrophobicContact CZ3-CD2 4.22Å
1908P78.9Confident83.2Confident69.2 Ų69.241.7 Ų41.745%0.44921%0.209SC..G310 helixtrans-69.5-19.5-178.5-1.77.3000114.3L1904L1904-P1908 WeakPolarHBondContact O-CD 3.3Å
1909E78.5Confident83.2Confident97.4 Ų97.441.6 Ų41.646%0.45521%0.208SC..G310 helixtrans-92.2-6.9-176.6-62.2-69.3148.700112.5I1841 P1877 C1906 W1907I1841-E1909 HydrophobicContact CD1-CB 3.39Å; I1841-E1909 VanDerWaalsContact CD1-CB 3.47Å; I1841-E1909 HydrophobicContact CD1-CG 3.75Å; I1841-E1909 HydrophobicContact CG1-CB 4.34Å; P1877-E1909 HydrophobicContact CB-CG 4.43Å; P1877-E1909 HydrophobicContact CG-CG 4.29Å; C1906-E1909 PolarHBondContact O-N 2.96Å; C1906-E1909 VanDerWaalsContact O-N 3.14Å; W1907-E1909 VanDerWaalsContact C-N 3.27Å; W1907-E1909 PolarHBondContact O-N 3.13Å
1910L80.7Confident83Confident11.6 Ų11.645 Ų456%0.06123%0.226CC..SBendtrans-81.7144.5176.4-67.6169.2000111.4L1846 W1850 C1906 W1907 Q1914 Q1915 L1918L1846-L1910 HydrophobicContact CD1-CD2 4.19Å; L1846-L1910 HydrophobicContact CD2-CD1 4.28Å; L1846-L1910 HydrophobicContact CD2-CD2 3.53Å; L1846-L1910 HydrophobicContact CD2-CG 4.4Å; W1850-L1910 HydrophobicContact CH2-CD1 3.91Å; W1850-L1910 HydrophobicContact CH2-CD2 3.91Å; W1850-L1910 HydrophobicContact CH2-CG 4.32Å; W1850-L1910 HydrophobicContact CZ3-CD1 4.24Å; W1850-L1910 HydrophobicContact CZ3-CD2 4.36Å; C1906-L1910 WeakPolarHBondContact O-CG 3.35Å; C1906-L1910 PolarHBondContact O-N 3.35Å; W1907-L1910 HydrophobicContact CE3-CD1 4.36Å; W1907-L1910 PolarHBondContact O-N 3.01Å; L1910-Q1914 HydrophobicContact CB-CB 4.37Å; L1910-Q1914 HydrophobicContact CD2-CB 4.39Å; L1910-Q1915 HydrophobicContact CB-CG 3.88Å; L1910-Q1915 PolarHBondContact O-NE2 3.07Å; L1910-L1918 HydrophobicContact CD1-CD2 4.28Å
1911N81.7Confident82.9Confident100.4 Ų100.444.2 Ų44.254%0.53722%0.222SC..  trans-68153172.4-67.8-22.7000110.7H1913 Q1914 Q1915N1911-H1913 VanDerWaalsContact C-N 3.27Å; N1911-H1913 PolarHBondContact O-N 3.22Å; N1911-H1913 VanDerWaalsContact O-N 3.15Å; N1911-Q1914 HydrophobicContact CB-CG 4.34Å; N1911-Q1914 WeakPolarHBondContact O-CB 3.33Å; N1911-Q1914 PolarHBondContact O-N 3.22Å; N1911-Q1915 PolarHBondContact O-N 3.06Å
1912Y81.3Confident83Confident157.6 Ų157.643.5 Ų43.562%0.61822%0.216SC*.Hα-helixtrans-52.7-41178.7-82.1-68.5000113.6Q1914 Q1915 D1916 R1958Y1912-Q1914 VanDerWaalsContact C-N 3.33Å; Y1912-Q1914 PolarHBondContact O-N 3.34Å; Y1912-Q1915 WeakPolarHBondContact O-CB 3.49Å; Y1912-Q1915 PolarHBondContact O-N 3.28Å; Y1912-D1916 WeakPolarHBondContact CE1-OD2 3.4Å; Y1912-D1916 VanDerWaalsContact O-CG 3.31Å; Y1912-D1916 PolarHBondContact O-N 3.28Å; Y1912-R1958 VanDerWaalsContact OH-CZ 3.25Å; Y1912-R1958 PolarHBondContact OH-NH1 3.44Å; Y1912-R1958 PolarHBondContact OH-NH2 2.97Å
1913H82.4Confident82.9Confident143 Ų14345.2 Ų45.266%0.66222%0.224SC*.Hα-helixtrans-61.7-39.5175.8-106.7-65.1000112.9N1911 D1916 D1917N1911-H1913 VanDerWaalsContact C-N 3.27Å; N1911-H1913 PolarHBondContact O-N 3.22Å; N1911-H1913 VanDerWaalsContact O-N 3.15Å; H1913-D1916 PolarHBondContact O-N 3.17Å; H1913-D1917 IonicContact CE1-OD1 2.91Å; H1913-D1917 IonicContact CE1-OD2 3.17Å; H1913-D1917 PolarHBondContact CE1-OD2 3.2Å; H1913-D1917 IonicContact ND1-OD1 2.7Å; H1913-D1917 IonicContact ND1-OD2 3.28Å; H1913-D1917 PolarHBondContact ND1-OD2 3Å; H1913-D1917 WeakPolarHBondContact O-CB 3.49Å; H1913-D1917 VanDerWaalsContact O-CG 3.27Å; H1913-D1917 PolarHBondContact O-N 3.16Å
1914Q81.2Confident82.7Confident15.4 Ų15.452.7 Ų52.77%0.07225%0.252CS..Hα-helixtrans-72.2-35.9179.7-67.1169.5-3000111.6E1847 W1850 L1910 N1911 Y1912 D1917 L1918E1847-Q1914 WeakPolarHBondContact OE1-CG 3.27Å; E1847-Q1914 PolarHBondContact OE1-NE2 3.13Å; W1850-Q1914 HydrophobicContact CH2-CB 4.34Å; W1850-Q1914 HydrophobicContact CZ2-CB 4.19Å; W1850-Q1914 HydrophobicContact CZ2-CG 4.49Å; L1910-Q1914 HydrophobicContact CB-CB 4.37Å; L1910-Q1914 HydrophobicContact CD2-CB 4.39Å; N1911-Q1914 HydrophobicContact CB-CG 4.34Å; N1911-Q1914 WeakPolarHBondContact O-CB 3.33Å; N1911-Q1914 PolarHBondContact O-N 3.22Å; Y1912-Q1914 VanDerWaalsContact C-N 3.33Å; Y1912-Q1914 PolarHBondContact O-N 3.34Å; Q1914-D1917 PolarHBondContact O-N 3.16Å; Q1914-L1918 WeakPolarHBondContact O-CB 3.38Å; Q1914-L1918 PolarHBondContact O-N 3.08Å
1915Q82.7Confident82.7Confident19.4 Ų19.451.4 Ų51.49%0.09125%0.246CC..Hα-helixtrans-61.6-47172.5-69.2177-10.500110.5W1907 L1910 N1911 Y1912 D1917 L1918 I1919W1907-Q1915 HydrophobicContact CD2-CG 4.39Å; W1907-Q1915 HydrophobicContact CE3-CG 4.42Å; W1907-Q1915 HydrophobicContact CH2-CB 3.79Å; W1907-Q1915 HydrophobicContact CH2-CG 4.03Å; W1907-Q1915 HydrophobicContact CZ2-CB 4.02Å; W1907-Q1915 HydrophobicContact CZ2-CG 4.02Å; W1907-Q1915 HydrophobicContact CZ3-CB 4.32Å; W1907-Q1915 HydrophobicContact CZ3-CG 4.26Å; W1907-Q1915 PolarHBondContact O-NE2 3.1Å; L1910-Q1915 HydrophobicContact CB-CG 3.88Å; L1910-Q1915 PolarHBondContact O-NE2 3.07Å; N1911-Q1915 PolarHBondContact O-N 3.06Å; Y1912-Q1915 WeakPolarHBondContact O-CB 3.49Å; Y1912-Q1915 PolarHBondContact O-N 3.28Å; Q1915-D1917 PolarHBondContact O-N 3.36Å; Q1915-L1918 WeakPolarHBondContact O-CB 3.37Å; Q1915-L1918 PolarHBondContact O-N 3.21Å; Q1915-I1919 VanDerWaalsContact O-CD1 3.26Å; Q1915-I1919 WeakPolarHBondContact O-CD1 3.25Å; Q1915-I1919 VanDerWaalsContact O-CG1 3.24Å; Q1915-I1919 WeakPolarHBondContact O-CG1 3.38Å; Q1915-I1919 PolarHBondContact O-N 3.32Å
1916D82.7Confident82.7Confident69 Ų6951 Ų5137%0.36924%0.243SC..Hα-helixtrans-62.3-42177.2-71.4-20.3000111.6Y1912 H1913 L1918 I1919 N1920 R1958Y1912-D1916 WeakPolarHBondContact CE1-OD2 3.4Å; Y1912-D1916 VanDerWaalsContact O-CG 3.31Å; Y1912-D1916 PolarHBondContact O-N 3.28Å; H1913-D1916 PolarHBondContact O-N 3.17Å; D1916-L1918 PolarHBondContact O-N 2.95Å; D1916-I1919 PolarHBondContact O-N 3.05Å; D1916-N1920 WeakPolarHBondContact O-CB 3.32Å; D1916-N1920 PolarHBondContact O-N 3.18Å; D1916-N1920 PolarHBondContact O-ND2 3.16Å; D1916-R1958 IonicContact OD1-NH1 3.23Å; D1916-R1958 PolarHBondContact OD1-NH1 3.07Å; D1916-R1958 IonicContact OD2-NH1 3.34Å
1917D84.6Confident82.6Confident62.8 Ų62.858.4 Ų58.434%0.33627%0.271SS..Hα-helixtrans-63.4-40.2175.8-75.1-24.3000112.7H1913 Q1914 Q1915 N1920 T1921H1913-D1917 IonicContact CE1-OD1 2.91Å; H1913-D1917 IonicContact CE1-OD2 3.17Å; H1913-D1917 PolarHBondContact CE1-OD2 3.2Å; H1913-D1917 IonicContact ND1-OD1 2.7Å; H1913-D1917 IonicContact ND1-OD2 3.28Å; H1913-D1917 PolarHBondContact ND1-OD2 3Å; H1913-D1917 WeakPolarHBondContact O-CB 3.49Å; H1913-D1917 VanDerWaalsContact O-CG 3.27Å; H1913-D1917 PolarHBondContact O-N 3.16Å; Q1914-D1917 PolarHBondContact O-N 3.16Å; Q1915-D1917 PolarHBondContact O-N 3.36Å; D1917-N1920 PolarHBondContact O-N 3.19Å; D1917-T1921 WeakPolarHBondContact O-CB 3.34Å; D1917-T1921 VanDerWaalsContact O-CG2 3.31Å; D1917-T1921 WeakPolarHBondContact O-CG2 3.48Å; D1917-T1921 PolarHBondContact O-N 3.32Å; D1917-T1921 PolarHBondContact O-OG1 3.14Å
1918L84.9Confident82.5Confident2 Ų259.8 Ų59.81%0.0128%0.28CS..Hα-helixtrans-66.7-42.4175.7-17752.1000111.4W1850 F1903 W1907 L1910 Q1914 Q1915 D1916 N1920 T1921 L1922W1850-L1918 HydrophobicContact CB-CD1 3.99Å; W1850-L1918 HydrophobicContact CD2-CD1 3.93Å; W1850-L1918 HydrophobicContact CD2-CD2 4.37Å; W1850-L1918 HydrophobicContact CD2-CG 4.48Å; W1850-L1918 HydrophobicContact CE3-CB 3.69Å; W1850-L1918 HydrophobicContact CE3-CD1 3.77Å; W1850-L1918 HydrophobicContact CE3-CD2 4Å; W1850-L1918 HydrophobicContact CE3-CG 4.21Å; W1850-L1918 HydrophobicContact CG-CD1 4.21Å; W1850-L1918 HydrophobicContact CH2-CB 4.2Å; W1850-L1918 HydrophobicContact CH2-CD1 4.24Å; W1850-L1918 HydrophobicContact CH2-CD2 3.26Å; W1850-L1918 HydrophobicContact CH2-CG 4.07Å; W1850-L1918 HydrophobicContact CZ2-CD1 4.06Å; W1850-L1918 HydrophobicContact CZ2-CD2 3.79Å; W1850-L1918 HydrophobicContact CZ2-CG 4.38Å; W1850-L1918 HydrophobicContact CZ3-CB 3.45Å; W1850-L1918 HydrophobicContact CZ3-CD1 3.9Å; W1850-L1918 HydrophobicContact CZ3-CD2 3.75Å; W1850-L1918 HydrophobicContact CZ3-CG 3.75Å; F1903-L1918 HydrophobicContact CE2-CD2 3.59Å; F1903-L1918 HydrophobicContact CE2-CG 4.26Å; F1903-L1918 HydrophobicContact CZ-CD2 3.77Å; F1903-L1918 HydrophobicContact CZ-CG 4.34Å; W1907-L1918 HydrophobicContact CE3-CD2 4.24Å; W1907-L1918 HydrophobicContact CZ3-CB 4.47Å; W1907-L1918 HydrophobicContact CZ3-CD2 3.82Å; W1907-L1918 HydrophobicContact CZ3-CG 4.36Å; L1910-L1918 HydrophobicContact CD1-CD2 4.28Å; Q1914-L1918 WeakPolarHBondContact O-CB 3.38Å; Q1914-L1918 PolarHBondContact O-N 3.08Å; Q1915-L1918 WeakPolarHBondContact O-CB 3.37Å; Q1915-L1918 PolarHBondContact O-N 3.21Å; D1916-L1918 PolarHBondContact O-N 2.95Å; L1918-N1920 VanDerWaalsContact C-N 3.32Å; L1918-N1920 PolarHBondContact O-N 3.23Å; L1918-T1921 WeakPolarHBondContact CA-OG1 3.28Å; L1918-T1921 CarbonylContact O-C 3.56Å; L1918-T1921 WeakPolarHBondContact O-CA 3.41Å; L1918-T1921 WeakPolarHBondContact O-CB 3.34Å; L1918-T1921 PolarHBondContact O-N 3.18Å; L1918-T1921 VanDerWaalsContact O-N 3.12Å; L1918-T1921 PolarHBondContact O-OG1 2.98Å; L1918-L1922 HydrophobicContact CD1-CD1 4.29Å; L1918-L1922 HydrophobicContact CD1-CG 4.3Å; L1918-L1922 HydrophobicContact CG-CD1 4.3Å; L1918-L1922 HydrophobicContact CG-CG 4.38Å; L1918-L1922 VanDerWaalsContact O-CG 3.32Å; L1918-L1922 WeakPolarHBondContact O-CG 3.33Å; L1918-L1922 PolarHBondContact O-N 3.04Å
1919I84.8Confident82Confident13.4 Ų13.461 Ų617%0.06929%0.288CS..Hα-helixtrans-59.8-48.3174.5-69.4157000110.2W1907 Q1915 D1916 T1921 L1922 E1923 L1961 P1962 L1963W1907-I1919 HydrophobicContact CH2-CD1 3.87Å; W1907-I1919 HydrophobicContact CH2-CG1 3.88Å; W1907-I1919 HydrophobicContact CZ2-CD1 4.3Å; Q1915-I1919 VanDerWaalsContact O-CD1 3.26Å; Q1915-I1919 WeakPolarHBondContact O-CD1 3.25Å; Q1915-I1919 VanDerWaalsContact O-CG1 3.24Å; Q1915-I1919 WeakPolarHBondContact O-CG1 3.38Å; Q1915-I1919 PolarHBondContact O-N 3.32Å; D1916-I1919 PolarHBondContact O-N 3.05Å; I1919-T1921 VanDerWaalsContact C-N 3.29Å; I1919-T1921 PolarHBondContact O-N 3.09Å; I1919-L1922 PolarHBondContact O-N 3.25Å; I1919-L1922 VanDerWaalsContact O-N 3.15Å; I1919-E1923 VanDerWaalsContact O-CB 3.28Å; I1919-E1923 WeakPolarHBondContact O-CB 3.44Å; I1919-E1923 PolarHBondContact O-N 3.08Å; I1919-L1961 HydrophobicContact CD1-CD1 4.37Å; I1919-L1961 HydrophobicContact CG1-CD1 3.6Å; I1919-L1961 HydrophobicContact CG1-CD2 4.4Å; I1919-L1961 HydrophobicContact CG1-CG 4.41Å; I1919-P1962 VanDerWaalsContact CD1-CD 3.45Å; I1919-P1962 HydrophobicContact CD1-CG 3.9Å; I1919-P1962 VanDerWaalsContact CD1-CG 3.45Å; I1919-P1962 HydrophobicContact CG1-CG 4.25Å; I1919-P1962 HydrophobicContact CG2-CG 4.33Å; I1919-L1963 HydrophobicContact CG2-CD2 4.35Å
1920N84.6Confident81.6Confident78.2 Ų78.262.6 Ų62.642%0.41830%0.3SS..Hα-helixtrans-60-35.6177.2-72.8-34.9000111.8D1916 D1917 L1918 R1924D1916-N1920 WeakPolarHBondContact O-CB 3.32Å; D1916-N1920 PolarHBondContact O-N 3.18Å; D1916-N1920 PolarHBondContact O-ND2 3.16Å; D1917-N1920 PolarHBondContact O-N 3.19Å; L1918-N1920 VanDerWaalsContact C-N 3.32Å; L1918-N1920 PolarHBondContact O-N 3.23Å; N1920-R1924 VanDerWaalsContact O-CB 3.25Å; N1920-R1924 WeakPolarHBondContact O-CB 3.24Å; N1920-R1924 PolarHBondContact O-N 3.21Å
1921T84.3Confident81Confident11.4 Ų11.462.7 Ų62.77%0.0730%0.3CS..Hα-helixtrans-68.9-47.6175-44.20000111.3W1850 W1864 D1917 L1918 I1919 E1923 R1924 V1925W1850-T1921 WeakPolarHBondContact O-CG2 3.41Å; W1864-T1921 HydrophobicContact CZ2-CG2 4.15Å; D1917-T1921 WeakPolarHBondContact O-CB 3.34Å; D1917-T1921 VanDerWaalsContact O-CG2 3.31Å; D1917-T1921 WeakPolarHBondContact O-CG2 3.48Å; D1917-T1921 PolarHBondContact O-N 3.32Å; D1917-T1921 PolarHBondContact O-OG1 3.14Å; L1918-T1921 WeakPolarHBondContact CA-OG1 3.28Å; L1918-T1921 CarbonylContact O-C 3.56Å; L1918-T1921 WeakPolarHBondContact O-CA 3.41Å; L1918-T1921 WeakPolarHBondContact O-CB 3.34Å; L1918-T1921 PolarHBondContact O-N 3.18Å; L1918-T1921 VanDerWaalsContact O-N 3.12Å; L1918-T1921 PolarHBondContact O-OG1 2.98Å; I1919-T1921 VanDerWaalsContact C-N 3.29Å; I1919-T1921 PolarHBondContact O-N 3.09Å; T1921-E1923 VanDerWaalsContact C-N 3.33Å; T1921-E1923 PolarHBondContact O-N 3.12Å; T1921-R1924 WeakPolarHBondContact O-CB 3.36Å; T1921-R1924 PolarHBondContact O-N 3.32Å; T1921-V1925 HydrophobicContact CG2-CG2 4.43Å; T1921-V1925 WeakPolarHBondContact O-CB 3.38Å; T1921-V1925 WeakPolarHBondContact O-CG2 3.37Å; T1921-V1925 PolarHBondContact O-N 3.16Å
1922L85.2Confident80.7Confident2.4 Ų2.457.9 Ų57.91%0.01327%0.274CS..Hα-helixtrans-61.5-41.2177-69.5174.2000111.9W1864 F1903 L1918 I1919 V1925 L1926 I1939 L1942 L1961 L1963W1864-L1922 HydrophobicContact CH2-CD2 4.21Å; F1903-L1922 HydrophobicContact CE2-CD1 4.4Å; F1903-L1922 HydrophobicContact CZ-CD1 4.32Å; L1918-L1922 HydrophobicContact CD1-CD1 4.29Å; L1918-L1922 HydrophobicContact CD1-CG 4.3Å; L1918-L1922 HydrophobicContact CG-CD1 4.3Å; L1918-L1922 HydrophobicContact CG-CG 4.38Å; L1918-L1922 VanDerWaalsContact O-CG 3.32Å; L1918-L1922 WeakPolarHBondContact O-CG 3.33Å; L1918-L1922 PolarHBondContact O-N 3.04Å; I1919-L1922 PolarHBondContact O-N 3.25Å; I1919-L1922 VanDerWaalsContact O-N 3.15Å; L1922-V1925 WeakPolarHBondContact O-CB 3.4Å; L1922-V1925 PolarHBondContact O-N 3.05Å; L1922-L1926 VanDerWaalsContact O-CG 3.31Å; L1922-L1926 WeakPolarHBondContact O-CG 3.44Å; L1922-L1926 PolarHBondContact O-N 3.31Å; L1922-I1939 HydrophobicContact CD2-CD1 4.07Å; L1922-I1939 HydrophobicContact CD2-CG1 4.1Å; L1922-I1939 HydrophobicContact CD2-CG2 4.42Å; L1922-L1942 HydrophobicContact CD1-CD2 4.44Å; L1922-L1961 HydrophobicContact CD1-CD1 4.13Å; L1922-L1961 HydrophobicContact CD1-CD2 3.83Å; L1922-L1963 HydrophobicContact CB-CD2 4.36Å
1923E83.8Confident80.4Confident35.2 Ų35.253.9 Ų53.916%0.16427%0.267CS..Hα-helixtrans-64.6-44.6175.5-171.4-177.7-172.500111.5I1919 T1921 V1925 L1926 R1927 L1963 P1964I1919-E1923 VanDerWaalsContact O-CB 3.28Å; I1919-E1923 WeakPolarHBondContact O-CB 3.44Å; I1919-E1923 PolarHBondContact O-N 3.08Å; T1921-E1923 VanDerWaalsContact C-N 3.33Å; T1921-E1923 PolarHBondContact O-N 3.12Å; E1923-V1925 VanDerWaalsContact C-N 3.3Å; E1923-V1925 PolarHBondContact O-N 3.2Å; E1923-L1926 PolarHBondContact O-N 3.03Å; E1923-R1927 VanDerWaalsContact CD-NH2 3.31Å; E1923-R1927 WeakPolarHBondContact O-CG 3.33Å; E1923-R1927 PolarHBondContact O-N 3.03Å; E1923-R1927 VanDerWaalsContact O-N 3.12Å; E1923-R1927 IonicContact OE1-CZ 3.46Å; E1923-R1927 VanDerWaalsContact OE1-CZ 3.27Å; E1923-R1927 IonicContact OE1-NE 2.96Å; E1923-R1927 PolarHBondContact OE1-NE 3.26Å; E1923-R1927 IonicContact OE1-NH1 2.61Å; E1923-R1927 PolarHBondContact OE1-NH1 3.16Å; E1923-R1927 IonicContact OE1-NH2 3.52Å; E1923-R1927 PolarHBondContact OE1-NH2 3.12Å; E1923-R1927 IonicContact OE2-CZ 3.99Å; E1923-R1927 IonicContact OE2-NH2 3.09Å; E1923-L1963 HydrophobicContact CB-CD2 3.85Å; E1923-L1963 HydrophobicContact CG-CD2 4.35Å; E1923-P1964 HydrophobicContact CG-CG 4.42Å; E1923-P1964 WeakPolarHBondContact OE1-CD 3.2Å; E1923-P1964 VanDerWaalsContact OE1-CG 3.28Å; E1923-P1964 WeakPolarHBondContact OE1-CG 3.34Å
1924R83.1Confident80.3Confident162 Ų16251 Ų5161%0.61125%0.254SS*.Hα-helixtrans-58.7-44.6175.1-175.1-177.3-59.2156.84.7111N1920 T1921 L1926 R1927 V1928N1920-R1924 VanDerWaalsContact O-CB 3.25Å; N1920-R1924 WeakPolarHBondContact O-CB 3.24Å; N1920-R1924 PolarHBondContact O-N 3.21Å; T1921-R1924 WeakPolarHBondContact O-CB 3.36Å; T1921-R1924 PolarHBondContact O-N 3.32Å; R1924-L1926 VanDerWaalsContact C-N 3.35Å; R1924-L1926 PolarHBondContact O-N 3.29Å; R1924-R1927 PolarHBondContact O-N 3.3Å; R1924-R1927 VanDerWaalsContact O-N 3.11Å; R1924-V1928 WeakPolarHBondContact O-CG2 3.37Å; R1924-V1928 PolarHBondContact O-N 3.27Å
1925V82.4Confident80.4Confident3.4 Ų3.450.3 Ų50.32%0.02125%0.251CS..Hα-helixtrans-59.5-45.3177.7168.90000111W1861 W1864 T1921 L1922 E1923 R1927 V1928 Q1931 V1935 I1939W1861-V1925 HydrophobicContact CE3-CG1 4.48Å; W1861-V1925 HydrophobicContact CE3-CG2 4.36Å; W1861-V1925 HydrophobicContact CH2-CG2 4.11Å; W1861-V1925 HydrophobicContact CZ3-CB 4.48Å; W1861-V1925 HydrophobicContact CZ3-CG1 4.4Å; W1861-V1925 HydrophobicContact CZ3-CG2 3.64Å; W1864-V1925 HydrophobicContact CH2-CB 4.48Å; W1864-V1925 HydrophobicContact CH2-CG1 4.34Å; W1864-V1925 HydrophobicContact CH2-CG2 3.87Å; W1864-V1925 HydrophobicContact CZ2-CG2 4.17Å; W1864-V1925 HydrophobicContact CZ3-CG1 4.09Å; W1864-V1925 HydrophobicContact CZ3-CG2 4.19Å; T1921-V1925 HydrophobicContact CG2-CG2 4.43Å; T1921-V1925 WeakPolarHBondContact O-CB 3.38Å; T1921-V1925 WeakPolarHBondContact O-CG2 3.37Å; T1921-V1925 PolarHBondContact O-N 3.16Å; L1922-V1925 WeakPolarHBondContact O-CB 3.4Å; L1922-V1925 PolarHBondContact O-N 3.05Å; E1923-V1925 VanDerWaalsContact C-N 3.3Å; E1923-V1925 PolarHBondContact O-N 3.2Å; V1925-R1927 VanDerWaalsContact C-N 3.3Å; V1925-R1927 PolarHBondContact O-N 3.2Å; V1925-V1928 PolarHBondContact O-N 3.14Å; V1925-Q1931 PolarHBondContact O-OE1 3.08Å; V1925-V1935 HydrophobicContact CG1-CG1 4.26Å; V1925-I1939 HydrophobicContact CB-CD1 4.34Å; V1925-I1939 HydrophobicContact CG1-CD1 3.63Å
1926L81.6Confident80.4Confident4.2 Ų4.249.4 Ų49.42%0.02225%0.247CC..Hα-helixtrans-68.1-24.6177.8-71172.3000113.8L1922 E1923 R1924 I1939 L1963 V1967 L1968 R1971L1922-L1926 VanDerWaalsContact O-CG 3.31Å; L1922-L1926 WeakPolarHBondContact O-CG 3.44Å; L1922-L1926 PolarHBondContact O-N 3.31Å; E1923-L1926 PolarHBondContact O-N 3.03Å; R1924-L1926 VanDerWaalsContact C-N 3.35Å; R1924-L1926 PolarHBondContact O-N 3.29Å; L1926-I1939 HydrophobicContact CD1-CG2 3.91Å; L1926-I1939 HydrophobicContact CD2-CB 4.26Å; L1926-I1939 HydrophobicContact CD2-CD1 4.21Å; L1926-I1939 HydrophobicContact CD2-CG2 4.02Å; L1926-I1939 HydrophobicContact CG-CD1 4.38Å; L1926-I1939 HydrophobicContact CG-CG2 4.14Å; L1926-L1963 HydrophobicContact CD1-CD1 3.92Å; L1926-L1963 HydrophobicContact CD1-CD2 4.45Å; L1926-V1967 HydrophobicContact CB-CG1 3.96Å; L1926-V1967 HydrophobicContact CD1-CG1 4.48Å; L1926-L1968 HydrophobicContact CD1-CD2 3.87Å; L1926-R1971 HydrophobicContact CD2-CB 4.47Å; L1926-R1971 HydrophobicContact CD2-CG 4.23Å; L1926-R1971 WeakPolarHBondContact O-CD 3.36Å; L1926-R1971 PolarHBondContact O-NE 2.87Å; L1926-R1971 PolarHBondContact O-NH2 2.84Å; L1926-R1971 VanDerWaalsContact O-NH2 3.08Å
1927R82.3Confident80.5Confident157 Ų15748.8 Ų48.859%0.59224%0.242SC*.Hα-helixtrans-80.3-16.6178.4-73.9178-179.7-169.22.5113.7E1923 R1924 V1925 V1967 R1971E1923-R1927 VanDerWaalsContact CD-NH2 3.31Å; E1923-R1927 WeakPolarHBondContact O-CG 3.33Å; E1923-R1927 PolarHBondContact O-N 3.03Å; E1923-R1927 VanDerWaalsContact O-N 3.12Å; E1923-R1927 IonicContact OE1-CZ 3.46Å; E1923-R1927 VanDerWaalsContact OE1-CZ 3.27Å; E1923-R1927 IonicContact OE1-NE 2.96Å; E1923-R1927 PolarHBondContact OE1-NE 3.26Å; E1923-R1927 IonicContact OE1-NH1 2.61Å; E1923-R1927 PolarHBondContact OE1-NH1 3.16Å; E1923-R1927 IonicContact OE1-NH2 3.52Å; E1923-R1927 PolarHBondContact OE1-NH2 3.12Å; E1923-R1927 IonicContact OE2-CZ 3.99Å; E1923-R1927 IonicContact OE2-NH2 3.09Å; R1924-R1927 PolarHBondContact O-N 3.3Å; R1924-R1927 VanDerWaalsContact O-N 3.11Å; V1925-R1927 VanDerWaalsContact C-N 3.3Å; V1925-R1927 PolarHBondContact O-N 3.2Å; R1927-V1967 HydrophobicContact CG-CG1 4.39Å; R1927-R1971 VanDerWaalsContact C-NH2 3.32Å; R1927-R1971 PolarHBondContact O-NH2 3.06Å; R1927-R1971 VanDerWaalsContact O-NH2 3.1Å
1928V80.9Confident80.5Confident41.2 Ų41.247.2 Ų47.225%0.2523%0.234CC..  trans-67.9125.9-179.1176.90000111W1861 R1924 V1925 D1930 R1971W1861-V1928 HydrophobicContact CH2-CG2 4.37Å; W1861-V1928 HydrophobicContact CZ2-CB 4.44Å; W1861-V1928 HydrophobicContact CZ2-CG1 4.32Å; W1861-V1928 HydrophobicContact CZ2-CG2 4.02Å; R1924-V1928 WeakPolarHBondContact O-CG2 3.37Å; R1924-V1928 PolarHBondContact O-N 3.27Å; V1925-V1928 PolarHBondContact O-N 3.14Å; V1928-D1930 VanDerWaalsContact C-N 3.33Å; V1928-D1930 PolarHBondContact O-N 3Å; V1928-R1971 PolarHBondContact O-NH1 3.2Å; V1928-R1971 VanDerWaalsContact O-NH1 3.11Å; V1928-R1971 PolarHBondContact O-NH2 2.95Å
1929P68.9Low80.5Confident94.6 Ų94.647.2 Ų47.261%0.61424%0.235SC*.THydrogen-bonded Turntrans-65-37.9-175.122.4-31000113.6Q1931 R1971P1929-Q1931 VanDerWaalsContact C-N 3.31Å; P1929-Q1931 PolarHBondContact O-N 3.41Å; P1929-R1971 PolarHBondContact O-NH1 3.23Å; P1929-R1971 PolarHBondContact O-NH2 2.98Å
1930D68.4Low80.5Confident131 Ų13146.6 Ų46.670%0.70123%0.231SC*.THydrogen-bonded Turntrans-101.429-170.9-73-22.5000114.4V1928V1928-D1930 VanDerWaalsContact C-N 3.33Å; V1928-D1930 PolarHBondContact O-N 3Å
1931Q69.3Low80.6Confident12.6 Ų12.645.8 Ų45.86%0.05923%0.227CC..  trans-72.4147.9-179.9-170.5-164.913.500112W1861 V1925 P1929 V1935 R1971W1861-Q1931 HydrophobicContact CG-CG 4.43Å; V1925-Q1931 PolarHBondContact O-OE1 3.08Å; P1929-Q1931 VanDerWaalsContact C-N 3.31Å; P1929-Q1931 PolarHBondContact O-N 3.41Å; Q1931-V1935 HydrophobicContact CG-CB 4.35Å; Q1931-V1935 VanDerWaalsContact NE2-CB 3.31Å; Q1931-R1971 PolarHBondContact O-NH2 3.14Å
1932S74.6Confident80.6Confident0.4 Ų0.445.2 Ų45.20%0.00322%0.224CC..  trans-55.4132.9167.7138.60000113H1858 E1934 V1935 S1936H1858-S1932 WeakPolarHBondContact CD2-CA 3.42Å; H1858-S1932 VanDerWaalsContact CD2-CB 3.49Å; H1858-S1932 WeakPolarHBondContact CD2-CB 3.29Å; H1858-S1932 VanDerWaalsContact CE1-CB 3.45Å; H1858-S1932 WeakPolarHBondContact CE1-CB 3.37Å; H1858-S1932 PolarHBondContact CE1-OG 3.4Å; H1858-S1932 VanDerWaalsContact CE1-OG 3.32Å; H1858-S1932 VanDerWaalsContact NE2-CA 3.28Å; H1858-S1932 WeakPolarHBondContact NE2-CA 3.34Å; H1858-S1932 WeakPolarHBondContact NE2-CB 3.37Å; H1858-S1932 PolarHBondContact NE2-OG 3.06Å; S1932-E1934 PolarHBondContact O-N 2.91Å; S1932-E1934 PolarHBondContact OG-N 3.25Å; S1932-V1935 PolarHBondContact O-N 3.07Å; S1932-V1935 VanDerWaalsContact O-N 3.16Å; S1932-V1935 WeakPolarHBondContact OG-CB 3.39Å; S1932-V1935 WeakPolarHBondContact OG-CG2 3.43Å; S1932-S1936 PolarHBondContact O-N 3.27Å; S1932-S1936 PolarHBondContact O-OG 3.21Å; S1932-S1936 VanDerWaalsContact O-OG 3.05Å
1933P76.4Confident80.6Confident72.4 Ų72.446 Ų4647%0.4723%0.227SC..Hα-helixtrans-61.7-28.7176.125.7-33.5000111.9V1935 S1936 Q1937 N1975P1933-V1935 PolarHBondContact O-N 2.64Å; P1933-S1936 WeakPolarHBondContact CA-OG 3.25Å; P1933-S1936 PolarHBondContact O-N 2.91Å; P1933-S1936 PolarHBondContact O-OG 3.09Å; P1933-S1936 VanDerWaalsContact O-OG 3.09Å; P1933-Q1937 VanDerWaalsContact O-CB 3.29Å; P1933-Q1937 WeakPolarHBondContact O-CB 3.25Å; P1933-Q1937 WeakPolarHBondContact O-CG 3.5Å; P1933-Q1937 PolarHBondContact O-N 3.15Å; P1933-N1975 PolarHBondContact O-ND2 3.13Å
1934E78.9Confident80.4Confident83.4 Ų83.448.1 Ų48.139%0.3924%0.237SC..Hα-helixtrans-61.7-46.8176.9-102.7-171.6173.800111.6Y1212 R1896 S1932 S1936 Q1937 T1938Y1212-E1934 PolarHBondContact OH-OE2 2.67Å; R1896-E1934 IonicContact CZ-OE1 3.51Å; R1896-E1934 IonicContact CZ-OE2 3.29Å; R1896-E1934 IonicContact NE-OE1 3.44Å; R1896-E1934 PolarHBondContact NE-OE1 2.89Å; R1896-E1934 IonicContact NH2-OE1 3.18Å; R1896-E1934 PolarHBondContact NH2-OE1 3.41Å; R1896-E1934 IonicContact NH2-OE2 3.16Å; R1896-E1934 PolarHBondContact NH2-OE2 3.26Å; S1932-E1934 PolarHBondContact O-N 2.91Å; S1932-E1934 PolarHBondContact OG-N 3.25Å; E1934-S1936 PolarHBondContact O-N 2.78Å; E1934-Q1937 PolarHBondContact O-N 3.23Å; E1934-Q1937 VanDerWaalsContact O-N 3.15Å; E1934-T1938 WeakPolarHBondContact O-CB 3.26Å; E1934-T1938 WeakPolarHBondContact O-CG2 3.37Å; E1934-T1938 PolarHBondContact O-N 3.22Å; E1934-T1938 PolarHBondContact O-OG1 3.19Å
1935V83.3Confident80.3Confident0.4 Ų0.442.1 Ų42.10%0.00222%0.216CC..Hα-helixtrans-68.3-45.4-176.6-1770000110.5W1861 W1864 L1865 V1925 Q1931 S1932 P1933 Q1937 T1938 I1939W1861-V1935 HydrophobicContact CB-CG2 4.17Å; W1861-V1935 WeakPolarHBondContact O-CG2 3.27Å; W1864-V1935 HydrophobicContact CE3-CG1 4.09Å; W1864-V1935 HydrophobicContact CZ3-CG1 3.8Å; L1865-V1935 HydrophobicContact CB-CG1 4.47Å; L1865-V1935 HydrophobicContact CB-CG2 4.12Å; L1865-V1935 HydrophobicContact CD2-CB 4.47Å; L1865-V1935 HydrophobicContact CD2-CG1 4.42Å; L1865-V1935 HydrophobicContact CD2-CG2 4.02Å; V1925-V1935 HydrophobicContact CG1-CG1 4.26Å; Q1931-V1935 HydrophobicContact CG-CB 4.35Å; Q1931-V1935 VanDerWaalsContact NE2-CB 3.31Å; S1932-V1935 PolarHBondContact O-N 3.07Å; S1932-V1935 VanDerWaalsContact O-N 3.16Å; S1932-V1935 WeakPolarHBondContact OG-CB 3.39Å; S1932-V1935 WeakPolarHBondContact OG-CG2 3.43Å; P1933-V1935 PolarHBondContact O-N 2.64Å; V1935-Q1937 VanDerWaalsContact C-N 3.3Å; V1935-Q1937 PolarHBondContact O-N 3.19Å; V1935-T1938 WeakPolarHBondContact CA-OG1 3.43Å; V1935-T1938 PolarHBondContact O-N 3.15Å; V1935-T1938 PolarHBondContact O-OG1 2.91Å; V1935-I1939 HydrophobicContact CG1-CD1 4.13Å; V1935-I1939 WeakPolarHBondContact O-CG1 3.3Å; V1935-I1939 PolarHBondContact O-N 3.23Å
1936S83.5Confident80.1Confident0.8 Ų0.842 Ų421%0.00622%0.215CC..Hα-helixtrans-62-39.2174.844.20000111.9S1932 P1933 E1934 T1938 I1939 L1940 R1971 N1975S1932-S1936 PolarHBondContact O-N 3.27Å; S1932-S1936 PolarHBondContact O-OG 3.21Å; S1932-S1936 VanDerWaalsContact O-OG 3.05Å; P1933-S1936 WeakPolarHBondContact CA-OG 3.25Å; P1933-S1936 PolarHBondContact O-N 2.91Å; P1933-S1936 PolarHBondContact O-OG 3.09Å; P1933-S1936 VanDerWaalsContact O-OG 3.09Å; E1934-S1936 PolarHBondContact O-N 2.78Å; S1936-T1938 VanDerWaalsContact C-N 3.33Å; S1936-T1938 PolarHBondContact O-N 3.09Å; S1936-I1939 PolarHBondContact O-N 3.24Å; S1936-L1940 WeakPolarHBondContact O-CB 3.46Å; S1936-L1940 VanDerWaalsContact O-CG 3.25Å; S1936-L1940 WeakPolarHBondContact O-CG 3.35Å; S1936-L1940 PolarHBondContact O-N 2.97Å; S1936-R1971 PolarHBondContact OG-NE 3.02Å; S1936-R1971 PolarHBondContact OG-NH2 3.12Å; S1936-N1975 VanDerWaalsContact CB-ND2 3.29Å; S1936-N1975 WeakPolarHBondContact CB-ND2 3.33Å; S1936-N1975 PolarHBondContact OG-ND2 3.05Å; S1936-N1975 PolarHBondContact OG-OD1 3.29Å
1937Q84.2Confident79.8Confident56 Ų5643.2 Ų43.226%0.26223%0.225SC..Hα-helixtrans-64.5-40175.5-154.752.321.500112.2P1933 E1934 V1935 I1939 L1940 N1941 N1975P1933-Q1937 VanDerWaalsContact O-CB 3.29Å; P1933-Q1937 WeakPolarHBondContact O-CB 3.25Å; P1933-Q1937 WeakPolarHBondContact O-CG 3.5Å; P1933-Q1937 PolarHBondContact O-N 3.15Å; E1934-Q1937 PolarHBondContact O-N 3.23Å; E1934-Q1937 VanDerWaalsContact O-N 3.15Å; V1935-Q1937 VanDerWaalsContact C-N 3.3Å; V1935-Q1937 PolarHBondContact O-N 3.19Å; Q1937-I1939 VanDerWaalsContact C-N 3.34Å; Q1937-I1939 PolarHBondContact O-N 3.12Å; Q1937-L1940 PolarHBondContact O-N 3.1Å; Q1937-N1941 PolarHBondContact NE2-OD1 3.22Å; Q1937-N1941 VanDerWaalsContact NE2-OD1 3.08Å; Q1937-N1941 WeakPolarHBondContact O-CB 3.36Å; Q1937-N1941 PolarHBondContact O-N 2.92Å; Q1937-N1941 PolarHBondContact O-ND2 2.67Å; Q1937-N1941 PolarHBondContact O-OD1 3.17Å; Q1937-N1975 HydrophobicContact CG-CB 4.39Å; Q1937-N1975 PolarHBondContact N-ND2 3.29Å; Q1937-N1975 PolarHBondContact NE2-O 3.2Å; Q1937-N1975 PolarHBondContact OE1-ND2 2.81Å
1938T84.1Confident79.3Confident29 Ų2939.9 Ų39.918%0.17822%0.216CC..Hα-helixtrans-64.1-38.7176.142.40000112.3L1865 F1899 E1934 V1935 S1936 N1941 L1942L1865-T1938 HydrophobicContact CD1-CG2 4.16Å; L1865-T1938 HydrophobicContact CD2-CG2 3.92Å; L1865-T1938 VanDerWaalsContact CD2-OG1 3.32Å; L1865-T1938 WeakPolarHBondContact CD2-OG1 3.45Å; F1899-T1938 HydrophobicContact CD1-CG2 3.47Å; F1899-T1938 VanDerWaalsContact CD1-CG2 3.47Å; F1899-T1938 HydrophobicContact CE1-CG2 3.6Å; F1899-T1938 HydrophobicContact CG-CG2 4.17Å; F1899-T1938 HydrophobicContact CZ-CG2 4.36Å; E1934-T1938 WeakPolarHBondContact O-CB 3.26Å; E1934-T1938 WeakPolarHBondContact O-CG2 3.37Å; E1934-T1938 PolarHBondContact O-N 3.22Å; E1934-T1938 PolarHBondContact O-OG1 3.19Å; V1935-T1938 WeakPolarHBondContact CA-OG1 3.43Å; V1935-T1938 PolarHBondContact O-N 3.15Å; V1935-T1938 PolarHBondContact O-OG1 2.91Å; S1936-T1938 VanDerWaalsContact C-N 3.33Å; S1936-T1938 PolarHBondContact O-N 3.09Å; T1938-N1941 PolarHBondContact O-N 3.11Å; T1938-L1942 WeakPolarHBondContact O-CB 3.33Å; T1938-L1942 PolarHBondContact O-N 3.18Å
1939I86.2Confident78.6Confident2.8 Ų2.839.6 Ų39.61%0.01421%0.213CC..Hα-helixtrans-68.1-41.6175.8-62.5168000110.7L1922 V1925 L1926 V1935 S1936 Q1937 N1941 L1942 E1943 L1963L1922-I1939 HydrophobicContact CD2-CD1 4.07Å; L1922-I1939 HydrophobicContact CD2-CG1 4.1Å; L1922-I1939 HydrophobicContact CD2-CG2 4.42Å; V1925-I1939 HydrophobicContact CB-CD1 4.34Å; V1925-I1939 HydrophobicContact CG1-CD1 3.63Å; L1926-I1939 HydrophobicContact CD1-CG2 3.91Å; L1926-I1939 HydrophobicContact CD2-CB 4.26Å; L1926-I1939 HydrophobicContact CD2-CD1 4.21Å; L1926-I1939 HydrophobicContact CD2-CG2 4.02Å; L1926-I1939 HydrophobicContact CG-CD1 4.38Å; L1926-I1939 HydrophobicContact CG-CG2 4.14Å; V1935-I1939 HydrophobicContact CG1-CD1 4.13Å; V1935-I1939 WeakPolarHBondContact O-CG1 3.3Å; V1935-I1939 PolarHBondContact O-N 3.23Å; S1936-I1939 PolarHBondContact O-N 3.24Å; Q1937-I1939 VanDerWaalsContact C-N 3.34Å; Q1937-I1939 PolarHBondContact O-N 3.12Å; I1939-N1941 VanDerWaalsContact C-N 3.29Å; I1939-N1941 PolarHBondContact O-N 3.08Å; I1939-L1942 WeakPolarHBondContact O-CB 3.33Å; I1939-L1942 PolarHBondContact O-N 3.2Å; I1939-E1943 PolarHBondContact O-N 3.16Å; I1939-L1963 HydrophobicContact CG2-CD1 4.32Å
1940L84.7Confident78.3Confident0 Ų038 Ų380%020%0.199CC..Hα-helixtrans-64.9-32175-68.2172.1000112.6S1936 Q1937 E1944 L1968 A1972 K1980 Y1984S1936-L1940 WeakPolarHBondContact O-CB 3.46Å; S1936-L1940 VanDerWaalsContact O-CG 3.25Å; S1936-L1940 WeakPolarHBondContact O-CG 3.35Å; S1936-L1940 PolarHBondContact O-N 2.97Å; Q1937-L1940 PolarHBondContact O-N 3.1Å; L1940-E1944 WeakPolarHBondContact O-CB 3.34Å; L1940-E1944 PolarHBondContact O-N 3.21Å; L1940-L1968 HydrophobicContact CD2-CB 4.33Å; L1940-L1968 HydrophobicContact CD2-CD2 3.83Å; L1940-A1972 HydrophobicContact CD1-CB 3.98Å; L1940-A1972 HydrophobicContact CD2-CB 4.39Å; L1940-K1980 HydrophobicContact CB-CD 4.22Å; L1940-K1980 PolarHBondContact O-NZ 3.14Å; L1940-K1980 VanDerWaalsContact O-NZ 3.11Å; L1940-Y1984 HydrophobicContact CD2-CE2 3.94Å
1941N85.9Confident77.8Confident60.8 Ų60.839.5 Ų39.533%0.32520%0.199SC..Hα-helixtrans-74.9-34.2173.8-68.3-8.4000111.7N1900 Q1937 T1938 I1939 F1945 K1980N1900-N1941 PolarHBondContact ND2-O 3.22Å; Q1937-N1941 PolarHBondContact NE2-OD1 3.22Å; Q1937-N1941 VanDerWaalsContact NE2-OD1 3.08Å; Q1937-N1941 WeakPolarHBondContact O-CB 3.36Å; Q1937-N1941 PolarHBondContact O-N 2.92Å; Q1937-N1941 PolarHBondContact O-ND2 2.67Å; Q1937-N1941 PolarHBondContact O-OD1 3.17Å; T1938-N1941 PolarHBondContact O-N 3.11Å; I1939-N1941 VanDerWaalsContact C-N 3.29Å; I1939-N1941 PolarHBondContact O-N 3.08Å; N1941-F1945 VanDerWaalsContact O-CB 3.28Å; N1941-F1945 WeakPolarHBondContact O-CB 3.4Å; N1941-F1945 PolarHBondContact O-N 3.13Å; N1941-F1945 VanDerWaalsContact O-N 3.07Å; N1941-K1980 VanDerWaalsContact OD1-CE 3.25Å; N1941-K1980 WeakPolarHBondContact OD1-CE 2.96Å; N1941-K1980 PolarHBondContact OD1-NZ 3.32Å
1942L85.7Confident76.9Confident0.6 Ų0.645.8 Ų45.80%0.00322%0.223CC..Hα-helixtrans-66.5-45.4175.4176.664.9000111.2F1899 N1900 F1903 L1922 T1938 I1939 F1945 M1946F1899-L1942 HydrophobicContact CE1-CB 4.25Å; F1899-L1942 HydrophobicContact CE1-CD1 4.47Å; F1899-L1942 HydrophobicContact CE1-CD2 4Å; F1899-L1942 HydrophobicContact CE1-CG 4.46Å; F1899-L1942 HydrophobicContact CZ-CD2 4.4Å; N1900-L1942 HydrophobicContact CB-CD1 4.46Å; N1900-L1942 WeakPolarHBondContact OD1-CA 3.21Å; F1903-L1942 HydrophobicContact CB-CD1 3.82Å; F1903-L1942 HydrophobicContact CB-CD2 4.46Å; F1903-L1942 HydrophobicContact CD1-CD1 3.71Å; F1903-L1942 HydrophobicContact CD1-CD2 4.07Å; F1903-L1942 HydrophobicContact CD1-CG 4.36Å; F1903-L1942 HydrophobicContact CD2-CD1 4.37Å; F1903-L1942 HydrophobicContact CD2-CD2 3.75Å; F1903-L1942 HydrophobicContact CE1-CD1 4.38Å; F1903-L1942 HydrophobicContact CE1-CD2 4.11Å; F1903-L1942 HydrophobicContact CE2-CD2 3.78Å; F1903-L1942 HydrophobicContact CG-CD1 3.73Å; F1903-L1942 HydrophobicContact CG-CD2 3.89Å; F1903-L1942 HydrophobicContact CG-CG 4.37Å; F1903-L1942 HydrophobicContact CZ-CD2 3.96Å; L1922-L1942 HydrophobicContact CD1-CD2 4.44Å; T1938-L1942 WeakPolarHBondContact O-CB 3.33Å; T1938-L1942 PolarHBondContact O-N 3.18Å; I1939-L1942 WeakPolarHBondContact O-CB 3.33Å; I1939-L1942 PolarHBondContact O-N 3.2Å; L1942-F1945 PolarHBondContact O-N 3.17Å; L1942-M1946 HydrophobicContact CD1-CG 4.26Å; L1942-M1946 HydrophobicContact CD1-SD 4.2Å; L1942-M1946 HydrophobicContact CG-CG 4.46Å; L1942-M1946 HydrophobicContact CG-SD 4.23Å; L1942-M1946 WeakPolarHBondContact O-CB 3.4Å; L1942-M1946 VanDerWaalsContact O-CG 3.31Å; L1942-M1946 WeakPolarHBondContact O-CG 3.39Å; L1942-M1946 PolarHBondContact O-N 3.09Å
1943E83.6Confident75.8Confident17.6 Ų17.647.4 Ų47.48%0.08224%0.235CC..Hα-helixtrans-61.2-47.6178.3-168.7-78.5160.500111.1I1939 F1945 M1946 A1947 L1961 L1968 Y1984I1939-E1943 PolarHBondContact O-N 3.16Å; E1943-F1945 VanDerWaalsContact C-N 3.33Å; E1943-F1945 PolarHBondContact O-N 3.24Å; E1943-M1946 PolarHBondContact O-N 3.34Å; E1943-M1946 VanDerWaalsContact O-N 3.16Å; E1943-A1947 WeakPolarHBondContact O-CB 3.34Å; E1943-A1947 PolarHBondContact O-N 3.28Å; E1943-L1961 HydrophobicContact CB-CD1 4.41Å; E1943-L1968 HydrophobicContact CG-CD1 4.06Å; E1943-L1968 HydrophobicContact CG-CD2 4.47Å; E1943-Y1984 VanDerWaalsContact OE2-CE1 3.23Å; E1943-Y1984 WeakPolarHBondContact OE2-CE1 3.4Å; E1943-Y1984 VanDerWaalsContact OE2-CZ 3.24Å; E1943-Y1984 PolarHBondContact OE2-OH 3.23Å
1944E80.5Confident74.4Confident79 Ų7950.2 Ų50.237%0.36926%0.256SS..Hα-helixtrans-57.5-47174.8176.6-177.4-168.500111.4L1940 M1946 A1947 H1948 K1980L1940-E1944 WeakPolarHBondContact O-CB 3.34Å; L1940-E1944 PolarHBondContact O-N 3.21Å; E1944-M1946 VanDerWaalsContact C-N 3.33Å; E1944-M1946 PolarHBondContact O-N 3.2Å; E1944-A1947 PolarHBondContact O-N 3.21Å; E1944-H1948 PolarHBondContact O-CD2 3.11Å; E1944-H1948 VanDerWaalsContact O-CD2 3.26Å; E1944-H1948 PolarHBondContact O-N 3.1Å; E1944-K1980 VanDerWaalsContact CD-NZ 3.33Å; E1944-K1980 WeakPolarHBondContact OE2-CE 3.4Å; E1944-K1980 IonicContact OE2-NZ 3.26Å; E1944-K1980 PolarHBondContact OE2-NZ 3.19Å
1945F80.2Confident73Confident37.8 Ų37.851.5 Ų51.517%0.16627%0.274CS..Hα-helixtrans-60-44.1178.7-178.9-96.6000111.7V1383 F1394 N1900 L1904 N1941 L1942 E1943 A1947 H1948 M1949V1383-F1945 HydrophobicContact CB-CE2 4.35Å; V1383-F1945 HydrophobicContact CG1-CD2 3.99Å; V1383-F1945 HydrophobicContact CG1-CE2 3.86Å; V1383-F1945 HydrophobicContact CG2-CD2 4.06Å; V1383-F1945 HydrophobicContact CG2-CE2 3.53Å; V1383-F1945 VanDerWaalsContact CG2-CE2 3.47Å; V1383-F1945 HydrophobicContact CG2-CZ 4.16Å; F1394-F1945 HydrophobicContact CE1-CZ 4.12Å; F1394-F1945 HydrophobicContact CZ-CE2 4.24Å; F1394-F1945 AromaticContact CZ-CZ 3.86Å; F1394-F1945 HydrophobicContact CZ-CZ 4.1Å; N1900-F1945 HydrophobicContact CB-CB 4.29Å; N1900-F1945 HydrophobicContact CB-CD1 3.74Å; N1900-F1945 HydrophobicContact CB-CD2 4.23Å; N1900-F1945 HydrophobicContact CB-CE1 4.01Å; N1900-F1945 HydrophobicContact CB-CE2 4.42Å; N1900-F1945 HydrophobicContact CB-CG 3.85Å; N1900-F1945 HydrophobicContact CB-CZ 4.37Å; L1904-F1945 HydrophobicContact CB-CE1 4.19Å; L1904-F1945 HydrophobicContact CD2-CE1 3.9Å; L1904-F1945 HydrophobicContact CD2-CZ 4.37Å; N1941-F1945 VanDerWaalsContact O-CB 3.28Å; N1941-F1945 WeakPolarHBondContact O-CB 3.4Å; N1941-F1945 PolarHBondContact O-N 3.13Å; N1941-F1945 VanDerWaalsContact O-N 3.07Å; L1942-F1945 PolarHBondContact O-N 3.17Å; E1943-F1945 VanDerWaalsContact C-N 3.33Å; E1943-F1945 PolarHBondContact O-N 3.24Å; F1945-A1947 PolarHBondContact O-N 3.36Å; F1945-H1948 PolarHBondContact O-N 3.22Å; F1945-M1949 HydrophobicContact CD1-CG 4.39Å; F1945-M1949 HydrophobicContact CE1-CG 4.21Å; F1945-M1949 HydrophobicContact CZ-CG 4.37Å; F1945-M1949 HydrophobicContact CZ-SD 4.31Å; F1945-M1949 WeakPolarHBondContact O-CB 3.2Å; F1945-M1949 VanDerWaalsContact O-CG 3.29Å; F1945-M1949 WeakPolarHBondContact O-CG 3.26Å; F1945-M1949 PolarHBondContact O-N 3.28Å; F1945-M1949 VanDerWaalsContact O-N 3.13Å
1946M79.1Confident71.2Confident1.4 Ų1.454.1 Ų54.11%0.00729%0.292CS..Hα-helixtrans-66.9-38.2177.1-71.4-174.969.500112.5F1903 W1907 L1942 E1943 E1944 H1948 M1949 D1950 V1959 L1961F1903-M1946 HydrophobicContact CD1-CE 4.5Å; F1903-M1946 HydrophobicContact CD1-SD 3.87Å; F1903-M1946 HydrophobicContact CE1-CE 4.05Å; F1903-M1946 HydrophobicContact CE1-SD 3.49Å; F1903-M1946 VanDerWaalsContact CE1-SD 3.55Å; F1903-M1946 WeakPolarHBondContact CE1-SD 3.34Å; F1903-M1946 HydrophobicContact CZ-SD 4.46Å; W1907-M1946 HydrophobicContact CD2-CE 4.16Å; W1907-M1946 HydrophobicContact CG-CE 4.28Å; W1907-M1946 HydrophobicContact CZ2-CE 4.43Å; L1942-M1946 HydrophobicContact CD1-CG 4.26Å; L1942-M1946 HydrophobicContact CD1-SD 4.2Å; L1942-M1946 HydrophobicContact CG-CG 4.46Å; L1942-M1946 HydrophobicContact CG-SD 4.23Å; L1942-M1946 WeakPolarHBondContact O-CB 3.4Å; L1942-M1946 VanDerWaalsContact O-CG 3.31Å; L1942-M1946 WeakPolarHBondContact O-CG 3.39Å; L1942-M1946 PolarHBondContact O-N 3.09Å; E1943-M1946 PolarHBondContact O-N 3.34Å; E1943-M1946 VanDerWaalsContact O-N 3.16Å; E1944-M1946 VanDerWaalsContact C-N 3.33Å; E1944-M1946 PolarHBondContact O-N 3.2Å; M1946-H1948 VanDerWaalsContact C-N 3.3Å; M1946-H1948 PolarHBondContact O-N 3.16Å; M1946-M1949 WeakPolarHBondContact O-CB 3.36Å; M1946-M1949 PolarHBondContact O-N 3.17Å; M1946-D1950 PolarHBondContact O-N 3.21Å; M1946-D1950 VanDerWaalsContact O-N 3.11Å; M1946-V1959 HydrophobicContact CB-CG1 4.28Å; M1946-V1959 HydrophobicContact CE-CG1 3.75Å; M1946-V1959 VanDerWaalsContact CE-O 3.31Å; M1946-V1959 WeakPolarHBondContact CE-O 3.39Å; M1946-V1959 HydrophobicContact CG-CG1 4.47Å; M1946-L1961 HydrophobicContact CB-CD1 4.26Å; M1946-L1961 HydrophobicContact CE-CB 4.26Å; M1946-L1961 HydrophobicContact CE-CD1 4.05Å; M1946-L1961 HydrophobicContact CE-CG 4.12Å; M1946-L1961 HydrophobicContact CG-CD1 4.35Å; M1946-L1961 HydrophobicContact SD-CB 4.06Å; M1946-L1961 HydrophobicContact SD-CD1 3.92Å; M1946-L1961 WeakPolarHBondContact SD-CD1 3.43Å; M1946-L1961 HydrophobicContact SD-CD2 4.46Å; M1946-L1961 HydrophobicContact SD-CG 4.2Å
1947A74.7Confident69.4Low28.4 Ų28.462.5 Ų62.524%0.23533%0.331CS..Hα-helixtrans-64.3-37.2176.200000112.5E1943 E1944 F1945 M1949E1943-A1947 WeakPolarHBondContact O-CB 3.34Å; E1943-A1947 PolarHBondContact O-N 3.28Å; E1944-A1947 PolarHBondContact O-N 3.21Å; F1945-A1947 PolarHBondContact O-N 3.36Å; A1947-M1949 VanDerWaalsContact C-N 3.3Å; A1947-M1949 PolarHBondContact O-N 2.86Å
1948H72.1Confident67.7Low87.2 Ų87.266.7 Ų66.740%0.40435%0.345SS..Hα-helixtrans-68.1-34.3173.9-83.6-73.6000112.9V1383 E1944 F1945 M1946 D1950 Y1952V1383-H1948 HydrophobicContact CG1-CB 4.45Å; E1944-H1948 PolarHBondContact O-CD2 3.11Å; E1944-H1948 VanDerWaalsContact O-CD2 3.26Å; E1944-H1948 PolarHBondContact O-N 3.1Å; F1945-H1948 PolarHBondContact O-N 3.22Å; M1946-H1948 VanDerWaalsContact C-N 3.3Å; M1946-H1948 PolarHBondContact O-N 3.16Å; H1948-D1950 PolarHBondContact O-N 3.04Å; H1948-Y1952 VanDerWaalsContact O-CD2 3.32Å; H1948-Y1952 WeakPolarHBondContact O-CD2 3.48Å
1949M66.6Low66.3Low35.4 Ų35.465.9 Ų65.917%0.17434%0.34CS..Hα-helixtrans-71.7-31.1-178.6-71.5-57.7-39.500114V1383 W1388 L1904 F1945 M1946 A1947 K1951 Y1952 S1953 V1959V1383-M1949 HydrophobicContact CG1-SD 3.6Å; V1383-M1949 VanDerWaalsContact CG1-SD 3.6Å; V1383-M1949 HydrophobicContact CG2-SD 4.26Å; W1388-M1949 HydrophobicContact CD2-CE 3.37Å; W1388-M1949 HydrophobicContact CD2-SD 4.46Å; W1388-M1949 VanDerWaalsContact CE2-SD 3.54Å; W1388-M1949 HydrophobicContact CE3-CE 3.48Å; W1388-M1949 VanDerWaalsContact CE3-CE 3.48Å; W1388-M1949 HydrophobicContact CG-CE 4.35Å; W1388-M1949 HydrophobicContact CH2-CE 3.11Å; W1388-M1949 HydrophobicContact CH2-CG 4.49Å; W1388-M1949 HydrophobicContact CH2-SD 3.57Å; W1388-M1949 VanDerWaalsContact CH2-SD 3.57Å; W1388-M1949 HydrophobicContact CZ2-CE 2.94Å; W1388-M1949 HydrophobicContact CZ2-CG 4.44Å; W1388-M1949 HydrophobicContact CZ2-SD 3.05Å; W1388-M1949 WeakPolarHBondContact CZ2-SD 3.48Å; W1388-M1949 HydrophobicContact CZ3-CE 3.34Å; W1388-M1949 HydrophobicContact CZ3-SD 4.4Å; L1904-M1949 HydrophobicContact CD1-CG 4.44Å; L1904-M1949 HydrophobicContact CD2-CE 4.18Å; L1904-M1949 HydrophobicContact CD2-CG 4.07Å; L1904-M1949 HydrophobicContact CD2-SD 4.31Å; F1945-M1949 HydrophobicContact CD1-CG 4.39Å; F1945-M1949 HydrophobicContact CE1-CG 4.21Å; F1945-M1949 HydrophobicContact CZ-CG 4.37Å; F1945-M1949 HydrophobicContact CZ-SD 4.31Å; F1945-M1949 WeakPolarHBondContact O-CB 3.2Å; F1945-M1949 VanDerWaalsContact O-CG 3.29Å; F1945-M1949 WeakPolarHBondContact O-CG 3.26Å; F1945-M1949 PolarHBondContact O-N 3.28Å; F1945-M1949 VanDerWaalsContact O-N 3.13Å; M1946-M1949 WeakPolarHBondContact O-CB 3.36Å; M1946-M1949 PolarHBondContact O-N 3.17Å; A1947-M1949 VanDerWaalsContact C-N 3.3Å; A1947-M1949 PolarHBondContact O-N 2.86Å; M1949-K1951 VanDerWaalsContact C-N 3.29Å; M1949-K1951 PolarHBondContact O-N 3.16Å; M1949-Y1952 HydrophobicContact CE-CD2 3.79Å; M1949-Y1952 HydrophobicContact CE-CG 4.43Å; M1949-Y1952 PolarHBondContact O-N 2.94Å; M1949-Y1952 VanDerWaalsContact O-N 3.12Å; M1949-S1953 PolarHBondContact O-N 3.06Å; M1949-S1953 VanDerWaalsContact O-N 3.14Å; M1949-V1959 HydrophobicContact CB-CG1 4.34Å
1950D61.5Low65Low61.8 Ų61.870.2 Ų70.233%0.3336%0.36SS..Hα-helixtrans-60.8-32.5179.4-159.530000112.3M1946 H1948 Y1952 S1953 V1959 H1960M1946-D1950 PolarHBondContact O-N 3.21Å; M1946-D1950 VanDerWaalsContact O-N 3.11Å; H1948-D1950 PolarHBondContact O-N 3.04Å; D1950-Y1952 VanDerWaalsContact C-N 3.26Å; D1950-Y1952 PolarHBondContact O-N 3.02Å; D1950-S1953 PolarHBondContact O-N 3.18Å; D1950-V1959 HydrophobicContact CB-CB 4.33Å; D1950-V1959 HydrophobicContact CB-CG1 4.37Å; D1950-H1960 IonicContact OD2-CE1 2.66Å; D1950-H1960 PolarHBondContact OD2-CE1 3.25Å; D1950-H1960 IonicContact OD2-ND1 3.35Å; D1950-H1960 IonicContact OD2-NE2 3.83Å; D1950-H1960 PolarHBondContact OD2-NE2 3.21Å
1951K57.9Low64.1Low161.8 Ų161.870.6 Ų70.670%0.70336%0.362SS*.THydrogen-bonded Turntrans-61.5-19.4177.7-67.8-176.8-180177.60114.1M1949M1949-K1951 VanDerWaalsContact C-N 3.29Å; M1949-K1951 PolarHBondContact O-N 3.16Å
1952Y51.9Low63.3Low143.8 Ų143.871.4 Ų71.456%0.56437%0.37SS*.THydrogen-bonded Turntrans-115.5-12.1-173.9-62.9-75.7000114W1388 H1948 M1949 D1950 S1954W1388-Y1952 VanDerWaalsContact CE3-CB 3.42Å; W1388-Y1952 HydrophobicContact CE3-CD2 4.09Å; W1388-Y1952 AromaticContact CE3-CG 3.88Å; W1388-Y1952 HydrophobicContact CE3-CG 3.88Å; W1388-Y1952 AromaticContact CH2-CD1 2.88Å; W1388-Y1952 HydrophobicContact CH2-CD1 2.88Å; W1388-Y1952 AromaticContact CH2-CD2 3.52Å; W1388-Y1952 HydrophobicContact CH2-CD2 3.52Å; W1388-Y1952 AromaticContact CH2-CE1 3.45Å; W1388-Y1952 HydrophobicContact CH2-CE1 3.45Å; W1388-Y1952 VanDerWaalsContact CH2-CE1 3.45Å; W1388-Y1952 HydrophobicContact CH2-CE2 4.02Å; W1388-Y1952 AromaticContact CH2-CG 2.88Å; W1388-Y1952 HydrophobicContact CH2-CG 2.88Å; W1388-Y1952 AromaticContact CH2-CZ 3.98Å; W1388-Y1952 AromaticContact CZ2-CD1 3.51Å; W1388-Y1952 HydrophobicContact CZ2-CD1 3.51Å; W1388-Y1952 HydrophobicContact CZ2-CE1 4.32Å; W1388-Y1952 AromaticContact CZ2-CG 3.63Å; W1388-Y1952 HydrophobicContact CZ2-CG 3.63Å; W1388-Y1952 AromaticContact CZ3-CD1 3.54Å; W1388-Y1952 HydrophobicContact CZ3-CD1 3.54Å; W1388-Y1952 AromaticContact CZ3-CD2 3.14Å; W1388-Y1952 HydrophobicContact CZ3-CD2 3.14Å; W1388-Y1952 HydrophobicContact CZ3-CE1 4.1Å; W1388-Y1952 AromaticContact CZ3-CE2 3.79Å; W1388-Y1952 HydrophobicContact CZ3-CE2 3.79Å; W1388-Y1952 AromaticContact CZ3-CG 2.97Å; W1388-Y1952 HydrophobicContact CZ3-CG 2.97Å; H1948-Y1952 VanDerWaalsContact O-CD2 3.32Å; H1948-Y1952 WeakPolarHBondContact O-CD2 3.48Å; M1949-Y1952 HydrophobicContact CE-CD2 3.79Å; M1949-Y1952 HydrophobicContact CE-CG 4.43Å; M1949-Y1952 PolarHBondContact O-N 2.94Å; M1949-Y1952 VanDerWaalsContact O-N 3.12Å; D1950-Y1952 VanDerWaalsContact C-N 3.26Å; D1950-Y1952 PolarHBondContact O-N 3.02Å; Y1952-S1954 PolarHBondContact O-N 3.17Å
1953S50.3Low62.9Low35.2 Ų35.272 Ų7225%0.24637%0.373CS..  trans-98.778.9-178.4-174.20000111.3M1949 D1950 S1955 S1956M1949-S1953 PolarHBondContact O-N 3.06Å; M1949-S1953 VanDerWaalsContact O-N 3.14Å; D1950-S1953 PolarHBondContact O-N 3.18Å; S1953-S1955 PolarHBondContact O-N 3.17Å; S1953-S1955 VanDerWaalsContact O-N 3.09Å; S1953-S1956 VanDerWaalsContact OG-CB 3.26Å; S1953-S1956 WeakPolarHBondContact OG-CB 3.33Å
1954S48.2Very low62.6Low131.8 Ų131.873.5 Ų73.592%0.92239%0.385SS*.THydrogen-bonded Turntrans-64.8-6.3177.3-6.30000114.6Y1952Y1952-S1954 PolarHBondContact O-N 3.17Å
1955S48.7Very low62.6Low110.2 Ų110.271.4 Ų71.477%0.77138%0.376SS*.THydrogen-bonded Turntrans-111.9-7-171.374.20000116S1953S1953-S1955 PolarHBondContact O-N 3.17Å; S1953-S1955 VanDerWaalsContact O-N 3.09Å
1956S46.6Very low62.7Low54.2 Ų54.270.5 Ų70.538%0.37938%0.377SS..  trans-123.6114.1-177.5-165.40000111.7S1953 R1958S1953-S1956 VanDerWaalsContact OG-CB 3.26Å; S1953-S1956 WeakPolarHBondContact OG-CB 3.33Å; S1956-R1958 VanDerWaalsContact C-N 3.27Å; S1956-R1958 PolarHBondContact O-N 3.12Å; S1956-R1958 VanDerWaalsContact O-N 3.15Å
1957H45.3Very low62.9Low177.8 Ų177.872 Ų7282%0.82339%0.386SS*.THydrogen-bonded Turntrans-67.432-175.9-154.2-47.2000112.3
1958R48.6Very low63.4Low143.4 Ų143.470.7 Ų70.754%0.54138%0.375SS..THydrogen-bonded Turntrans-172.170175.9-68.5-171.4-177.9-161.63.5114.7W1907 Y1912 D1916 S1956W1907-R1958 PolarHBondContact NE1-O 3.05Å; W1907-R1958 VanDerWaalsContact NE1-O 3.11Å; Y1912-R1958 VanDerWaalsContact OH-CZ 3.25Å; Y1912-R1958 PolarHBondContact OH-NH1 3.44Å; Y1912-R1958 PolarHBondContact OH-NH2 2.97Å; D1916-R1958 IonicContact OD1-NH1 3.23Å; D1916-R1958 PolarHBondContact OD1-NH1 3.07Å; D1916-R1958 IonicContact OD2-NH1 3.34Å; S1956-R1958 VanDerWaalsContact C-N 3.27Å; S1956-R1958 PolarHBondContact O-N 3.12Å; S1956-R1958 VanDerWaalsContact O-N 3.15Å
1959V54.8Low64Low13.2 Ų13.266.6 Ų66.68%0.0836%0.356CS..  trans-98.5-6.4168.9-171.10000112.1L1904 M1946 M1949 D1950 L1961L1904-V1959 HydrophobicContact CD1-CG1 4.29Å; M1946-V1959 HydrophobicContact CB-CG1 4.28Å; M1946-V1959 HydrophobicContact CE-CG1 3.75Å; M1946-V1959 VanDerWaalsContact CE-O 3.31Å; M1946-V1959 WeakPolarHBondContact CE-O 3.39Å; M1946-V1959 HydrophobicContact CG-CG1 4.47Å; M1949-V1959 HydrophobicContact CB-CG1 4.34Å; D1950-V1959 HydrophobicContact CB-CB 4.33Å; D1950-V1959 HydrophobicContact CB-CG1 4.37Å; V1959-L1961 PolarHBondContact O-N 3.31Å
1960H57.5Low64.8Low93.2 Ų93.268.9 Ų68.943%0.43137%0.37SS..SBendtrans-77.6132.6171.4142-53.4000110.4D1950 P1962D1950-H1960 IonicContact OD2-CE1 2.66Å; D1950-H1960 PolarHBondContact OD2-CE1 3.25Å; D1950-H1960 IonicContact OD2-ND1 3.35Å; D1950-H1960 IonicContact OD2-NE2 3.83Å; D1950-H1960 PolarHBondContact OD2-NE2 3.21Å; H1960-P1962 WeakPolarHBondContact O-CD 3.39Å
1961L67.2Low65.9Low7.2 Ų7.266.8 Ų66.84%0.03836%0.357CS..  trans-77.9111.1167.1-133.793.4000107.5F1903 W1907 I1919 L1922 E1943 M1946 V1959 L1963F1903-L1961 HydrophobicContact CE1-CD2 4.43Å; F1903-L1961 HydrophobicContact CZ-CD1 4.34Å; F1903-L1961 HydrophobicContact CZ-CD2 4.1Å; W1907-L1961 HydrophobicContact CH2-CD1 3.9Å; W1907-L1961 HydrophobicContact CH2-CD2 4.07Å; W1907-L1961 HydrophobicContact CZ2-CD1 4.37Å; W1907-L1961 HydrophobicContact CZ3-CD1 4.35Å; W1907-L1961 HydrophobicContact CZ3-CD2 4.22Å; I1919-L1961 HydrophobicContact CD1-CD1 4.37Å; I1919-L1961 HydrophobicContact CG1-CD1 3.6Å; I1919-L1961 HydrophobicContact CG1-CD2 4.4Å; I1919-L1961 HydrophobicContact CG1-CG 4.41Å; L1922-L1961 HydrophobicContact CD1-CD1 4.13Å; L1922-L1961 HydrophobicContact CD1-CD2 3.83Å; E1943-L1961 HydrophobicContact CB-CD1 4.41Å; M1946-L1961 HydrophobicContact CB-CD1 4.26Å; M1946-L1961 HydrophobicContact CE-CB 4.26Å; M1946-L1961 HydrophobicContact CE-CD1 4.05Å; M1946-L1961 HydrophobicContact CE-CG 4.12Å; M1946-L1961 HydrophobicContact CG-CD1 4.35Å; M1946-L1961 HydrophobicContact SD-CB 4.06Å; M1946-L1961 HydrophobicContact SD-CD1 3.92Å; M1946-L1961 WeakPolarHBondContact SD-CD1 3.43Å; M1946-L1961 HydrophobicContact SD-CD2 4.46Å; M1946-L1961 HydrophobicContact SD-CG 4.2Å; V1959-L1961 PolarHBondContact O-N 3.31Å; L1961-L1963 HydrophobicContact CB-CD1 4.14Å; L1961-L1963 HydrophobicContact CB-CG 4.15Å; L1961-L1963 HydrophobicContact CD2-CD1 3.62Å; L1961-L1963 VanDerWaalsContact CD2-CD1 3.48Å; L1961-L1963 HydrophobicContact CD2-CG 3.85Å; L1961-L1963 HydrophobicContact CG-CD1 4.13Å; L1961-L1963 HydrophobicContact CG-CG 4Å; L1961-L1963 PolarHBondContact O-N 3.31Å
1962P69.2Low67.2Low77.6 Ų77.659.1 Ų59.150%0.50432%0.324SS..  trans-76.567.1-177.332.8-35.1000110.9I1919 H1960I1919-P1962 VanDerWaalsContact CD1-CD 3.45Å; I1919-P1962 HydrophobicContact CD1-CG 3.9Å; I1919-P1962 VanDerWaalsContact CD1-CG 3.45Å; I1919-P1962 HydrophobicContact CG1-CG 4.25Å; I1919-P1962 HydrophobicContact CG2-CG 4.33Å; H1960-P1962 WeakPolarHBondContact O-CD 3.39Å
1963L76Confident68.6Low13.8 Ų13.854.6 Ų54.67%0.07231%0.309CS..  trans-90.3141.7171.7-69172.6000109.9I1919 L1922 E1923 L1926 I1939 L1961 L1965 L1968I1919-L1963 HydrophobicContact CG2-CD2 4.35Å; L1922-L1963 HydrophobicContact CB-CD2 4.36Å; E1923-L1963 HydrophobicContact CB-CD2 3.85Å; E1923-L1963 HydrophobicContact CG-CD2 4.35Å; L1926-L1963 HydrophobicContact CD1-CD1 3.92Å; L1926-L1963 HydrophobicContact CD1-CD2 4.45Å; I1939-L1963 HydrophobicContact CG2-CD1 4.32Å; L1961-L1963 HydrophobicContact CB-CD1 4.14Å; L1961-L1963 HydrophobicContact CB-CG 4.15Å; L1961-L1963 HydrophobicContact CD2-CD1 3.62Å; L1961-L1963 VanDerWaalsContact CD2-CD1 3.48Å; L1961-L1963 HydrophobicContact CD2-CG 3.85Å; L1961-L1963 HydrophobicContact CG-CD1 4.13Å; L1961-L1963 HydrophobicContact CG-CG 4Å; L1961-L1963 PolarHBondContact O-N 3.31Å; L1963-L1965 PolarHBondContact O-N 3.29Å; L1963-L1965 VanDerWaalsContact O-N 3.16Å; L1963-L1968 HydrophobicContact CB-CD1 4.08Å; L1963-L1968 HydrophobicContact CB-CD2 4.32Å; L1963-L1968 HydrophobicContact CB-CG 4.29Å; L1963-L1968 HydrophobicContact CD1-CD2 4.08Å
1964P78.1Confident70.1Confident49.4 Ų49.459.3 Ų59.332%0.32133%0.325SS..  trans-65.1121.6177.914.8-19.7000111.7E1923 G1966 V1967 L1968E1923-P1964 HydrophobicContact CG-CG 4.42Å; E1923-P1964 WeakPolarHBondContact OE1-CD 3.2Å; E1923-P1964 VanDerWaalsContact OE1-CG 3.28Å; E1923-P1964 WeakPolarHBondContact OE1-CG 3.34Å; P1964-G1966 VanDerWaalsContact C-N 3.27Å; P1964-G1966 PolarHBondContact O-N 3.21Å; P1964-G1966 VanDerWaalsContact O-N 3.15Å; P1964-V1967 HydrophobicContact CB-CB 4.41Å; P1964-V1967 HydrophobicContact CB-CG2 4.21Å; P1964-V1967 HydrophobicContact CG-CB 4.05Å; P1964-V1967 HydrophobicContact CG-CG2 3.81Å; P1964-V1967 PolarHBondContact O-N 3.12Å; P1964-L1968 PolarHBondContact O-N 3.34Å
1965L81.2Confident71.5Confident34.4 Ų34.454.4 Ų54.418%0.1829%0.289CS..Hα-helixtrans-51.4-38.9-179.9-72.1163.4000113.2L1963 V1967 L1968 A1969 Y1984 Q1987 E1988 M1991L1963-L1965 PolarHBondContact O-N 3.29Å; L1963-L1965 VanDerWaalsContact O-N 3.16Å; L1965-V1967 VanDerWaalsContact C-N 3.34Å; L1965-V1967 PolarHBondContact O-N 3.34Å; L1965-L1968 PolarHBondContact O-N 3.32Å; L1965-A1969 WeakPolarHBondContact O-CB 3.4Å; L1965-A1969 PolarHBondContact O-N 3.08Å; L1965-Y1984 HydrophobicContact CD2-CD1 3.93Å; L1965-Q1987 HydrophobicContact CD1-CB 4.29Å; L1965-Q1987 HydrophobicContact CD1-CG 4.07Å; L1965-Q1987 HydrophobicContact CD2-CB 4.34Å; L1965-Q1987 HydrophobicContact CD2-CG 4.23Å; L1965-E1988 HydrophobicContact CB-CB 4.46Å; L1965-M1991 HydrophobicContact CD1-CE 3.84Å; L1965-M1991 VanDerWaalsContact CD1-CE 3.48Å; L1965-M1991 HydrophobicContact CD1-SD 3.56Å; L1965-M1991 VanDerWaalsContact CD1-SD 3.55Å; L1965-M1991 WeakPolarHBondContact CD1-SD 3.47Å
1966G81.1Confident73Confident18.6 Ų18.656 Ų5619%0.19228%0.278CS..Hα-helixtrans-61.2-39.8177.900000113.3P1964 A1969 D1970P1964-G1966 VanDerWaalsContact C-N 3.27Å; P1964-G1966 PolarHBondContact O-N 3.21Å; P1964-G1966 VanDerWaalsContact O-N 3.15Å; G1966-A1969 PolarHBondContact O-N 3.11Å; G1966-D1970 WeakPolarHBondContact O-CB 3.34Å; G1966-D1970 VanDerWaalsContact O-CG 3.26Å; G1966-D1970 PolarHBondContact O-N 2.95Å
1967V83.5Confident74.6Confident33.6 Ų33.654.3 Ų54.320%0.20427%0.267CS..Hα-helixtrans-70.4-39.9178.4179.10000110.7L1926 R1927 P1964 L1965 D1970 R1971L1926-V1967 HydrophobicContact CB-CG1 3.96Å; L1926-V1967 HydrophobicContact CD1-CG1 4.48Å; R1927-V1967 HydrophobicContact CG-CG1 4.39Å; P1964-V1967 HydrophobicContact CB-CB 4.41Å; P1964-V1967 HydrophobicContact CB-CG2 4.21Å; P1964-V1967 HydrophobicContact CG-CB 4.05Å; P1964-V1967 HydrophobicContact CG-CG2 3.81Å; P1964-V1967 PolarHBondContact O-N 3.12Å; L1965-V1967 VanDerWaalsContact C-N 3.34Å; L1965-V1967 PolarHBondContact O-N 3.34Å; V1967-D1970 PolarHBondContact O-N 2.76Å; V1967-R1971 VanDerWaalsContact O-CB 3.29Å; V1967-R1971 WeakPolarHBondContact O-CB 3.37Å; V1967-R1971 VanDerWaalsContact O-CG 3.27Å; V1967-R1971 WeakPolarHBondContact O-CG 3.26Å; V1967-R1971 PolarHBondContact O-N 3.15Å; V1967-R1971 VanDerWaalsContact O-N 3.08Å
1968L85.2Confident76.5Confident1 Ų147.8 Ų47.81%0.00524%0.235CC..Hα-helixtrans-62.6-45.7175.4-66.1172.6000111.2L1926 L1940 E1943 L1963 P1964 L1965 R1971 A1972 Y1984L1926-L1968 HydrophobicContact CD1-CD2 3.87Å; L1940-L1968 HydrophobicContact CD2-CB 4.33Å; L1940-L1968 HydrophobicContact CD2-CD2 3.83Å; E1943-L1968 HydrophobicContact CG-CD1 4.06Å; E1943-L1968 HydrophobicContact CG-CD2 4.47Å; L1963-L1968 HydrophobicContact CB-CD1 4.08Å; L1963-L1968 HydrophobicContact CB-CD2 4.32Å; L1963-L1968 HydrophobicContact CB-CG 4.29Å; L1963-L1968 HydrophobicContact CD1-CD2 4.08Å; P1964-L1968 PolarHBondContact O-N 3.34Å; L1965-L1968 PolarHBondContact O-N 3.32Å; L1968-R1971 PolarHBondContact O-N 3.1Å; L1968-A1972 VanDerWaalsContact O-CB 3.25Å; L1968-A1972 WeakPolarHBondContact O-CB 3.33Å; L1968-A1972 PolarHBondContact O-N 3.13Å; L1968-Y1984 HydrophobicContact CB-CD1 4.32Å; L1968-Y1984 HydrophobicContact CB-CD2 3.86Å; L1968-Y1984 HydrophobicContact CB-CE1 4.42Å; L1968-Y1984 HydrophobicContact CB-CE2 3.99Å; L1968-Y1984 HydrophobicContact CB-CG 4.05Å; L1968-Y1984 HydrophobicContact CD1-CD1 4.29Å; L1968-Y1984 HydrophobicContact CD1-CE1 4Å
1969A84Confident78.2Confident0.6 Ų0.644.4 Ų44.41%0.00524%0.238CC..Hα-helixtrans-62.4-47.5178.800000112.3L1965 G1966 R1971 A1972 L1973 K1985L1965-A1969 WeakPolarHBondContact O-CB 3.4Å; L1965-A1969 PolarHBondContact O-N 3.08Å; G1966-A1969 PolarHBondContact O-N 3.11Å; A1969-R1971 VanDerWaalsContact C-N 3.32Å; A1969-R1971 PolarHBondContact O-N 3.25Å; A1969-A1972 PolarHBondContact O-N 3.13Å; A1969-L1973 WeakPolarHBondContact O-CB 3.31Å; A1969-L1973 PolarHBondContact O-N 3.28Å; A1969-K1985 HydrophobicContact CB-CB 4.4Å; A1969-K1985 HydrophobicContact CB-CD 3.62Å; A1969-K1985 VanDerWaalsContact CB-CD 3.49Å; A1969-K1985 VanDerWaalsContact CB-CE 3.44Å; A1969-K1985 HydrophobicContact CB-CG 3.83Å
1970D84.1Confident79.6Confident84 Ų8445.3 Ų45.345%0.44924%0.241SC..Hα-helixtrans-65.5-37.6-179.8-72.3-5.5000111.6G1966 V1967 L1973 K1974 K1985G1966-D1970 WeakPolarHBondContact O-CB 3.34Å; G1966-D1970 VanDerWaalsContact O-CG 3.26Å; G1966-D1970 PolarHBondContact O-N 2.95Å; V1967-D1970 PolarHBondContact O-N 2.76Å; D1970-L1973 PolarHBondContact O-N 3.24Å; D1970-K1974 WeakPolarHBondContact O-CG 3.37Å; D1970-K1974 PolarHBondContact O-N 2.91Å; D1970-K1974 VanDerWaalsContact O-N 3.11Å; D1970-K1985 IonicContact OD1-NZ 3.3Å; D1970-K1985 PolarHBondContact OD1-NZ 3.08Å; D1970-K1985 VanDerWaalsContact OD1-NZ 3.14Å
1971R84Confident81Confident18 Ų1840.9 Ų40.97%0.06822%0.22CC..Hα-helixtrans-72-41.2175.9-12930.8-175.7174.78.3112.2L1926 R1927 V1928 P1929 Q1931 S1936 V1967 L1968 A1969 L1973 K1974 N1975L1926-R1971 HydrophobicContact CD2-CB 4.47Å; L1926-R1971 HydrophobicContact CD2-CG 4.23Å; L1926-R1971 WeakPolarHBondContact O-CD 3.36Å; L1926-R1971 PolarHBondContact O-NE 2.87Å; L1926-R1971 PolarHBondContact O-NH2 2.84Å; L1926-R1971 VanDerWaalsContact O-NH2 3.08Å; R1927-R1971 VanDerWaalsContact C-NH2 3.32Å; R1927-R1971 PolarHBondContact O-NH2 3.06Å; R1927-R1971 VanDerWaalsContact O-NH2 3.1Å; V1928-R1971 PolarHBondContact O-NH1 3.2Å; V1928-R1971 VanDerWaalsContact O-NH1 3.11Å; V1928-R1971 PolarHBondContact O-NH2 2.95Å; P1929-R1971 PolarHBondContact O-NH1 3.23Å; P1929-R1971 PolarHBondContact O-NH2 2.98Å; Q1931-R1971 PolarHBondContact O-NH2 3.14Å; S1936-R1971 PolarHBondContact OG-NE 3.02Å; S1936-R1971 PolarHBondContact OG-NH2 3.12Å; V1967-R1971 VanDerWaalsContact O-CB 3.29Å; V1967-R1971 WeakPolarHBondContact O-CB 3.37Å; V1967-R1971 VanDerWaalsContact O-CG 3.27Å; V1967-R1971 WeakPolarHBondContact O-CG 3.26Å; V1967-R1971 PolarHBondContact O-N 3.15Å; V1967-R1971 VanDerWaalsContact O-N 3.08Å; L1968-R1971 PolarHBondContact O-N 3.1Å; A1969-R1971 VanDerWaalsContact C-N 3.32Å; A1969-R1971 PolarHBondContact O-N 3.25Å; R1971-L1973 VanDerWaalsContact C-N 3.27Å; R1971-L1973 PolarHBondContact O-N 3.25Å; R1971-K1974 PolarHBondContact O-N 3.07Å; R1971-N1975 WeakPolarHBondContact O-CB 3.34Å; R1971-N1975 VanDerWaalsContact O-CG 3.27Å; R1971-N1975 PolarHBondContact O-N 3.16Å; R1971-N1975 PolarHBondContact O-OD1 3.05Å
1972A85.3Confident82Confident0 Ų041.7 Ų41.70%023%0.225CC..Hα-helixtrans-60.3-39173.700000111.4L1940 L1968 A1969 N1975 R1976 A1977 K1980 A1981 Y1984L1940-A1972 HydrophobicContact CD1-CB 3.98Å; L1940-A1972 HydrophobicContact CD2-CB 4.39Å; L1968-A1972 VanDerWaalsContact O-CB 3.25Å; L1968-A1972 WeakPolarHBondContact O-CB 3.33Å; L1968-A1972 PolarHBondContact O-N 3.13Å; A1969-A1972 PolarHBondContact O-N 3.13Å; A1972-N1975 CarbonylContact O-C 3.58Å; A1972-N1975 PolarHBondContact O-N 3.23Å; A1972-R1976 PolarHBondContact O-N 3.27Å; A1972-A1977 HydrophobicContact CB-CB 4.43Å; A1972-A1977 PolarHBondContact O-N 3.28Å; A1972-K1980 HydrophobicContact CB-CB 4.14Å; A1972-A1981 HydrophobicContact CB-CB 3.77Å; A1972-Y1984 HydrophobicContact CB-CD2 4.42Å
1973L82.6Confident82.8Confident49.4 Ų49.443.6 Ų43.626%0.25922%0.223SC..Hα-helixtrans-64.5-43.7175.4-168.4143.5000111.7A1969 D1970 R1971 N1975 R1976 Y1978 A1981 I2010A1969-L1973 WeakPolarHBondContact O-CB 3.31Å; A1969-L1973 PolarHBondContact O-N 3.28Å; D1970-L1973 PolarHBondContact O-N 3.24Å; R1971-L1973 VanDerWaalsContact C-N 3.27Å; R1971-L1973 PolarHBondContact O-N 3.25Å; L1973-N1975 VanDerWaalsContact C-N 3.33Å; L1973-N1975 PolarHBondContact O-N 3.33Å; L1973-R1976 PolarHBondContact O-N 3.2Å; L1973-R1976 VanDerWaalsContact O-N 3.13Å; L1973-Y1978 HydrophobicContact CD1-CD1 4.4Å; L1973-Y1978 HydrophobicContact CD1-CE1 4.49Å; L1973-A1981 HydrophobicContact CB-CB 4.25Å; L1973-A1981 HydrophobicContact CD1-CB 4.46Å; L1973-I2010 HydrophobicContact CD1-CD1 4.26Å; L1973-I2010 HydrophobicContact CD1-CG1 3.81Å; L1973-I2010 VanDerWaalsContact CD1-CG1 3.46Å
1974K81.6Confident83.4Confident134.6 Ų134.643.1 Ų43.159%0.58522%0.22SC*.Hα-helixtrans-64.2-38.9174.9-74.3178.9-179.4-177.90112.7D1970 R1971 R1976D1970-K1974 WeakPolarHBondContact O-CG 3.37Å; D1970-K1974 PolarHBondContact O-N 2.91Å; D1970-K1974 VanDerWaalsContact O-N 3.11Å; R1971-K1974 PolarHBondContact O-N 3.07Å; K1974-R1976 PolarHBondContact O-N 3.13Å; K1974-R1976 VanDerWaalsContact O-N 3.17Å
1975N78Confident83.8Confident28.8 Ų28.841.4 Ų41.415%0.15421%0.207CC..THydrogen-bonded Turntrans-74.41.2176.5-76.69.9000113.9P1933 S1936 Q1937 R1971 A1972 L1973 A1977P1933-N1975 PolarHBondContact O-ND2 3.13Å; S1936-N1975 VanDerWaalsContact CB-ND2 3.29Å; S1936-N1975 WeakPolarHBondContact CB-ND2 3.33Å; S1936-N1975 PolarHBondContact OG-ND2 3.05Å; S1936-N1975 PolarHBondContact OG-OD1 3.29Å; Q1937-N1975 HydrophobicContact CG-CB 4.39Å; Q1937-N1975 PolarHBondContact N-ND2 3.29Å; Q1937-N1975 PolarHBondContact NE2-O 3.2Å; Q1937-N1975 PolarHBondContact OE1-ND2 2.81Å; R1971-N1975 WeakPolarHBondContact O-CB 3.34Å; R1971-N1975 VanDerWaalsContact O-CG 3.27Å; R1971-N1975 PolarHBondContact O-N 3.16Å; R1971-N1975 PolarHBondContact O-OD1 3.05Å; A1972-N1975 CarbonylContact O-C 3.58Å; A1972-N1975 PolarHBondContact O-N 3.23Å; L1973-N1975 VanDerWaalsContact C-N 3.33Å; L1973-N1975 PolarHBondContact O-N 3.33Å; N1975-A1977 HydrophobicContact CB-CB 4.49Å; N1975-A1977 PolarHBondContact O-N 3.27Å; N1975-A1977 VanDerWaalsContact O-N 3.16Å
1976R80.3Confident84.1Confident143.6 Ų143.643.1 Ų43.154%0.54221%0.214SC..THydrogen-bonded Turntrans59.919-174.2-52.8175.4176.8-173.21.4113.8A1972 L1973 K1974 Y1978 A2172 E2176A1972-R1976 PolarHBondContact O-N 3.27Å; L1973-R1976 PolarHBondContact O-N 3.2Å; L1973-R1976 VanDerWaalsContact O-N 3.13Å; K1974-R1976 PolarHBondContact O-N 3.13Å; K1974-R1976 VanDerWaalsContact O-N 3.17Å; R1976-Y1978 VanDerWaalsContact C-N 3.28Å; R1976-Y1978 HydrophobicContact CB-CE2 4.17Å; R1976-Y1978 WeakPolarHBondContact O-CD2 3.45Å; R1976-Y1978 PolarHBondContact O-N 3.13Å; R1976-Y1978 VanDerWaalsContact O-N 3.08Å; R1976-A2172 PolarHBondContact NH1-O 3.36Å; R1976-E2176 WeakPolarHBondContact CD-OE1 3.49Å; R1976-E2176 WeakPolarHBondContact CG-OE1 3.36Å; R1976-E2176 IonicContact CZ-OE1 3.15Å; R1976-E2176 VanDerWaalsContact CZ-OE1 3.32Å; R1976-E2176 IonicContact NE-OE1 2.66Å; R1976-E2176 PolarHBondContact NE-OE1 2.91Å; R1976-E2176 VanDerWaalsContact NE-OE1 3.16Å; R1976-E2176 IonicContact NH1-OE1 2.69Å; R1976-E2176 PolarHBondContact NH1-OE1 3.1Å
1977A80.2Confident84.3Confident18.2 Ų18.245 Ų4515%0.1522%0.218CC..  trans-83.765.8172.800000110A1972 N1975 A1979 K1980 A1981A1972-A1977 HydrophobicContact CB-CB 4.43Å; A1972-A1977 PolarHBondContact O-N 3.28Å; N1975-A1977 HydrophobicContact CB-CB 4.49Å; N1975-A1977 PolarHBondContact O-N 3.27Å; N1975-A1977 VanDerWaalsContact O-N 3.16Å; A1977-A1979 VanDerWaalsContact C-N 3.29Å; A1977-A1979 PolarHBondContact O-N 3.07Å; A1977-K1980 HydrophobicContact CB-CB 4.34Å; A1977-K1980 HydrophobicContact CB-CD 4.4Å; A1977-K1980 HydrophobicContact CB-CG 4.48Å; A1977-K1980 PolarHBondContact O-N 3.04Å; A1977-K1980 VanDerWaalsContact O-N 3.15Å; A1977-A1981 PolarHBondContact O-N 3.28Å
1978Y84.3Confident84.3Confident41.2 Ų41.245.3 Ų45.316%0.16222%0.217CC..Hα-helixtrans-60.8-32.8-170.3-59.3-61.3000114L1973 R1976 A1981 L1982 K2013 L2014 R2180L1973-Y1978 HydrophobicContact CD1-CD1 4.4Å; L1973-Y1978 HydrophobicContact CD1-CE1 4.49Å; R1976-Y1978 VanDerWaalsContact C-N 3.28Å; R1976-Y1978 HydrophobicContact CB-CE2 4.17Å; R1976-Y1978 WeakPolarHBondContact O-CD2 3.45Å; R1976-Y1978 PolarHBondContact O-N 3.13Å; R1976-Y1978 VanDerWaalsContact O-N 3.08Å; Y1978-A1981 PolarHBondContact O-N 2.97Å; Y1978-L1982 VanDerWaalsContact O-CB 3.28Å; Y1978-L1982 WeakPolarHBondContact O-CB 3.4Å; Y1978-L1982 PolarHBondContact O-N 3.21Å; Y1978-K2013 HydrophobicContact CD1-CB 3.98Å; Y1978-K2013 HydrophobicContact CD1-CD 4.17Å; Y1978-K2013 HydrophobicContact CD1-CG 4.38Å; Y1978-K2013 HydrophobicContact CD2-CB 4.42Å; Y1978-K2013 HydrophobicContact CE1-CB 3.83Å; Y1978-K2013 HydrophobicContact CE1-CD 4.07Å; Y1978-K2013 HydrophobicContact CE1-CG 4.02Å; Y1978-K2013 HydrophobicContact CE2-CB 4.33Å; Y1978-K2013 HydrophobicContact CG-CB 4.28Å; Y1978-L2014 VanDerWaalsContact CB-CD2 3.5Å; Y1978-L2014 HydrophobicContact CG-CD1 4.43Å; Y1978-L2014 HydrophobicContact CG-CD2 4.44Å; Y1978-R2180 PolarHBondContact OH-NH1 3.14Å; Y1978-R2180 PolarHBondContact OH-NH2 2.96Å
1979A83.3Confident84.2Confident72.6 Ų72.647.3 Ų47.360%0.623%0.226SC*.Hα-helixtrans-65.4-42.8176.900000112.2A1977 L1982 Y1983A1977-A1979 VanDerWaalsContact C-N 3.29Å; A1977-A1979 PolarHBondContact O-N 3.07Å; A1979-L1982 WeakPolarHBondContact O-CB 3.36Å; A1979-L1982 PolarHBondContact O-N 3.16Å; A1979-Y1983 PolarHBondContact O-N 3.15Å
1980K84.1Confident84.3Confident31.4 Ų31.451.9 Ų51.914%0.13725%0.25CS..Hα-helixtrans-67.3-43.9174.3-65-171.7173.8-138.80111L1940 N1941 E1944 A1972 A1977 L1982 Y1983 Y1984L1940-K1980 HydrophobicContact CB-CD 4.22Å; L1940-K1980 PolarHBondContact O-NZ 3.14Å; L1940-K1980 VanDerWaalsContact O-NZ 3.11Å; N1941-K1980 VanDerWaalsContact OD1-CE 3.25Å; N1941-K1980 WeakPolarHBondContact OD1-CE 2.96Å; N1941-K1980 PolarHBondContact OD1-NZ 3.32Å; E1944-K1980 VanDerWaalsContact CD-NZ 3.33Å; E1944-K1980 WeakPolarHBondContact OE2-CE 3.4Å; E1944-K1980 IonicContact OE2-NZ 3.26Å; E1944-K1980 PolarHBondContact OE2-NZ 3.19Å; A1972-K1980 HydrophobicContact CB-CB 4.14Å; A1977-K1980 HydrophobicContact CB-CB 4.34Å; A1977-K1980 HydrophobicContact CB-CD 4.4Å; A1977-K1980 HydrophobicContact CB-CG 4.48Å; A1977-K1980 PolarHBondContact O-N 3.04Å; A1977-K1980 VanDerWaalsContact O-N 3.15Å; K1980-L1982 VanDerWaalsContact C-N 3.28Å; K1980-L1982 PolarHBondContact O-N 3.26Å; K1980-Y1983 PolarHBondContact O-N 3.23Å; K1980-Y1984 HydrophobicContact CB-CD2 4.4Å; K1980-Y1984 HydrophobicContact CB-CE2 3.97Å; K1980-Y1984 WeakPolarHBondContact O-CD2 3.32Å; K1980-Y1984 PolarHBondContact O-N 3.1Å
1981A87.4Confident84.1Confident0 Ų051.8 Ų51.80%025%0.248CC..Hα-helixtrans-58.6-41.3176.300000111.5A1972 L1973 A1977 Y1978 K1985 I2010A1972-A1981 HydrophobicContact CB-CB 3.77Å; L1973-A1981 HydrophobicContact CB-CB 4.25Å; L1973-A1981 HydrophobicContact CD1-CB 4.46Å; A1977-A1981 PolarHBondContact O-N 3.28Å; Y1978-A1981 PolarHBondContact O-N 2.97Å; A1981-K1985 VanDerWaalsContact O-CB 3.27Å; A1981-K1985 WeakPolarHBondContact O-CB 3.42Å; A1981-K1985 WeakPolarHBondContact O-CG 3.23Å; A1981-K1985 PolarHBondContact O-N 3.32Å; A1981-I2010 HydrophobicContact CB-CD1 4Å; A1981-I2010 HydrophobicContact CB-CG1 4.36Å
1982L88.4Confident83.9Confident25.2 Ų25.252.4 Ų52.413%0.13225%0.252CS..Hα-helixtrans-60.4-53.1175-177.771.3000110.7Y1978 A1979 K1980 Y1984 K1985 E1986 L2007 I2010 Y2011 L2014Y1978-L1982 VanDerWaalsContact O-CB 3.28Å; Y1978-L1982 WeakPolarHBondContact O-CB 3.4Å; Y1978-L1982 PolarHBondContact O-N 3.21Å; A1979-L1982 WeakPolarHBondContact O-CB 3.36Å; A1979-L1982 PolarHBondContact O-N 3.16Å; K1980-L1982 VanDerWaalsContact C-N 3.28Å; K1980-L1982 PolarHBondContact O-N 3.26Å; L1982-Y1984 PolarHBondContact O-N 3.14Å; L1982-K1985 PolarHBondContact O-N 3Å; L1982-K1985 VanDerWaalsContact O-N 3.16Å; L1982-E1986 HydrophobicContact CD1-CG 4.01Å; L1982-E1986 WeakPolarHBondContact CD1-OE1 3.43Å; L1982-E1986 WeakPolarHBondContact CD2-OE1 3.37Å; L1982-E1986 HydrophobicContact CG-CG 4.24Å; L1982-E1986 WeakPolarHBondContact O-CB 3.34Å; L1982-E1986 WeakPolarHBondContact O-CG 3.36Å; L1982-E1986 PolarHBondContact O-N 3.16Å; L1982-L2007 HydrophobicContact CD1-CD1 3.99Å; L1982-L2007 HydrophobicContact CD1-CD2 3.94Å; L1982-I2010 HydrophobicContact CB-CG2 3.77Å; L1982-I2010 HydrophobicContact CD1-CG2 3.96Å; L1982-I2010 HydrophobicContact CG-CG2 4.43Å; L1982-Y2011 HydrophobicContact CD1-CD1 3.9Å; L1982-Y2011 HydrophobicContact CD1-CE1 3.39Å; L1982-Y2011 HydrophobicContact CD1-CE2 4.28Å; L1982-Y2011 HydrophobicContact CD1-CG 4.36Å; L1982-Y2011 HydrophobicContact CD2-CD1 4.46Å; L1982-Y2011 HydrophobicContact CD2-CE1 3.88Å; L1982-Y2011 HydrophobicContact CG-CE1 4.34Å; L1982-L2014 HydrophobicContact CB-CD1 4.29Å; L1982-L2014 HydrophobicContact CD1-CD1 4.02Å; L1982-L2014 HydrophobicContact CD2-CD1 3.88Å
1983Y86.9Confident83.3Confident117 Ų11754.3 Ų54.346%0.45927%0.265SS..Hα-helixtrans-55.2-49.9179.5175.6-103.1000112.3A1979 K1980 K1985 E1986 Q1987A1979-Y1983 PolarHBondContact O-N 3.15Å; K1980-Y1983 PolarHBondContact O-N 3.23Å; Y1983-K1985 VanDerWaalsContact C-N 3.33Å; Y1983-K1985 PolarHBondContact O-N 3.23Å; Y1983-E1986 PolarHBondContact O-N 3.12Å; Y1983-Q1987 HydrophobicContact CE1-CG 4.29Å; Y1983-Q1987 HydrophobicContact CE2-CG 4.29Å; Y1983-Q1987 WeakPolarHBondContact O-CB 3.43Å; Y1983-Q1987 WeakPolarHBondContact O-CG 3.28Å; Y1983-Q1987 PolarHBondContact O-N 3.36Å; Y1983-Q1987 PolarHBondContact OH-NE2 3.18Å
1984Y87.4Confident83Confident3.8 Ų3.859.6 Ų59.62%0.01529%0.288CS..Hα-helixtrans-65.3-38179.7-62.1-52000112.5L1940 E1943 L1965 L1968 A1972 K1980 L1982 Q1987 E1988L1940-Y1984 HydrophobicContact CD2-CE2 3.94Å; E1943-Y1984 VanDerWaalsContact OE2-CE1 3.23Å; E1943-Y1984 WeakPolarHBondContact OE2-CE1 3.4Å; E1943-Y1984 VanDerWaalsContact OE2-CZ 3.24Å; E1943-Y1984 PolarHBondContact OE2-OH 3.23Å; L1965-Y1984 HydrophobicContact CD2-CD1 3.93Å; L1968-Y1984 HydrophobicContact CB-CD1 4.32Å; L1968-Y1984 HydrophobicContact CB-CD2 3.86Å; L1968-Y1984 HydrophobicContact CB-CE1 4.42Å; L1968-Y1984 HydrophobicContact CB-CE2 3.99Å; L1968-Y1984 HydrophobicContact CB-CG 4.05Å; L1968-Y1984 HydrophobicContact CD1-CD1 4.29Å; L1968-Y1984 HydrophobicContact CD1-CE1 4Å; A1972-Y1984 HydrophobicContact CB-CD2 4.42Å; K1980-Y1984 HydrophobicContact CB-CD2 4.4Å; K1980-Y1984 HydrophobicContact CB-CE2 3.97Å; K1980-Y1984 WeakPolarHBondContact O-CD2 3.32Å; K1980-Y1984 PolarHBondContact O-N 3.1Å; L1982-Y1984 PolarHBondContact O-N 3.14Å; Y1984-Q1987 PolarHBondContact O-N 3.17Å; Y1984-E1988 WeakPolarHBondContact O-CB 3.26Å; Y1984-E1988 PolarHBondContact O-N 3.08Å
1985K86.3Confident82.5Confident13.4 Ų13.461 Ų616%0.05829%0.294CS..Hα-helixtrans-72.4-34176.6-88.1-36.4-170.7-178.20112.9A1969 D1970 A1981 L1982 Y1983 E1988 F1989 T2003 S2006 L2007 I2010A1969-K1985 HydrophobicContact CB-CB 4.4Å; A1969-K1985 HydrophobicContact CB-CD 3.62Å; A1969-K1985 VanDerWaalsContact CB-CD 3.49Å; A1969-K1985 VanDerWaalsContact CB-CE 3.44Å; A1969-K1985 HydrophobicContact CB-CG 3.83Å; D1970-K1985 IonicContact OD1-NZ 3.3Å; D1970-K1985 PolarHBondContact OD1-NZ 3.08Å; D1970-K1985 VanDerWaalsContact OD1-NZ 3.14Å; A1981-K1985 VanDerWaalsContact O-CB 3.27Å; A1981-K1985 WeakPolarHBondContact O-CB 3.42Å; A1981-K1985 WeakPolarHBondContact O-CG 3.23Å; A1981-K1985 PolarHBondContact O-N 3.32Å; L1982-K1985 PolarHBondContact O-N 3Å; L1982-K1985 VanDerWaalsContact O-N 3.16Å; Y1983-K1985 VanDerWaalsContact C-N 3.33Å; Y1983-K1985 PolarHBondContact O-N 3.23Å; K1985-E1988 VanDerWaalsContact CD-OE2 3.3Å; K1985-E1988 WeakPolarHBondContact CD-OE2 3.32Å; K1985-E1988 WeakPolarHBondContact CE-OE2 3.33Å; K1985-E1988 IonicContact NZ-OE1 3.38Å; K1985-E1988 PolarHBondContact NZ-OE1 3.36Å; K1985-E1988 IonicContact NZ-OE2 3.43Å; K1985-E1988 PolarHBondContact NZ-OE2 3.18Å; K1985-E1988 PolarHBondContact O-N 3.11Å; K1985-F1989 VanDerWaalsContact O-CB 3.28Å; K1985-F1989 WeakPolarHBondContact O-CB 3.4Å; K1985-F1989 PolarHBondContact O-N 3.3Å; K1985-T2003 HydrophobicContact CG-CG2 4.25Å; K1985-S2006 WeakPolarHBondContact CE-OG 3.37Å; K1985-L2007 HydrophobicContact CB-CD1 4.38Å; K1985-L2007 HydrophobicContact CB-CD2 3.76Å; K1985-L2007 HydrophobicContact CB-CG 4.23Å; K1985-L2007 HydrophobicContact CG-CD2 4Å; K1985-L2007 HydrophobicContact CG-CG 3.94Å; K1985-I2010 HydrophobicContact CB-CD1 4.08Å; K1985-I2010 HydrophobicContact CG-CD1 3.76Å
1986E87.5Confident81.7Confident69.2 Ų69.268.1 Ų68.132%0.32332%0.319SS..Hα-helixtrans-67.5-40.2172.7-76-179.7173.500110.8L1982 Y1983 F1989 L1990 L2007 Y2011L1982-E1986 HydrophobicContact CD1-CG 4.01Å; L1982-E1986 WeakPolarHBondContact CD1-OE1 3.43Å; L1982-E1986 WeakPolarHBondContact CD2-OE1 3.37Å; L1982-E1986 HydrophobicContact CG-CG 4.24Å; L1982-E1986 WeakPolarHBondContact O-CB 3.34Å; L1982-E1986 WeakPolarHBondContact O-CG 3.36Å; L1982-E1986 PolarHBondContact O-N 3.16Å; Y1983-E1986 PolarHBondContact O-N 3.12Å; E1986-F1989 WeakPolarHBondContact O-CB 3.28Å; E1986-F1989 PolarHBondContact O-N 3.05Å; E1986-L1990 WeakPolarHBondContact O-CB 3.41Å; E1986-L1990 VanDerWaalsContact O-CG 3.31Å; E1986-L1990 WeakPolarHBondContact O-CG 3.41Å; E1986-L1990 PolarHBondContact O-N 3.04Å; E1986-L2007 HydrophobicContact CG-CD1 3.96Å; E1986-L2007 HydrophobicContact CG-CD2 3.9Å; E1986-Y2011 PolarHBondContact OE1-OH 3.15Å
1987Q84.9Confident80.8Confident58.6 Ų58.666.3 Ų66.327%0.27433%0.328SS..Hα-helixtrans-64.7-41.7172.6-107.8-153.52.100112.2L1965 Y1983 Y1984 F1989 L1990 M1991L1965-Q1987 HydrophobicContact CD1-CB 4.29Å; L1965-Q1987 HydrophobicContact CD1-CG 4.07Å; L1965-Q1987 HydrophobicContact CD2-CB 4.34Å; L1965-Q1987 HydrophobicContact CD2-CG 4.23Å; Y1983-Q1987 HydrophobicContact CE1-CG 4.29Å; Y1983-Q1987 HydrophobicContact CE2-CG 4.29Å; Y1983-Q1987 WeakPolarHBondContact O-CB 3.43Å; Y1983-Q1987 WeakPolarHBondContact O-CG 3.28Å; Y1983-Q1987 PolarHBondContact O-N 3.36Å; Y1983-Q1987 PolarHBondContact OH-NE2 3.18Å; Y1984-Q1987 PolarHBondContact O-N 3.17Å; Q1987-F1989 VanDerWaalsContact C-N 3.32Å; Q1987-F1989 PolarHBondContact O-N 3.23Å; Q1987-L1990 PolarHBondContact O-N 3.19Å; Q1987-M1991 WeakPolarHBondContact O-CB 3.33Å; Q1987-M1991 VanDerWaalsContact O-CG 3.28Å; Q1987-M1991 WeakPolarHBondContact O-CG 3.39Å; Q1987-M1991 PolarHBondContact O-N 3.21Å
1988E83.8Confident79.8Confident40.2 Ų40.268.5 Ų68.519%0.18834%0.342CS..Hα-helixtrans-59.6-43.8172.4-174.8173.4-153.400110.8L1965 Y1984 K1985 M1991 E1992 T2003L1965-E1988 HydrophobicContact CB-CB 4.46Å; Y1984-E1988 WeakPolarHBondContact O-CB 3.26Å; Y1984-E1988 PolarHBondContact O-N 3.08Å; K1985-E1988 VanDerWaalsContact CD-OE2 3.3Å; K1985-E1988 WeakPolarHBondContact CD-OE2 3.32Å; K1985-E1988 WeakPolarHBondContact CE-OE2 3.33Å; K1985-E1988 IonicContact NZ-OE1 3.38Å; K1985-E1988 PolarHBondContact NZ-OE1 3.36Å; K1985-E1988 IonicContact NZ-OE2 3.43Å; K1985-E1988 PolarHBondContact NZ-OE2 3.18Å; K1985-E1988 PolarHBondContact O-N 3.11Å; E1988-M1991 PolarHBondContact O-N 3Å; E1988-E1992 HydrophobicContact CG-CG 4.47Å; E1988-E1992 WeakPolarHBondContact O-CB 3.26Å; E1988-E1992 VanDerWaalsContact O-CG 3.3Å; E1988-E1992 WeakPolarHBondContact O-CG 3.36Å; E1988-E1992 PolarHBondContact O-N 2.99Å; E1988-T2003 HydrophobicContact CB-CG2 4.32Å; E1988-T2003 HydrophobicContact CG-CG2 4.3Å
1989F84.7Confident79.1Confident44 Ų4467.1 Ų67.119%0.19334%0.338CS..Hα-helixtrans-61.2-45.5175.1174.1-91.9000112.5K1985 E1986 Q1987 E1992 S1993 P1999 T2003 L2004 L2007 Y2026K1985-F1989 VanDerWaalsContact O-CB 3.28Å; K1985-F1989 WeakPolarHBondContact O-CB 3.4Å; K1985-F1989 PolarHBondContact O-N 3.3Å; E1986-F1989 WeakPolarHBondContact O-CB 3.28Å; E1986-F1989 PolarHBondContact O-N 3.05Å; Q1987-F1989 VanDerWaalsContact C-N 3.32Å; Q1987-F1989 PolarHBondContact O-N 3.23Å; F1989-E1992 PolarHBondContact O-N 3.22Å; F1989-S1993 VanDerWaalsContact O-CB 3.26Å; F1989-S1993 WeakPolarHBondContact O-CB 3.31Å; F1989-S1993 PolarHBondContact O-N 3Å; F1989-S1993 PolarHBondContact O-OG 2.83Å; F1989-P1999 HydrophobicContact CD2-CB 3.75Å; F1989-P1999 HydrophobicContact CD2-CG 4.12Å; F1989-P1999 HydrophobicContact CE2-CB 3.69Å; F1989-P1999 HydrophobicContact CE2-CG 3.63Å; F1989-P1999 HydrophobicContact CZ-CG 4.4Å; F1989-T2003 HydrophobicContact CB-CG2 4.09Å; F1989-L2004 HydrophobicContact CD2-CD2 4.21Å; F1989-L2004 HydrophobicContact CE2-CD2 3.83Å; F1989-L2007 HydrophobicContact CB-CD1 4.01Å; F1989-L2007 HydrophobicContact CD2-CD1 3.98Å; F1989-L2007 HydrophobicContact CG-CD1 4.14Å; F1989-Y2026 HydrophobicContact CE2-CD1 4.41Å; F1989-Y2026 AromaticContact CE2-CE1 3.91Å; F1989-Y2026 HydrophobicContact CE2-CE1 4.1Å; F1989-Y2026 HydrophobicContact CZ-CD1 4.36Å; F1989-Y2026 AromaticContact CZ-CE1 3.76Å; F1989-Y2026 HydrophobicContact CZ-CE1 4.02Å; F1989-Y2026 AromaticContact CZ-CZ 3.99Å
1990L84.1Confident78.6Confident96.4 Ų96.465.3 Ų65.351%0.50532%0.321SS..Hα-helixtrans-62.3-47.5177-71.6171.6000110.8E1986 Q1987 E1992 S1993 E1994E1986-L1990 WeakPolarHBondContact O-CB 3.41Å; E1986-L1990 VanDerWaalsContact O-CG 3.31Å; E1986-L1990 WeakPolarHBondContact O-CG 3.41Å; E1986-L1990 PolarHBondContact O-N 3.04Å; Q1987-L1990 PolarHBondContact O-N 3.19Å; L1990-E1992 VanDerWaalsContact C-N 3.33Å; L1990-E1992 PolarHBondContact O-N 2.9Å; L1990-S1993 WeakPolarHBondContact CA-OG 3.26Å; L1990-S1993 WeakPolarHBondContact O-CB 3.29Å; L1990-S1993 PolarHBondContact O-N 3.22Å; L1990-S1993 PolarHBondContact O-OG 2.99Å; L1990-E1994 WeakPolarHBondContact O-CG 3.39Å; L1990-E1994 PolarHBondContact O-N 3.12Å
1991M80.7Confident78.2Confident81.6 Ų81.666.9 Ų66.940%0.40233%0.334SS..Hα-helixtrans-61.8-39.6176.7-74.7-166.9154.700113L1965 Q1987 E1988 K1995L1965-M1991 HydrophobicContact CD1-CE 3.84Å; L1965-M1991 VanDerWaalsContact CD1-CE 3.48Å; L1965-M1991 HydrophobicContact CD1-SD 3.56Å; L1965-M1991 VanDerWaalsContact CD1-SD 3.55Å; L1965-M1991 WeakPolarHBondContact CD1-SD 3.47Å; Q1987-M1991 WeakPolarHBondContact O-CB 3.33Å; Q1987-M1991 VanDerWaalsContact O-CG 3.28Å; Q1987-M1991 WeakPolarHBondContact O-CG 3.39Å; Q1987-M1991 PolarHBondContact O-N 3.21Å; E1988-M1991 PolarHBondContact O-N 3Å; M1991-K1995 WeakPolarHBondContact O-CB 3.46Å; M1991-K1995 VanDerWaalsContact O-CG 3.3Å; M1991-K1995 WeakPolarHBondContact O-CG 3.45Å; M1991-K1995 PolarHBondContact O-N 3.16Å; M1991-K1995 VanDerWaalsContact O-N 3.14Å
1992E79.4Confident77.8Confident31.8 Ų31.869.8 Ų69.815%0.14936%0.358CS..Hα-helixtrans-68.9-39.6175.3-76-169.6150.100111.6E1988 F1989 L1990 E1994 K1995 R1996 P1999 S2000 T2003E1988-E1992 HydrophobicContact CG-CG 4.47Å; E1988-E1992 WeakPolarHBondContact O-CB 3.26Å; E1988-E1992 VanDerWaalsContact O-CG 3.3Å; E1988-E1992 WeakPolarHBondContact O-CG 3.36Å; E1988-E1992 PolarHBondContact O-N 2.99Å; F1989-E1992 PolarHBondContact O-N 3.22Å; L1990-E1992 VanDerWaalsContact C-N 3.33Å; L1990-E1992 PolarHBondContact O-N 2.9Å; E1992-E1994 VanDerWaalsContact C-N 3.33Å; E1992-E1994 PolarHBondContact O-N 3.25Å; E1992-K1995 PolarHBondContact O-N 3.08Å; E1992-R1996 WeakPolarHBondContact O-CA 3.18Å; E1992-R1996 WeakPolarHBondContact O-CB 3.26Å; E1992-R1996 PolarHBondContact O-N 3.24Å; E1992-R1996 IonicContact OE1-NH1 3.9Å; E1992-R1996 PolarHBondContact OE1-NH1 3.34Å; E1992-P1999 HydrophobicContact CB-CB 4.48Å; E1992-S2000 VanDerWaalsContact OE1-CB 3.26Å; E1992-S2000 WeakPolarHBondContact OE1-CB 3.34Å; E1992-S2000 WeakPolarHBondContact OE2-CB 3.27Å; E1992-S2000 PolarHBondContact OE2-N 3.15Å; E1992-S2000 VanDerWaalsContact OE2-N 3.1Å; E1992-T2003 WeakPolarHBondContact OE2-CB 3.4Å; E1992-T2003 PolarHBondContact OE2-OG1 3.16Å
1993S74Confident77.5Confident40 Ų4068.8 Ų68.828%0.2835%0.353SS..Hα-helixtrans-62.5-40.4178.193.90000111.8F1989 L1990 S1997F1989-S1993 VanDerWaalsContact O-CB 3.26Å; F1989-S1993 WeakPolarHBondContact O-CB 3.31Å; F1989-S1993 PolarHBondContact O-N 3Å; F1989-S1993 PolarHBondContact O-OG 2.83Å; L1990-S1993 WeakPolarHBondContact CA-OG 3.26Å; L1990-S1993 WeakPolarHBondContact O-CB 3.29Å; L1990-S1993 PolarHBondContact O-N 3.22Å; L1990-S1993 PolarHBondContact O-OG 2.99Å; S1993-S1997 VanDerWaalsContact O-CA 3.3Å; S1993-S1997 WeakPolarHBondContact O-CA 3.43Å; S1993-S1997 PolarHBondContact O-N 3.18Å
1994E74.9Confident77.3Confident160 Ų16063.7 Ų63.775%0.74833%0.334SS*.Hα-helixtrans-69.7-40.7176.9-72.1178.4179.100112.3L1990 E1992L1990-E1994 WeakPolarHBondContact O-CG 3.39Å; L1990-E1994 PolarHBondContact O-N 3.12Å; E1992-E1994 VanDerWaalsContact C-N 3.33Å; E1992-E1994 PolarHBondContact O-N 3.25Å
1995K71.2Confident77Confident163.8 Ų163.865.7 Ų65.771%0.71235%0.348SS*.Hα-helixtrans-84.6-36.4-173.7-71.3175.9-177.2173.10114.4M1991 E1992M1991-K1995 WeakPolarHBondContact O-CB 3.46Å; M1991-K1995 VanDerWaalsContact O-CG 3.3Å; M1991-K1995 WeakPolarHBondContact O-CG 3.45Å; M1991-K1995 PolarHBondContact O-N 3.16Å; M1991-K1995 VanDerWaalsContact O-N 3.14Å; E1992-K1995 PolarHBondContact O-N 3.08Å
1996R61.4Low76.9Confident179 Ų17966.2 Ų66.268%0.67535%0.353SS*.Hα-helixtrans-116-5.9-169-75-176.7175.7174.4-0.3114.6E1992 C1998E1992-R1996 WeakPolarHBondContact O-CA 3.18Å; E1992-R1996 WeakPolarHBondContact O-CB 3.26Å; E1992-R1996 PolarHBondContact O-N 3.24Å; E1992-R1996 IonicContact OE1-NH1 3.9Å; E1992-R1996 PolarHBondContact OE1-NH1 3.34Å; R1996-C1998 WeakPolarHBondContact CB-O 3.41Å; R1996-C1998 PolarHBondContact O-N 3.22Å
1997S61.5Low76.9Confident104.6 Ų104.663.1 Ų63.173%0.73134%0.339SS*.SBendtrans59.5-23.7-171-54.30000115.5S1993S1993-S1997 VanDerWaalsContact O-CA 3.3Å; S1993-S1997 WeakPolarHBondContact O-CA 3.43Å; S1993-S1997 PolarHBondContact O-N 3.18Å
1998C59.6Low76.8Confident64.4 Ų64.460.4 Ų60.444%0.43533%0.326SS..SBendtrans-123120.5174.9-70.10000109.5R1996R1996-C1998 WeakPolarHBondContact CB-O 3.41Å; R1996-C1998 PolarHBondContact O-N 3.22Å
1999P68.7Low76.8Confident13 Ų1360.5 Ų60.58%0.08433%0.33CS..  trans-70.8151.9176.728.3-32.5000111.4F1989 E1992 L2004 Y2026F1989-P1999 HydrophobicContact CD2-CB 3.75Å; F1989-P1999 HydrophobicContact CD2-CG 4.12Å; F1989-P1999 HydrophobicContact CE2-CB 3.69Å; F1989-P1999 HydrophobicContact CE2-CG 3.63Å; F1989-P1999 HydrophobicContact CZ-CG 4.4Å; E1992-P1999 HydrophobicContact CB-CB 4.48Å; P1999-L2004 HydrophobicContact CG-CD1 4.34Å; P1999-L2004 HydrophobicContact CG-CD2 4.27Å; P1999-L2004 HydrophobicContact CG-CG 4.36Å; P1999-Y2026 HydrophobicContact CG-CE1 3.89Å
2000S73Confident76.9Confident33.6 Ų33.658.5 Ų58.524%0.23532%0.321CS..  trans-66.1138.8-179.9161.40000111.4E1992 A2002 T2003 L2004E1992-S2000 VanDerWaalsContact OE1-CB 3.26Å; E1992-S2000 WeakPolarHBondContact OE1-CB 3.34Å; E1992-S2000 WeakPolarHBondContact OE2-CB 3.27Å; E1992-S2000 PolarHBondContact OE2-N 3.15Å; E1992-S2000 VanDerWaalsContact OE2-N 3.1Å; S2000-A2002 PolarHBondContact O-N 3.23Å; S2000-A2002 VanDerWaalsContact O-N 3.16Å; S2000-A2002 PolarHBondContact OG-N 3.35Å; S2000-T2003 WeakPolarHBondContact O-CA 3.32Å; S2000-T2003 WeakPolarHBondContact O-CB 3.31Å; S2000-T2003 PolarHBondContact O-N 3.18Å; S2000-T2003 VanDerWaalsContact O-N 3.09Å; S2000-T2003 PolarHBondContact OG-N 3.16Å; S2000-T2003 PolarHBondContact OG-OG1 2.87Å; S2000-L2004 PolarHBondContact O-N 3.02Å; S2000-L2004 VanDerWaalsContact O-N 3.14Å
2001P75.5Confident77Confident65.2 Ų65.255 Ų5542%0.42330%0.301SS..Hα-helixtrans-60.5-26.3174.915.2-21.7000112.6S2005 L2035P2001-S2005 VanDerWaalsContact O-CB 3.27Å; P2001-S2005 WeakPolarHBondContact O-CB 3.37Å; P2001-S2005 PolarHBondContact O-N 3.12Å; P2001-S2005 PolarHBondContact O-OG 3.19Å; P2001-L2035 HydrophobicContact CB-CD1 4.49Å
2002A78.9Confident77.1Confident60.6 Ų60.653.3 Ų53.350%0.50130%0.298SS..Hα-helixtrans-67.4-42.917400000111.7S2000 L2004 S2005 S2006S2000-A2002 PolarHBondContact O-N 3.23Å; S2000-A2002 VanDerWaalsContact O-N 3.16Å; S2000-A2002 PolarHBondContact OG-N 3.35Å; A2002-L2004 PolarHBondContact O-N 3.17Å; A2002-S2005 WeakPolarHBondContact O-CB 3.15Å; A2002-S2005 PolarHBondContact O-N 3.23Å; A2002-S2005 PolarHBondContact O-OG 3.48Å; A2002-S2006 WeakPolarHBondContact O-CB 3.4Å; A2002-S2006 PolarHBondContact O-N 3.21Å; A2002-S2006 PolarHBondContact O-OG 3.23Å
2003T82.6Confident77.1Confident4.4 Ų4.456.7 Ų56.73%0.02731%0.312CS..Hα-helixtrans-61.7-47175.9-51.10000110.6K1985 E1988 F1989 E1992 S2000 S2005 S2006 L2007K1985-T2003 HydrophobicContact CG-CG2 4.25Å; E1988-T2003 HydrophobicContact CB-CG2 4.32Å; E1988-T2003 HydrophobicContact CG-CG2 4.3Å; F1989-T2003 HydrophobicContact CB-CG2 4.09Å; E1992-T2003 WeakPolarHBondContact OE2-CB 3.4Å; E1992-T2003 PolarHBondContact OE2-OG1 3.16Å; S2000-T2003 WeakPolarHBondContact O-CA 3.32Å; S2000-T2003 WeakPolarHBondContact O-CB 3.31Å; S2000-T2003 PolarHBondContact O-N 3.18Å; S2000-T2003 VanDerWaalsContact O-N 3.09Å; S2000-T2003 PolarHBondContact OG-N 3.16Å; S2000-T2003 PolarHBondContact OG-OG1 2.87Å; T2003-S2005 PolarHBondContact O-N 3.27Å; T2003-S2006 WeakPolarHBondContact O-CB 3.32Å; T2003-S2006 PolarHBondContact O-N 3.3Å; T2003-S2006 PolarHBondContact O-OG 3.18Å; T2003-L2007 HydrophobicContact CG2-CD1 4.4Å; T2003-L2007 WeakPolarHBondContact O-CB 3.46Å; T2003-L2007 WeakPolarHBondContact O-CG 3.31Å; T2003-L2007 PolarHBondContact O-N 3.06Å
2004L83.3Confident77.5Confident10.8 Ų10.857.3 Ų57.36%0.05731%0.312CS..Hα-helixtrans-60.2-44.8176-67.3172.1000112.2F1989 P1999 S2000 A2002 S2006 L2007 L2008 V2023 Y2026 A2027 L2035F1989-L2004 HydrophobicContact CD2-CD2 4.21Å; F1989-L2004 HydrophobicContact CE2-CD2 3.83Å; P1999-L2004 HydrophobicContact CG-CD1 4.34Å; P1999-L2004 HydrophobicContact CG-CD2 4.27Å; P1999-L2004 HydrophobicContact CG-CG 4.36Å; S2000-L2004 PolarHBondContact O-N 3.02Å; S2000-L2004 VanDerWaalsContact O-N 3.14Å; A2002-L2004 PolarHBondContact O-N 3.17Å; L2004-S2006 VanDerWaalsContact C-N 3.33Å; L2004-S2006 PolarHBondContact O-N 3Å; L2004-L2007 PolarHBondContact O-N 3.22Å; L2004-L2008 VanDerWaalsContact O-CB 3.26Å; L2004-L2008 WeakPolarHBondContact O-CB 3.34Å; L2004-L2008 VanDerWaalsContact O-CG 3.29Å; L2004-L2008 WeakPolarHBondContact O-CG 3.25Å; L2004-L2008 PolarHBondContact O-N 3.22Å; L2004-V2023 HydrophobicContact CB-CG1 4.46Å; L2004-V2023 HydrophobicContact CD2-CG1 3.91Å; L2004-Y2026 HydrophobicContact CD2-CD1 4.27Å; L2004-A2027 HydrophobicContact CD1-CB 4.03Å; L2004-L2035 HydrophobicContact CB-CD1 4.04Å; L2004-L2035 HydrophobicContact CB-CD2 4.37Å; L2004-L2035 HydrophobicContact CD1-CD1 4.11Å
2005S81.7Confident77.6Confident44.4 Ų44.454 Ų5431%0.3130%0.299SS..Hα-helixtrans-62-39.2176.1138.50000112.7P2001 A2002 T2003 T2009 W2041P2001-S2005 VanDerWaalsContact O-CB 3.27Å; P2001-S2005 WeakPolarHBondContact O-CB 3.37Å; P2001-S2005 PolarHBondContact O-N 3.12Å; P2001-S2005 PolarHBondContact O-OG 3.19Å; A2002-S2005 WeakPolarHBondContact O-CB 3.15Å; A2002-S2005 PolarHBondContact O-N 3.23Å; A2002-S2005 PolarHBondContact O-OG 3.48Å; T2003-S2005 PolarHBondContact O-N 3.27Å; S2005-T2009 WeakPolarHBondContact O-CB 3.35Å; S2005-T2009 PolarHBondContact O-N 3.15Å; S2005-T2009 VanDerWaalsContact O-N 3.12Å; S2005-T2009 PolarHBondContact O-OG1 3.19Å; S2005-W2041 VanDerWaalsContact O-CH2 3.26Å; S2005-W2041 WeakPolarHBondContact O-CH2 3.23Å; S2005-W2041 WeakPolarHBondContact O-CZ2 3.39Å; S2005-W2041 WeakPolarHBondContact OG-CZ2 3.4Å
2006S84.1Confident78.2Confident23.6 Ų23.649.4 Ų49.417%0.16528%0.282CS..Hα-helixtrans-67.8-44.7176.1-17.90000111.5K1985 A2002 T2003 L2004 L2008 T2009 I2010K1985-S2006 WeakPolarHBondContact CE-OG 3.37Å; A2002-S2006 WeakPolarHBondContact O-CB 3.4Å; A2002-S2006 PolarHBondContact O-N 3.21Å; A2002-S2006 PolarHBondContact O-OG 3.23Å; T2003-S2006 WeakPolarHBondContact O-CB 3.32Å; T2003-S2006 PolarHBondContact O-N 3.3Å; T2003-S2006 PolarHBondContact O-OG 3.18Å; L2004-S2006 VanDerWaalsContact C-N 3.33Å; L2004-S2006 PolarHBondContact O-N 3Å; S2006-L2008 VanDerWaalsContact C-N 3.29Å; S2006-L2008 PolarHBondContact O-N 3.21Å; S2006-T2009 WeakPolarHBondContact O-CB 3.33Å; S2006-T2009 PolarHBondContact O-N 3.09Å; S2006-T2009 VanDerWaalsContact O-N 3.16Å; S2006-I2010 WeakPolarHBondContact O-CD1 3.33Å; S2006-I2010 VanDerWaalsContact O-CG1 3.27Å; S2006-I2010 WeakPolarHBondContact O-CG1 3.24Å; S2006-I2010 PolarHBondContact O-N 3.13Å
2007L86.5Confident79Confident4.8 Ų4.844.8 Ų44.83%0.02527%0.268CS..Hα-helixtrans-60.2-45176.1-111.7134.5000111.3L1982 K1985 E1986 F1989 T2003 L2004 T2009 I2010 Y2011 V2023L1982-L2007 HydrophobicContact CD1-CD1 3.99Å; L1982-L2007 HydrophobicContact CD1-CD2 3.94Å; K1985-L2007 HydrophobicContact CB-CD1 4.38Å; K1985-L2007 HydrophobicContact CB-CD2 3.76Å; K1985-L2007 HydrophobicContact CB-CG 4.23Å; K1985-L2007 HydrophobicContact CG-CD2 4Å; K1985-L2007 HydrophobicContact CG-CG 3.94Å; E1986-L2007 HydrophobicContact CG-CD1 3.96Å; E1986-L2007 HydrophobicContact CG-CD2 3.9Å; F1989-L2007 HydrophobicContact CB-CD1 4.01Å; F1989-L2007 HydrophobicContact CD2-CD1 3.98Å; F1989-L2007 HydrophobicContact CG-CD1 4.14Å; T2003-L2007 HydrophobicContact CG2-CD1 4.4Å; T2003-L2007 WeakPolarHBondContact O-CB 3.46Å; T2003-L2007 WeakPolarHBondContact O-CG 3.31Å; T2003-L2007 PolarHBondContact O-N 3.06Å; L2004-L2007 PolarHBondContact O-N 3.22Å; L2007-T2009 VanDerWaalsContact C-N 3.31Å; L2007-T2009 PolarHBondContact O-N 3.2Å; L2007-I2010 PolarHBondContact O-N 3.27Å; L2007-I2010 VanDerWaalsContact O-N 3.14Å; L2007-Y2011 HydrophobicContact CB-CD2 4.36Å; L2007-Y2011 HydrophobicContact CB-CE2 4.28Å; L2007-Y2011 HydrophobicContact CD1-CD2 4.3Å; L2007-Y2011 HydrophobicContact CD1-CE2 3.73Å; L2007-Y2011 HydrophobicContact CD2-CE2 4.14Å; L2007-Y2011 HydrophobicContact CG-CD2 3.83Å; L2007-Y2011 HydrophobicContact CG-CE2 3.44Å; L2007-Y2011 VanDerWaalsContact CG-CE2 3.44Å; L2007-Y2011 VanDerWaalsContact O-CD2 3.28Å; L2007-Y2011 WeakPolarHBondContact O-CD2 3.38Å; L2007-Y2011 PolarHBondContact O-N 3.29Å; L2007-V2023 HydrophobicContact CB-CG1 4.47Å; L2007-V2023 HydrophobicContact CB-CG2 4.45Å; L2007-V2023 HydrophobicContact CD2-CG1 4.23Å; L2007-V2023 HydrophobicContact CD2-CG2 3.62Å; L2007-V2023 HydrophobicContact CG-CG2 4.19Å
2008L83.4Confident79.9Confident1.2 Ų1.246.1 Ų46.11%0.00626%0.263CS..Hα-helixtrans-63.2-37.7176.6-122.9126.4000112L2004 S2006 I2010 S2012 A2020 V2023 L2024 L2035 W2041 L2045L2004-L2008 VanDerWaalsContact O-CB 3.26Å; L2004-L2008 WeakPolarHBondContact O-CB 3.34Å; L2004-L2008 VanDerWaalsContact O-CG 3.29Å; L2004-L2008 WeakPolarHBondContact O-CG 3.25Å; L2004-L2008 PolarHBondContact O-N 3.22Å; S2006-L2008 VanDerWaalsContact C-N 3.29Å; S2006-L2008 PolarHBondContact O-N 3.21Å; L2008-I2010 VanDerWaalsContact C-N 3.35Å; L2008-I2010 PolarHBondContact O-N 3.43Å; L2008-S2012 VanDerWaalsContact O-CB 3.25Å; L2008-S2012 WeakPolarHBondContact O-CB 3.29Å; L2008-S2012 PolarHBondContact O-N 3.09Å; L2008-S2012 VanDerWaalsContact O-N 3.1Å; L2008-A2020 HydrophobicContact CD1-CB 3.79Å; L2008-A2020 WeakPolarHBondContact CD1-O 3.25Å; L2008-A2020 HydrophobicContact CD2-CB 4.18Å; L2008-A2020 WeakPolarHBondContact CD2-O 3.36Å; L2008-A2020 HydrophobicContact CG-CB 4.23Å; L2008-V2023 HydrophobicContact CB-CG1 4.42Å; L2008-V2023 HydrophobicContact CD1-CB 4.18Å; L2008-V2023 HydrophobicContact CD1-CG1 4.17Å; L2008-V2023 HydrophobicContact CD2-CB 3.82Å; L2008-V2023 HydrophobicContact CD2-CG1 3.93Å; L2008-V2023 HydrophobicContact CG-CB 4.22Å; L2008-V2023 HydrophobicContact CG-CG1 3.78Å; L2008-L2024 HydrophobicContact CD1-CB 4.11Å; L2008-L2024 HydrophobicContact CD1-CD1 4.29Å; L2008-L2024 HydrophobicContact CD2-CB 4.42Å; L2008-L2035 HydrophobicContact CD1-CD2 4.13Å; L2008-L2035 HydrophobicContact CD2-CD2 4.37Å; L2008-W2041 HydrophobicContact CB-CD2 4.16Å; L2008-W2041 HydrophobicContact CB-CE3 3.7Å; L2008-W2041 VanDerWaalsContact CB-CE3 3.49Å; L2008-W2041 HydrophobicContact CB-CH2 3.96Å; L2008-W2041 HydrophobicContact CB-CZ2 4.29Å; L2008-W2041 HydrophobicContact CB-CZ3 3.84Å; L2008-W2041 HydrophobicContact CD1-CB 4.41Å; L2008-W2041 HydrophobicContact CD1-CD2 3.57Å; L2008-W2041 HydrophobicContact CD1-CE3 4.11Å; L2008-W2041 HydrophobicContact CD1-CG 3.78Å; L2008-W2041 HydrophobicContact CD1-CZ2 4.38Å; L2008-W2041 HydrophobicContact CD1-CZ3 4.48Å; L2008-W2041 HydrophobicContact CD2-CB 3.95Å; L2008-W2041 HydrophobicContact CD2-CD2 3.16Å; L2008-W2041 VanDerWaalsContact CD2-CD2 3.4Å; L2008-W2041 HydrophobicContact CD2-CE3 3.14Å; L2008-W2041 HydrophobicContact CD2-CG 3.53Å; L2008-W2041 HydrophobicContact CD2-CH2 4.08Å; L2008-W2041 HydrophobicContact CD2-CZ2 4.13Å; L2008-W2041 HydrophobicContact CD2-CZ3 3.61Å; L2008-W2041 HydrophobicContact CG-CD2 4.19Å; L2008-W2041 HydrophobicContact CG-CE3 3.95Å; L2008-W2041 HydrophobicContact CG-CG 4.39Å; L2008-W2041 HydrophobicContact CG-CH2 4.12Å; L2008-W2041 HydrophobicContact CG-CZ2 4.45Å; L2008-W2041 HydrophobicContact CG-CZ3 4.14Å; L2008-W2041 VanDerWaalsContact CG-CZ3 3.5Å; L2008-L2045 HydrophobicContact CD1-CD1 4.45Å; L2008-L2045 HydrophobicContact CD2-CD1 4.34Å
2009T84.3Confident81.1Confident43.4 Ų43.444.4 Ų44.427%0.26625%0.253SS..Hα-helixtrans-62.8-45.3172.5-55.80000111.3S2005 S2006 L2007 S2012 K2013 W2041S2005-T2009 WeakPolarHBondContact O-CB 3.35Å; S2005-T2009 PolarHBondContact O-N 3.15Å; S2005-T2009 VanDerWaalsContact O-N 3.12Å; S2005-T2009 PolarHBondContact O-OG1 3.19Å; S2006-T2009 WeakPolarHBondContact O-CB 3.33Å; S2006-T2009 PolarHBondContact O-N 3.09Å; S2006-T2009 VanDerWaalsContact O-N 3.16Å; L2007-T2009 VanDerWaalsContact C-N 3.31Å; L2007-T2009 PolarHBondContact O-N 3.2Å; T2009-S2012 PolarHBondContact O-N 3.13Å; T2009-K2013 HydrophobicContact CG2-CD 4.41Å; T2009-K2013 HydrophobicContact CG2-CG 4.47Å; T2009-K2013 WeakPolarHBondContact O-CB 3.4Å; T2009-K2013 VanDerWaalsContact O-CG 3.24Å; T2009-K2013 WeakPolarHBondContact O-CG 3.31Å; T2009-K2013 PolarHBondContact O-N 3.3Å; T2009-K2013 VanDerWaalsContact O-N 3.1Å; T2009-W2041 WeakPolarHBondContact OG1-CH2 3.46Å
2010I86.1Confident81.8Confident1.2 Ų1.243.8 Ų43.81%0.00625%0.25CC..Hα-helixtrans-66.6-48.5-178.7-66.6161000110.6L1973 A1981 L1982 K1985 S2006 L2007 L2008 S2012 K2013 L2014L1973-I2010 HydrophobicContact CD1-CD1 4.26Å; L1973-I2010 HydrophobicContact CD1-CG1 3.81Å; L1973-I2010 VanDerWaalsContact CD1-CG1 3.46Å; A1981-I2010 HydrophobicContact CB-CD1 4Å; A1981-I2010 HydrophobicContact CB-CG1 4.36Å; L1982-I2010 HydrophobicContact CB-CG2 3.77Å; L1982-I2010 HydrophobicContact CD1-CG2 3.96Å; L1982-I2010 HydrophobicContact CG-CG2 4.43Å; K1985-I2010 HydrophobicContact CB-CD1 4.08Å; K1985-I2010 HydrophobicContact CG-CD1 3.76Å; S2006-I2010 WeakPolarHBondContact O-CD1 3.33Å; S2006-I2010 VanDerWaalsContact O-CG1 3.27Å; S2006-I2010 WeakPolarHBondContact O-CG1 3.24Å; S2006-I2010 PolarHBondContact O-N 3.13Å; L2007-I2010 PolarHBondContact O-N 3.27Å; L2007-I2010 VanDerWaalsContact O-N 3.14Å; L2008-I2010 VanDerWaalsContact C-N 3.35Å; L2008-I2010 PolarHBondContact O-N 3.43Å; I2010-S2012 VanDerWaalsContact C-N 3.31Å; I2010-S2012 PolarHBondContact O-N 3.25Å; I2010-K2013 CarbonylContact O-C 3.57Å; I2010-K2013 WeakPolarHBondContact O-CA 3.41Å; I2010-K2013 PolarHBondContact O-N 3.19Å; I2010-K2013 VanDerWaalsContact O-N 3.11Å; I2010-L2014 HydrophobicContact CG2-CD1 3.73Å; I2010-L2014 HydrophobicContact CG2-CG 4.44Å; I2010-L2014 WeakPolarHBondContact O-CB 3.44Å; I2010-L2014 WeakPolarHBondContact O-CD1 3.48Å; I2010-L2014 WeakPolarHBondContact O-CG 3.4Å; I2010-L2014 PolarHBondContact O-N 3.28Å
2011Y86.4Confident82.2Confident22.6 Ų22.645.2 Ų45.29%0.08925%0.254CS..Hα-helixtrans-61.2-39.5177.1-74.2-54.9000112.5L1982 E1986 L2007 K2013 L2014 N2015 L2016 A2019 V2023L1982-Y2011 HydrophobicContact CD1-CD1 3.9Å; L1982-Y2011 HydrophobicContact CD1-CE1 3.39Å; L1982-Y2011 HydrophobicContact CD1-CE2 4.28Å; L1982-Y2011 HydrophobicContact CD1-CG 4.36Å; L1982-Y2011 HydrophobicContact CD2-CD1 4.46Å; L1982-Y2011 HydrophobicContact CD2-CE1 3.88Å; L1982-Y2011 HydrophobicContact CG-CE1 4.34Å; E1986-Y2011 PolarHBondContact OE1-OH 3.15Å; L2007-Y2011 HydrophobicContact CB-CD2 4.36Å; L2007-Y2011 HydrophobicContact CB-CE2 4.28Å; L2007-Y2011 HydrophobicContact CD1-CD2 4.3Å; L2007-Y2011 HydrophobicContact CD1-CE2 3.73Å; L2007-Y2011 HydrophobicContact CD2-CE2 4.14Å; L2007-Y2011 HydrophobicContact CG-CD2 3.83Å; L2007-Y2011 HydrophobicContact CG-CE2 3.44Å; L2007-Y2011 VanDerWaalsContact CG-CE2 3.44Å; L2007-Y2011 VanDerWaalsContact O-CD2 3.28Å; L2007-Y2011 WeakPolarHBondContact O-CD2 3.38Å; L2007-Y2011 PolarHBondContact O-N 3.29Å; Y2011-K2013 VanDerWaalsContact C-N 3.34Å; Y2011-K2013 PolarHBondContact O-N 3.17Å; Y2011-L2014 CarbonylContact O-C 3.52Å; Y2011-L2014 PolarHBondContact O-N 3.15Å; Y2011-N2015 PolarHBondContact O-N 3.09Å; Y2011-N2015 VanDerWaalsContact O-N 3.13Å; Y2011-L2016 HydrophobicContact CD1-CB 4.07Å; Y2011-L2016 HydrophobicContact CD1-CD1 4.07Å; Y2011-L2016 HydrophobicContact CE1-CD1 4.37Å; Y2011-L2016 PolarHBondContact O-N 3.23Å; Y2011-A2019 HydrophobicContact CD1-CB 3.57Å; Y2011-A2019 VanDerWaalsContact CD1-CB 3.48Å; Y2011-A2019 HydrophobicContact CD2-CB 4.19Å; Y2011-A2019 HydrophobicContact CE1-CB 3.57Å; Y2011-A2019 VanDerWaalsContact CE1-CB 3.47Å; Y2011-A2019 HydrophobicContact CE2-CB 4.15Å; Y2011-A2019 HydrophobicContact CG-CB 3.94Å; Y2011-V2023 HydrophobicContact CD2-CG2 3.87Å; Y2011-V2023 HydrophobicContact CE2-CG2 3.57Å; Y2011-V2023 VanDerWaalsContact CE2-CG2 3.49Å
2012S81.9Confident82.6Confident46.2 Ų46.243.6 Ų43.632%0.32325%0.25SC..Hα-helixtrans-61.7-42.3173174.20000111.8L2008 T2009 I2010 L2014 N2015L2008-S2012 VanDerWaalsContact O-CB 3.25Å; L2008-S2012 WeakPolarHBondContact O-CB 3.29Å; L2008-S2012 PolarHBondContact O-N 3.09Å; L2008-S2012 VanDerWaalsContact O-N 3.1Å; T2009-S2012 PolarHBondContact O-N 3.13Å; I2010-S2012 VanDerWaalsContact C-N 3.31Å; I2010-S2012 PolarHBondContact O-N 3.25Å; S2012-L2014 VanDerWaalsContact C-N 3.33Å; S2012-L2014 PolarHBondContact O-N 3.27Å; S2012-N2015 PolarHBondContact O-N 3.25Å; S2012-N2015 VanDerWaalsContact O-N 3.17Å; S2012-N2015 PolarHBondContact O-OD1 3.1Å
2013K80.8Confident82.9Confident104.2 Ų104.241.3 Ų41.345%0.45323%0.23SC..Hα-helixtrans-69.5-25.8176.2-69.8-82.3-177.7-176.90113.7Y1978 T2009 I2010 Y2011 N2015 R2180Y1978-K2013 HydrophobicContact CD1-CB 3.98Å; Y1978-K2013 HydrophobicContact CD1-CD 4.17Å; Y1978-K2013 HydrophobicContact CD1-CG 4.38Å; Y1978-K2013 HydrophobicContact CD2-CB 4.42Å; Y1978-K2013 HydrophobicContact CE1-CB 3.83Å; Y1978-K2013 HydrophobicContact CE1-CD 4.07Å; Y1978-K2013 HydrophobicContact CE1-CG 4.02Å; Y1978-K2013 HydrophobicContact CE2-CB 4.33Å; Y1978-K2013 HydrophobicContact CG-CB 4.28Å; T2009-K2013 HydrophobicContact CG2-CD 4.41Å; T2009-K2013 HydrophobicContact CG2-CG 4.47Å; T2009-K2013 WeakPolarHBondContact O-CB 3.4Å; T2009-K2013 VanDerWaalsContact O-CG 3.24Å; T2009-K2013 WeakPolarHBondContact O-CG 3.31Å; T2009-K2013 PolarHBondContact O-N 3.3Å; T2009-K2013 VanDerWaalsContact O-N 3.1Å; I2010-K2013 CarbonylContact O-C 3.57Å; I2010-K2013 WeakPolarHBondContact O-CA 3.41Å; I2010-K2013 PolarHBondContact O-N 3.19Å; I2010-K2013 VanDerWaalsContact O-N 3.11Å; Y2011-K2013 VanDerWaalsContact C-N 3.34Å; Y2011-K2013 PolarHBondContact O-N 3.17Å; K2013-N2015 VanDerWaalsContact C-N 3.29Å; K2013-R2180 PolarHBondContact O-NH2 3.26Å
2014L81.7Confident82.7Confident52.6 Ų52.641.5 Ų41.528%0.27523%0.23SC..THydrogen-bonded Turntrans-84.7-0.4173.3-74.5159.5000113.4Y1978 L1982 I2010 Y2011 S2012 L2016Y1978-L2014 VanDerWaalsContact CB-CD2 3.5Å; Y1978-L2014 HydrophobicContact CG-CD1 4.43Å; Y1978-L2014 HydrophobicContact CG-CD2 4.44Å; L1982-L2014 HydrophobicContact CB-CD1 4.29Å; L1982-L2014 HydrophobicContact CD1-CD1 4.02Å; L1982-L2014 HydrophobicContact CD2-CD1 3.88Å; I2010-L2014 HydrophobicContact CG2-CD1 3.73Å; I2010-L2014 HydrophobicContact CG2-CG 4.44Å; I2010-L2014 WeakPolarHBondContact O-CB 3.44Å; I2010-L2014 WeakPolarHBondContact O-CD1 3.48Å; I2010-L2014 WeakPolarHBondContact O-CG 3.4Å; I2010-L2014 PolarHBondContact O-N 3.28Å; Y2011-L2014 CarbonylContact O-C 3.52Å; Y2011-L2014 PolarHBondContact O-N 3.15Å; S2012-L2014 VanDerWaalsContact C-N 3.33Å; S2012-L2014 PolarHBondContact O-N 3.27Å; L2014-L2016 VanDerWaalsContact C-N 3.26Å; L2014-L2016 HydrophobicContact CB-CD1 4Å; L2014-L2016 HydrophobicContact CB-CG 4Å; L2014-L2016 HydrophobicContact CD1-CD1 4.16Å; L2014-L2016 HydrophobicContact CD2-CD1 4.2Å; L2014-L2016 PolarHBondContact O-N 3.09Å
2015N76.8Confident82.5Confident90.4 Ų90.445.2 Ų45.248%0.48325%0.25SC..THydrogen-bonded Turntrans55.832.3-173-82.8-0.6000113.6Y2011 S2012 K2013 E2017Y2011-N2015 PolarHBondContact O-N 3.09Å; Y2011-N2015 VanDerWaalsContact O-N 3.13Å; S2012-N2015 PolarHBondContact O-N 3.25Å; S2012-N2015 VanDerWaalsContact O-N 3.17Å; S2012-N2015 PolarHBondContact O-OD1 3.1Å; K2013-N2015 VanDerWaalsContact C-N 3.29Å; N2015-E2017 VanDerWaalsContact C-N 3.3Å; N2015-E2017 PolarHBondContact O-N 3.13Å
2016L83.2Confident82.4Confident67.8 Ų67.847.2 Ų47.236%0.35525%0.251SS..  trans-97.870173.9-67.2177.2000110Y2011 L2014 E2018 A2019 A2020Y2011-L2016 HydrophobicContact CD1-CB 4.07Å; Y2011-L2016 HydrophobicContact CD1-CD1 4.07Å; Y2011-L2016 HydrophobicContact CE1-CD1 4.37Å; Y2011-L2016 PolarHBondContact O-N 3.23Å; L2014-L2016 VanDerWaalsContact C-N 3.26Å; L2014-L2016 HydrophobicContact CB-CD1 4Å; L2014-L2016 HydrophobicContact CB-CG 4Å; L2014-L2016 HydrophobicContact CD1-CD1 4.16Å; L2014-L2016 HydrophobicContact CD2-CD1 4.2Å; L2014-L2016 PolarHBondContact O-N 3.09Å; L2016-E2018 VanDerWaalsContact C-N 3.32Å; L2016-E2018 PolarHBondContact O-N 3.18Å; L2016-A2019 HydrophobicContact CB-CB 4.14Å; L2016-A2019 HydrophobicContact CD1-CB 4.37Å; L2016-A2019 PolarHBondContact O-N 3.07Å; L2016-A2020 WeakPolarHBondContact O-CB 3.37Å; L2016-A2020 PolarHBondContact O-N 3.2Å; L2016-A2020 VanDerWaalsContact O-N 3.09Å
2017E78.7Confident82Confident81.4 Ų81.446.3 Ų46.338%0.3825%0.245SC..Hα-helixtrans-59.3-35.8-177.8-66.6174.7-159.500112.8N2015 A2020 N2021 H2046N2015-E2017 VanDerWaalsContact C-N 3.3Å; N2015-E2017 PolarHBondContact O-N 3.13Å; E2017-A2020 PolarHBondContact O-N 2.87Å; E2017-N2021 VanDerWaalsContact O-CB 3.28Å; E2017-N2021 WeakPolarHBondContact O-CB 3.38Å; E2017-N2021 VanDerWaalsContact O-CG 3.26Å; E2017-N2021 PolarHBondContact O-N 3.17Å; E2017-N2021 PolarHBondContact O-ND2 3.19Å; E2017-N2021 VanDerWaalsContact O-ND2 3.15Å; E2017-H2046 IonicContact OE1-CD2 2.97Å; E2017-H2046 PolarHBondContact OE1-CD2 2.89Å; E2017-H2046 IonicContact OE1-NE2 3.31Å; E2017-H2046 IonicContact OE2-CD2 3.37Å
2018E80.7Confident81.3Confident131.6 Ų131.648.8 Ų48.862%0.61526%0.261SS*.Hα-helixtrans-66.8-43179-61.4173.2166.400112.3L2016 A2020 N2021 G2022 R2971L2016-E2018 VanDerWaalsContact C-N 3.32Å; L2016-E2018 PolarHBondContact O-N 3.18Å; E2018-A2020 VanDerWaalsContact C-N 3.31Å; E2018-N2021 WeakPolarHBondContact O-CB 3.38Å; E2018-N2021 PolarHBondContact O-N 3.18Å; E2018-G2022 PolarHBondContact O-N 3.28Å; E2018-R2971 IonicContact OE1-CZ 2.78Å; E2018-R2971 VanDerWaalsContact OE1-CZ 3.22Å; E2018-R2971 IonicContact OE1-NE 3.37Å; E2018-R2971 PolarHBondContact OE1-NE 3.47Å; E2018-R2971 IonicContact OE1-NH2 2.74Å; E2018-R2971 PolarHBondContact OE1-NH2 3.02Å
2019A84.7Confident80.8Confident29 Ų2957.5 Ų57.524%0.2429%0.293CS..Hα-helixtrans-66.6-41.9176.800000110.9Y2011 L2016 N2021 G2022 V2023Y2011-A2019 HydrophobicContact CD1-CB 3.57Å; Y2011-A2019 VanDerWaalsContact CD1-CB 3.48Å; Y2011-A2019 HydrophobicContact CD2-CB 4.19Å; Y2011-A2019 HydrophobicContact CE1-CB 3.57Å; Y2011-A2019 VanDerWaalsContact CE1-CB 3.47Å; Y2011-A2019 HydrophobicContact CE2-CB 4.15Å; Y2011-A2019 HydrophobicContact CG-CB 3.94Å; L2016-A2019 HydrophobicContact CB-CB 4.14Å; L2016-A2019 HydrophobicContact CD1-CB 4.37Å; L2016-A2019 PolarHBondContact O-N 3.07Å; A2019-N2021 VanDerWaalsContact C-N 3.34Å; A2019-N2021 PolarHBondContact O-N 3.05Å; A2019-G2022 CarbonylContact O-C 3.58Å; A2019-G2022 WeakPolarHBondContact O-CA 3.4Å; A2019-G2022 PolarHBondContact O-N 3.2Å; A2019-G2022 VanDerWaalsContact O-N 3.14Å; A2019-V2023 WeakPolarHBondContact O-CG2 3.39Å; A2019-V2023 PolarHBondContact O-N 3.22Å
2020A84.2Confident79.7Confident0.6 Ų0.657.8 Ų57.81%0.00530%0.297CS..Hα-helixtrans-63.2-40.8174.900000112.2L2008 L2016 E2017 E2018 G2022 V2023 L2024 L2045L2008-A2020 HydrophobicContact CD1-CB 3.79Å; L2008-A2020 WeakPolarHBondContact CD1-O 3.25Å; L2008-A2020 HydrophobicContact CD2-CB 4.18Å; L2008-A2020 WeakPolarHBondContact CD2-O 3.36Å; L2008-A2020 HydrophobicContact CG-CB 4.23Å; L2016-A2020 WeakPolarHBondContact O-CB 3.37Å; L2016-A2020 PolarHBondContact O-N 3.2Å; L2016-A2020 VanDerWaalsContact O-N 3.09Å; E2017-A2020 PolarHBondContact O-N 2.87Å; E2018-A2020 VanDerWaalsContact C-N 3.31Å; A2020-G2022 VanDerWaalsContact C-N 3.32Å; A2020-G2022 PolarHBondContact O-N 3.16Å; A2020-V2023 PolarHBondContact O-N 3.22Å; A2020-V2023 VanDerWaalsContact O-N 3.16Å; A2020-L2024 WeakPolarHBondContact O-CB 3.46Å; A2020-L2024 PolarHBondContact O-N 3.02Å; A2020-L2045 HydrophobicContact CB-CD2 3.42Å; A2020-L2045 VanDerWaalsContact CB-CD2 3.44Å
2021N81.2Confident78.2Confident62.6 Ų62.663.6 Ų63.634%0.33533%0.333SS..Hα-helixtrans-61-40.2171-82.6-43.1000111.7E2017 E2018 A2019 L2024 L2025 L2045E2017-N2021 VanDerWaalsContact O-CB 3.28Å; E2017-N2021 WeakPolarHBondContact O-CB 3.38Å; E2017-N2021 VanDerWaalsContact O-CG 3.26Å; E2017-N2021 PolarHBondContact O-N 3.17Å; E2017-N2021 PolarHBondContact O-ND2 3.19Å; E2017-N2021 VanDerWaalsContact O-ND2 3.15Å; E2018-N2021 WeakPolarHBondContact O-CB 3.38Å; E2018-N2021 PolarHBondContact O-N 3.18Å; A2019-N2021 VanDerWaalsContact C-N 3.34Å; A2019-N2021 PolarHBondContact O-N 3.05Å; N2021-L2024 PolarHBondContact O-N 3.28Å; N2021-L2025 VanDerWaalsContact O-CB 3.3Å; N2021-L2025 WeakPolarHBondContact O-CB 3.34Å; N2021-L2025 VanDerWaalsContact O-CG 3.28Å; N2021-L2025 WeakPolarHBondContact O-CG 3.41Å; N2021-L2025 PolarHBondContact O-N 3.13Å; N2021-L2045 WeakPolarHBondContact OD1-CB 3.44Å; N2021-L2045 WeakPolarHBondContact OD1-CD1 3.39Å; N2021-L2045 WeakPolarHBondContact OD1-CD2 3.4Å
2022G84.1Confident76.5Confident31.8 Ų31.870.7 Ų70.733%0.32837%0.367SS..Hα-helixtrans-60-44.9173.400000112.8E2018 A2019 A2020 L2025 Y2026E2018-G2022 PolarHBondContact O-N 3.28Å; A2019-G2022 CarbonylContact O-C 3.58Å; A2019-G2022 WeakPolarHBondContact O-CA 3.4Å; A2019-G2022 PolarHBondContact O-N 3.2Å; A2019-G2022 VanDerWaalsContact O-N 3.14Å; A2020-G2022 VanDerWaalsContact C-N 3.32Å; A2020-G2022 PolarHBondContact O-N 3.16Å; G2022-L2025 PolarHBondContact O-N 3.1Å; G2022-Y2026 VanDerWaalsContact O-CB 3.31Å; G2022-Y2026 WeakPolarHBondContact O-CB 3.39Å; G2022-Y2026 PolarHBondContact O-N 3.08Å
2023V83.6Confident75Confident13 Ų1373.6 Ų73.68%0.07938%0.379CS..Hα-helixtrans-64-42.5175.2176.90000111.2L2004 L2007 L2008 Y2011 A2019 A2020 L2025 Y2026 A2027L2004-V2023 HydrophobicContact CB-CG1 4.46Å; L2004-V2023 HydrophobicContact CD2-CG1 3.91Å; L2007-V2023 HydrophobicContact CB-CG1 4.47Å; L2007-V2023 HydrophobicContact CB-CG2 4.45Å; L2007-V2023 HydrophobicContact CD2-CG1 4.23Å; L2007-V2023 HydrophobicContact CD2-CG2 3.62Å; L2007-V2023 HydrophobicContact CG-CG2 4.19Å; L2008-V2023 HydrophobicContact CB-CG1 4.42Å; L2008-V2023 HydrophobicContact CD1-CB 4.18Å; L2008-V2023 HydrophobicContact CD1-CG1 4.17Å; L2008-V2023 HydrophobicContact CD2-CB 3.82Å; L2008-V2023 HydrophobicContact CD2-CG1 3.93Å; L2008-V2023 HydrophobicContact CG-CB 4.22Å; L2008-V2023 HydrophobicContact CG-CG1 3.78Å; Y2011-V2023 HydrophobicContact CD2-CG2 3.87Å; Y2011-V2023 HydrophobicContact CE2-CG2 3.57Å; Y2011-V2023 VanDerWaalsContact CE2-CG2 3.49Å; A2019-V2023 WeakPolarHBondContact O-CG2 3.39Å; A2019-V2023 PolarHBondContact O-N 3.22Å; A2020-V2023 PolarHBondContact O-N 3.22Å; A2020-V2023 VanDerWaalsContact O-N 3.16Å; V2023-L2025 VanDerWaalsContact C-N 3.32Å; V2023-L2025 PolarHBondContact O-N 3.3Å; V2023-Y2026 PolarHBondContact O-N 3.29Å; V2023-A2027 VanDerWaalsContact O-CB 3.27Å; V2023-A2027 WeakPolarHBondContact O-CB 3.45Å; V2023-A2027 PolarHBondContact O-N 3.29Å
2024L79.8Confident73.9Confident8 Ų878 Ų784%0.04240%0.398CS..Hα-helixtrans-62.9-42.7175.9-175.470.6000111.4L2008 A2020 N2021 Y2026 A2027 T2028 L2035 E2038 W2041 R2042 L2045L2008-L2024 HydrophobicContact CD1-CB 4.11Å; L2008-L2024 HydrophobicContact CD1-CD1 4.29Å; L2008-L2024 HydrophobicContact CD2-CB 4.42Å; A2020-L2024 WeakPolarHBondContact O-CB 3.46Å; A2020-L2024 PolarHBondContact O-N 3.02Å; N2021-L2024 PolarHBondContact O-N 3.28Å; L2024-Y2026 VanDerWaalsContact C-N 3.34Å; L2024-Y2026 PolarHBondContact O-N 2.99Å; L2024-A2027 WeakPolarHBondContact O-CB 3.47Å; L2024-A2027 PolarHBondContact O-N 3.36Å; L2024-T2028 HydrophobicContact CD1-CG2 4.34Å; L2024-T2028 HydrophobicContact CG-CG2 4.37Å; L2024-T2028 WeakPolarHBondContact O-CB 3.39Å; L2024-T2028 VanDerWaalsContact O-CG2 3.29Å; L2024-T2028 WeakPolarHBondContact O-CG2 3.41Å; L2024-T2028 PolarHBondContact O-N 3.17Å; L2024-T2028 PolarHBondContact O-OG1 3.28Å; L2024-L2035 HydrophobicContact CD1-CD1 4.11Å; L2024-L2035 HydrophobicContact CD1-CD2 4.21Å; L2024-E2038 HydrophobicContact CD1-CG 4.36Å; L2024-W2041 HydrophobicContact CD1-CB 4.05Å; L2024-R2042 HydrophobicContact CD2-CG 3.76Å; L2024-L2045 HydrophobicContact CB-CD1 3.91Å; L2024-L2045 HydrophobicContact CD2-CD1 3.57Å; L2024-L2045 HydrophobicContact CG-CD1 4.2Å
2025L79.1Confident72.8Confident89.2 Ų89.276.3 Ų76.347%0.46739%0.389SS..Hα-helixtrans-66.2-40.1178.2-153120.2000111.6N2021 G2022 V2023 A2027 T2028 R2029N2021-L2025 VanDerWaalsContact O-CB 3.3Å; N2021-L2025 WeakPolarHBondContact O-CB 3.34Å; N2021-L2025 VanDerWaalsContact O-CG 3.28Å; N2021-L2025 WeakPolarHBondContact O-CG 3.41Å; N2021-L2025 PolarHBondContact O-N 3.13Å; G2022-L2025 PolarHBondContact O-N 3.1Å; V2023-L2025 VanDerWaalsContact C-N 3.32Å; V2023-L2025 PolarHBondContact O-N 3.3Å; L2025-A2027 VanDerWaalsContact C-N 3.33Å; L2025-A2027 PolarHBondContact O-N 2.82Å; L2025-T2028 WeakPolarHBondContact CA-OG1 3.42Å; L2025-T2028 PolarHBondContact O-N 2.97Å; L2025-T2028 PolarHBondContact O-OG1 3.02Å; L2025-T2028 VanDerWaalsContact O-OG1 3.09Å; L2025-R2029 HydrophobicContact CD2-CG 4.33Å; L2025-R2029 WeakPolarHBondContact O-CB 3.39Å; L2025-R2029 VanDerWaalsContact O-CG 3.29Å; L2025-R2029 WeakPolarHBondContact O-CG 3.36Å; L2025-R2029 PolarHBondContact O-N 3.24Å; L2025-R2029 VanDerWaalsContact O-N 3.09Å
2026Y78.8Confident72Confident86.6 Ų86.675.4 Ų75.434%0.3439%0.394SS..Hα-helixtrans-61-47.3172.8-178.7-92000111.2F1989 P1999 L2004 G2022 V2023 L2024 T2028 R2029 S2030F1989-Y2026 HydrophobicContact CE2-CD1 4.41Å; F1989-Y2026 AromaticContact CE2-CE1 3.91Å; F1989-Y2026 HydrophobicContact CE2-CE1 4.1Å; F1989-Y2026 HydrophobicContact CZ-CD1 4.36Å; F1989-Y2026 AromaticContact CZ-CE1 3.76Å; F1989-Y2026 HydrophobicContact CZ-CE1 4.02Å; F1989-Y2026 AromaticContact CZ-CZ 3.99Å; P1999-Y2026 HydrophobicContact CG-CE1 3.89Å; L2004-Y2026 HydrophobicContact CD2-CD1 4.27Å; G2022-Y2026 VanDerWaalsContact O-CB 3.31Å; G2022-Y2026 WeakPolarHBondContact O-CB 3.39Å; G2022-Y2026 PolarHBondContact O-N 3.08Å; V2023-Y2026 PolarHBondContact O-N 3.29Å; L2024-Y2026 VanDerWaalsContact C-N 3.34Å; L2024-Y2026 PolarHBondContact O-N 2.99Å; Y2026-T2028 VanDerWaalsContact C-N 3.33Å; Y2026-T2028 PolarHBondContact O-N 3.36Å; Y2026-R2029 PolarHBondContact O-N 2.95Å; Y2026-S2030 VanDerWaalsContact O-CB 3.29Å; Y2026-S2030 WeakPolarHBondContact O-CB 3.24Å; Y2026-S2030 PolarHBondContact O-N 3.16Å; Y2026-S2030 VanDerWaalsContact O-N 3.1Å; Y2026-S2030 PolarHBondContact O-OG 3.16Å
2027A75.7Confident71.4Confident4.2 Ų4.276.6 Ų76.64%0.03540%0.401CS..Hα-helixtrans-65.5-35.7179.700000113.2L2004 V2023 L2024 L2025 R2029 T2031 L2035L2004-A2027 HydrophobicContact CD1-CB 4.03Å; V2023-A2027 VanDerWaalsContact O-CB 3.27Å; V2023-A2027 WeakPolarHBondContact O-CB 3.45Å; V2023-A2027 PolarHBondContact O-N 3.29Å; L2024-A2027 WeakPolarHBondContact O-CB 3.47Å; L2024-A2027 PolarHBondContact O-N 3.36Å; L2025-A2027 VanDerWaalsContact C-N 3.33Å; L2025-A2027 PolarHBondContact O-N 2.82Å; A2027-R2029 PolarHBondContact O-N 3.15Å; A2027-T2031 PolarHBondContact O-OG1 3.44Å; A2027-L2035 HydrophobicContact CB-CB 4.42Å; A2027-L2035 HydrophobicContact CB-CD1 3.59Å; A2027-L2035 HydrophobicContact CB-CD2 4.11Å; A2027-L2035 HydrophobicContact CB-CG 4.09Å
2028T72.7Confident71.1Confident57.2 Ų57.274.5 Ų74.535%0.35139%0.391SS..Hα-helixtrans-76.8-22.4176.844.10000113.5L2024 L2025 Y2026 E2038L2024-T2028 HydrophobicContact CD1-CG2 4.34Å; L2024-T2028 HydrophobicContact CG-CG2 4.37Å; L2024-T2028 WeakPolarHBondContact O-CB 3.39Å; L2024-T2028 VanDerWaalsContact O-CG2 3.29Å; L2024-T2028 WeakPolarHBondContact O-CG2 3.41Å; L2024-T2028 PolarHBondContact O-N 3.17Å; L2024-T2028 PolarHBondContact O-OG1 3.28Å; L2025-T2028 WeakPolarHBondContact CA-OG1 3.42Å; L2025-T2028 PolarHBondContact O-N 2.97Å; L2025-T2028 PolarHBondContact O-OG1 3.02Å; L2025-T2028 VanDerWaalsContact O-OG1 3.09Å; Y2026-T2028 VanDerWaalsContact C-N 3.33Å; Y2026-T2028 PolarHBondContact O-N 3.36Å; T2028-E2038 HydrophobicContact CG2-CG 4.3Å; T2028-E2038 WeakPolarHBondContact CG2-OE1 3.29Å
2029R71.4Confident71Confident184.2 Ų184.268.8 Ų68.870%0.69536%0.364SS*.Hα-helixtrans-78.1-29.5173.7-78.3178.6157.6-176.21113.1L2025 Y2026 A2027 T2031L2025-R2029 HydrophobicContact CD2-CG 4.33Å; L2025-R2029 WeakPolarHBondContact O-CB 3.39Å; L2025-R2029 VanDerWaalsContact O-CG 3.29Å; L2025-R2029 WeakPolarHBondContact O-CG 3.36Å; L2025-R2029 PolarHBondContact O-N 3.24Å; L2025-R2029 VanDerWaalsContact O-N 3.09Å; Y2026-R2029 PolarHBondContact O-N 2.95Å; A2027-R2029 PolarHBondContact O-N 3.15Å; R2029-T2031 PolarHBondContact O-N 3.15Å; R2029-T2031 VanDerWaalsContact O-N 3.16Å
2030S63.1Low70.8Confident49.2 Ų49.269.6 Ų69.634%0.34437%0.366SS..  trans-77.284.3-179.7-76.70000110.9Y2026 Q2032Y2026-S2030 VanDerWaalsContact O-CB 3.29Å; Y2026-S2030 WeakPolarHBondContact O-CB 3.24Å; Y2026-S2030 PolarHBondContact O-N 3.16Å; Y2026-S2030 VanDerWaalsContact O-N 3.1Å; Y2026-S2030 PolarHBondContact O-OG 3.16Å; S2030-Q2032 PolarHBondContact O-N 3.09Å; S2030-Q2032 VanDerWaalsContact O-N 3.1Å
2031T53.7Low70.4Confident123.2 Ų123.270.3 Ų70.376%0.75637%0.369SS*.THydrogen-bonded Turntrans-77.4-2.4-172.441.40000115.1A2027 R2029 D2033A2027-T2031 PolarHBondContact O-OG1 3.44Å; R2029-T2031 PolarHBondContact O-N 3.15Å; R2029-T2031 VanDerWaalsContact O-N 3.16Å; T2031-D2033 VanDerWaalsContact C-N 3.34Å; T2031-D2033 WeakPolarHBondContact CB-O 2.92Å; T2031-D2033 PolarHBondContact OG1-O 3.13Å
2032Q50.4Low70.4Confident171.6 Ų171.669.7 Ų69.780%0.80236%0.362SS*.THydrogen-bonded Turntrans-92.9-27.4-173.3-70.5-177.8-19.600114.2S2030S2030-Q2032 PolarHBondContact O-N 3.09Å; S2030-Q2032 VanDerWaalsContact O-N 3.1Å
2033D51.1Low70.2Confident108.2 Ų108.269.2 Ų69.258%0.57935%0.351SS*.  trans-123105.1178.5-78-36.6000110.8T2031 L2035T2031-D2033 VanDerWaalsContact C-N 3.34Å; T2031-D2033 WeakPolarHBondContact CB-O 2.92Å; T2031-D2033 PolarHBondContact OG1-O 3.13Å; D2033-L2035 PolarHBondContact O-N 3.33Å; D2033-L2035 VanDerWaalsContact O-N 3.13Å
2034K56.4Low69.9Low194.8 Ų194.873.2 Ų73.285%0.84737%0.367SS*.PPolyproline II helixtrans-60.1124169.8-70.4179.8179.8177.20108.5A2036K2034-A2036 PolarHBondContact O-N 2.95Å; K2034-A2036 VanDerWaalsContact O-N 3.15Å
2035L58.5Low69.7Low17.4 Ų17.473.4 Ų73.49%0.09137%0.369CS..PPolyproline II helixtrans-51.7130.8171.7-120.394.7000109.3P2001 L2004 L2008 L2024 A2027 D2033 N2037 E2038 W2041P2001-L2035 HydrophobicContact CB-CD1 4.49Å; L2004-L2035 HydrophobicContact CB-CD1 4.04Å; L2004-L2035 HydrophobicContact CB-CD2 4.37Å; L2004-L2035 HydrophobicContact CD1-CD1 4.11Å; L2008-L2035 HydrophobicContact CD1-CD2 4.13Å; L2008-L2035 HydrophobicContact CD2-CD2 4.37Å; L2024-L2035 HydrophobicContact CD1-CD1 4.11Å; L2024-L2035 HydrophobicContact CD1-CD2 4.21Å; A2027-L2035 HydrophobicContact CB-CB 4.42Å; A2027-L2035 HydrophobicContact CB-CD1 3.59Å; A2027-L2035 HydrophobicContact CB-CD2 4.11Å; A2027-L2035 HydrophobicContact CB-CG 4.09Å; D2033-L2035 PolarHBondContact O-N 3.33Å; D2033-L2035 VanDerWaalsContact O-N 3.13Å; L2035-N2037 PolarHBondContact O-N 3.18Å; L2035-N2037 VanDerWaalsContact O-N 3.15Å; L2035-E2038 PolarHBondContact O-N 2.91Å; L2035-W2041 VanDerWaalsContact CD2-CD1 3.5Å; L2035-W2041 HydrophobicContact CD2-CG 4.24Å
2036A62Low69.6Low72.2 Ų72.274 Ų7460%0.59737%0.368SS*.THydrogen-bonded Turntrans-57.5124.8168.700000108.8K2034K2034-A2036 PolarHBondContact O-N 2.95Å; K2034-A2036 VanDerWaalsContact O-N 3.15Å
2037N68.7Low69.7Low91.8 Ų91.872.5 Ų72.549%0.49137%0.367SS..THydrogen-bonded Turntrans67.242.6176.1-46.6-30.2000115.8L2035 E2039 V2040 W2041L2035-N2037 PolarHBondContact O-N 3.18Å; L2035-N2037 VanDerWaalsContact O-N 3.15Å; N2037-E2039 WeakPolarHBondContact CA-OE1 3.28Å; N2037-E2039 PolarHBondContact O-N 3.27Å; N2037-E2039 VanDerWaalsContact O-N 3.14Å; N2037-V2040 HydrophobicContact CB-CB 4.2Å; N2037-V2040 HydrophobicContact CB-CG2 4.03Å; N2037-V2040 WeakPolarHBondContact O-CB 3.06Å; N2037-V2040 PolarHBondContact O-N 2.98Å; N2037-V2040 VanDerWaalsContact O-N 3.08Å; N2037-W2041 VanDerWaalsContact O-CD1 3.25Å; N2037-W2041 PolarHBondContact O-N 3.23Å
2038E74.3Confident70.1Confident38.8 Ų38.873.9 Ų73.918%0.18137%0.371CS..Hα-helixtrans-47-40.2172.6-170.7-172.7161.900113L2024 T2028 L2035 V2040 W2041 R2042 L2054L2024-E2038 HydrophobicContact CD1-CG 4.36Å; T2028-E2038 HydrophobicContact CG2-CG 4.3Å; T2028-E2038 WeakPolarHBondContact CG2-OE1 3.29Å; L2035-E2038 PolarHBondContact O-N 2.91Å; E2038-V2040 VanDerWaalsContact C-N 3.33Å; E2038-V2040 PolarHBondContact O-N 3.16Å; E2038-W2041 WeakPolarHBondContact O-CB 3.41Å; E2038-W2041 PolarHBondContact O-N 3.2Å; E2038-R2042 HydrophobicContact CG-CG 4.37Å; E2038-R2042 WeakPolarHBondContact O-CG 3.21Å; E2038-R2042 PolarHBondContact O-N 3.16Å; E2038-R2042 IonicContact OE1-CZ 3.12Å; E2038-R2042 VanDerWaalsContact OE1-CZ 3.24Å; E2038-R2042 IonicContact OE1-NE 3.23Å; E2038-R2042 PolarHBondContact OE1-NE 3.19Å; E2038-R2042 IonicContact OE1-NH2 3.41Å; E2038-R2042 PolarHBondContact OE1-NH2 3.24Å; E2038-L2054 HydrophobicContact CB-CD1 4.29Å; E2038-L2054 HydrophobicContact CG-CD1 3.94Å
2039E78.5Confident70.6Confident10.8 Ų10.876.5 Ų76.55%0.0538%0.378CS..Hα-helixtrans-59.7-40.6178.763-76.9-172.300113.4N2037 W2041 R2042 E2043 L2054 Y2055 K2058N2037-E2039 WeakPolarHBondContact CA-OE1 3.28Å; N2037-E2039 PolarHBondContact O-N 3.27Å; N2037-E2039 VanDerWaalsContact O-N 3.14Å; E2039-W2041 VanDerWaalsContact C-N 3.3Å; E2039-W2041 PolarHBondContact O-N 3.24Å; E2039-R2042 PolarHBondContact O-N 3.22Å; E2039-E2043 VanDerWaalsContact O-CB 3.32Å; E2039-E2043 WeakPolarHBondContact O-CB 3.24Å; E2039-E2043 PolarHBondContact O-N 3.2Å; E2039-L2054 HydrophobicContact CB-CB 4.11Å; E2039-L2054 HydrophobicContact CB-CD1 4.33Å; E2039-Y2055 HydrophobicContact CB-CD1 4.21Å; E2039-Y2055 HydrophobicContact CB-CD2 4.41Å; E2039-Y2055 HydrophobicContact CB-CE1 3.86Å; E2039-Y2055 HydrophobicContact CB-CE2 4.09Å; E2039-Y2055 HydrophobicContact CB-CG 4.42Å; E2039-Y2055 HydrophobicContact CG-CD1 3.97Å; E2039-Y2055 HydrophobicContact CG-CE1 3.39Å; E2039-Y2055 VanDerWaalsContact CG-CE1 3.42Å; E2039-Y2055 HydrophobicContact CG-CE2 4.37Å; E2039-Y2055 HydrophobicContact CG-CG 4.29Å; E2039-K2058 HydrophobicContact CG-CD 4.44Å; E2039-K2058 IonicContact OE1-NZ 3.32Å; E2039-K2058 PolarHBondContact OE1-NZ 3.14Å; E2039-K2058 WeakPolarHBondContact OE2-CE 3.22Å; E2039-K2058 IonicContact OE2-NZ 3.8Å; E2039-K2058 PolarHBondContact OE2-NZ 3.14Å
2040V79.8Confident71.2Confident46.2 Ų46.269.3 Ų69.328%0.2836%0.355SS..Hα-helixtrans-70.2-32.2178.51790000110.5N2037 E2038 E2043 K2044 Y2055N2037-V2040 HydrophobicContact CB-CB 4.2Å; N2037-V2040 HydrophobicContact CB-CG2 4.03Å; N2037-V2040 WeakPolarHBondContact O-CB 3.06Å; N2037-V2040 PolarHBondContact O-N 2.98Å; N2037-V2040 VanDerWaalsContact O-N 3.08Å; E2038-V2040 VanDerWaalsContact C-N 3.33Å; E2038-V2040 PolarHBondContact O-N 3.16Å; V2040-E2043 WeakPolarHBondContact O-CB 3.38Å; V2040-K2044 HydrophobicContact CG1-CD 4.45Å; V2040-K2044 WeakPolarHBondContact O-CB 3.3Å; V2040-K2044 VanDerWaalsContact O-CG 3.29Å; V2040-K2044 WeakPolarHBondContact O-CG 3.3Å; V2040-K2044 PolarHBondContact O-N 3.32Å; V2040-K2044 VanDerWaalsContact O-N 3.07Å; V2040-Y2055 WeakPolarHBondContact CG2-OH 3.24Å
2041W76.1Confident72.3Confident16.2 Ų16.266.9 Ų66.96%0.06134%0.339CS..Hα-helixtrans-74.3-41.9176.8-69.5118.7000112.4S2005 L2008 T2009 L2024 L2035 N2037 E2038 E2039 E2043 K2044 L2045S2005-W2041 VanDerWaalsContact O-CH2 3.26Å; S2005-W2041 WeakPolarHBondContact O-CH2 3.23Å; S2005-W2041 WeakPolarHBondContact O-CZ2 3.39Å; S2005-W2041 WeakPolarHBondContact OG-CZ2 3.4Å; L2008-W2041 HydrophobicContact CB-CD2 4.16Å; L2008-W2041 HydrophobicContact CB-CE3 3.7Å; L2008-W2041 VanDerWaalsContact CB-CE3 3.49Å; L2008-W2041 HydrophobicContact CB-CH2 3.96Å; L2008-W2041 HydrophobicContact CB-CZ2 4.29Å; L2008-W2041 HydrophobicContact CB-CZ3 3.84Å; L2008-W2041 HydrophobicContact CD1-CB 4.41Å; L2008-W2041 HydrophobicContact CD1-CD2 3.57Å; L2008-W2041 HydrophobicContact CD1-CE3 4.11Å; L2008-W2041 HydrophobicContact CD1-CG 3.78Å; L2008-W2041 HydrophobicContact CD1-CZ2 4.38Å; L2008-W2041 HydrophobicContact CD1-CZ3 4.48Å; L2008-W2041 HydrophobicContact CD2-CB 3.95Å; L2008-W2041 HydrophobicContact CD2-CD2 3.16Å; L2008-W2041 VanDerWaalsContact CD2-CD2 3.4Å; L2008-W2041 HydrophobicContact CD2-CE3 3.14Å; L2008-W2041 HydrophobicContact CD2-CG 3.53Å; L2008-W2041 HydrophobicContact CD2-CH2 4.08Å; L2008-W2041 HydrophobicContact CD2-CZ2 4.13Å; L2008-W2041 HydrophobicContact CD2-CZ3 3.61Å; L2008-W2041 HydrophobicContact CG-CD2 4.19Å; L2008-W2041 HydrophobicContact CG-CE3 3.95Å; L2008-W2041 HydrophobicContact CG-CG 4.39Å; L2008-W2041 HydrophobicContact CG-CH2 4.12Å; L2008-W2041 HydrophobicContact CG-CZ2 4.45Å; L2008-W2041 HydrophobicContact CG-CZ3 4.14Å; L2008-W2041 VanDerWaalsContact CG-CZ3 3.5Å; T2009-W2041 WeakPolarHBondContact OG1-CH2 3.46Å; L2024-W2041 HydrophobicContact CD1-CB 4.05Å; L2035-W2041 VanDerWaalsContact CD2-CD1 3.5Å; L2035-W2041 HydrophobicContact CD2-CG 4.24Å; N2037-W2041 VanDerWaalsContact O-CD1 3.25Å; N2037-W2041 PolarHBondContact O-N 3.23Å; E2038-W2041 WeakPolarHBondContact O-CB 3.41Å; E2038-W2041 PolarHBondContact O-N 3.2Å; E2039-W2041 VanDerWaalsContact C-N 3.3Å; E2039-W2041 PolarHBondContact O-N 3.24Å; W2041-E2043 VanDerWaalsContact C-N 3.27Å; W2041-E2043 PolarHBondContact O-N 2.94Å; W2041-K2044 HydrophobicContact CD2-CD 4.45Å; W2041-K2044 HydrophobicContact CE3-CB 4.4Å; W2041-K2044 HydrophobicContact CE3-CD 3.63Å; W2041-K2044 HydrophobicContact CH2-CD 4.26Å; W2041-K2044 HydrophobicContact CZ3-CD 3.61Å; W2041-K2044 VanDerWaalsContact CZ3-CD 3.47Å; W2041-K2044 PolarHBondContact O-N 3.22Å; W2041-L2045 VanDerWaalsContact O-CB 3.3Å; W2041-L2045 WeakPolarHBondContact O-CB 3.37Å; W2041-L2045 WeakPolarHBondContact O-CD1 3.39Å; W2041-L2045 WeakPolarHBondContact O-CG 3.38Å; W2041-L2045 PolarHBondContact O-N 3.33Å
2042R80.7Confident73.9Confident48.4 Ų48.461.7 Ų61.718%0.18331%0.306CS..Hα-helixtrans-62.1-37.4172-69-173.9-179.3-88.3-3.2112.1L2024 E2038 E2039 L2045 H2046 D2047 S2050 A2051 L2054L2024-R2042 HydrophobicContact CD2-CG 3.76Å; E2038-R2042 HydrophobicContact CG-CG 4.37Å; E2038-R2042 WeakPolarHBondContact O-CG 3.21Å; E2038-R2042 PolarHBondContact O-N 3.16Å; E2038-R2042 IonicContact OE1-CZ 3.12Å; E2038-R2042 VanDerWaalsContact OE1-CZ 3.24Å; E2038-R2042 IonicContact OE1-NE 3.23Å; E2038-R2042 PolarHBondContact OE1-NE 3.19Å; E2038-R2042 IonicContact OE1-NH2 3.41Å; E2038-R2042 PolarHBondContact OE1-NH2 3.24Å; E2039-R2042 PolarHBondContact O-N 3.22Å; R2042-L2045 CarbonylContact O-C 3.56Å; R2042-L2045 PolarHBondContact O-N 3Å; R2042-H2046 PolarHBondContact O-N 2.97Å; R2042-H2046 VanDerWaalsContact O-N 3.17Å; R2042-D2047 HydrophobicContact CB-CB 4.25Å; R2042-D2047 IonicContact CZ-OD2 2.72Å; R2042-D2047 IonicContact NH1-OD2 3.35Å; R2042-D2047 PolarHBondContact NH1-OD2 3.24Å; R2042-D2047 PolarHBondContact O-N 3.33Å; R2042-S2050 WeakPolarHBondContact CD-OG 3.38Å; R2042-S2050 PolarHBondContact NH1-OG 3.12Å; R2042-S2050 VanDerWaalsContact NH1-OG 3.13Å; R2042-A2051 HydrophobicContact CB-CB 3.83Å; R2042-L2054 VanDerWaalsContact CD-CD1 3.48Å; R2042-L2054 HydrophobicContact CG-CD1 4.28Å
2043E81Confident75.7Confident21.6 Ų21.657.9 Ų57.910%0.10129%0.291CS..Hα-helixtrans-59.2-50.9171.5-168.7-167.615000111.3E2039 V2040 W2041 L2045 H2046 W2048 A2051 Y2055 R2076E2039-E2043 VanDerWaalsContact O-CB 3.32Å; E2039-E2043 WeakPolarHBondContact O-CB 3.24Å; E2039-E2043 PolarHBondContact O-N 3.2Å; V2040-E2043 WeakPolarHBondContact O-CB 3.38Å; W2041-E2043 VanDerWaalsContact C-N 3.27Å; W2041-E2043 PolarHBondContact O-N 2.94Å; E2043-L2045 VanDerWaalsContact C-N 3.27Å; E2043-L2045 PolarHBondContact O-N 3.18Å; E2043-H2046 PolarHBondContact O-N 3.05Å; E2043-H2046 VanDerWaalsContact O-N 3.13Å; E2043-W2048 HydrophobicContact CB-CZ3 4.37Å; E2043-W2048 HydrophobicContact CG-CE3 4.2Å; E2043-W2048 HydrophobicContact CG-CH2 4.34Å; E2043-W2048 HydrophobicContact CG-CZ3 3.54Å; E2043-W2048 VanDerWaalsContact CG-CZ3 3.48Å; E2043-W2048 WeakPolarHBondContact O-CH2 3.34Å; E2043-W2048 WeakPolarHBondContact O-CZ3 3.5Å; E2043-A2051 HydrophobicContact CB-CB 4.29Å; E2043-Y2055 HydrophobicContact CB-CE2 4.47Å; E2043-Y2055 WeakPolarHBondContact OE2-CE2 3.17Å; E2043-Y2055 PolarHBondContact OE2-OH 2.94Å; E2043-R2076 WeakPolarHBondContact OE1-CD 3.35Å; E2043-R2076 IonicContact OE1-CZ 3.36Å; E2043-R2076 VanDerWaalsContact OE1-CZ 3.24Å; E2043-R2076 IonicContact OE1-NE 3.07Å; E2043-R2076 PolarHBondContact OE1-NE 2.88Å; E2043-R2076 IonicContact OE1-NH1 2.94Å; E2043-R2076 PolarHBondContact OE1-NH1 3.17Å; E2043-R2076 IonicContact OE1-NH2 2.98Å; E2043-R2076 PolarHBondContact OE1-NH2 3.18Å; E2043-R2076 IonicContact OE2-CZ 3.09Å; E2043-R2076 IonicContact OE2-NE 2.77Å; E2043-R2076 IonicContact OE2-NH1 3.06Å; E2043-R2076 PolarHBondContact OE2-NH1 3.09Å; E2043-R2076 IonicContact OE2-NH2 3.48Å; E2043-R2076 PolarHBondContact OE2-NH2 2.96Å
2044K75.9Confident77.3Confident97.2 Ų97.254.4 Ų54.442%0.42327%0.272SS..Hα-helixtrans-64.8-25.5177.8-75.6175.1179.31790114.3V2040 W2041 H2046V2040-K2044 HydrophobicContact CG1-CD 4.45Å; V2040-K2044 WeakPolarHBondContact O-CB 3.3Å; V2040-K2044 VanDerWaalsContact O-CG 3.29Å; V2040-K2044 WeakPolarHBondContact O-CG 3.3Å; V2040-K2044 PolarHBondContact O-N 3.32Å; V2040-K2044 VanDerWaalsContact O-N 3.07Å; W2041-K2044 HydrophobicContact CD2-CD 4.45Å; W2041-K2044 HydrophobicContact CE3-CB 4.4Å; W2041-K2044 HydrophobicContact CE3-CD 3.63Å; W2041-K2044 HydrophobicContact CH2-CD 4.26Å; W2041-K2044 HydrophobicContact CZ3-CD 3.61Å; W2041-K2044 VanDerWaalsContact CZ3-CD 3.47Å; W2041-K2044 PolarHBondContact O-N 3.22Å; K2044-H2046 VanDerWaalsContact C-N 3.28Å
2045L76.3Confident78.8Confident12.6 Ų12.645.3 Ų45.37%0.06623%0.233CC..THydrogen-bonded Turntrans-929.8178.4-68.2167000113L2008 A2020 N2021 L2024 W2041 R2042 E2043 D2047L2008-L2045 HydrophobicContact CD1-CD1 4.45Å; L2008-L2045 HydrophobicContact CD2-CD1 4.34Å; A2020-L2045 HydrophobicContact CB-CD2 3.42Å; A2020-L2045 VanDerWaalsContact CB-CD2 3.44Å; N2021-L2045 WeakPolarHBondContact OD1-CB 3.44Å; N2021-L2045 WeakPolarHBondContact OD1-CD1 3.39Å; N2021-L2045 WeakPolarHBondContact OD1-CD2 3.4Å; L2024-L2045 HydrophobicContact CB-CD1 3.91Å; L2024-L2045 HydrophobicContact CD2-CD1 3.57Å; L2024-L2045 HydrophobicContact CG-CD1 4.2Å; W2041-L2045 VanDerWaalsContact O-CB 3.3Å; W2041-L2045 WeakPolarHBondContact O-CB 3.37Å; W2041-L2045 WeakPolarHBondContact O-CD1 3.39Å; W2041-L2045 WeakPolarHBondContact O-CG 3.38Å; W2041-L2045 PolarHBondContact O-N 3.33Å; R2042-L2045 CarbonylContact O-C 3.56Å; R2042-L2045 PolarHBondContact O-N 3Å; E2043-L2045 VanDerWaalsContact C-N 3.27Å; E2043-L2045 PolarHBondContact O-N 3.18Å; L2045-D2047 PolarHBondContact O-N 3.07Å; L2045-D2047 VanDerWaalsContact O-N 3.11Å
2046H77Confident80.1Confident100.6 Ų100.647.2 Ų47.247%0.46624%0.241SC..THydrogen-bonded Turntrans60.718.5178.9-57-53000115E2017 R2042 E2043 K2044 W2048E2017-H2046 IonicContact OE1-CD2 2.97Å; E2017-H2046 PolarHBondContact OE1-CD2 2.89Å; E2017-H2046 IonicContact OE1-NE2 3.31Å; E2017-H2046 IonicContact OE2-CD2 3.37Å; R2042-H2046 PolarHBondContact O-N 2.97Å; R2042-H2046 VanDerWaalsContact O-N 3.17Å; E2043-H2046 PolarHBondContact O-N 3.05Å; E2043-H2046 VanDerWaalsContact O-N 3.13Å; K2044-H2046 VanDerWaalsContact C-N 3.28Å; H2046-W2048 VanDerWaalsContact C-N 3.3Å; H2046-W2048 HydrophobicContact CB-CZ2 4.41Å; H2046-W2048 AromaticContact ND1-CE2 3.78Å; H2046-W2048 AromaticContact ND1-CH2 3.96Å; H2046-W2048 AromaticContact ND1-CZ2 3.25Å; H2046-W2048 VanDerWaalsContact ND1-CZ2 3.33Å; H2046-W2048 WeakPolarHBondContact ND1-CZ2 3.26Å; H2046-W2048 AromaticContact ND1-NE1 3.76Å; H2046-W2048 PolarHBondContact O-N 3.22Å; H2046-W2048 VanDerWaalsContact O-N 3.14Å; H2046-W2048 PolarHBondContact O-NE1 3.32Å
2047D80.9Confident81.2Confident56.6 Ų56.652.1 Ų52.130%0.30324%0.244SC..  trans-86.866.8170-175.39.3000110.5R2042 L2045 K2049 S2050 A2051R2042-D2047 HydrophobicContact CB-CB 4.25Å; R2042-D2047 IonicContact CZ-OD2 2.72Å; R2042-D2047 IonicContact NH1-OD2 3.35Å; R2042-D2047 PolarHBondContact NH1-OD2 3.24Å; R2042-D2047 PolarHBondContact O-N 3.33Å; L2045-D2047 PolarHBondContact O-N 3.07Å; L2045-D2047 VanDerWaalsContact O-N 3.11Å; D2047-K2049 VanDerWaalsContact C-N 3.31Å; D2047-K2049 PolarHBondContact O-N 3.1Å; D2047-K2049 VanDerWaalsContact O-N 3.15Å; D2047-S2050 VanDerWaalsContact CG-CB 3.43Å; D2047-S2050 VanDerWaalsContact CG-OG 3.29Å; D2047-S2050 PolarHBondContact O-N 3.02Å; D2047-S2050 PolarHBondContact O-OG 3.02Å; D2047-S2050 WeakPolarHBondContact OD1-CB 3.37Å; D2047-S2050 PolarHBondContact OD1-N 3.15Å; D2047-S2050 PolarHBondContact OD1-OG 3.17Å; D2047-S2050 WeakPolarHBondContact OD2-CB 3.44Å; D2047-S2050 PolarHBondContact OD2-OG 3.19Å; D2047-S2050 VanDerWaalsContact OD2-OG 3.08Å; D2047-A2051 VanDerWaalsContact O-CB 3.29Å; D2047-A2051 WeakPolarHBondContact O-CB 3.38Å; D2047-A2051 PolarHBondContact O-N 3.19Å; D2047-A2051 VanDerWaalsContact O-N 3.08Å
2048W84Confident81.9Confident33.6 Ų33.651 Ų5113%0.12724%0.235CC..Hα-helixtrans-63.4-30.5-171.6-54107000114E2043 H2046 L2052 C2077 A2080 L2081 E2226E2043-W2048 HydrophobicContact CB-CZ3 4.37Å; E2043-W2048 HydrophobicContact CG-CE3 4.2Å; E2043-W2048 HydrophobicContact CG-CH2 4.34Å; E2043-W2048 HydrophobicContact CG-CZ3 3.54Å; E2043-W2048 VanDerWaalsContact CG-CZ3 3.48Å; E2043-W2048 WeakPolarHBondContact O-CH2 3.34Å; E2043-W2048 WeakPolarHBondContact O-CZ3 3.5Å; H2046-W2048 VanDerWaalsContact C-N 3.3Å; H2046-W2048 HydrophobicContact CB-CZ2 4.41Å; H2046-W2048 AromaticContact ND1-CE2 3.78Å; H2046-W2048 AromaticContact ND1-CH2 3.96Å; H2046-W2048 AromaticContact ND1-CZ2 3.25Å; H2046-W2048 VanDerWaalsContact ND1-CZ2 3.33Å; H2046-W2048 WeakPolarHBondContact ND1-CZ2 3.26Å; H2046-W2048 AromaticContact ND1-NE1 3.76Å; H2046-W2048 PolarHBondContact O-N 3.22Å; H2046-W2048 VanDerWaalsContact O-N 3.14Å; H2046-W2048 PolarHBondContact O-NE1 3.32Å; W2048-L2052 VanDerWaalsContact O-CB 3.24Å; W2048-L2052 WeakPolarHBondContact O-CB 3.38Å; W2048-L2052 PolarHBondContact O-N 2.98Å; W2048-C2077 HydrophobicContact CE3-CB 4.49Å; W2048-A2080 HydrophobicContact CD2-CB 3.3Å; W2048-A2080 VanDerWaalsContact CE2-CB 3.42Å; W2048-A2080 HydrophobicContact CE3-CB 3.59Å; W2048-A2080 HydrophobicContact CG-CB 3.78Å; W2048-A2080 HydrophobicContact CH2-CB 3.88Å; W2048-A2080 HydrophobicContact CZ2-CB 3.63Å; W2048-A2080 VanDerWaalsContact CZ2-CB 3.49Å; W2048-A2080 HydrophobicContact CZ3-CB 3.85Å; W2048-L2081 HydrophobicContact CB-CD1 4.37Å; W2048-L2081 HydrophobicContact CB-CD2 3.87Å; W2048-L2081 HydrophobicContact CB-CG 3.86Å; W2048-E2226 PolarHBondContact NE1-OE1 3.18Å
2049K84Confident82.3Confident112 Ų11250.6 Ų50.649%0.48723%0.234SC..Hα-helixtrans-72-46.6-178.1-68.4-178.4-176.3171.10111.1D2047 L2052 N2053 L2081 G2259D2047-K2049 VanDerWaalsContact C-N 3.31Å; D2047-K2049 PolarHBondContact O-N 3.1Å; D2047-K2049 VanDerWaalsContact O-N 3.15Å; K2049-L2052 PolarHBondContact O-N 3.09Å; K2049-N2053 VanDerWaalsContact O-CG 3.27Å; K2049-N2053 PolarHBondContact O-N 3.16Å; K2049-N2053 VanDerWaalsContact O-N 3.14Å; K2049-N2053 PolarHBondContact O-ND2 3.13Å; K2049-N2053 PolarHBondContact O-OD1 2.99Å; K2049-L2081 HydrophobicContact CG-CD1 4.49Å; K2049-L2081 HydrophobicContact CG-CD2 3.85Å; K2049-G2259 PolarHBondContact NZ-O 3.24Å
2050S82.4Confident82.5Confident31.6 Ų31.657.1 Ų57.122%0.22126%0.264CS..Hα-helixtrans-71.5-37.2177.5290000111.3R2042 D2047 L2052 N2053 L2054R2042-S2050 WeakPolarHBondContact CD-OG 3.38Å; R2042-S2050 PolarHBondContact NH1-OG 3.12Å; R2042-S2050 VanDerWaalsContact NH1-OG 3.13Å; D2047-S2050 VanDerWaalsContact CG-CB 3.43Å; D2047-S2050 VanDerWaalsContact CG-OG 3.29Å; D2047-S2050 PolarHBondContact O-N 3.02Å; D2047-S2050 PolarHBondContact O-OG 3.02Å; D2047-S2050 WeakPolarHBondContact OD1-CB 3.37Å; D2047-S2050 PolarHBondContact OD1-N 3.15Å; D2047-S2050 PolarHBondContact OD1-OG 3.17Å; D2047-S2050 WeakPolarHBondContact OD2-CB 3.44Å; D2047-S2050 PolarHBondContact OD2-OG 3.19Å; D2047-S2050 VanDerWaalsContact OD2-OG 3.08Å; S2050-L2052 PolarHBondContact O-N 3.43Å; S2050-N2053 PolarHBondContact O-N 3.12Å; S2050-L2054 WeakPolarHBondContact O-CG 3.35Å; S2050-L2054 PolarHBondContact O-N 3.22Å
2051A86.3Confident82.6Confident0 Ų058 Ų580%027%0.267CS..Hα-helixtrans-58.2-47.1172.300000111.5R2042 E2043 D2047 N2053 L2054 Y2055R2042-A2051 HydrophobicContact CB-CB 3.83Å; E2043-A2051 HydrophobicContact CB-CB 4.29Å; D2047-A2051 VanDerWaalsContact O-CB 3.29Å; D2047-A2051 WeakPolarHBondContact O-CB 3.38Å; D2047-A2051 PolarHBondContact O-N 3.19Å; D2047-A2051 VanDerWaalsContact O-N 3.08Å; A2051-N2053 PolarHBondContact O-N 3.12Å; A2051-L2054 WeakPolarHBondContact O-CB 3.32Å; A2051-L2054 PolarHBondContact O-N 3.2Å; A2051-L2054 VanDerWaalsContact O-N 3.12Å; A2051-Y2055 HydrophobicContact CB-CD2 4.49Å; A2051-Y2055 HydrophobicContact CB-CE2 4.38Å; A2051-Y2055 WeakPolarHBondContact O-CD2 3.4Å; A2051-Y2055 PolarHBondContact O-N 3.1Å
2052L87.4Confident82.4Confident14 Ų1463.8 Ų63.87%0.07330%0.3CS..Hα-helixtrans-57-49.3176.2-178.764000111.7W2048 K2049 S2050 L2054 Y2055 E2056 R2074 C2077 L2078 L2081W2048-L2052 VanDerWaalsContact O-CB 3.24Å; W2048-L2052 WeakPolarHBondContact O-CB 3.38Å; W2048-L2052 PolarHBondContact O-N 2.98Å; K2049-L2052 PolarHBondContact O-N 3.09Å; S2050-L2052 PolarHBondContact O-N 3.43Å; L2052-L2054 VanDerWaalsContact C-N 3.29Å; L2052-L2054 PolarHBondContact O-N 3.16Å; L2052-Y2055 PolarHBondContact O-N 3.07Å; L2052-Y2055 VanDerWaalsContact O-N 3.16Å; L2052-E2056 HydrophobicContact CD1-CG 4.29Å; L2052-E2056 HydrophobicContact CG-CG 4.48Å; L2052-E2056 WeakPolarHBondContact O-CG 3.34Å; L2052-E2056 PolarHBondContact O-N 3.08Å; L2052-R2074 HydrophobicContact CD1-CG 3.72Å; L2052-C2077 HydrophobicContact CB-CB 4.05Å; L2052-C2077 HydrophobicContact CD1-CB 4.12Å; L2052-L2078 HydrophobicContact CD1-CD2 4.2Å; L2052-L2078 HydrophobicContact CD1-CG 4.23Å; L2052-L2078 HydrophobicContact CD2-CD2 4.12Å; L2052-L2081 HydrophobicContact CB-CD1 4.44Å; L2052-L2081 HydrophobicContact CD2-CD1 3.75Å
2053N87.8Confident82.1Confident90.8 Ų90.871.9 Ų71.949%0.48633%0.33SS..Hα-helixtrans-60.2-36.9178.6-68.7-14000112.5K2049 S2050 A2051 R2057K2049-N2053 VanDerWaalsContact O-CG 3.27Å; K2049-N2053 PolarHBondContact O-N 3.16Å; K2049-N2053 VanDerWaalsContact O-N 3.14Å; K2049-N2053 PolarHBondContact O-ND2 3.13Å; K2049-N2053 PolarHBondContact O-OD1 2.99Å; S2050-N2053 PolarHBondContact O-N 3.12Å; A2051-N2053 PolarHBondContact O-N 3.12Å; N2053-R2057 VanDerWaalsContact O-CB 3.31Å; N2053-R2057 WeakPolarHBondContact O-CB 3.39Å; N2053-R2057 WeakPolarHBondContact O-CD 3.41Å; N2053-R2057 VanDerWaalsContact O-CG 3.26Å; N2053-R2057 WeakPolarHBondContact O-CG 3.35Å; N2053-R2057 PolarHBondContact O-N 3.1Å; N2053-R2057 VanDerWaalsContact O-N 3.08Å
2054L84.7Confident81.6Confident35.2 Ų35.273.4 Ų73.418%0.18434%0.339CS..Hα-helixtrans-70.6-41.2175.4-70.6-179.4000112.1E2038 E2039 R2042 S2050 A2051 L2052 E2056 R2057 K2058E2038-L2054 HydrophobicContact CB-CD1 4.29Å; E2038-L2054 HydrophobicContact CG-CD1 3.94Å; E2039-L2054 HydrophobicContact CB-CB 4.11Å; E2039-L2054 HydrophobicContact CB-CD1 4.33Å; R2042-L2054 VanDerWaalsContact CD-CD1 3.48Å; R2042-L2054 HydrophobicContact CG-CD1 4.28Å; S2050-L2054 WeakPolarHBondContact O-CG 3.35Å; S2050-L2054 PolarHBondContact O-N 3.22Å; A2051-L2054 WeakPolarHBondContact O-CB 3.32Å; A2051-L2054 PolarHBondContact O-N 3.2Å; A2051-L2054 VanDerWaalsContact O-N 3.12Å; L2052-L2054 VanDerWaalsContact C-N 3.29Å; L2052-L2054 PolarHBondContact O-N 3.16Å; L2054-E2056 VanDerWaalsContact C-N 3.35Å; L2054-R2057 PolarHBondContact O-N 3.24Å; L2054-K2058 WeakPolarHBondContact O-CB 3.26Å; L2054-K2058 WeakPolarHBondContact O-CG 3.38Å; L2054-K2058 PolarHBondContact O-N 3.08Å
2055Y87.9Confident81.2Confident4.4 Ų4.478.5 Ų78.52%0.01736%0.361CS..Hα-helixtrans-62.3-43.5174.9-78.7-59.7000111.6E2039 V2040 E2043 A2051 L2052 K2058 L2059 L2070 G2073 C2077E2039-Y2055 HydrophobicContact CB-CD1 4.21Å; E2039-Y2055 HydrophobicContact CB-CD2 4.41Å; E2039-Y2055 HydrophobicContact CB-CE1 3.86Å; E2039-Y2055 HydrophobicContact CB-CE2 4.09Å; E2039-Y2055 HydrophobicContact CB-CG 4.42Å; E2039-Y2055 HydrophobicContact CG-CD1 3.97Å; E2039-Y2055 HydrophobicContact CG-CE1 3.39Å; E2039-Y2055 VanDerWaalsContact CG-CE1 3.42Å; E2039-Y2055 HydrophobicContact CG-CE2 4.37Å; E2039-Y2055 HydrophobicContact CG-CG 4.29Å; V2040-Y2055 WeakPolarHBondContact CG2-OH 3.24Å; E2043-Y2055 HydrophobicContact CB-CE2 4.47Å; E2043-Y2055 WeakPolarHBondContact OE2-CE2 3.17Å; E2043-Y2055 PolarHBondContact OE2-OH 2.94Å; A2051-Y2055 HydrophobicContact CB-CD2 4.49Å; A2051-Y2055 HydrophobicContact CB-CE2 4.38Å; A2051-Y2055 WeakPolarHBondContact O-CD2 3.4Å; A2051-Y2055 PolarHBondContact O-N 3.1Å; L2052-Y2055 PolarHBondContact O-N 3.07Å; L2052-Y2055 VanDerWaalsContact O-N 3.16Å; Y2055-K2058 PolarHBondContact O-N 2.87Å; Y2055-L2059 WeakPolarHBondContact O-CB 3.37Å; Y2055-L2059 WeakPolarHBondContact O-CD1 3.32Å; Y2055-L2059 VanDerWaalsContact O-CG 3.25Å; Y2055-L2059 WeakPolarHBondContact O-CG 3.44Å; Y2055-L2059 PolarHBondContact O-N 3.11Å; Y2055-L2070 HydrophobicContact CD1-CB 4.39Å; Y2055-L2070 HydrophobicContact CD1-CD2 3.86Å; Y2055-L2070 HydrophobicContact CE1-CD2 4.07Å; Y2055-G2073 VanDerWaalsContact CZ-CA 3.47Å; Y2055-C2077 VanDerWaalsContact CE2-SG 3.57Å
2056E87.5Confident81Confident57.4 Ų57.483.6 Ų83.627%0.26839%0.388SS..Hα-helixtrans-63.3-47.1178-71.6-177.6157.300111.4L2052 L2054 K2058 L2059 E2060 R2074L2052-E2056 HydrophobicContact CD1-CG 4.29Å; L2052-E2056 HydrophobicContact CG-CG 4.48Å; L2052-E2056 WeakPolarHBondContact O-CG 3.34Å; L2052-E2056 PolarHBondContact O-N 3.08Å; L2054-E2056 VanDerWaalsContact C-N 3.35Å; E2056-K2058 VanDerWaalsContact C-N 3.29Å; E2056-K2058 PolarHBondContact O-N 3.13Å; E2056-L2059 PolarHBondContact O-N 3.31Å; E2056-L2059 VanDerWaalsContact O-N 3.13Å; E2056-E2060 WeakPolarHBondContact O-CG 3.32Å; E2056-E2060 PolarHBondContact O-N 3.14Å; E2056-E2060 VanDerWaalsContact O-N 3.14Å; E2056-R2074 IonicContact OE1-CZ 3.18Å; E2056-R2074 VanDerWaalsContact OE1-CZ 3.31Å; E2056-R2074 IonicContact OE1-NE 3.25Å; E2056-R2074 PolarHBondContact OE1-NE 3.2Å; E2056-R2074 VanDerWaalsContact OE1-NE 3.1Å; E2056-R2074 IonicContact OE1-NH2 3.08Å; E2056-R2074 PolarHBondContact OE1-NH2 3.15Å
2057R85.1Confident81.1Confident175 Ų17581.6 Ų81.666%0.6638%0.378SS*.Hα-helixtrans-60.2-34.1174.1-109.3174.9-176.6167.72.4113.5N2053 L2054 D2061N2053-R2057 VanDerWaalsContact O-CB 3.31Å; N2053-R2057 WeakPolarHBondContact O-CB 3.39Å; N2053-R2057 WeakPolarHBondContact O-CD 3.41Å; N2053-R2057 VanDerWaalsContact O-CG 3.26Å; N2053-R2057 WeakPolarHBondContact O-CG 3.35Å; N2053-R2057 PolarHBondContact O-N 3.1Å; N2053-R2057 VanDerWaalsContact O-N 3.08Å; L2054-R2057 PolarHBondContact O-N 3.24Å; R2057-D2061 PolarHBondContact O-N 3.01Å
2058K82.1Confident81.1Confident67.4 Ų67.480.6 Ų80.629%0.29338%0.375SS..Hα-helixtrans-77.4-29.2175.9-78-170.8170.5-170.60112.9E2039 L2054 Y2055 E2056 E2060 D2061 I2064 L2070E2039-K2058 HydrophobicContact CG-CD 4.44Å; E2039-K2058 IonicContact OE1-NZ 3.32Å; E2039-K2058 PolarHBondContact OE1-NZ 3.14Å; E2039-K2058 WeakPolarHBondContact OE2-CE 3.22Å; E2039-K2058 IonicContact OE2-NZ 3.8Å; E2039-K2058 PolarHBondContact OE2-NZ 3.14Å; L2054-K2058 WeakPolarHBondContact O-CB 3.26Å; L2054-K2058 WeakPolarHBondContact O-CG 3.38Å; L2054-K2058 PolarHBondContact O-N 3.08Å; Y2055-K2058 PolarHBondContact O-N 2.87Å; E2056-K2058 VanDerWaalsContact C-N 3.29Å; E2056-K2058 PolarHBondContact O-N 3.13Å; K2058-E2060 VanDerWaalsContact C-N 3.29Å; K2058-D2061 WeakPolarHBondContact O-CB 3.35Å; K2058-D2061 PolarHBondContact O-N 3.05Å; K2058-D2061 VanDerWaalsContact O-N 3.16Å; K2058-I2064 HydrophobicContact CB-CD1 4.34Å; K2058-L2070 HydrophobicContact CB-CD1 3.95Å; K2058-L2070 HydrophobicContact CB-CD2 4.16Å; K2058-L2070 HydrophobicContact CD-CD2 4.11Å
2059L83.4Confident80.9Confident31.2 Ų31.282.7 Ų82.716%0.16340%0.395CS..Hα-helixtrans-70.7-29.6174.9-76.1164.7000112.1Y2055 E2056 D2061 K2067 L2070 I2071 R2074Y2055-L2059 WeakPolarHBondContact O-CB 3.37Å; Y2055-L2059 WeakPolarHBondContact O-CD1 3.32Å; Y2055-L2059 VanDerWaalsContact O-CG 3.25Å; Y2055-L2059 WeakPolarHBondContact O-CG 3.44Å; Y2055-L2059 PolarHBondContact O-N 3.11Å; E2056-L2059 PolarHBondContact O-N 3.31Å; E2056-L2059 VanDerWaalsContact O-N 3.13Å; L2059-D2061 VanDerWaalsContact C-N 3.27Å; L2059-D2061 PolarHBondContact O-N 3.18Å; L2059-K2067 HydrophobicContact CD2-CB 4.11Å; L2059-K2067 HydrophobicContact CD2-CD 4.36Å; L2059-K2067 HydrophobicContact CD2-CG 4.46Å; L2059-K2067 PolarHBondContact O-NZ 3.11Å; L2059-L2070 HydrophobicContact CD2-CB 3.71Å; L2059-L2070 HydrophobicContact CD2-CD1 4.39Å; L2059-L2070 HydrophobicContact CG-CB 4.04Å; L2059-I2071 HydrophobicContact CD2-CG1 3.87Å; L2059-R2074 HydrophobicContact CD1-CB 4.23Å; L2059-R2074 VanDerWaalsContact CD1-CD 3.49Å; L2059-R2074 HydrophobicContact CD1-CG 4.46Å
2060E83.3Confident80.9Confident147.4 Ų147.477.9 Ų77.969%0.68938%0.375SS*.THydrogen-bonded Turntrans-68.5-19.8169.9-68.6170.6179.700113.1E2056 K2058 D2062E2056-E2060 WeakPolarHBondContact O-CG 3.32Å; E2056-E2060 PolarHBondContact O-N 3.14Å; E2056-E2060 VanDerWaalsContact O-N 3.14Å; K2058-E2060 VanDerWaalsContact C-N 3.29Å; E2060-D2062 PolarHBondContact O-N 3.19Å
2061D80.2Confident81.1Confident64.2 Ų64.277.5 Ų77.534%0.34337%0.37SS..  trans-79.5103.9179.5-156.9-15.1000111.1R2057 K2058 L2059 R2063 I2064 K2067R2057-D2061 PolarHBondContact O-N 3.01Å; K2058-D2061 WeakPolarHBondContact O-CB 3.35Å; K2058-D2061 PolarHBondContact O-N 3.05Å; K2058-D2061 VanDerWaalsContact O-N 3.16Å; L2059-D2061 VanDerWaalsContact C-N 3.27Å; L2059-D2061 PolarHBondContact O-N 3.18Å; D2061-R2063 PolarHBondContact O-N 3.32Å; D2061-R2063 VanDerWaalsContact O-N 3.11Å; D2061-R2063 VanDerWaalsContact OD1-CB 3.28Å; D2061-R2063 WeakPolarHBondContact OD1-CB 3.34Å; D2061-R2063 WeakPolarHBondContact OD1-CD 3.36Å; D2061-R2063 VanDerWaalsContact OD1-CG 3.29Å; D2061-R2063 WeakPolarHBondContact OD1-CG 3.36Å; D2061-R2063 IonicContact OD1-CZ 3.13Å; D2061-R2063 PolarHBondContact OD1-N 3.19Å; D2061-R2063 VanDerWaalsContact OD1-N 3.11Å; D2061-R2063 IonicContact OD1-NE 3.02Å; D2061-R2063 PolarHBondContact OD1-NE 2.98Å; D2061-R2063 IonicContact OD1-NH2 2.76Å; D2061-R2063 IonicContact OD2-CZ 3.59Å; D2061-R2063 IonicContact OD2-NE 3.14Å; D2061-R2063 PolarHBondContact OD2-NE 3.01Å; D2061-R2063 IonicContact OD2-NH2 2.68Å; D2061-R2063 PolarHBondContact OD2-NH2 3.27Å; D2061-I2064 HydrophobicContact CB-CD1 4.36Å; D2061-I2064 HydrophobicContact CB-CG1 4.41Å; D2061-I2064 PolarHBondContact O-N 3.2Å; D2061-K2067 WeakPolarHBondContact O-CE 3.39Å
2062D73.6Confident81.2Confident139.4 Ų139.478.1 Ų78.175%0.74537%0.373SS*.THydrogen-bonded Turntrans-67.4-9-179.2-71.5-31.4000114.6E2060 I2064 K2067E2060-D2062 PolarHBondContact O-N 3.19Å; D2062-I2064 PolarHBondContact O-N 2.93Å; D2062-K2067 IonicContact OD1-NZ 3.17Å; D2062-K2067 PolarHBondContact OD1-NZ 3.17Å
2063R73Confident81.1Confident218.2 Ų218.277.4 Ų77.482%0.82337%0.37SS*.THydrogen-bonded Turntrans-69.9-21175.2-61174.7-159.2-1711.9112.5D2061 K2065D2061-R2063 PolarHBondContact O-N 3.32Å; D2061-R2063 VanDerWaalsContact O-N 3.11Å; D2061-R2063 VanDerWaalsContact OD1-CB 3.28Å; D2061-R2063 WeakPolarHBondContact OD1-CB 3.34Å; D2061-R2063 WeakPolarHBondContact OD1-CD 3.36Å; D2061-R2063 VanDerWaalsContact OD1-CG 3.29Å; D2061-R2063 WeakPolarHBondContact OD1-CG 3.36Å; D2061-R2063 IonicContact OD1-CZ 3.13Å; D2061-R2063 PolarHBondContact OD1-N 3.19Å; D2061-R2063 VanDerWaalsContact OD1-N 3.11Å; D2061-R2063 IonicContact OD1-NE 3.02Å; D2061-R2063 PolarHBondContact OD1-NE 2.98Å; D2061-R2063 IonicContact OD1-NH2 2.76Å; D2061-R2063 IonicContact OD2-CZ 3.59Å; D2061-R2063 IonicContact OD2-NE 3.14Å; D2061-R2063 PolarHBondContact OD2-NE 3.01Å; D2061-R2063 IonicContact OD2-NH2 2.68Å; D2061-R2063 PolarHBondContact OD2-NH2 3.27Å; R2063-K2065 PolarHBondContact O-N 3.18Å
2064I71.2Confident81.2Confident52.8 Ų52.876.5 Ų76.527%0.27136%0.359SS..  trans-88.3105.3-176.4-54.2-179.4000109.2K2058 D2061 D2062 D2066 K2067 L2070K2058-I2064 HydrophobicContact CB-CD1 4.34Å; D2061-I2064 HydrophobicContact CB-CD1 4.36Å; D2061-I2064 HydrophobicContact CB-CG1 4.41Å; D2061-I2064 PolarHBondContact O-N 3.2Å; D2062-I2064 PolarHBondContact O-N 2.93Å; I2064-D2066 WeakPolarHBondContact CG2-O 3.46Å; I2064-K2067 HydrophobicContact CG2-CG 4.36Å; I2064-K2067 VanDerWaalsContact O-CE 3.29Å; I2064-K2067 WeakPolarHBondContact O-CE 3.38Å; I2064-K2067 VanDerWaalsContact O-CG 3.28Å; I2064-K2067 WeakPolarHBondContact O-CG 3.34Å; I2064-L2070 HydrophobicContact CD1-CD1 3.78Å; I2064-L2070 HydrophobicContact CG2-CD1 4.01Å
2065K66.8Low81.5Confident203.6 Ų203.674.9 Ų74.989%0.88535%0.351SS*.SBendtrans-70.2-44.2-179.8-66.1-175.3179.4-178.10112.8R2063 K2067R2063-K2065 PolarHBondContact O-N 3.18Å; K2065-K2067 PolarHBondContact O-N 3.28Å
2066D72.4Confident81.5Confident119.2 Ų119.279.2 Ų79.264%0.63737%0.367SS*.  trans-94.786.2179.1-107.1-3.9000110.6I2064 S2068I2064-D2066 WeakPolarHBondContact CG2-O 3.46Å; D2066-S2068 VanDerWaalsContact C-N 3.3Å; D2066-S2068 PolarHBondContact O-N 3.1Å; D2066-S2068 WeakPolarHBondContact OD1-CB 3.31Å; D2066-S2068 PolarHBondContact OD1-N 2.96Å; D2066-S2068 VanDerWaalsContact OD1-N 3.12Å; D2066-S2068 PolarHBondContact OD1-OG 3.27Å; D2066-S2068 PolarHBondContact OD2-OG 3.48Å
2067K78.8Confident81.6Confident59.8 Ų59.876.5 Ų76.526%0.2635%0.354SS..  trans-77.6-4.8178.3-61-169.4-179.8-169.70113.1L2059 D2061 D2062 I2064 K2065 S2069 L2070 I2071L2059-K2067 HydrophobicContact CD2-CB 4.11Å; L2059-K2067 HydrophobicContact CD2-CD 4.36Å; L2059-K2067 HydrophobicContact CD2-CG 4.46Å; L2059-K2067 PolarHBondContact O-NZ 3.11Å; D2061-K2067 WeakPolarHBondContact O-CE 3.39Å; D2062-K2067 IonicContact OD1-NZ 3.17Å; D2062-K2067 PolarHBondContact OD1-NZ 3.17Å; I2064-K2067 HydrophobicContact CG2-CG 4.36Å; I2064-K2067 VanDerWaalsContact O-CE 3.29Å; I2064-K2067 WeakPolarHBondContact O-CE 3.38Å; I2064-K2067 VanDerWaalsContact O-CG 3.28Å; I2064-K2067 WeakPolarHBondContact O-CG 3.34Å; K2065-K2067 PolarHBondContact O-N 3.28Å; K2067-S2069 PolarHBondContact O-N 3.15Å; K2067-L2070 PolarHBondContact O-N 3.17Å; K2067-I2071 HydrophobicContact CB-CD1 4.34Å; K2067-I2071 VanDerWaalsContact O-CG1 3.27Å; K2067-I2071 WeakPolarHBondContact O-CG1 3.33Å; K2067-I2071 PolarHBondContact O-N 3.15Å
2068S80.2Confident81.8Confident35.8 Ų35.868.2 Ų68.225%0.2532%0.323SS..Hα-helixtrans-60.1-43.5-173.4-39.90000114.2D2066 L2070 I2071 L2072D2066-S2068 VanDerWaalsContact C-N 3.3Å; D2066-S2068 PolarHBondContact O-N 3.1Å; D2066-S2068 WeakPolarHBondContact OD1-CB 3.31Å; D2066-S2068 PolarHBondContact OD1-N 2.96Å; D2066-S2068 VanDerWaalsContact OD1-N 3.12Å; D2066-S2068 PolarHBondContact OD1-OG 3.27Å; D2066-S2068 PolarHBondContact OD2-OG 3.48Å; S2068-L2070 PolarHBondContact O-N 3.3Å; S2068-I2071 PolarHBondContact O-N 3.02Å; S2068-L2072 WeakPolarHBondContact O-CG 3.32Å; S2068-L2072 PolarHBondContact O-N 3.11Å
2069S81.3Confident82Confident77.6 Ų77.667.6 Ų67.654%0.54332%0.319SS..Hα-helixtrans-67.6-36.7179.258.50000112.4K2067 L2072 G2073K2067-S2069 PolarHBondContact O-N 3.15Å; S2069-L2072 PolarHBondContact O-N 3.32Å; S2069-G2073 PolarHBondContact O-N 3.06Å
2070L84.2Confident82Confident10.6 Ų10.666.3 Ų66.36%0.05531%0.313CS..Hα-helixtrans-69.4-39.3175.7-61.4174.9000111.6Y2055 K2058 L2059 I2064 K2067 S2068 L2072 G2073 R2074Y2055-L2070 HydrophobicContact CD1-CB 4.39Å; Y2055-L2070 HydrophobicContact CD1-CD2 3.86Å; Y2055-L2070 HydrophobicContact CE1-CD2 4.07Å; K2058-L2070 HydrophobicContact CB-CD1 3.95Å; K2058-L2070 HydrophobicContact CB-CD2 4.16Å; K2058-L2070 HydrophobicContact CD-CD2 4.11Å; L2059-L2070 HydrophobicContact CD2-CB 3.71Å; L2059-L2070 HydrophobicContact CD2-CD1 4.39Å; L2059-L2070 HydrophobicContact CG-CB 4.04Å; I2064-L2070 HydrophobicContact CD1-CD1 3.78Å; I2064-L2070 HydrophobicContact CG2-CD1 4.01Å; K2067-L2070 PolarHBondContact O-N 3.17Å; S2068-L2070 PolarHBondContact O-N 3.3Å; L2070-L2072 VanDerWaalsContact C-N 3.35Å; L2070-G2073 PolarHBondContact O-N 3Å; L2070-R2074 WeakPolarHBondContact O-CB 3.49Å; L2070-R2074 PolarHBondContact O-N 3.15Å
2071I85.9Confident82Confident22.8 Ų22.860.1 Ų60.112%0.11729%0.285CS..Hα-helixtrans-60.9-47.3173.6-67.7164.6000109.9L2059 K2067 S2068 G2073 R2074 M2075 M2090L2059-I2071 HydrophobicContact CD2-CG1 3.87Å; K2067-I2071 HydrophobicContact CB-CD1 4.34Å; K2067-I2071 VanDerWaalsContact O-CG1 3.27Å; K2067-I2071 WeakPolarHBondContact O-CG1 3.33Å; K2067-I2071 PolarHBondContact O-N 3.15Å; S2068-I2071 PolarHBondContact O-N 3.02Å; I2071-G2073 VanDerWaalsContact C-N 3.34Å; I2071-G2073 PolarHBondContact O-N 3.13Å; I2071-R2074 WeakPolarHBondContact O-CB 3.47Å; I2071-R2074 PolarHBondContact O-N 3.13Å; I2071-M2075 HydrophobicContact CG2-CG 4.46Å; I2071-M2075 HydrophobicContact CG2-SD 4.26Å; I2071-M2075 WeakPolarHBondContact O-CB 3.35Å; I2071-M2075 VanDerWaalsContact O-CG 3.29Å; I2071-M2075 WeakPolarHBondContact O-CG 3.4Å; I2071-M2075 PolarHBondContact O-N 3.09Å; I2071-M2090 HydrophobicContact CG2-CE 4.13Å; I2071-M2090 HydrophobicContact CG2-SD 4.38Å
2072L87.3Confident82.1Confident13.2 Ų13.257.2 Ų57.27%0.06927%0.27CS..Hα-helixtrans-59.4-42.5175.3-76.3174.8000112.4S2068 S2069 L2070 R2074 M2075 R2076 V2102 L2105 M2106 L2109S2068-L2072 WeakPolarHBondContact O-CG 3.32Å; S2068-L2072 PolarHBondContact O-N 3.11Å; S2069-L2072 PolarHBondContact O-N 3.32Å; L2070-L2072 VanDerWaalsContact C-N 3.35Å; L2072-R2074 PolarHBondContact O-N 2.94Å; L2072-M2075 WeakPolarHBondContact O-CB 3.46Å; L2072-M2075 PolarHBondContact O-N 3.2Å; L2072-R2076 WeakPolarHBondContact O-CG 3.41Å; L2072-R2076 PolarHBondContact O-N 3.09Å; L2072-R2076 PolarHBondContact O-NE 3.03Å; L2072-V2102 HydrophobicContact CD1-CG1 4.05Å; L2072-V2102 HydrophobicContact CD2-CG1 4.43Å; L2072-V2102 HydrophobicContact CG-CG1 4.24Å; L2072-L2105 HydrophobicContact CD1-CB 4.08Å; L2072-L2105 HydrophobicContact CD1-CD1 4.04Å; L2072-L2105 HydrophobicContact CD2-CB 4.1Å; L2072-M2106 HydrophobicContact CD2-CB 4.27Å; L2072-M2106 HydrophobicContact CD2-CG 3.66Å; L2072-M2106 VanDerWaalsContact CD2-CG 3.45Å; L2072-M2106 HydrophobicContact CG-CG 4.44Å; L2072-L2109 HydrophobicContact CD2-CD1 4.38Å
2073G86.3Confident82.6Confident0.2 Ų0.252.9 Ų52.90%0.00225%0.245CC..Hα-helixtrans-59.7-47.8174.500000112.5Y2055 S2069 L2070 I2071 M2075 R2076 C2077Y2055-G2073 VanDerWaalsContact CZ-CA 3.47Å; S2069-G2073 PolarHBondContact O-N 3.06Å; L2070-G2073 PolarHBondContact O-N 3Å; I2071-G2073 VanDerWaalsContact C-N 3.34Å; I2071-G2073 PolarHBondContact O-N 3.13Å; G2073-M2075 VanDerWaalsContact C-N 3.33Å; G2073-M2075 PolarHBondContact O-N 3.12Å; G2073-R2076 PolarHBondContact O-N 3.12Å; G2073-R2076 VanDerWaalsContact O-N 3.16Å; G2073-C2077 PolarHBondContact O-N 3.15Å; G2073-C2077 PolarHBondContact O-SG 3.22Å; G2073-C2077 VanDerWaalsContact O-SG 3.37Å
2074R89.9Confident83.3Confident72 Ų7244.1 Ų44.127%0.27221%0.212SC..Hα-helixtrans-58.2-44173.8-174.7172.9-174.3-146.98.1111.9L2052 E2056 L2059 L2070 I2071 L2072 R2076 C2077 L2078 M2090L2052-R2074 HydrophobicContact CD1-CG 3.72Å; E2056-R2074 IonicContact OE1-CZ 3.18Å; E2056-R2074 VanDerWaalsContact OE1-CZ 3.31Å; E2056-R2074 IonicContact OE1-NE 3.25Å; E2056-R2074 PolarHBondContact OE1-NE 3.2Å; E2056-R2074 VanDerWaalsContact OE1-NE 3.1Å; E2056-R2074 IonicContact OE1-NH2 3.08Å; E2056-R2074 PolarHBondContact OE1-NH2 3.15Å; L2059-R2074 HydrophobicContact CD1-CB 4.23Å; L2059-R2074 VanDerWaalsContact CD1-CD 3.49Å; L2059-R2074 HydrophobicContact CD1-CG 4.46Å; L2070-R2074 WeakPolarHBondContact O-CB 3.49Å; L2070-R2074 PolarHBondContact O-N 3.15Å; I2071-R2074 WeakPolarHBondContact O-CB 3.47Å; I2071-R2074 PolarHBondContact O-N 3.13Å; L2072-R2074 PolarHBondContact O-N 2.94Å; R2074-R2076 VanDerWaalsContact C-N 3.34Å; R2074-R2076 PolarHBondContact O-N 3.23Å; R2074-C2077 PolarHBondContact O-N 3.17Å; R2074-L2078 HydrophobicContact CG-CD1 4.16Å; R2074-L2078 HydrophobicContact CG-CG 4.42Å; R2074-L2078 WeakPolarHBondContact O-CB 3.5Å; R2074-L2078 WeakPolarHBondContact O-CG 3.4Å; R2074-L2078 PolarHBondContact O-N 2.86Å; R2074-M2090 HydrophobicContact CB-CE 4.36Å; R2074-M2090 HydrophobicContact CG-CE 4.07Å; R2074-M2090 HydrophobicContact CG-SD 4.16Å; R2074-M2090 VanDerWaalsContact CZ-CE 3.44Å; R2074-M2090 VanDerWaalsContact NH1-CE 3.31Å; R2074-M2090 PolarHBondContact NH1-SD 3.45Å; R2074-M2090 VanDerWaalsContact NH1-SD 3.44Å
2075M90Very high84.1Confident0 Ų043.8 Ų43.80%022%0.217CC..Hα-helixtrans-61.3-42.2177.5-72.4-178.779.500112.4I2071 L2072 G2073 L2078 R2079 L2087 M2090 A2091 M2106 L2109 A2110I2071-M2075 HydrophobicContact CG2-CG 4.46Å; I2071-M2075 HydrophobicContact CG2-SD 4.26Å; I2071-M2075 WeakPolarHBondContact O-CB 3.35Å; I2071-M2075 VanDerWaalsContact O-CG 3.29Å; I2071-M2075 WeakPolarHBondContact O-CG 3.4Å; I2071-M2075 PolarHBondContact O-N 3.09Å; L2072-M2075 WeakPolarHBondContact O-CB 3.46Å; L2072-M2075 PolarHBondContact O-N 3.2Å; G2073-M2075 VanDerWaalsContact C-N 3.33Å; G2073-M2075 PolarHBondContact O-N 3.12Å; M2075-L2078 PolarHBondContact O-N 3.2Å; M2075-R2079 WeakPolarHBondContact O-CB 3.36Å; M2075-R2079 PolarHBondContact O-N 3.2Å; M2075-L2087 HydrophobicContact CB-CD1 3.64Å; M2075-L2087 HydrophobicContact CE-CD1 3.75Å; M2075-L2087 HydrophobicContact CG-CD1 3.68Å; M2075-L2087 WeakPolarHBondContact O-CD1 3.31Å; M2075-M2090 HydrophobicContact CB-CE 4.13Å; M2075-M2090 HydrophobicContact CG-CE 3.11Å; M2075-M2090 HydrophobicContact CG-CG 4.49Å; M2075-M2090 HydrophobicContact CG-SD 3.81Å; M2075-M2090 HydrophobicContact SD-CE 4.36Å; M2075-A2091 HydrophobicContact CE-CB 3.84Å; M2075-M2106 HydrophobicContact CE-CB 4.21Å; M2075-M2106 HydrophobicContact CE-CE 4.03Å; M2075-M2106 HydrophobicContact CE-CG 4.2Å; M2075-M2106 HydrophobicContact SD-CB 4.25Å; M2075-M2106 HydrophobicContact SD-CE 3.7Å; M2075-M2106 VanDerWaalsContact SD-CE 3.58Å; M2075-M2106 HydrophobicContact SD-CG 3.73Å; M2075-M2106 HydrophobicContact SD-SD 4.28Å; M2075-L2109 HydrophobicContact CB-CB 4.44Å; M2075-L2109 HydrophobicContact CB-CD1 3.67Å; M2075-L2109 HydrophobicContact CE-CB 3.99Å; M2075-L2109 HydrophobicContact CE-CD1 4.43Å; M2075-L2109 HydrophobicContact SD-CD1 4.47Å; M2075-A2110 HydrophobicContact CE-CB 4.43Å
2076R89.6Confident85.2Confident95.2 Ų95.236.9 Ų36.936%0.35919%0.194SC..Hα-helixtrans-65.3-42.5176.6-70.3-179.4-99.3-1722.1111.6E2043 L2072 G2073 R2074 L2078 R2079 A2080 L2109E2043-R2076 WeakPolarHBondContact OE1-CD 3.35Å; E2043-R2076 IonicContact OE1-CZ 3.36Å; E2043-R2076 VanDerWaalsContact OE1-CZ 3.24Å; E2043-R2076 IonicContact OE1-NE 3.07Å; E2043-R2076 PolarHBondContact OE1-NE 2.88Å; E2043-R2076 IonicContact OE1-NH1 2.94Å; E2043-R2076 PolarHBondContact OE1-NH1 3.17Å; E2043-R2076 IonicContact OE1-NH2 2.98Å; E2043-R2076 PolarHBondContact OE1-NH2 3.18Å; E2043-R2076 IonicContact OE2-CZ 3.09Å; E2043-R2076 IonicContact OE2-NE 2.77Å; E2043-R2076 IonicContact OE2-NH1 3.06Å; E2043-R2076 PolarHBondContact OE2-NH1 3.09Å; E2043-R2076 IonicContact OE2-NH2 3.48Å; E2043-R2076 PolarHBondContact OE2-NH2 2.96Å; L2072-R2076 WeakPolarHBondContact O-CG 3.41Å; L2072-R2076 PolarHBondContact O-N 3.09Å; L2072-R2076 PolarHBondContact O-NE 3.03Å; G2073-R2076 PolarHBondContact O-N 3.12Å; G2073-R2076 VanDerWaalsContact O-N 3.16Å; R2074-R2076 VanDerWaalsContact C-N 3.34Å; R2074-R2076 PolarHBondContact O-N 3.23Å; R2076-L2078 VanDerWaalsContact C-N 3.32Å; R2076-L2078 PolarHBondContact O-N 3.03Å; R2076-R2079 PolarHBondContact O-N 3.18Å; R2076-A2080 VanDerWaalsContact O-CB 3.3Å; R2076-A2080 WeakPolarHBondContact O-CB 3.43Å; R2076-A2080 PolarHBondContact O-N 3.2Å; R2076-L2109 HydrophobicContact CG-CD1 3.75Å; R2076-L2109 HydrophobicContact CG-CD2 4.07Å; R2076-L2109 HydrophobicContact CG-CG 4.42Å
2077C88.9Confident86.1Confident0 Ų031.3 Ų31.30%016%0.163CC..Hα-helixtrans-60.8-43.8173.8-65.40000112.1W2048 L2052 Y2055 G2073 R2074 A2080 L2081W2048-C2077 HydrophobicContact CE3-CB 4.49Å; L2052-C2077 HydrophobicContact CB-CB 4.05Å; L2052-C2077 HydrophobicContact CD1-CB 4.12Å; Y2055-C2077 VanDerWaalsContact CE2-SG 3.57Å; G2073-C2077 PolarHBondContact O-N 3.15Å; G2073-C2077 PolarHBondContact O-SG 3.22Å; G2073-C2077 VanDerWaalsContact O-SG 3.37Å; R2074-C2077 PolarHBondContact O-N 3.17Å; C2077-A2080 PolarHBondContact O-N 3.13Å; C2077-L2081 VanDerWaalsContact O-CB 3.31Å; C2077-L2081 WeakPolarHBondContact O-CB 3.45Å; C2077-L2081 VanDerWaalsContact O-CG 3.23Å; C2077-L2081 WeakPolarHBondContact O-CG 3.32Å; C2077-L2081 PolarHBondContact O-N 3.2Å
2078L88.9Confident86.6Confident2.6 Ų2.628.7 Ų28.71%0.01415%0.152CC..Hα-helixtrans-65.9-40.1177.6-70.2172.5000112.4L2052 R2074 M2075 R2076 L2081 G2082 Q2083 P2086 L2087 M2090L2052-L2078 HydrophobicContact CD1-CD2 4.2Å; L2052-L2078 HydrophobicContact CD1-CG 4.23Å; L2052-L2078 HydrophobicContact CD2-CD2 4.12Å; R2074-L2078 HydrophobicContact CG-CD1 4.16Å; R2074-L2078 HydrophobicContact CG-CG 4.42Å; R2074-L2078 WeakPolarHBondContact O-CB 3.5Å; R2074-L2078 WeakPolarHBondContact O-CG 3.4Å; R2074-L2078 PolarHBondContact O-N 2.86Å; M2075-L2078 PolarHBondContact O-N 3.2Å; R2076-L2078 VanDerWaalsContact C-N 3.32Å; R2076-L2078 PolarHBondContact O-N 3.03Å; L2078-L2081 CarbonylContact O-C 3.54Å; L2078-L2081 PolarHBondContact O-N 3.07Å; L2078-G2082 PolarHBondContact O-N 3.21Å; L2078-G2082 VanDerWaalsContact O-N 3.1Å; L2078-Q2083 HydrophobicContact CB-CB 4.46Å; L2078-Q2083 HydrophobicContact CD2-CB 4.01Å; L2078-Q2083 HydrophobicContact CD2-CG 4.47Å; L2078-Q2083 PolarHBondContact O-N 3.29Å; L2078-P2086 HydrophobicContact CD1-CB 4.36Å; L2078-P2086 HydrophobicContact CD2-CB 4.38Å; L2078-P2086 HydrophobicContact CD2-CG 4.25Å; L2078-L2087 HydrophobicContact CB-CB 4.07Å; L2078-L2087 HydrophobicContact CB-CD1 4.35Å; L2078-L2087 HydrophobicContact CD1-CB 4.41Å; L2078-M2090 HydrophobicContact CD1-CE 3.75Å; L2078-M2090 VanDerWaalsContact CD1-CE 3.47Å; L2078-M2090 HydrophobicContact CD1-SD 4.48Å
2079R86.8Confident87.1Confident53.6 Ų53.631 Ų3120%0.20216%0.162CC..Hα-helixtrans-60.6-49.8173.7174.8175.6171170.3-7.1110.6M2075 R2076 L2081 G2082 W2084 L2087 P2108 L2109 S2112M2075-R2079 WeakPolarHBondContact O-CB 3.36Å; M2075-R2079 PolarHBondContact O-N 3.2Å; R2076-R2079 PolarHBondContact O-N 3.18Å; R2079-L2081 VanDerWaalsContact C-N 3.31Å; R2079-L2081 PolarHBondContact O-N 3.31Å; R2079-G2082 WeakPolarHBondContact O-CA 3.36Å; R2079-G2082 PolarHBondContact O-N 3.22Å; R2079-G2082 VanDerWaalsContact O-N 3.11Å; R2079-W2084 HydrophobicContact CB-CZ3 4.46Å; R2079-W2084 HydrophobicContact CG-CH2 4.2Å; R2079-W2084 HydrophobicContact CG-CZ3 4.02Å; R2079-L2087 HydrophobicContact CB-CD2 3.81Å; R2079-P2108 PolarHBondContact NH1-O 3.32Å; R2079-L2109 HydrophobicContact CB-CD2 4.4Å; R2079-L2109 VanDerWaalsContact CD-CD2 3.41Å; R2079-L2109 HydrophobicContact CG-CD2 4.48Å; R2079-S2112 PolarHBondContact NE-OG 3.43Å; R2079-S2112 PolarHBondContact NH1-OG 3.33Å
2080A82.7Confident87.5Confident4.6 Ų4.628.1 Ų28.14%0.03814%0.14CC..Hα-helixtrans-63.4-39.217900000111.7W2048 R2076 C2077 G2082 E2226 R2260W2048-A2080 HydrophobicContact CD2-CB 3.3Å; W2048-A2080 VanDerWaalsContact CE2-CB 3.42Å; W2048-A2080 HydrophobicContact CE3-CB 3.59Å; W2048-A2080 HydrophobicContact CG-CB 3.78Å; W2048-A2080 HydrophobicContact CH2-CB 3.88Å; W2048-A2080 HydrophobicContact CZ2-CB 3.63Å; W2048-A2080 VanDerWaalsContact CZ2-CB 3.49Å; W2048-A2080 HydrophobicContact CZ3-CB 3.85Å; R2076-A2080 VanDerWaalsContact O-CB 3.3Å; R2076-A2080 WeakPolarHBondContact O-CB 3.43Å; R2076-A2080 PolarHBondContact O-N 3.2Å; C2077-A2080 PolarHBondContact O-N 3.13Å; A2080-G2082 PolarHBondContact O-N 3.2Å; A2080-G2082 VanDerWaalsContact O-N 3.13Å; A2080-E2226 VanDerWaalsContact O-OE1 3.12Å; A2080-R2260 PolarHBondContact O-NE 3.05Å; A2080-R2260 PolarHBondContact O-NH1 3.05Å; A2080-R2260 PolarHBondContact O-NH2 3.29Å
2081L83.8Confident87.7Confident17.6 Ų17.627.6 Ų27.69%0.09214%0.137CC..Hα-helixtrans-71.2-10.5174.6-69.6169.3000113.7W2048 K2049 L2052 C2077 L2078 R2079 Q2083W2048-L2081 HydrophobicContact CB-CD1 4.37Å; W2048-L2081 HydrophobicContact CB-CD2 3.87Å; W2048-L2081 HydrophobicContact CB-CG 3.86Å; K2049-L2081 HydrophobicContact CG-CD1 4.49Å; K2049-L2081 HydrophobicContact CG-CD2 3.85Å; L2052-L2081 HydrophobicContact CB-CD1 4.44Å; L2052-L2081 HydrophobicContact CD2-CD1 3.75Å; C2077-L2081 VanDerWaalsContact O-CB 3.31Å; C2077-L2081 WeakPolarHBondContact O-CB 3.45Å; C2077-L2081 VanDerWaalsContact O-CG 3.23Å; C2077-L2081 WeakPolarHBondContact O-CG 3.32Å; C2077-L2081 PolarHBondContact O-N 3.2Å; L2078-L2081 CarbonylContact O-C 3.54Å; L2078-L2081 PolarHBondContact O-N 3.07Å; R2079-L2081 VanDerWaalsContact C-N 3.31Å; R2079-L2081 PolarHBondContact O-N 3.31Å; L2081-Q2083 VanDerWaalsContact C-N 3.3Å; L2081-Q2083 HydrophobicContact CB-CG 4.25Å; L2081-Q2083 PolarHBondContact O-N 2.82Å
2082G81.6Confident87.8Confident2.6 Ų2.631.5 Ų31.53%0.02715%0.151CC..THydrogen-bonded Turntrans70.123.7-176.800000113.9L2078 R2079 A2080 W2084L2078-G2082 PolarHBondContact O-N 3.21Å; L2078-G2082 VanDerWaalsContact O-N 3.1Å; R2079-G2082 WeakPolarHBondContact O-CA 3.36Å; R2079-G2082 PolarHBondContact O-N 3.22Å; R2079-G2082 VanDerWaalsContact O-N 3.11Å; A2080-G2082 PolarHBondContact O-N 3.2Å; A2080-G2082 VanDerWaalsContact O-N 3.13Å; G2082-W2084 VanDerWaalsContact C-N 3.33Å; G2082-W2084 VanDerWaalsContact O-CD1 3.3Å; G2082-W2084 PolarHBondContact O-N 3.01Å; G2082-W2084 VanDerWaalsContact O-N 3.14Å; G2082-W2084 PolarHBondContact O-NE1 3.1Å
2083Q85.8Confident87.8Confident49 Ų4937.1 Ų37.123%0.22918%0.176CC..  trans-87.376.8178.1-67.4-172.31.400110.4L2078 L2081 A2085 P2086 L2087L2078-Q2083 HydrophobicContact CB-CB 4.46Å; L2078-Q2083 HydrophobicContact CD2-CB 4.01Å; L2078-Q2083 HydrophobicContact CD2-CG 4.47Å; L2078-Q2083 PolarHBondContact O-N 3.29Å; L2081-Q2083 VanDerWaalsContact C-N 3.3Å; L2081-Q2083 HydrophobicContact CB-CG 4.25Å; L2081-Q2083 PolarHBondContact O-N 2.82Å; Q2083-A2085 PolarHBondContact O-N 2.69Å; Q2083-P2086 HydrophobicContact CB-CG 4.18Å; Q2083-P2086 WeakPolarHBondContact O-CD 3.43Å; Q2083-P2086 WeakPolarHBondContact O-CG 3.34Å; Q2083-L2087 WeakPolarHBondContact O-CB 3.34Å; Q2083-L2087 PolarHBondContact O-N 3.08Å
2084W87.1Confident87.8Confident33.2 Ų33.242.5 Ų42.513%0.12620%0.196CC..Hα-helixtrans-67.8-38.7-171.4-53.1116.3000114.2R2079 G2082 L2087 N2088 A2113 A2116 L2117 Q2233R2079-W2084 HydrophobicContact CB-CZ3 4.46Å; R2079-W2084 HydrophobicContact CG-CH2 4.2Å; R2079-W2084 HydrophobicContact CG-CZ3 4.02Å; G2082-W2084 VanDerWaalsContact C-N 3.33Å; G2082-W2084 VanDerWaalsContact O-CD1 3.3Å; G2082-W2084 PolarHBondContact O-N 3.01Å; G2082-W2084 VanDerWaalsContact O-N 3.14Å; G2082-W2084 PolarHBondContact O-NE1 3.1Å; W2084-L2087 HydrophobicContact CE3-CD2 4.21Å; W2084-L2087 HydrophobicContact CZ3-CD2 4.39Å; W2084-L2087 PolarHBondContact O-N 3.05Å; W2084-N2088 VanDerWaalsContact O-CB 3.27Å; W2084-N2088 WeakPolarHBondContact O-CB 3.34Å; W2084-N2088 PolarHBondContact O-N 3.17Å; W2084-A2113 HydrophobicContact CE3-CB 4Å; W2084-A2116 HydrophobicContact CB-CB 4.12Å; W2084-A2116 HydrophobicContact CD2-CB 3.58Å; W2084-A2116 VanDerWaalsContact CD2-CB 3.48Å; W2084-A2116 HydrophobicContact CE3-CB 4.13Å; W2084-A2116 HydrophobicContact CG-CB 3.57Å; W2084-A2116 HydrophobicContact CZ2-CB 4.42Å; W2084-L2117 HydrophobicContact CB-CD1 4.33Å; W2084-L2117 HydrophobicContact CB-CD2 4.21Å; W2084-L2117 HydrophobicContact CB-CG 4.06Å; W2084-Q2233 VanDerWaalsContact CZ2-NE2 3.27Å
2085A88.1Confident87.5Confident46.2 Ų46.240 Ų4038%0.38219%0.187SC..Hα-helixtrans-64.7-51.9-178.600000113.5Q2083 L2087 N2088 N2089 L2117Q2083-A2085 PolarHBondContact O-N 2.69Å; A2085-L2087 VanDerWaalsContact C-N 3.28Å; A2085-L2087 PolarHBondContact O-N 3.16Å; A2085-N2088 PolarHBondContact O-N 3.22Å; A2085-N2089 PolarHBondContact O-N 3.32Å; A2085-N2089 VanDerWaalsContact O-N 3.07Å; A2085-L2117 HydrophobicContact CB-CD1 4.47Å
2086P89.4Confident87.3Confident60 Ų6046 Ų4639%0.3922%0.219SC..Hα-helixtrans-59.1-38.2173-15.822.2000112.8L2078 Q2083 M2090L2078-P2086 HydrophobicContact CD1-CB 4.36Å; L2078-P2086 HydrophobicContact CD2-CB 4.38Å; L2078-P2086 HydrophobicContact CD2-CG 4.25Å; Q2083-P2086 HydrophobicContact CB-CG 4.18Å; Q2083-P2086 WeakPolarHBondContact O-CD 3.43Å; Q2083-P2086 WeakPolarHBondContact O-CG 3.34Å; P2086-M2090 VanDerWaalsContact O-CB 3.28Å; P2086-M2090 WeakPolarHBondContact O-CB 3.36Å; P2086-M2090 PolarHBondContact O-N 3.05Å; P2086-M2090 VanDerWaalsContact O-N 3.07Å
2087L90.6Very high86.9Confident0 Ų046.4 Ų46.40%023%0.229CC..Hα-helixtrans-64.7-46.5178.6178.756.5000112.3M2075 L2078 R2079 Q2083 W2084 A2085 M2090 A2091 A2113M2075-L2087 HydrophobicContact CB-CD1 3.64Å; M2075-L2087 HydrophobicContact CE-CD1 3.75Å; M2075-L2087 HydrophobicContact CG-CD1 3.68Å; M2075-L2087 WeakPolarHBondContact O-CD1 3.31Å; L2078-L2087 HydrophobicContact CB-CB 4.07Å; L2078-L2087 HydrophobicContact CB-CD1 4.35Å; L2078-L2087 HydrophobicContact CD1-CB 4.41Å; R2079-L2087 HydrophobicContact CB-CD2 3.81Å; Q2083-L2087 WeakPolarHBondContact O-CB 3.34Å; Q2083-L2087 PolarHBondContact O-N 3.08Å; W2084-L2087 HydrophobicContact CE3-CD2 4.21Å; W2084-L2087 HydrophobicContact CZ3-CD2 4.39Å; W2084-L2087 PolarHBondContact O-N 3.05Å; A2085-L2087 VanDerWaalsContact C-N 3.28Å; A2085-L2087 PolarHBondContact O-N 3.16Å; L2087-M2090 HydrophobicContact CD1-CE 4.24Å; L2087-M2090 PolarHBondContact O-N 3.22Å; L2087-A2091 VanDerWaalsContact O-CB 3.27Å; L2087-A2091 WeakPolarHBondContact O-CB 3.4Å; L2087-A2091 PolarHBondContact O-N 3.22Å; L2087-A2113 HydrophobicContact CB-CB 4.09Å; L2087-A2113 HydrophobicContact CD2-CB 3.7Å; L2087-A2113 HydrophobicContact CG-CB 3.66Å
2088N90.3Very high86.5Confident5.4 Ų5.447.1 Ų47.13%0.02923%0.233CC..Hα-helixtrans-66.9-39.3179.8-175.831.6000112W2084 A2085 A2091 W2092 A2113 L2117 R2122W2084-N2088 VanDerWaalsContact O-CB 3.27Å; W2084-N2088 WeakPolarHBondContact O-CB 3.34Å; W2084-N2088 PolarHBondContact O-N 3.17Å; A2085-N2088 PolarHBondContact O-N 3.22Å; N2088-A2091 PolarHBondContact O-N 3.29Å; N2088-W2092 VanDerWaalsContact O-CB 3.31Å; N2088-W2092 WeakPolarHBondContact O-CB 3.3Å; N2088-W2092 PolarHBondContact O-N 3.2Å; N2088-A2113 HydrophobicContact CB-CB 4.1Å; N2088-L2117 HydrophobicContact CB-CD1 3.53Å; N2088-L2117 VanDerWaalsContact CB-CD1 3.47Å; N2088-L2117 VanDerWaalsContact ND2-CD1 3.3Å; N2088-L2117 WeakPolarHBondContact ND2-CD1 3.41Å; N2088-R2122 VanDerWaalsContact CG-NH1 3.31Å; N2088-R2122 PolarHBondContact ND2-NH1 3.18Å; N2088-R2122 WeakPolarHBondContact OD1-CD 3.43Å; N2088-R2122 PolarHBondContact OD1-NH1 3.05Å
2089N91.4Very high86.3Confident84.6 Ų84.652.5 Ų52.545%0.45226%0.261SS..Hα-helixtrans-65.5-47.3176.1-69.7-9.7000111.2A2085 A2091 W2092 E2093A2085-N2089 PolarHBondContact O-N 3.32Å; A2085-N2089 VanDerWaalsContact O-N 3.07Å; N2089-A2091 VanDerWaalsContact C-N 3.33Å; N2089-A2091 PolarHBondContact O-N 2.89Å; N2089-W2092 PolarHBondContact O-N 3.14Å; N2089-E2093 WeakPolarHBondContact O-CB 3.18Å; N2089-E2093 WeakPolarHBondContact O-CG 3.41Å; N2089-E2093 PolarHBondContact O-N 3.22Å
2090M88.2Confident86.1Confident16.4 Ų16.455.5 Ų55.58%0.08128%0.281CS..Hα-helixtrans-62.4-40.3177-173.1-17929.200112.2I2071 R2074 M2075 L2078 P2086 L2087 W2092 R2094I2071-M2090 HydrophobicContact CG2-CE 4.13Å; I2071-M2090 HydrophobicContact CG2-SD 4.38Å; R2074-M2090 HydrophobicContact CB-CE 4.36Å; R2074-M2090 HydrophobicContact CG-CE 4.07Å; R2074-M2090 HydrophobicContact CG-SD 4.16Å; R2074-M2090 VanDerWaalsContact CZ-CE 3.44Å; R2074-M2090 VanDerWaalsContact NH1-CE 3.31Å; R2074-M2090 PolarHBondContact NH1-SD 3.45Å; R2074-M2090 VanDerWaalsContact NH1-SD 3.44Å; M2075-M2090 HydrophobicContact CB-CE 4.13Å; M2075-M2090 HydrophobicContact CG-CE 3.11Å; M2075-M2090 HydrophobicContact CG-CG 4.49Å; M2075-M2090 HydrophobicContact CG-SD 3.81Å; M2075-M2090 HydrophobicContact SD-CE 4.36Å; L2078-M2090 HydrophobicContact CD1-CE 3.75Å; L2078-M2090 VanDerWaalsContact CD1-CE 3.47Å; L2078-M2090 HydrophobicContact CD1-SD 4.48Å; P2086-M2090 VanDerWaalsContact O-CB 3.28Å; P2086-M2090 WeakPolarHBondContact O-CB 3.36Å; P2086-M2090 PolarHBondContact O-N 3.05Å; P2086-M2090 VanDerWaalsContact O-N 3.07Å; L2087-M2090 HydrophobicContact CD1-CE 4.24Å; L2087-M2090 PolarHBondContact O-N 3.22Å; M2090-W2092 VanDerWaalsContact C-N 3.33Å; M2090-W2092 PolarHBondContact O-N 3Å; M2090-R2094 WeakPolarHBondContact O-CB 3.4Å; M2090-R2094 WeakPolarHBondContact O-CG 3.49Å; M2090-R2094 PolarHBondContact O-N 3.02Å; M2090-R2094 VanDerWaalsContact O-N 3.13Å
2091A88.7Confident86.1Confident0 Ų062.9 Ų62.90%032%0.316CS..Hα-helixtrans-60.9-44.1175.900000111.3M2075 L2087 N2088 N2089 W2095 M2106 A2110M2075-A2091 HydrophobicContact CE-CB 3.84Å; L2087-A2091 VanDerWaalsContact O-CB 3.27Å; L2087-A2091 WeakPolarHBondContact O-CB 3.4Å; L2087-A2091 PolarHBondContact O-N 3.22Å; N2088-A2091 PolarHBondContact O-N 3.29Å; N2089-A2091 VanDerWaalsContact C-N 3.33Å; N2089-A2091 PolarHBondContact O-N 2.89Å; A2091-W2095 WeakPolarHBondContact O-CA 3.35Å; A2091-W2095 VanDerWaalsContact O-CB 3.3Å; A2091-W2095 WeakPolarHBondContact O-CB 3.45Å; A2091-W2095 PolarHBondContact O-N 3.25Å; A2091-W2095 VanDerWaalsContact O-N 3.14Å; A2091-M2106 HydrophobicContact CB-CE 3.96Å; A2091-M2106 WeakPolarHBondContact O-CE 3.37Å; A2091-A2110 HydrophobicContact CB-CB 3.8Å
2092W88.7Confident86.1Confident105.4 Ų105.463.2 Ų63.240%0.39932%0.318SS..Hα-helixtrans-68.1-46.9-178.9-174.7-100.9000113N2088 N2089 M2090 R2094 W2095 R2122 R2125 Y2126N2088-W2092 VanDerWaalsContact O-CB 3.31Å; N2088-W2092 WeakPolarHBondContact O-CB 3.3Å; N2088-W2092 PolarHBondContact O-N 3.2Å; N2089-W2092 PolarHBondContact O-N 3.14Å; M2090-W2092 VanDerWaalsContact C-N 3.33Å; M2090-W2092 PolarHBondContact O-N 3Å; W2092-R2094 VanDerWaalsContact C-N 3.3Å; W2092-R2094 PolarHBondContact O-N 3.16Å; W2092-W2095 PolarHBondContact O-N 3.04Å; W2092-R2122 HydrophobicContact CE3-CG 4.09Å; W2092-R2122 HydrophobicContact CH2-CG 4.39Å; W2092-R2122 HydrophobicContact CZ3-CB 4.4Å; W2092-R2122 HydrophobicContact CZ3-CG 3.88Å; W2092-R2125 VanDerWaalsContact CH2-NH1 3.29Å; W2092-Y2126 WeakPolarHBondContact CA-OH 3.32Å; W2092-Y2126 HydrophobicContact CE3-CE1 4.49Å; W2092-Y2126 PolarHBondContact N-OH 3.08Å
2093E88Confident86.3Confident130 Ų13065.7 Ų65.761%0.60733%0.327SS*.Hα-helixtrans-60.1-40.1179.3-74.1171.2-167.800112.2N2089N2089-E2093 WeakPolarHBondContact O-CB 3.18Å; N2089-E2093 WeakPolarHBondContact O-CG 3.41Å; N2089-E2093 PolarHBondContact O-N 3.22Å
2094R84.6Confident86.3Confident113.2 Ų113.265.5 Ų65.543%0.42733%0.333SS..Hα-helixtrans-96.1-4.3-174-59.8-57.6-175175.1-0.2114.5M2090 W2092 N2096 D2097 V2098 M2106M2090-R2094 WeakPolarHBondContact O-CB 3.4Å; M2090-R2094 WeakPolarHBondContact O-CG 3.49Å; M2090-R2094 PolarHBondContact O-N 3.02Å; M2090-R2094 VanDerWaalsContact O-N 3.13Å; W2092-R2094 VanDerWaalsContact C-N 3.3Å; W2092-R2094 PolarHBondContact O-N 3.16Å; R2094-N2096 VanDerWaalsContact C-N 3.3Å; R2094-N2096 PolarHBondContact O-N 3.32Å; R2094-N2096 VanDerWaalsContact O-N 3.16Å; R2094-D2097 WeakPolarHBondContact CD-OD2 3.36Å; R2094-D2097 IonicContact CZ-OD2 3.46Å; R2094-D2097 IonicContact NE-OD2 3.8Å; R2094-D2097 IonicContact NH1-OD2 3.25Å; R2094-D2097 PolarHBondContact NH1-OD2 2.96Å; R2094-D2097 VanDerWaalsContact NH1-OD2 3.09Å; R2094-D2097 PolarHBondContact O-N 3.16Å; R2094-D2097 VanDerWaalsContact O-N 3.11Å; R2094-V2098 HydrophobicContact CB-CG2 4.38Å; R2094-V2098 VanDerWaalsContact O-CG2 3.23Å; R2094-V2098 WeakPolarHBondContact O-CG2 3.36Å; R2094-V2098 PolarHBondContact O-N 3.06Å; R2094-M2106 HydrophobicContact CB-CE 4.35Å
2095W85.4Confident86.2Confident21.2 Ų21.268.9 Ų68.98%0.0835%0.353CS..THydrogen-bonded Turntrans-57.4-39.9-173.5-167.3-105.7000113.5A2091 W2092 R2103 M2106 A2107 A2110 Y2126 A2129A2091-W2095 WeakPolarHBondContact O-CA 3.35Å; A2091-W2095 VanDerWaalsContact O-CB 3.3Å; A2091-W2095 WeakPolarHBondContact O-CB 3.45Å; A2091-W2095 PolarHBondContact O-N 3.25Å; A2091-W2095 VanDerWaalsContact O-N 3.14Å; W2092-W2095 PolarHBondContact O-N 3.04Å; W2095-R2103 HydrophobicContact CD2-CG 3.93Å; W2095-R2103 VanDerWaalsContact CE2-CD 3.45Å; W2095-R2103 HydrophobicContact CE3-CG 4.02Å; W2095-R2103 HydrophobicContact CH2-CB 4.44Å; W2095-R2103 HydrophobicContact CH2-CG 3.54Å; W2095-R2103 VanDerWaalsContact CH2-CG 3.43Å; W2095-R2103 HydrophobicContact CZ2-CB 4.48Å; W2095-R2103 VanDerWaalsContact CZ2-CD 3.45Å; W2095-R2103 HydrophobicContact CZ2-CG 3.41Å; W2095-R2103 HydrophobicContact CZ3-CG 3.84Å; W2095-R2103 PolarHBondContact O-NE 3.29Å; W2095-R2103 PolarHBondContact O-NH2 2.87Å; W2095-M2106 HydrophobicContact CE3-CE 4.24Å; W2095-M2106 HydrophobicContact CE3-CG 4.38Å; W2095-M2106 HydrophobicContact CE3-SD 4.05Å; W2095-M2106 HydrophobicContact CZ3-CB 4.15Å; W2095-M2106 HydrophobicContact CZ3-CG 4.15Å; W2095-M2106 HydrophobicContact CZ3-SD 4.35Å; W2095-A2107 HydrophobicContact CH2-CB 3.82Å; W2095-A2107 HydrophobicContact CZ3-CB 4.33Å; W2095-A2110 HydrophobicContact CZ3-CB 4.13Å; W2095-Y2126 AromaticContact CD2-CD1 3.72Å; W2095-Y2126 HydrophobicContact CD2-CD1 3.72Å; W2095-Y2126 AromaticContact CD2-CE1 3.53Å; W2095-Y2126 HydrophobicContact CD2-CE1 3.53Å; W2095-Y2126 VanDerWaalsContact CD2-CE1 3.5Å; W2095-Y2126 AromaticContact CE2-CD1 3.59Å; W2095-Y2126 AromaticContact CE2-CE1 3.87Å; W2095-Y2126 AromaticContact CE3-CD1 3.69Å; W2095-Y2126 HydrophobicContact CE3-CD1 3.69Å; W2095-Y2126 AromaticContact CE3-CE1 3.53Å; W2095-Y2126 HydrophobicContact CE3-CE1 3.53Å; W2095-Y2126 VanDerWaalsContact CE3-CE1 3.45Å; W2095-Y2126 HydrophobicContact CG-CD1 4.48Å; W2095-Y2126 AromaticContact CG-CE1 3.98Å; W2095-Y2126 HydrophobicContact CG-CE1 4.06Å; W2095-Y2126 AromaticContact CH2-CD1 3.44Å; W2095-Y2126 HydrophobicContact CH2-CD1 3.44Å; W2095-Y2126 VanDerWaalsContact CH2-CD1 3.44Å; W2095-Y2126 HydrophobicContact CH2-CE1 4.18Å; W2095-Y2126 HydrophobicContact CH2-CG 4.1Å; W2095-Y2126 AromaticContact CZ2-CD1 3.48Å; W2095-Y2126 HydrophobicContact CZ2-CD1 3.48Å; W2095-Y2126 VanDerWaalsContact CZ2-CD1 3.46Å; W2095-Y2126 HydrophobicContact CZ2-CE1 4.2Å; W2095-Y2126 HydrophobicContact CZ2-CG 4.35Å; W2095-Y2126 AromaticContact CZ3-CD1 3.55Å; W2095-Y2126 HydrophobicContact CZ3-CD1 3.55Å; W2095-Y2126 VanDerWaalsContact CZ3-CD1 3.48Å; W2095-Y2126 AromaticContact CZ3-CE1 3.87Å; W2095-Y2126 HydrophobicContact CZ3-CE1 3.87Å; W2095-Y2126 HydrophobicContact CZ3-CG 4.3Å; W2095-A2129 HydrophobicContact CH2-CB 4.1Å; W2095-A2129 HydrophobicContact CZ2-CB 3.8Å
2096N83.9Confident86.2Confident124.2 Ų124.266.8 Ų66.866%0.66434%0.335SS*.THydrogen-bonded Turntrans-86.9-21.2-176.8-58.5-33.7000112.9R2094 V2098 R2103 R2125R2094-N2096 VanDerWaalsContact C-N 3.3Å; R2094-N2096 PolarHBondContact O-N 3.32Å; R2094-N2096 VanDerWaalsContact O-N 3.16Å; N2096-V2098 VanDerWaalsContact C-N 3.29Å; N2096-V2098 PolarHBondContact O-N 3.01Å; N2096-R2103 PolarHBondContact O-NH2 3.47Å; N2096-R2103 VanDerWaalsContact O-NH2 3.08Å; N2096-R2125 PolarHBondContact OD1-NH2 2.87Å
2097D82.2Confident86.2Confident105.6 Ų105.663.9 Ų63.957%0.56532%0.317SS*.THydrogen-bonded Turntrans-77.5-18.7-178.1-67.3-10.2000112.9R2094R2094-D2097 WeakPolarHBondContact CD-OD2 3.36Å; R2094-D2097 IonicContact CZ-OD2 3.46Å; R2094-D2097 IonicContact NE-OD2 3.8Å; R2094-D2097 IonicContact NH1-OD2 3.25Å; R2094-D2097 PolarHBondContact NH1-OD2 2.96Å; R2094-D2097 VanDerWaalsContact NH1-OD2 3.09Å; R2094-D2097 PolarHBondContact O-N 3.16Å; R2094-D2097 VanDerWaalsContact O-N 3.11Å
2098V81.1Confident86.2Confident13.8 Ų13.864.7 Ų64.78%0.08432%0.322CS..SBendtrans-104.7145.6-165.9-173.90000111.7R2094 N2096 V2102 R2103 M2106R2094-V2098 HydrophobicContact CB-CG2 4.38Å; R2094-V2098 VanDerWaalsContact O-CG2 3.23Å; R2094-V2098 WeakPolarHBondContact O-CG2 3.36Å; R2094-V2098 PolarHBondContact O-N 3.06Å; N2096-V2098 VanDerWaalsContact C-N 3.29Å; N2096-V2098 PolarHBondContact O-N 3.01Å; V2098-V2102 HydrophobicContact CB-CB 4.09Å; V2098-V2102 HydrophobicContact CB-CG1 3.8Å; V2098-V2102 HydrophobicContact CG1-CB 3.28Å; V2098-V2102 HydrophobicContact CG1-CG1 3.33Å; V2098-V2102 HydrophobicContact CG1-CG2 4.32Å; V2098-V2102 HydrophobicContact CG2-CG1 4.25Å; V2098-R2103 HydrophobicContact CG1-CG 4.47Å; V2098-R2103 HydrophobicContact CG2-CB 4.08Å; V2098-R2103 HydrophobicContact CG2-CG 4.36Å; V2098-R2103 VanDerWaalsContact O-CZ 3.27Å; V2098-R2103 PolarHBondContact O-NE 3.41Å; V2098-R2103 PolarHBondContact O-NH2 3.04Å; V2098-M2106 HydrophobicContact CB-SD 4.36Å; V2098-M2106 HydrophobicContact CG1-SD 3.97Å; V2098-M2106 HydrophobicContact CG2-CE 4.46Å; V2098-M2106 HydrophobicContact CG2-SD 4.08Å
2099N83.1Confident86.1Confident115.4 Ų115.465.2 Ų65.262%0.61732%0.324SS*.  trans-62.3155.2176.6-51-0.4000112.8Q2101 V2102 R2103N2099-Q2101 VanDerWaalsContact C-N 3.29Å; N2099-Q2101 PolarHBondContact O-N 3.15Å; N2099-Q2101 VanDerWaalsContact O-N 3.15Å; N2099-Q2101 PolarHBondContact OD1-N 3.3Å; N2099-V2102 HydrophobicContact CB-CG2 4.5Å; N2099-V2102 PolarHBondContact O-N 3.17Å; N2099-V2102 WeakPolarHBondContact OD1-CB 3.28Å; N2099-V2102 WeakPolarHBondContact OD1-CG2 3.22Å; N2099-V2102 PolarHBondContact OD1-N 3.39Å; N2099-R2103 WeakPolarHBondContact O-CB 3.24Å; N2099-R2103 PolarHBondContact O-N 3.16Å
2100D82.9Confident86.1Confident116.4 Ų116.461.1 Ų61.162%0.62230%0.303SS*.Hα-helixtrans-56.4-37.4-176.9-61.3-13.6000113.7V2102 R2103 A2104D2100-V2102 VanDerWaalsContact C-N 3.32Å; D2100-V2102 PolarHBondContact O-N 3.13Å; D2100-R2103 WeakPolarHBondContact O-CB 3.37Å; D2100-R2103 PolarHBondContact O-N 3.25Å; D2100-R2103 IonicContact OD1-CZ 3.32Å; D2100-R2103 IonicContact OD1-NH1 3.1Å; D2100-R2103 PolarHBondContact OD1-NH1 3.32Å; D2100-R2103 IonicContact OD1-NH2 3.32Å; D2100-R2103 PolarHBondContact OD1-NH2 3.26Å; D2100-A2104 WeakPolarHBondContact O-CB 3.45Å; D2100-A2104 PolarHBondContact O-N 3.3Å
2101Q83Confident86.2Confident161.6 Ų161.660.4 Ų60.476%0.75530%0.299SS*.Hα-helixtrans-64.7-42.3177.6-133.9178.36.700112.3N2099 R2103 A2104 L2105N2099-Q2101 VanDerWaalsContact C-N 3.29Å; N2099-Q2101 PolarHBondContact O-N 3.15Å; N2099-Q2101 VanDerWaalsContact O-N 3.15Å; N2099-Q2101 PolarHBondContact OD1-N 3.3Å; Q2101-R2103 VanDerWaalsContact C-N 3.32Å; Q2101-A2104 PolarHBondContact O-N 3.16Å; Q2101-L2105 WeakPolarHBondContact O-CG 3.5Å; Q2101-L2105 PolarHBondContact O-N 3.14Å
2102V83.2Confident86.2Confident22.4 Ų22.460.5 Ų60.514%0.13630%0.3CS..Hα-helixtrans-73.9-34.4177.3177.70000109.7L2072 V2098 N2099 D2100 A2104 L2105 M2106L2072-V2102 HydrophobicContact CD1-CG1 4.05Å; L2072-V2102 HydrophobicContact CD2-CG1 4.43Å; L2072-V2102 HydrophobicContact CG-CG1 4.24Å; V2098-V2102 HydrophobicContact CB-CB 4.09Å; V2098-V2102 HydrophobicContact CB-CG1 3.8Å; V2098-V2102 HydrophobicContact CG1-CB 3.28Å; V2098-V2102 HydrophobicContact CG1-CG1 3.33Å; V2098-V2102 HydrophobicContact CG1-CG2 4.32Å; V2098-V2102 HydrophobicContact CG2-CG1 4.25Å; N2099-V2102 HydrophobicContact CB-CG2 4.5Å; N2099-V2102 PolarHBondContact O-N 3.17Å; N2099-V2102 WeakPolarHBondContact OD1-CB 3.28Å; N2099-V2102 WeakPolarHBondContact OD1-CG2 3.22Å; N2099-V2102 PolarHBondContact OD1-N 3.39Å; D2100-V2102 VanDerWaalsContact C-N 3.32Å; D2100-V2102 PolarHBondContact O-N 3.13Å; V2102-A2104 VanDerWaalsContact C-N 3.32Å; V2102-A2104 PolarHBondContact O-N 3.18Å; V2102-L2105 CarbonylContact O-C 3.53Å; V2102-L2105 WeakPolarHBondContact O-CA 3.3Å; V2102-L2105 WeakPolarHBondContact O-CB 3.29Å; V2102-L2105 PolarHBondContact O-N 3.06Å; V2102-L2105 VanDerWaalsContact O-N 3.09Å; V2102-M2106 HydrophobicContact CG1-CG 4.27Å; V2102-M2106 HydrophobicContact CG1-SD 4.1Å; V2102-M2106 WeakPolarHBondContact O-CB 3.48Å; V2102-M2106 VanDerWaalsContact O-CG 3.3Å; V2102-M2106 WeakPolarHBondContact O-CG 3.33Å; V2102-M2106 PolarHBondContact O-N 2.99Å
2103R86.7Confident86.2Confident56.2 Ų56.255.5 Ų55.521%0.21228%0.281CS..Hα-helixtrans-59.1-42.8173-147.3-178.3-71.4124.59.8111.7W2095 N2096 V2098 N2099 D2100 Q2101 L2105 M2106 A2107 A2129W2095-R2103 HydrophobicContact CD2-CG 3.93Å; W2095-R2103 VanDerWaalsContact CE2-CD 3.45Å; W2095-R2103 HydrophobicContact CE3-CG 4.02Å; W2095-R2103 HydrophobicContact CH2-CB 4.44Å; W2095-R2103 HydrophobicContact CH2-CG 3.54Å; W2095-R2103 VanDerWaalsContact CH2-CG 3.43Å; W2095-R2103 HydrophobicContact CZ2-CB 4.48Å; W2095-R2103 VanDerWaalsContact CZ2-CD 3.45Å; W2095-R2103 HydrophobicContact CZ2-CG 3.41Å; W2095-R2103 HydrophobicContact CZ3-CG 3.84Å; W2095-R2103 PolarHBondContact O-NE 3.29Å; W2095-R2103 PolarHBondContact O-NH2 2.87Å; N2096-R2103 PolarHBondContact O-NH2 3.47Å; N2096-R2103 VanDerWaalsContact O-NH2 3.08Å; V2098-R2103 HydrophobicContact CG1-CG 4.47Å; V2098-R2103 HydrophobicContact CG2-CB 4.08Å; V2098-R2103 HydrophobicContact CG2-CG 4.36Å; V2098-R2103 VanDerWaalsContact O-CZ 3.27Å; V2098-R2103 PolarHBondContact O-NE 3.41Å; V2098-R2103 PolarHBondContact O-NH2 3.04Å; N2099-R2103 WeakPolarHBondContact O-CB 3.24Å; N2099-R2103 PolarHBondContact O-N 3.16Å; D2100-R2103 WeakPolarHBondContact O-CB 3.37Å; D2100-R2103 PolarHBondContact O-N 3.25Å; D2100-R2103 IonicContact OD1-CZ 3.32Å; D2100-R2103 IonicContact OD1-NH1 3.1Å; D2100-R2103 PolarHBondContact OD1-NH1 3.32Å; D2100-R2103 IonicContact OD1-NH2 3.32Å; D2100-R2103 PolarHBondContact OD1-NH2 3.26Å; Q2101-R2103 VanDerWaalsContact C-N 3.32Å; R2103-L2105 VanDerWaalsContact C-N 3.29Å; R2103-L2105 PolarHBondContact O-N 3.07Å; R2103-M2106 WeakPolarHBondContact O-CB 3.32Å; R2103-M2106 PolarHBondContact O-N 3.19Å; R2103-M2106 VanDerWaalsContact O-N 3.15Å; R2103-A2107 VanDerWaalsContact O-CB 3.28Å; R2103-A2107 WeakPolarHBondContact O-CB 3.38Å; R2103-A2107 PolarHBondContact O-N 3.12Å; R2103-A2129 HydrophobicContact CG-CB 4.15Å
2104A85.4Confident86.4Confident43.4 Ų43.449.3 Ų49.336%0.35925%0.252SS..Hα-helixtrans-61.4-34.7174.600000113D2100 Q2101 V2102 P2108D2100-A2104 WeakPolarHBondContact O-CB 3.45Å; D2100-A2104 PolarHBondContact O-N 3.3Å; Q2101-A2104 PolarHBondContact O-N 3.16Å; V2102-A2104 VanDerWaalsContact C-N 3.32Å; V2102-A2104 PolarHBondContact O-N 3.18Å; A2104-P2108 VanDerWaalsContact O-CD 3.27Å; A2104-P2108 WeakPolarHBondContact O-CD 3.4Å
2105L84.9Confident86.6Confident106 Ų10644.1 Ų44.156%0.55523%0.232SC*.Hα-helixtrans-77.3-30.7174.5-65.6174.7000113.1L2072 Q2101 V2102 R2103L2072-L2105 HydrophobicContact CD1-CB 4.08Å; L2072-L2105 HydrophobicContact CD1-CD1 4.04Å; L2072-L2105 HydrophobicContact CD2-CB 4.1Å; Q2101-L2105 WeakPolarHBondContact O-CG 3.5Å; Q2101-L2105 PolarHBondContact O-N 3.14Å; V2102-L2105 CarbonylContact O-C 3.53Å; V2102-L2105 WeakPolarHBondContact O-CA 3.3Å; V2102-L2105 WeakPolarHBondContact O-CB 3.29Å; V2102-L2105 PolarHBondContact O-N 3.06Å; V2102-L2105 VanDerWaalsContact O-N 3.09Å; R2103-L2105 VanDerWaalsContact C-N 3.29Å; R2103-L2105 PolarHBondContact O-N 3.07Å
2106M88.4Confident86.6Confident1.2 Ų1.244.6 Ų44.61%0.00624%0.241CC..Hα-helixtrans-74.2-31.6175.2-87.2177.476.300111.9L2072 M2075 A2091 R2094 W2095 V2098 V2102 R2103 L2109 A2110L2072-M2106 HydrophobicContact CD2-CB 4.27Å; L2072-M2106 HydrophobicContact CD2-CG 3.66Å; L2072-M2106 VanDerWaalsContact CD2-CG 3.45Å; L2072-M2106 HydrophobicContact CG-CG 4.44Å; M2075-M2106 HydrophobicContact CE-CB 4.21Å; M2075-M2106 HydrophobicContact CE-CE 4.03Å; M2075-M2106 HydrophobicContact CE-CG 4.2Å; M2075-M2106 HydrophobicContact SD-CB 4.25Å; M2075-M2106 HydrophobicContact SD-CE 3.7Å; M2075-M2106 VanDerWaalsContact SD-CE 3.58Å; M2075-M2106 HydrophobicContact SD-CG 3.73Å; M2075-M2106 HydrophobicContact SD-SD 4.28Å; A2091-M2106 HydrophobicContact CB-CE 3.96Å; A2091-M2106 WeakPolarHBondContact O-CE 3.37Å; R2094-M2106 HydrophobicContact CB-CE 4.35Å; W2095-M2106 HydrophobicContact CE3-CE 4.24Å; W2095-M2106 HydrophobicContact CE3-CG 4.38Å; W2095-M2106 HydrophobicContact CE3-SD 4.05Å; W2095-M2106 HydrophobicContact CZ3-CB 4.15Å; W2095-M2106 HydrophobicContact CZ3-CG 4.15Å; W2095-M2106 HydrophobicContact CZ3-SD 4.35Å; V2098-M2106 HydrophobicContact CB-SD 4.36Å; V2098-M2106 HydrophobicContact CG1-SD 3.97Å; V2098-M2106 HydrophobicContact CG2-CE 4.46Å; V2098-M2106 HydrophobicContact CG2-SD 4.08Å; V2102-M2106 HydrophobicContact CG1-CG 4.27Å; V2102-M2106 HydrophobicContact CG1-SD 4.1Å; V2102-M2106 WeakPolarHBondContact O-CB 3.48Å; V2102-M2106 VanDerWaalsContact O-CG 3.3Å; V2102-M2106 WeakPolarHBondContact O-CG 3.33Å; V2102-M2106 PolarHBondContact O-N 2.99Å; R2103-M2106 WeakPolarHBondContact O-CB 3.32Å; R2103-M2106 PolarHBondContact O-N 3.19Å; R2103-M2106 VanDerWaalsContact O-N 3.15Å; M2106-L2109 WeakPolarHBondContact O-CB 3.42Å; M2106-L2109 PolarHBondContact O-N 3.12Å; M2106-L2109 VanDerWaalsContact O-N 3.14Å; M2106-A2110 WeakPolarHBondContact O-CB 3.39Å; M2106-A2110 PolarHBondContact O-N 3.04Å
2107A89.7Confident86.7Confident0 Ų041.9 Ų41.90%023%0.226CC..Hα-helixtrans-56.8-46.9-170.500000114.5W2095 R2103 L2109 A2110 C2111 Y2126 A2129 L2130W2095-A2107 HydrophobicContact CH2-CB 3.82Å; W2095-A2107 HydrophobicContact CZ3-CB 4.33Å; R2103-A2107 VanDerWaalsContact O-CB 3.28Å; R2103-A2107 WeakPolarHBondContact O-CB 3.38Å; R2103-A2107 PolarHBondContact O-N 3.12Å; A2107-L2109 VanDerWaalsContact C-N 3.29Å; A2107-L2109 PolarHBondContact O-N 3.18Å; A2107-A2110 PolarHBondContact O-N 3.14Å; A2107-C2111 VanDerWaalsContact O-CB 3.31Å; A2107-C2111 WeakPolarHBondContact O-CB 3.33Å; A2107-C2111 PolarHBondContact O-N 3.02Å; A2107-C2111 PolarHBondContact O-SG 3.05Å; A2107-Y2126 WeakPolarHBondContact CB-O 3.34Å; A2107-A2129 HydrophobicContact CB-CB 4.31Å; A2107-L2130 HydrophobicContact CB-CD1 3.57Å; A2107-L2130 HydrophobicContact CB-CD2 3.81Å; A2107-L2130 HydrophobicContact CB-CG 3.83Å
2108P89.6Confident86.9Confident17 Ų1742 Ų4211%0.1123%0.227CC..Hα-helixtrans-62.1-36176.9-19.629.2000113.2R2079 A2104 S2112 L2130 D2137 Y2141R2079-P2108 PolarHBondContact NH1-O 3.32Å; A2104-P2108 VanDerWaalsContact O-CD 3.27Å; A2104-P2108 WeakPolarHBondContact O-CD 3.4Å; P2108-S2112 WeakPolarHBondContact O-CB 3.3Å; P2108-S2112 PolarHBondContact O-N 3.13Å; P2108-S2112 VanDerWaalsContact O-N 3.1Å; P2108-S2112 PolarHBondContact O-OG 3.11Å; P2108-S2112 VanDerWaalsContact O-OG 3.11Å; P2108-L2130 HydrophobicContact CB-CD2 4.46Å; P2108-L2130 HydrophobicContact CG-CD2 3.89Å; P2108-D2137 HydrophobicContact CB-CB 4.21Å; P2108-D2137 WeakPolarHBondContact CB-OD2 3.44Å; P2108-D2137 HydrophobicContact CG-CB 4.31Å; P2108-Y2141 HydrophobicContact CB-CE2 4.43Å; P2108-Y2141 PolarHBondContact O-OH 3.12Å
2109L89.4Confident87.3Confident14.4 Ų14.443 Ų438%0.07523%0.234CC..Hα-helixtrans-69.7-43.8178.1-53.9175.5000110.4L2072 M2075 R2076 R2079 M2106 A2107 S2112 A2113L2072-L2109 HydrophobicContact CD2-CD1 4.38Å; M2075-L2109 HydrophobicContact CB-CB 4.44Å; M2075-L2109 HydrophobicContact CB-CD1 3.67Å; M2075-L2109 HydrophobicContact CE-CB 3.99Å; M2075-L2109 HydrophobicContact CE-CD1 4.43Å; M2075-L2109 HydrophobicContact SD-CD1 4.47Å; R2076-L2109 HydrophobicContact CG-CD1 3.75Å; R2076-L2109 HydrophobicContact CG-CD2 4.07Å; R2076-L2109 HydrophobicContact CG-CG 4.42Å; R2079-L2109 HydrophobicContact CB-CD2 4.4Å; R2079-L2109 VanDerWaalsContact CD-CD2 3.41Å; R2079-L2109 HydrophobicContact CG-CD2 4.48Å; M2106-L2109 WeakPolarHBondContact O-CB 3.42Å; M2106-L2109 PolarHBondContact O-N 3.12Å; M2106-L2109 VanDerWaalsContact O-N 3.14Å; A2107-L2109 VanDerWaalsContact C-N 3.29Å; A2107-L2109 PolarHBondContact O-N 3.18Å; L2109-S2112 PolarHBondContact O-N 3.09Å; L2109-S2112 PolarHBondContact O-OG 3.15Å; L2109-A2113 PolarHBondContact O-N 3.21Å; L2109-A2113 VanDerWaalsContact O-N 3.11Å
2110A90.6Very high87.6Confident0 Ų039.6 Ų39.60%021%0.213CC..Hα-helixtrans-67.1-43.6178.400000112M2075 A2091 W2095 M2106 A2107 S2112 A2113 A2114 Y2126M2075-A2110 HydrophobicContact CE-CB 4.43Å; A2091-A2110 HydrophobicContact CB-CB 3.8Å; W2095-A2110 HydrophobicContact CZ3-CB 4.13Å; M2106-A2110 WeakPolarHBondContact O-CB 3.39Å; M2106-A2110 PolarHBondContact O-N 3.04Å; A2107-A2110 PolarHBondContact O-N 3.14Å; A2110-S2112 PolarHBondContact O-N 3.11Å; A2110-A2113 PolarHBondContact O-N 3.39Å; A2110-A2114 WeakPolarHBondContact O-CB 3.32Å; A2110-A2114 PolarHBondContact O-N 3.2Å; A2110-Y2126 HydrophobicContact CB-CD1 4.22Å; A2110-Y2126 HydrophobicContact CB-CD2 3.52Å; A2110-Y2126 VanDerWaalsContact CB-CD2 3.42Å; A2110-Y2126 HydrophobicContact CB-CE1 4.28Å; A2110-Y2126 HydrophobicContact CB-CE2 3.59Å; A2110-Y2126 HydrophobicContact CB-CG 3.84Å; A2110-Y2126 WeakPolarHBondContact O-CD2 3.5Å
2111C90Very high87.9Confident0 Ų040.4 Ų40.40%022%0.217CC..Hα-helixtrans-57.4-48.6173.3-73.30000111.4A2107 A2113 A2114 W2115 Y2126 T2127 Y2141A2107-C2111 VanDerWaalsContact O-CB 3.31Å; A2107-C2111 WeakPolarHBondContact O-CB 3.33Å; A2107-C2111 PolarHBondContact O-N 3.02Å; A2107-C2111 PolarHBondContact O-SG 3.05Å; C2111-A2113 VanDerWaalsContact C-N 3.29Å; C2111-A2113 PolarHBondContact O-N 3.02Å; C2111-A2114 PolarHBondContact O-N 3.18Å; C2111-W2115 WeakPolarHBondContact O-CB 3.34Å; C2111-W2115 PolarHBondContact O-N 3.07Å; C2111-Y2126 WeakPolarHBondContact SG-CB 3.37Å; C2111-T2127 PolarHBondContact SG-OG1 2.95Å; C2111-T2127 VanDerWaalsContact SG-OG1 3.42Å; C2111-Y2141 HydrophobicContact CB-CD1 4.01Å; C2111-Y2141 HydrophobicContact CB-CD2 3.83Å; C2111-Y2141 HydrophobicContact CB-CE1 3.95Å; C2111-Y2141 HydrophobicContact CB-CE2 3.77Å; C2111-Y2141 HydrophobicContact CB-CG 3.98Å
2112S88.5Confident88.2Confident3.2 Ų3.235.6 Ų35.62%0.02219%0.192CC..Hα-helixtrans-57.4-42.3177.824.10000112.4R2079 P2108 L2109 A2110 A2116 Y2141R2079-S2112 PolarHBondContact NE-OG 3.43Å; R2079-S2112 PolarHBondContact NH1-OG 3.33Å; P2108-S2112 WeakPolarHBondContact O-CB 3.3Å; P2108-S2112 PolarHBondContact O-N 3.13Å; P2108-S2112 VanDerWaalsContact O-N 3.1Å; P2108-S2112 PolarHBondContact O-OG 3.11Å; P2108-S2112 VanDerWaalsContact O-OG 3.11Å; L2109-S2112 PolarHBondContact O-N 3.09Å; L2109-S2112 PolarHBondContact O-OG 3.15Å; A2110-S2112 PolarHBondContact O-N 3.11Å; S2112-A2116 VanDerWaalsContact O-CB 3.28Å; S2112-A2116 WeakPolarHBondContact O-CB 3.43Å; S2112-A2116 PolarHBondContact O-N 3.3Å; S2112-Y2141 WeakPolarHBondContact CB-OH 3.42Å; S2112-Y2141 PolarHBondContact OG-OH 3.18Å
2113A89.9Confident88.5Confident0 Ų034.6 Ų34.60%019%0.186CC..Hα-helixtrans-72.7-43-179.300000113.3W2084 L2087 N2088 L2109 A2110 C2111 W2115 A2116 L2117W2084-A2113 HydrophobicContact CE3-CB 4Å; L2087-A2113 HydrophobicContact CB-CB 4.09Å; L2087-A2113 HydrophobicContact CD2-CB 3.7Å; L2087-A2113 HydrophobicContact CG-CB 3.66Å; N2088-A2113 HydrophobicContact CB-CB 4.1Å; L2109-A2113 PolarHBondContact O-N 3.21Å; L2109-A2113 VanDerWaalsContact O-N 3.11Å; A2110-A2113 PolarHBondContact O-N 3.39Å; C2111-A2113 VanDerWaalsContact C-N 3.29Å; C2111-A2113 PolarHBondContact O-N 3.02Å; A2113-W2115 VanDerWaalsContact C-N 3.33Å; A2113-A2116 PolarHBondContact O-N 3.11Å; A2113-L2117 WeakPolarHBondContact O-CD1 3.3Å; A2113-L2117 WeakPolarHBondContact O-CG 3.34Å; A2113-L2117 PolarHBondContact O-N 3.07Å; A2113-L2117 VanDerWaalsContact O-N 3.16Å
2114A91.1Very high88.6Confident0 Ų037 Ų370%020%0.2CC..Hα-helixtrans-64.9-4117600000111.4A2110 C2111 A2116 L2117 N2118 S2119 R2122 V2123 Y2126A2110-A2114 WeakPolarHBondContact O-CB 3.32Å; A2110-A2114 PolarHBondContact O-N 3.2Å; C2111-A2114 PolarHBondContact O-N 3.18Å; A2114-A2116 VanDerWaalsContact C-N 3.34Å; A2114-A2116 PolarHBondContact O-N 2.84Å; A2114-L2117 CarbonylContact O-C 3.53Å; A2114-L2117 PolarHBondContact O-N 3.17Å; A2114-L2117 VanDerWaalsContact O-N 3.15Å; A2114-N2118 PolarHBondContact O-N 3.29Å; A2114-N2118 VanDerWaalsContact O-N 3.14Å; A2114-S2119 PolarHBondContact O-N 3.11Å; A2114-R2122 HydrophobicContact CB-CB 3.85Å; A2114-V2123 HydrophobicContact CB-CG2 3.63Å; A2114-Y2126 HydrophobicContact CB-CD2 4.14Å; A2114-Y2126 HydrophobicContact CB-CE2 4.02Å
2115W90.2Very high88.7Confident4 Ų441.1 Ų41.12%0.01521%0.206CC..Hα-helixtrans-64.2-40.9175.2-178.326.7000111.5C2111 A2113 L2117 N2118 W2120 V2123 F2140 Y2141 V2144 Q2233 L2234 L2237C2111-W2115 WeakPolarHBondContact O-CB 3.34Å; C2111-W2115 PolarHBondContact O-N 3.07Å; A2113-W2115 VanDerWaalsContact C-N 3.33Å; W2115-L2117 PolarHBondContact O-N 3.25Å; W2115-L2117 VanDerWaalsContact O-N 3.16Å; W2115-N2118 PolarHBondContact O-N 3.14Å; W2115-N2118 VanDerWaalsContact O-N 3.12Å; W2115-N2118 PolarHBondContact O-OD1 2.79Å; W2115-W2120 AromaticContact CD1-CH2 3.51Å; W2115-W2120 VanDerWaalsContact CD1-CH2 3.45Å; W2115-W2120 AromaticContact CD1-CZ2 3.95Å; W2115-W2120 AromaticContact CD1-CZ3 3.91Å; W2115-W2120 AromaticContact NE1-CH2 3.54Å; W2115-V2123 HydrophobicContact CB-CG2 4.07Å; W2115-F2140 HydrophobicContact CH2-CE1 4.35Å; W2115-F2140 HydrophobicContact CH2-CZ 4.31Å; W2115-F2140 HydrophobicContact CZ3-CE1 4.06Å; W2115-F2140 HydrophobicContact CZ3-CZ 4.44Å; W2115-Y2141 HydrophobicContact CE3-CD1 4.44Å; W2115-Y2141 AromaticContact CE3-CE1 3.95Å; W2115-Y2141 HydrophobicContact CE3-CE1 3.95Å; W2115-Y2141 HydrophobicContact CZ3-CE1 4.35Å; W2115-V2144 HydrophobicContact CD2-CG1 4.41Å; W2115-V2144 HydrophobicContact CH2-CG1 4.49Å; W2115-V2144 HydrophobicContact CH2-CG2 4.38Å; W2115-V2144 HydrophobicContact CZ2-CG1 3.98Å; W2115-V2144 HydrophobicContact CZ2-CG2 4.47Å; W2115-Q2233 VanDerWaalsContact CD2-CD 3.46Å; W2115-Q2233 HydrophobicContact CD2-CG 3.87Å; W2115-Q2233 VanDerWaalsContact CE3-CD 3.46Å; W2115-Q2233 HydrophobicContact CE3-CG 4.11Å; W2115-Q2233 HydrophobicContact CG-CG 4.45Å; W2115-Q2233 HydrophobicContact CH2-CB 4.27Å; W2115-Q2233 HydrophobicContact CH2-CG 4.06Å; W2115-Q2233 HydrophobicContact CZ2-CB 4.31Å; W2115-Q2233 HydrophobicContact CZ2-CG 3.79Å; W2115-Q2233 WeakPolarHBondContact CZ2-O 3.38Å; W2115-Q2233 HydrophobicContact CZ3-CB 4.37Å; W2115-Q2233 HydrophobicContact CZ3-CG 4.2Å; W2115-Q2233 PolarHBondContact O-NE2 3.09Å; W2115-L2234 HydrophobicContact CH2-CB 4.18Å; W2115-L2234 HydrophobicContact CH2-CD1 4.38Å; W2115-L2234 HydrophobicContact CZ2-CB 4.44Å; W2115-L2234 HydrophobicContact CZ2-CD1 4.46Å; W2115-L2237 HydrophobicContact CZ2-CD1 3.66Å
2116A85.1Confident88.9Confident30.8 Ų30.836.1 Ų36.126%0.25518%0.179SC..Hα-helixtrans-67.6-21.117900000113.1W2084 S2112 A2113 A2114 Q2233W2084-A2116 HydrophobicContact CB-CB 4.12Å; W2084-A2116 HydrophobicContact CD2-CB 3.58Å; W2084-A2116 VanDerWaalsContact CD2-CB 3.48Å; W2084-A2116 HydrophobicContact CE3-CB 4.13Å; W2084-A2116 HydrophobicContact CG-CB 3.57Å; W2084-A2116 HydrophobicContact CZ2-CB 4.42Å; S2112-A2116 VanDerWaalsContact O-CB 3.28Å; S2112-A2116 WeakPolarHBondContact O-CB 3.43Å; S2112-A2116 PolarHBondContact O-N 3.3Å; A2113-A2116 PolarHBondContact O-N 3.11Å; A2114-A2116 VanDerWaalsContact C-N 3.34Å; A2114-A2116 PolarHBondContact O-N 2.84Å; A2116-Q2233 VanDerWaalsContact CA-NE2 3.28Å
2117L86.5Confident88.9Confident67.6 Ų67.636.3 Ų36.335%0.35418%0.181SC..THydrogen-bonded Turntrans-102.312.8175.8-62.6170000112.6W2084 A2085 N2088 A2113 A2114 W2115 S2119W2084-L2117 HydrophobicContact CB-CD1 4.33Å; W2084-L2117 HydrophobicContact CB-CD2 4.21Å; W2084-L2117 HydrophobicContact CB-CG 4.06Å; A2085-L2117 HydrophobicContact CB-CD1 4.47Å; N2088-L2117 HydrophobicContact CB-CD1 3.53Å; N2088-L2117 VanDerWaalsContact CB-CD1 3.47Å; N2088-L2117 VanDerWaalsContact ND2-CD1 3.3Å; N2088-L2117 WeakPolarHBondContact ND2-CD1 3.41Å; A2113-L2117 WeakPolarHBondContact O-CD1 3.3Å; A2113-L2117 WeakPolarHBondContact O-CG 3.34Å; A2113-L2117 PolarHBondContact O-N 3.07Å; A2113-L2117 VanDerWaalsContact O-N 3.16Å; A2114-L2117 CarbonylContact O-C 3.53Å; A2114-L2117 PolarHBondContact O-N 3.17Å; A2114-L2117 VanDerWaalsContact O-N 3.15Å; W2115-L2117 PolarHBondContact O-N 3.25Å; W2115-L2117 VanDerWaalsContact O-N 3.16Å; L2117-S2119 PolarHBondContact O-N 3.07Å; L2117-S2119 VanDerWaalsContact O-N 3.1Å; L2117-S2119 PolarHBondContact O-OG 3.09Å; L2117-S2119 VanDerWaalsContact O-OG 3.06Å
2118N86.3Confident88.6Confident108.4 Ų108.443.1 Ų43.158%0.5821%0.212SC*.THydrogen-bonded Turntrans52.427.5-178.4-61.8-34.6000114.6A2114 W2115 W2120A2114-N2118 PolarHBondContact O-N 3.29Å; A2114-N2118 VanDerWaalsContact O-N 3.14Å; W2115-N2118 PolarHBondContact O-N 3.14Å; W2115-N2118 VanDerWaalsContact O-N 3.12Å; W2115-N2118 PolarHBondContact O-OD1 2.79Å; N2118-W2120 VanDerWaalsContact C-N 3.33Å; N2118-W2120 VanDerWaalsContact O-CD1 3.28Å; N2118-W2120 PolarHBondContact O-N 3.01Å; N2118-W2120 VanDerWaalsContact O-N 3.14Å
2119S89.2Confident88.3Confident34.8 Ų34.843.9 Ų43.924%0.24322%0.221CC..  trans-89.771.1-179.9-620000110.9A2114 L2117 D2121 R2122 V2123A2114-S2119 PolarHBondContact O-N 3.11Å; L2117-S2119 PolarHBondContact O-N 3.07Å; L2117-S2119 VanDerWaalsContact O-N 3.1Å; L2117-S2119 PolarHBondContact O-OG 3.09Å; L2117-S2119 VanDerWaalsContact O-OG 3.06Å; S2119-D2121 VanDerWaalsContact C-N 3.33Å; S2119-D2121 PolarHBondContact O-N 3.27Å; S2119-R2122 WeakPolarHBondContact O-CB 3.3Å; S2119-R2122 PolarHBondContact O-N 3.16Å; S2119-R2122 VanDerWaalsContact O-N 3.1Å; S2119-V2123 PolarHBondContact O-N 3.2Å
2120W88.9Confident87.9Confident44.4 Ų44.443.6 Ų43.617%0.16822%0.219CC..Hα-helixtrans-58.4-37.7-172-65.9104.4000114.5W2115 N2118 R2122 V2123 E2124 V2144 L2145 H2148 L2237W2115-W2120 AromaticContact CD1-CH2 3.51Å; W2115-W2120 VanDerWaalsContact CD1-CH2 3.45Å; W2115-W2120 AromaticContact CD1-CZ2 3.95Å; W2115-W2120 AromaticContact CD1-CZ3 3.91Å; W2115-W2120 AromaticContact NE1-CH2 3.54Å; N2118-W2120 VanDerWaalsContact C-N 3.33Å; N2118-W2120 VanDerWaalsContact O-CD1 3.28Å; N2118-W2120 PolarHBondContact O-N 3.01Å; N2118-W2120 VanDerWaalsContact O-N 3.14Å; W2120-R2122 PolarHBondContact O-N 3.24Å; W2120-R2122 VanDerWaalsContact O-N 3.15Å; W2120-V2123 HydrophobicContact CE3-CB 4.44Å; W2120-V2123 HydrophobicContact CE3-CG2 4.46Å; W2120-V2123 WeakPolarHBondContact O-CA 3.45Å; W2120-V2123 WeakPolarHBondContact O-CB 3.35Å; W2120-V2123 PolarHBondContact O-N 3.23Å; W2120-V2123 VanDerWaalsContact O-N 3.07Å; W2120-E2124 PolarHBondContact O-N 3.16Å; W2120-V2144 HydrophobicContact CH2-CG1 4.15Å; W2120-V2144 HydrophobicContact CZ3-CG1 4.13Å; W2120-L2145 HydrophobicContact CE3-CD1 4.25Å; W2120-L2145 HydrophobicContact CE3-CD2 3.96Å; W2120-L2145 HydrophobicContact CZ3-CD2 4.34Å; W2120-H2148 AromaticContact CD1-CE1 3.82Å; W2120-H2148 AromaticContact CD1-NE2 3.67Å; W2120-H2148 AromaticContact CD2-CD2 3.88Å; W2120-H2148 AromaticContact CD2-CE1 3.89Å; W2120-H2148 AromaticContact CD2-CG 3.91Å; W2120-H2148 AromaticContact CD2-ND1 3.93Å; W2120-H2148 AromaticContact CD2-NE2 3.89Å; W2120-H2148 AromaticContact CE2-CD2 3.41Å; W2120-H2148 VanDerWaalsContact CE2-CD2 3.41Å; W2120-H2148 AromaticContact CE2-CE1 3.97Å; W2120-H2148 AromaticContact CE2-CG 3.87Å; W2120-H2148 AromaticContact CE2-NE2 3.54Å; W2120-H2148 HydrophobicContact CE3-CB 4.27Å; W2120-H2148 AromaticContact CE3-CG 3.92Å; W2120-H2148 AromaticContact CG-CE1 3.86Å; W2120-H2148 AromaticContact CG-NE2 3.96Å; W2120-H2148 HydrophobicContact CH2-CB 4.1Å; W2120-H2148 AromaticContact CH2-CD2 3.95Å; W2120-H2148 HydrophobicContact CZ2-CB 4.34Å; W2120-H2148 AromaticContact CZ2-CD2 3.5Å; W2120-H2148 VanDerWaalsContact CZ2-CD2 3.41Å; W2120-H2148 WeakPolarHBondContact CZ2-CD2 3.39Å; W2120-H2148 AromaticContact CZ2-CG 3.95Å; W2120-H2148 AromaticContact CZ2-NE2 3.98Å; W2120-H2148 HydrophobicContact CZ3-CB 4.04Å; W2120-H2148 AromaticContact NE1-CD2 3.71Å; W2120-H2148 AromaticContact NE1-CE1 3.88Å; W2120-H2148 AromaticContact NE1-NE2 3.33Å; W2120-H2148 PolarHBondContact NE1-NE2 3.25Å; W2120-L2237 HydrophobicContact CH2-CD1 4.22Å; W2120-L2237 HydrophobicContact CH2-CD2 3.87Å; W2120-L2237 HydrophobicContact CH2-CG 4.24Å; W2120-L2237 HydrophobicContact CZ2-CD2 3.96Å
2121D89.6Confident87.2Confident132.8 Ų132.846.7 Ų46.771%0.7124%0.241SC*.Hα-helixtrans-58.8-34177.2-44.5-40.5000112.3S2119 R2125S2119-D2121 VanDerWaalsContact C-N 3.33Å; S2119-D2121 PolarHBondContact O-N 3.27Å; D2121-R2125 PolarHBondContact O-N 3.12Å
2122R89.6Confident86.1Confident61 Ų6148.2 Ų48.223%0.2325%0.253CS..Hα-helixtrans-76.7-38.2176.4-60.5-171.8-175.7-170.30.8111.2N2088 W2092 A2114 S2119 W2120 E2124 R2125 Y2126N2088-R2122 VanDerWaalsContact CG-NH1 3.31Å; N2088-R2122 PolarHBondContact ND2-NH1 3.18Å; N2088-R2122 WeakPolarHBondContact OD1-CD 3.43Å; N2088-R2122 PolarHBondContact OD1-NH1 3.05Å; W2092-R2122 HydrophobicContact CE3-CG 4.09Å; W2092-R2122 HydrophobicContact CH2-CG 4.39Å; W2092-R2122 HydrophobicContact CZ3-CB 4.4Å; W2092-R2122 HydrophobicContact CZ3-CG 3.88Å; A2114-R2122 HydrophobicContact CB-CB 3.85Å; S2119-R2122 WeakPolarHBondContact O-CB 3.3Å; S2119-R2122 PolarHBondContact O-N 3.16Å; S2119-R2122 VanDerWaalsContact O-N 3.1Å; W2120-R2122 PolarHBondContact O-N 3.24Å; W2120-R2122 VanDerWaalsContact O-N 3.15Å; R2122-E2124 VanDerWaalsContact C-N 3.32Å; R2122-E2124 PolarHBondContact O-N 3.22Å; R2122-R2125 PolarHBondContact O-N 3.11Å; R2122-Y2126 HydrophobicContact CB-CD2 4.29Å; R2122-Y2126 HydrophobicContact CB-CE2 3.86Å; R2122-Y2126 VanDerWaalsContact O-CB 3.25Å; R2122-Y2126 WeakPolarHBondContact O-CB 3.41Å; R2122-Y2126 WeakPolarHBondContact O-CD2 3.32Å; R2122-Y2126 PolarHBondContact O-N 2.97Å
2123V88.6Confident85.1Confident2 Ų252.8 Ų52.81%0.01228%0.278CS..Hα-helixtrans-59-45.9176179.30000110.1A2114 W2115 S2119 W2120 R2125 Y2126 T2127 L2145A2114-V2123 HydrophobicContact CB-CG2 3.63Å; W2115-V2123 HydrophobicContact CB-CG2 4.07Å; S2119-V2123 PolarHBondContact O-N 3.2Å; W2120-V2123 HydrophobicContact CE3-CB 4.44Å; W2120-V2123 HydrophobicContact CE3-CG2 4.46Å; W2120-V2123 WeakPolarHBondContact O-CA 3.45Å; W2120-V2123 WeakPolarHBondContact O-CB 3.35Å; W2120-V2123 PolarHBondContact O-N 3.23Å; W2120-V2123 VanDerWaalsContact O-N 3.07Å; V2123-R2125 PolarHBondContact O-N 3.1Å; V2123-Y2126 PolarHBondContact O-N 3.08Å; V2123-T2127 HydrophobicContact CG1-CG2 4.11Å; V2123-T2127 VanDerWaalsContact O-CB 3.24Å; V2123-T2127 WeakPolarHBondContact O-CB 3.33Å; V2123-T2127 VanDerWaalsContact O-CG2 3.29Å; V2123-T2127 WeakPolarHBondContact O-CG2 3.39Å; V2123-T2127 PolarHBondContact O-N 2.94Å; V2123-T2127 PolarHBondContact O-OG1 3.19Å; V2123-L2145 HydrophobicContact CB-CD2 4.36Å; V2123-L2145 HydrophobicContact CG1-CD1 4.4Å; V2123-L2145 HydrophobicContact CG1-CD2 4.09Å; V2123-L2145 HydrophobicContact CG1-CG 4.3Å
2124E89Confident84.3Confident106.2 Ų106.259.8 Ų59.850%0.49632%0.315SS..Hα-helixtrans-57-54.1177.8-173.5169.1-153.300111.4W2120 R2122 Y2126 T2127 E2128 L2145W2120-E2124 PolarHBondContact O-N 3.16Å; R2122-E2124 VanDerWaalsContact C-N 3.32Å; R2122-E2124 PolarHBondContact O-N 3.22Å; E2124-Y2126 VanDerWaalsContact C-N 3.31Å; E2124-Y2126 PolarHBondContact O-N 3.04Å; E2124-T2127 WeakPolarHBondContact O-CA 3.39Å; E2124-T2127 WeakPolarHBondContact O-CB 3.36Å; E2124-T2127 PolarHBondContact O-N 3.05Å; E2124-T2127 VanDerWaalsContact O-N 3.12Å; E2124-T2127 PolarHBondContact O-OG1 3.34Å; E2124-E2128 WeakPolarHBondContact O-CG 3.44Å; E2124-E2128 PolarHBondContact O-N 2.95Å; E2124-E2128 VanDerWaalsContact O-N 3.07Å; E2124-L2145 HydrophobicContact CB-CD1 4.41Å; E2124-L2145 HydrophobicContact CB-CD2 4.31Å; E2124-L2145 HydrophobicContact CG-CD2 4.18Å
2125R88.2Confident84Confident129.6 Ų129.661.4 Ų61.449%0.48933%0.326SS..Hα-helixtrans-58.7-38.2177.4-110.3-174.6179.2155.82.2113.9W2092 N2096 D2121 R2122 V2123 E2128W2092-R2125 VanDerWaalsContact CH2-NH1 3.29Å; N2096-R2125 PolarHBondContact OD1-NH2 2.87Å; D2121-R2125 PolarHBondContact O-N 3.12Å; R2122-R2125 PolarHBondContact O-N 3.11Å; V2123-R2125 PolarHBondContact O-N 3.1Å; R2125-E2128 PolarHBondContact O-N 2.84Å
2126Y88.9Confident83.9Confident0.2 Ų0.263 Ų630%0.00133%0.333CS..Hα-helixtrans-72.5-34.7177.7-62.5-29.8000111.5W2092 W2095 A2107 A2110 C2111 A2114 R2122 V2123 E2124 E2128 A2129 L2130W2092-Y2126 WeakPolarHBondContact CA-OH 3.32Å; W2092-Y2126 HydrophobicContact CE3-CE1 4.49Å; W2092-Y2126 PolarHBondContact N-OH 3.08Å; W2095-Y2126 AromaticContact CD2-CD1 3.72Å; W2095-Y2126 HydrophobicContact CD2-CD1 3.72Å; W2095-Y2126 AromaticContact CD2-CE1 3.53Å; W2095-Y2126 HydrophobicContact CD2-CE1 3.53Å; W2095-Y2126 VanDerWaalsContact CD2-CE1 3.5Å; W2095-Y2126 AromaticContact CE2-CD1 3.59Å; W2095-Y2126 AromaticContact CE2-CE1 3.87Å; W2095-Y2126 AromaticContact CE3-CD1 3.69Å; W2095-Y2126 HydrophobicContact CE3-CD1 3.69Å; W2095-Y2126 AromaticContact CE3-CE1 3.53Å; W2095-Y2126 HydrophobicContact CE3-CE1 3.53Å; W2095-Y2126 VanDerWaalsContact CE3-CE1 3.45Å; W2095-Y2126 HydrophobicContact CG-CD1 4.48Å; W2095-Y2126 AromaticContact CG-CE1 3.98Å; W2095-Y2126 HydrophobicContact CG-CE1 4.06Å; W2095-Y2126 AromaticContact CH2-CD1 3.44Å; W2095-Y2126 HydrophobicContact CH2-CD1 3.44Å; W2095-Y2126 VanDerWaalsContact CH2-CD1 3.44Å; W2095-Y2126 HydrophobicContact CH2-CE1 4.18Å; W2095-Y2126 HydrophobicContact CH2-CG 4.1Å; W2095-Y2126 AromaticContact CZ2-CD1 3.48Å; W2095-Y2126 HydrophobicContact CZ2-CD1 3.48Å; W2095-Y2126 VanDerWaalsContact CZ2-CD1 3.46Å; W2095-Y2126 HydrophobicContact CZ2-CE1 4.2Å; W2095-Y2126 HydrophobicContact CZ2-CG 4.35Å; W2095-Y2126 AromaticContact CZ3-CD1 3.55Å; W2095-Y2126 HydrophobicContact CZ3-CD1 3.55Å; W2095-Y2126 VanDerWaalsContact CZ3-CD1 3.48Å; W2095-Y2126 AromaticContact CZ3-CE1 3.87Å; W2095-Y2126 HydrophobicContact CZ3-CE1 3.87Å; W2095-Y2126 HydrophobicContact CZ3-CG 4.3Å; A2107-Y2126 WeakPolarHBondContact CB-O 3.34Å; A2110-Y2126 HydrophobicContact CB-CD1 4.22Å; A2110-Y2126 HydrophobicContact CB-CD2 3.52Å; A2110-Y2126 VanDerWaalsContact CB-CD2 3.42Å; A2110-Y2126 HydrophobicContact CB-CE1 4.28Å; A2110-Y2126 HydrophobicContact CB-CE2 3.59Å; A2110-Y2126 HydrophobicContact CB-CG 3.84Å; A2110-Y2126 WeakPolarHBondContact O-CD2 3.5Å; C2111-Y2126 WeakPolarHBondContact SG-CB 3.37Å; A2114-Y2126 HydrophobicContact CB-CD2 4.14Å; A2114-Y2126 HydrophobicContact CB-CE2 4.02Å; R2122-Y2126 HydrophobicContact CB-CD2 4.29Å; R2122-Y2126 HydrophobicContact CB-CE2 3.86Å; R2122-Y2126 VanDerWaalsContact O-CB 3.25Å; R2122-Y2126 WeakPolarHBondContact O-CB 3.41Å; R2122-Y2126 WeakPolarHBondContact O-CD2 3.32Å; R2122-Y2126 PolarHBondContact O-N 2.97Å; V2123-Y2126 PolarHBondContact O-N 3.08Å; E2124-Y2126 VanDerWaalsContact C-N 3.31Å; E2124-Y2126 PolarHBondContact O-N 3.04Å; Y2126-E2128 VanDerWaalsContact C-N 3.3Å; Y2126-E2128 PolarHBondContact O-N 3.3Å; Y2126-A2129 WeakPolarHBondContact O-CB 3.29Å; Y2126-A2129 PolarHBondContact O-N 3.22Å; Y2126-A2129 VanDerWaalsContact O-N 3.16Å; Y2126-L2130 WeakPolarHBondContact O-CD1 3.49Å
2127T86.9Confident84Confident5.6 Ų5.663.6 Ų63.63%0.03433%0.332CS..Hα-helixtrans-68.6-28.1178.1190000113.5C2111 V2123 E2124 A2129 L2130 R2142 L2145C2111-T2127 PolarHBondContact SG-OG1 2.95Å; C2111-T2127 VanDerWaalsContact SG-OG1 3.42Å; V2123-T2127 HydrophobicContact CG1-CG2 4.11Å; V2123-T2127 VanDerWaalsContact O-CB 3.24Å; V2123-T2127 WeakPolarHBondContact O-CB 3.33Å; V2123-T2127 VanDerWaalsContact O-CG2 3.29Å; V2123-T2127 WeakPolarHBondContact O-CG2 3.39Å; V2123-T2127 PolarHBondContact O-N 2.94Å; V2123-T2127 PolarHBondContact O-OG1 3.19Å; E2124-T2127 WeakPolarHBondContact O-CA 3.39Å; E2124-T2127 WeakPolarHBondContact O-CB 3.36Å; E2124-T2127 PolarHBondContact O-N 3.05Å; E2124-T2127 VanDerWaalsContact O-N 3.12Å; E2124-T2127 PolarHBondContact O-OG1 3.34Å; T2127-A2129 VanDerWaalsContact C-N 3.27Å; T2127-A2129 PolarHBondContact O-N 3.18Å; T2127-L2130 HydrophobicContact CG2-CD1 4.06Å; T2127-L2130 WeakPolarHBondContact O-CB 3.35Å; T2127-L2130 PolarHBondContact O-N 3.15Å; T2127-L2130 VanDerWaalsContact O-N 3.11Å; T2127-R2142 HydrophobicContact CG2-CB 4.49Å; T2127-R2142 HydrophobicContact CG2-CG 3.51Å; T2127-R2142 VanDerWaalsContact CG2-CG 3.41Å; T2127-R2142 PolarHBondContact O-NH2 3.18Å; T2127-R2142 VanDerWaalsContact O-NH2 3.12Å; T2127-L2145 HydrophobicContact CG2-CD1 4.11Å
2128E85Confident84.1Confident142.2 Ų142.260.4 Ų60.466%0.66432%0.315SS*.Hα-helixtrans-59.2-33.5172.6-69.3175.3168.300112.5E2124 R2125 Y2126 L2130E2124-E2128 WeakPolarHBondContact O-CG 3.44Å; E2124-E2128 PolarHBondContact O-N 2.95Å; E2124-E2128 VanDerWaalsContact O-N 3.07Å; R2125-E2128 PolarHBondContact O-N 2.84Å; Y2126-E2128 VanDerWaalsContact C-N 3.3Å; Y2126-E2128 PolarHBondContact O-N 3.3Å; E2128-L2130 VanDerWaalsContact C-N 3.32Å; E2128-L2130 PolarHBondContact O-N 3.17Å
2129A82.5Confident84.3Confident34 Ų3455.4 Ų55.428%0.28129%0.289SS..THydrogen-bonded Turntrans-78.5-10.4178.400000114W2095 R2103 A2107 Y2126 T2127W2095-A2129 HydrophobicContact CH2-CB 4.1Å; W2095-A2129 HydrophobicContact CZ2-CB 3.8Å; R2103-A2129 HydrophobicContact CG-CB 4.15Å; A2107-A2129 HydrophobicContact CB-CB 4.31Å; Y2126-A2129 WeakPolarHBondContact O-CB 3.29Å; Y2126-A2129 PolarHBondContact O-N 3.22Å; Y2126-A2129 VanDerWaalsContact O-N 3.16Å; T2127-A2129 VanDerWaalsContact C-N 3.27Å; T2127-A2129 PolarHBondContact O-N 3.18Å
2130L81.1Confident84.4Confident8.6 Ų8.653.9 Ų53.95%0.04528%0.278CS..SBendtrans-88135.4176-71.3131.4000110.6A2107 P2108 Y2126 T2127 E2128 A2132 D2137 Y2141 R2142A2107-L2130 HydrophobicContact CB-CD1 3.57Å; A2107-L2130 HydrophobicContact CB-CD2 3.81Å; A2107-L2130 HydrophobicContact CB-CG 3.83Å; P2108-L2130 HydrophobicContact CB-CD2 4.46Å; P2108-L2130 HydrophobicContact CG-CD2 3.89Å; Y2126-L2130 WeakPolarHBondContact O-CD1 3.49Å; T2127-L2130 HydrophobicContact CG2-CD1 4.06Å; T2127-L2130 WeakPolarHBondContact O-CB 3.35Å; T2127-L2130 PolarHBondContact O-N 3.15Å; T2127-L2130 VanDerWaalsContact O-N 3.11Å; E2128-L2130 VanDerWaalsContact C-N 3.32Å; E2128-L2130 PolarHBondContact O-N 3.17Å; L2130-A2132 PolarHBondContact O-N 3.1Å; L2130-D2137 HydrophobicContact CD1-CB 4.3Å; L2130-D2137 HydrophobicContact CD2-CB 3.91Å; L2130-Y2141 HydrophobicContact CD1-CD2 3.98Å; L2130-Y2141 HydrophobicContact CD2-CD2 4.26Å; L2130-R2142 VanDerWaalsContact O-CZ 3.26Å; L2130-R2142 PolarHBondContact O-NH1 3.19Å; L2130-R2142 PolarHBondContact O-NH2 3.02Å
2131S77.1Confident84.6Confident65.4 Ų65.452 Ų5246%0.45727%0.271SS..  trans-59.8135.717198.80000111S2135 R2142S2131-S2135 WeakPolarHBondContact OG-CB 3.37Å; S2131-R2142 PolarHBondContact O-NH1 3.28Å
2132A65.9Low84.6Confident30.6 Ų30.647.7 Ų47.725%0.25325%0.245SC..SBendtrans-73.8-35.2-177.800000113.5L2130 R2142 F2158L2130-A2132 PolarHBondContact O-N 3.1Å; A2132-R2142 VanDerWaalsContact CA-NH1 3.28Å; A2132-R2142 VanDerWaalsContact CB-NH1 3.34Å; A2132-F2158 HydrophobicContact CB-CE1 4.32Å
2133D67.3Low84.8Confident101.6 Ų101.644.8 Ų44.854%0.54323%0.234SC..SBendtrans-106.1-27.6-165.5-57.2-44.5000114.2K2161 V2165D2133-K2161 WeakPolarHBondContact OD1-CE 3.43Å; D2133-K2161 IonicContact OD1-NZ 3.12Å; D2133-K2161 PolarHBondContact OD1-NZ 3.41Å; D2133-V2165 WeakPolarHBondContact O-CG2 3.27Å
2134N73.4Confident84.9Confident145.8 Ų145.844.8 Ų44.878%0.7823%0.234SC*.SBendtrans-105.83.1-173.2-70.6-7000114.8
2135S83.6Confident85Confident32.8 Ų32.841.2 Ų41.223%0.22922%0.218CC..  trans-130.5125.6-175.51800000111.6S2131 D2137 G2138 A2139S2131-S2135 WeakPolarHBondContact OG-CB 3.37Å; S2135-D2137 VanDerWaalsContact C-N 3.33Å; S2135-D2137 PolarHBondContact O-N 3.07Å; S2135-G2138 PolarHBondContact O-N 3.18Å; S2135-G2138 PolarHBondContact OG-N 3.18Å; S2135-A2139 PolarHBondContact O-N 3.07Å; S2135-A2139 VanDerWaalsContact O-N 3.13Å
2136F88.7Confident85.2Confident39.2 Ų39.236 Ų3617%0.17220%0.199CC..Hα-helixtrans-55-49.8173.9169.9-99.7000111.4G2138 A2139 F2140 A2162 V2165 L2166 L2191F2136-G2138 VanDerWaalsContact C-N 3.28Å; F2136-G2138 PolarHBondContact O-N 3.26Å; F2136-A2139 PolarHBondContact O-N 2.93Å; F2136-F2140 HydrophobicContact CE1-CB 4.44Å; F2136-F2140 HydrophobicContact CZ-CB 4.38Å; F2136-F2140 HydrophobicContact CZ-CD2 4.45Å; F2136-F2140 HydrophobicContact CZ-CG 4.41Å; F2136-F2140 VanDerWaalsContact O-CB 3.26Å; F2136-F2140 WeakPolarHBondContact O-CB 3.39Å; F2136-F2140 PolarHBondContact O-N 3.09Å; F2136-A2162 HydrophobicContact CD2-CB 4.12Å; F2136-A2162 HydrophobicContact CE2-CB 4.28Å; F2136-V2165 HydrophobicContact CB-CG1 4.2Å; F2136-L2166 HydrophobicContact CD2-CB 4.31Å; F2136-L2166 HydrophobicContact CD2-CD1 3.97Å; F2136-L2166 HydrophobicContact CD2-CD2 3.96Å; F2136-L2166 HydrophobicContact CD2-CG 3.64Å; F2136-L2166 HydrophobicContact CE2-CD1 3.51Å; F2136-L2166 VanDerWaalsContact CE2-CD1 3.42Å; F2136-L2166 HydrophobicContact CE2-CD2 4.14Å; F2136-L2166 HydrophobicContact CE2-CG 3.87Å; F2136-L2166 HydrophobicContact CG-CD2 4.2Å; F2136-L2166 HydrophobicContact CG-CG 4.45Å; F2136-L2166 HydrophobicContact CZ-CD1 4.35Å; F2136-L2191 HydrophobicContact CE2-CD1 3.95Å; F2136-L2191 HydrophobicContact CE2-CD2 4.15Å; F2136-L2191 HydrophobicContact CE2-CG 4.02Å
2137D87.8Confident85.3Confident43.8 Ų43.836 Ų3623%0.23420%0.199CC..Hα-helixtrans-58.8-40.8178.6-72.5-41.5000111.4P2108 L2130 S2135 A2139 F2140 Y2141P2108-D2137 HydrophobicContact CB-CB 4.21Å; P2108-D2137 WeakPolarHBondContact CB-OD2 3.44Å; P2108-D2137 HydrophobicContact CG-CB 4.31Å; L2130-D2137 HydrophobicContact CD1-CB 4.3Å; L2130-D2137 HydrophobicContact CD2-CB 3.91Å; S2135-D2137 VanDerWaalsContact C-N 3.33Å; S2135-D2137 PolarHBondContact O-N 3.07Å; D2137-A2139 PolarHBondContact O-N 3.28Å; D2137-F2140 PolarHBondContact O-N 3.34Å; D2137-Y2141 HydrophobicContact CB-CD2 4.15Å; D2137-Y2141 HydrophobicContact CB-CE2 3.99Å; D2137-Y2141 WeakPolarHBondContact O-CB 3.47Å; D2137-Y2141 WeakPolarHBondContact O-CD2 3.29Å; D2137-Y2141 PolarHBondContact O-N 3.32Å
2138G88.3Confident85.5Confident0 Ų039.7 Ų39.70%022%0.216CC..Hα-helixtrans-64.4-40.4-179.500000113.7S2135 F2136 R2142S2135-G2138 PolarHBondContact O-N 3.18Å; S2135-G2138 PolarHBondContact OG-N 3.18Å; F2136-G2138 VanDerWaalsContact C-N 3.28Å; F2136-G2138 PolarHBondContact O-N 3.26Å; G2138-R2142 WeakPolarHBondContact O-CD 3.44Å; G2138-R2142 VanDerWaalsContact O-CG 3.27Å; G2138-R2142 WeakPolarHBondContact O-CG 3.4Å; G2138-R2142 PolarHBondContact O-N 3.3Å; G2138-R2142 PolarHBondContact O-NH1 3.16Å; G2138-R2142 VanDerWaalsContact O-NH1 3.16Å
2139A90.4Very high85.7Confident1.8 Ų1.835.5 Ų35.52%0.01520%0.203CC..Hα-helixtrans-74.3-42.3174.300000111.4S2135 F2136 D2137 R2142 A2143 K2161 A2162S2135-A2139 PolarHBondContact O-N 3.07Å; S2135-A2139 VanDerWaalsContact O-N 3.13Å; F2136-A2139 PolarHBondContact O-N 2.93Å; D2137-A2139 PolarHBondContact O-N 3.28Å; A2139-R2142 PolarHBondContact O-N 3.42Å; A2139-A2143 PolarHBondContact O-N 3.12Å; A2139-K2161 HydrophobicContact CB-CB 4.33Å; A2139-A2162 HydrophobicContact CB-CB 3.78Å
2140F92.3Very high86.1Confident4.4 Ų4.440 Ų402%0.01922%0.218CC..Hα-helixtrans-62.1-51.1-179.5177.3-106.2000113W2115 F2136 D2137 R2142 A2143 V2144 L2190 L2191 L2234W2115-F2140 HydrophobicContact CH2-CE1 4.35Å; W2115-F2140 HydrophobicContact CH2-CZ 4.31Å; W2115-F2140 HydrophobicContact CZ3-CE1 4.06Å; W2115-F2140 HydrophobicContact CZ3-CZ 4.44Å; F2136-F2140 HydrophobicContact CE1-CB 4.44Å; F2136-F2140 HydrophobicContact CZ-CB 4.38Å; F2136-F2140 HydrophobicContact CZ-CD2 4.45Å; F2136-F2140 HydrophobicContact CZ-CG 4.41Å; F2136-F2140 VanDerWaalsContact O-CB 3.26Å; F2136-F2140 WeakPolarHBondContact O-CB 3.39Å; F2136-F2140 PolarHBondContact O-N 3.09Å; D2137-F2140 PolarHBondContact O-N 3.34Å; F2140-R2142 VanDerWaalsContact C-N 3.3Å; F2140-R2142 PolarHBondContact O-N 3.07Å; F2140-A2143 WeakPolarHBondContact O-CB 3.37Å; F2140-A2143 PolarHBondContact O-N 3.26Å; F2140-A2143 VanDerWaalsContact O-N 3.11Å; F2140-V2144 HydrophobicContact CD1-CG2 4.45Å; F2140-V2144 HydrophobicContact CE1-CG2 4.12Å; F2140-V2144 HydrophobicContact CE2-CG2 4.17Å; F2140-V2144 HydrophobicContact CZ-CG2 3.93Å; F2140-V2144 WeakPolarHBondContact O-CG2 3.33Å; F2140-V2144 PolarHBondContact O-N 3.3Å; F2140-L2190 HydrophobicContact CE2-CB 4.04Å; F2140-L2190 HydrophobicContact CZ-CB 4.41Å; F2140-L2190 HydrophobicContact CZ-CD1 4.42Å; F2140-L2191 HydrophobicContact CD2-CD2 3.89Å; F2140-L2234 HydrophobicContact CE2-CD1 4.43Å; F2140-L2234 HydrophobicContact CZ-CD1 4.38Å
2141Y91.9Very high86.7Confident4 Ų443.5 Ų43.52%0.01623%0.234CC..Hα-helixtrans-65.6-32.9179.5-71.1-60000112.4P2108 C2111 S2112 W2115 L2130 D2137 V2144 L2145P2108-Y2141 HydrophobicContact CB-CE2 4.43Å; P2108-Y2141 PolarHBondContact O-OH 3.12Å; C2111-Y2141 HydrophobicContact CB-CD1 4.01Å; C2111-Y2141 HydrophobicContact CB-CD2 3.83Å; C2111-Y2141 HydrophobicContact CB-CE1 3.95Å; C2111-Y2141 HydrophobicContact CB-CE2 3.77Å; C2111-Y2141 HydrophobicContact CB-CG 3.98Å; S2112-Y2141 WeakPolarHBondContact CB-OH 3.42Å; S2112-Y2141 PolarHBondContact OG-OH 3.18Å; W2115-Y2141 HydrophobicContact CE3-CD1 4.44Å; W2115-Y2141 AromaticContact CE3-CE1 3.95Å; W2115-Y2141 HydrophobicContact CE3-CE1 3.95Å; W2115-Y2141 HydrophobicContact CZ3-CE1 4.35Å; L2130-Y2141 HydrophobicContact CD1-CD2 3.98Å; L2130-Y2141 HydrophobicContact CD2-CD2 4.26Å; D2137-Y2141 HydrophobicContact CB-CD2 4.15Å; D2137-Y2141 HydrophobicContact CB-CE2 3.99Å; D2137-Y2141 WeakPolarHBondContact O-CB 3.47Å; D2137-Y2141 WeakPolarHBondContact O-CD2 3.29Å; D2137-Y2141 PolarHBondContact O-N 3.32Å; Y2141-V2144 PolarHBondContact O-N 3.13Å; Y2141-L2145 WeakPolarHBondContact O-CB 3.27Å; Y2141-L2145 VanDerWaalsContact O-CG 3.31Å; Y2141-L2145 WeakPolarHBondContact O-CG 3.48Å; Y2141-L2145 PolarHBondContact O-N 3.37Å
2142R91Very high87.4Confident43.4 Ų43.442.8 Ų42.816%0.16422%0.222CC..Hα-helixtrans-66.4-39.8171.4-74.6-177.9179.497.2-2.6111.9T2127 L2130 S2131 A2132 G2138 A2139 F2140 V2144 L2145 N2146 F2158T2127-R2142 HydrophobicContact CG2-CB 4.49Å; T2127-R2142 HydrophobicContact CG2-CG 3.51Å; T2127-R2142 VanDerWaalsContact CG2-CG 3.41Å; T2127-R2142 PolarHBondContact O-NH2 3.18Å; T2127-R2142 VanDerWaalsContact O-NH2 3.12Å; L2130-R2142 VanDerWaalsContact O-CZ 3.26Å; L2130-R2142 PolarHBondContact O-NH1 3.19Å; L2130-R2142 PolarHBondContact O-NH2 3.02Å; S2131-R2142 PolarHBondContact O-NH1 3.28Å; A2132-R2142 VanDerWaalsContact CA-NH1 3.28Å; A2132-R2142 VanDerWaalsContact CB-NH1 3.34Å; G2138-R2142 WeakPolarHBondContact O-CD 3.44Å; G2138-R2142 VanDerWaalsContact O-CG 3.27Å; G2138-R2142 WeakPolarHBondContact O-CG 3.4Å; G2138-R2142 PolarHBondContact O-N 3.3Å; G2138-R2142 PolarHBondContact O-NH1 3.16Å; G2138-R2142 VanDerWaalsContact O-NH1 3.16Å; A2139-R2142 PolarHBondContact O-N 3.42Å; F2140-R2142 VanDerWaalsContact C-N 3.3Å; F2140-R2142 PolarHBondContact O-N 3.07Å; R2142-V2144 VanDerWaalsContact C-N 3.35Å; R2142-L2145 PolarHBondContact O-N 3.07Å; R2142-N2146 WeakPolarHBondContact O-CB 3.25Å; R2142-N2146 PolarHBondContact O-N 3.28Å; R2142-N2146 PolarHBondContact O-ND2 3.21Å; R2142-F2158 HydrophobicContact CB-CB 4.47Å; R2142-F2158 HydrophobicContact CB-CD1 4.03Å; R2142-F2158 HydrophobicContact CB-CD2 4.02Å; R2142-F2158 HydrophobicContact CB-CE1 4.18Å; R2142-F2158 HydrophobicContact CB-CE2 4.18Å; R2142-F2158 HydrophobicContact CB-CG 3.96Å; R2142-F2158 HydrophobicContact CB-CZ 4.26Å
2143A92Very high88.7Confident0.6 Ų0.644.9 Ų44.91%0.00524%0.239CC..Hα-helixtrans-59.5-48.4172.800000110.9A2139 F2140 L2145 N2146 I2147 F2158 I2159A2139-A2143 PolarHBondContact O-N 3.12Å; F2140-A2143 WeakPolarHBondContact O-CB 3.37Å; F2140-A2143 PolarHBondContact O-N 3.26Å; F2140-A2143 VanDerWaalsContact O-N 3.11Å; A2143-L2145 PolarHBondContact O-N 3.14Å; A2143-N2146 PolarHBondContact O-N 3Å; A2143-N2146 VanDerWaalsContact O-N 3.15Å; A2143-I2147 VanDerWaalsContact O-CG1 3.26Å; A2143-I2147 WeakPolarHBondContact O-CG1 3.39Å; A2143-I2147 PolarHBondContact O-N 3.15Å; A2143-F2158 HydrophobicContact CB-CB 3.92Å; A2143-I2159 HydrophobicContact CB-CD1 4.45Å; A2143-I2159 HydrophobicContact CB-CG1 3.74Å
2144V92Very high89.9Confident2 Ų245.2 Ų45.21%0.01224%0.236CC..Hα-helixtrans-59.5-44.5177.6172.40000112.1W2115 W2120 F2140 Y2141 R2142 N2146 I2147 H2148 L2234 L2237W2115-V2144 HydrophobicContact CD2-CG1 4.41Å; W2115-V2144 HydrophobicContact CH2-CG1 4.49Å; W2115-V2144 HydrophobicContact CH2-CG2 4.38Å; W2115-V2144 HydrophobicContact CZ2-CG1 3.98Å; W2115-V2144 HydrophobicContact CZ2-CG2 4.47Å; W2120-V2144 HydrophobicContact CH2-CG1 4.15Å; W2120-V2144 HydrophobicContact CZ3-CG1 4.13Å; F2140-V2144 HydrophobicContact CD1-CG2 4.45Å; F2140-V2144 HydrophobicContact CE1-CG2 4.12Å; F2140-V2144 HydrophobicContact CE2-CG2 4.17Å; F2140-V2144 HydrophobicContact CZ-CG2 3.93Å; F2140-V2144 WeakPolarHBondContact O-CG2 3.33Å; F2140-V2144 PolarHBondContact O-N 3.3Å; Y2141-V2144 PolarHBondContact O-N 3.13Å; R2142-V2144 VanDerWaalsContact C-N 3.35Å; V2144-N2146 VanDerWaalsContact C-N 3.34Å; V2144-N2146 PolarHBondContact O-N 3.11Å; V2144-I2147 WeakPolarHBondContact O-CB 3.41Å; V2144-I2147 PolarHBondContact O-N 3.1Å; V2144-H2148 PolarHBondContact O-N 3.17Å; V2144-L2234 HydrophobicContact CG2-CD1 4.12Å; V2144-L2237 HydrophobicContact CG1-CD1 4.19Å; V2144-L2237 HydrophobicContact CG1-CD2 4.23Å
2145L91.3Very high90.8Very high29.6 Ų29.638.3 Ų38.316%0.15520%0.198CC..Hα-helixtrans-61.5-42176.2-159.584.6000111.8W2120 V2123 E2124 T2127 Y2141 R2142 A2143 I2147 H2148 S2149W2120-L2145 HydrophobicContact CE3-CD1 4.25Å; W2120-L2145 HydrophobicContact CE3-CD2 3.96Å; W2120-L2145 HydrophobicContact CZ3-CD2 4.34Å; V2123-L2145 HydrophobicContact CB-CD2 4.36Å; V2123-L2145 HydrophobicContact CG1-CD1 4.4Å; V2123-L2145 HydrophobicContact CG1-CD2 4.09Å; V2123-L2145 HydrophobicContact CG1-CG 4.3Å; E2124-L2145 HydrophobicContact CB-CD1 4.41Å; E2124-L2145 HydrophobicContact CB-CD2 4.31Å; E2124-L2145 HydrophobicContact CG-CD2 4.18Å; T2127-L2145 HydrophobicContact CG2-CD1 4.11Å; Y2141-L2145 WeakPolarHBondContact O-CB 3.27Å; Y2141-L2145 VanDerWaalsContact O-CG 3.31Å; Y2141-L2145 WeakPolarHBondContact O-CG 3.48Å; Y2141-L2145 PolarHBondContact O-N 3.37Å; R2142-L2145 PolarHBondContact O-N 3.07Å; A2143-L2145 PolarHBondContact O-N 3.14Å; L2145-I2147 PolarHBondContact O-N 3.36Å; L2145-H2148 WeakPolarHBondContact O-CB 3.4Å; L2145-H2148 PolarHBondContact O-N 3.01Å; L2145-S2149 PolarHBondContact O-N 3.19Å; L2145-S2149 PolarHBondContact O-OG 3.19Å
2146N92.1Very high91.2Very high19.8 Ų19.839 Ų3911%0.10620%0.203CC..Hα-helixtrans-69.1-32.8176.6-76.5-74.1000112.5R2142 A2143 V2144 H2148 S2149 E2150 Q2151 K2154 A2155 F2158R2142-N2146 WeakPolarHBondContact O-CB 3.25Å; R2142-N2146 PolarHBondContact O-N 3.28Å; R2142-N2146 PolarHBondContact O-ND2 3.21Å; A2143-N2146 PolarHBondContact O-N 3Å; A2143-N2146 VanDerWaalsContact O-N 3.15Å; V2144-N2146 VanDerWaalsContact C-N 3.34Å; V2144-N2146 PolarHBondContact O-N 3.11Å; N2146-H2148 VanDerWaalsContact C-N 3.31Å; N2146-H2148 PolarHBondContact O-N 2.74Å; N2146-S2149 WeakPolarHBondContact CA-OG 3.33Å; N2146-S2149 CarbonylContact O-C 3.55Å; N2146-S2149 PolarHBondContact O-N 2.88Å; N2146-S2149 PolarHBondContact O-OG 3.45Å; N2146-E2150 CarbonylContact O-C 3.49Å; N2146-E2150 PolarHBondContact O-N 3.27Å; N2146-E2150 VanDerWaalsContact O-N 3.14Å; N2146-Q2151 HydrophobicContact CB-CB 4.33Å; N2146-Q2151 PolarHBondContact O-N 3.11Å; N2146-K2154 HydrophobicContact CB-CB 4.43Å; N2146-K2154 WeakPolarHBondContact OD1-CB 3.31Å; N2146-K2154 WeakPolarHBondContact OD1-CD 3.32Å; N2146-A2155 HydrophobicContact CB-CB 3.82Å; N2146-F2158 WeakPolarHBondContact ND2-CD2 3.28Å; N2146-F2158 WeakPolarHBondContact ND2-CE2 3.26Å
2147I91.6Very high91.4Very high0 Ų041.7 Ų41.70%022%0.219CC..Hα-helixtrans-65.9-38.1171.8-68167.6000111A2143 V2144 L2145 E2150 A2155 A2194 V2197 I2198 K2201 L2237A2143-I2147 VanDerWaalsContact O-CG1 3.26Å; A2143-I2147 WeakPolarHBondContact O-CG1 3.39Å; A2143-I2147 PolarHBondContact O-N 3.15Å; V2144-I2147 WeakPolarHBondContact O-CB 3.41Å; V2144-I2147 PolarHBondContact O-N 3.1Å; L2145-I2147 PolarHBondContact O-N 3.36Å; I2147-E2150 PolarHBondContact O-N 3.2Å; I2147-A2155 HydrophobicContact CG1-CB 3.72Å; I2147-A2194 HydrophobicContact CD1-CB 4.08Å; I2147-V2197 HydrophobicContact CG2-CG1 3.78Å; I2147-I2198 HydrophobicContact CD1-CD1 4.12Å; I2147-I2198 HydrophobicContact CD1-CG1 4.04Å; I2147-I2198 HydrophobicContact CG1-CD1 3.95Å; I2147-I2198 HydrophobicContact CG1-CG1 3.81Å; I2147-K2201 PolarHBondContact O-NZ 3.26Å; I2147-K2201 VanDerWaalsContact O-NZ 3.12Å; I2147-L2237 HydrophobicContact CB-CD1 4.5Å; I2147-L2237 HydrophobicContact CB-CD2 4.26Å; I2147-L2237 HydrophobicContact CG2-CD1 3.98Å; I2147-L2237 HydrophobicContact CG2-CD2 3.75Å
2148H89.9Confident91.7Very high83.6 Ų83.641.6 Ų41.639%0.38722%0.217SC..Hα-helixtrans-68.1-44.9175.4-179.5-94.2000111.5W2120 V2144 L2145 N2146 E2150W2120-H2148 AromaticContact CD1-CE1 3.82Å; W2120-H2148 AromaticContact CD1-NE2 3.67Å; W2120-H2148 AromaticContact CD2-CD2 3.88Å; W2120-H2148 AromaticContact CD2-CE1 3.89Å; W2120-H2148 AromaticContact CD2-CG 3.91Å; W2120-H2148 AromaticContact CD2-ND1 3.93Å; W2120-H2148 AromaticContact CD2-NE2 3.89Å; W2120-H2148 AromaticContact CE2-CD2 3.41Å; W2120-H2148 VanDerWaalsContact CE2-CD2 3.41Å; W2120-H2148 AromaticContact CE2-CE1 3.97Å; W2120-H2148 AromaticContact CE2-CG 3.87Å; W2120-H2148 AromaticContact CE2-NE2 3.54Å; W2120-H2148 HydrophobicContact CE3-CB 4.27Å; W2120-H2148 AromaticContact CE3-CG 3.92Å; W2120-H2148 AromaticContact CG-CE1 3.86Å; W2120-H2148 AromaticContact CG-NE2 3.96Å; W2120-H2148 HydrophobicContact CH2-CB 4.1Å; W2120-H2148 AromaticContact CH2-CD2 3.95Å; W2120-H2148 HydrophobicContact CZ2-CB 4.34Å; W2120-H2148 AromaticContact CZ2-CD2 3.5Å; W2120-H2148 VanDerWaalsContact CZ2-CD2 3.41Å; W2120-H2148 WeakPolarHBondContact CZ2-CD2 3.39Å; W2120-H2148 AromaticContact CZ2-CG 3.95Å; W2120-H2148 AromaticContact CZ2-NE2 3.98Å; W2120-H2148 HydrophobicContact CZ3-CB 4.04Å; W2120-H2148 AromaticContact NE1-CD2 3.71Å; W2120-H2148 AromaticContact NE1-CE1 3.88Å; W2120-H2148 AromaticContact NE1-NE2 3.33Å; W2120-H2148 PolarHBondContact NE1-NE2 3.25Å; V2144-H2148 PolarHBondContact O-N 3.17Å; L2145-H2148 WeakPolarHBondContact O-CB 3.4Å; L2145-H2148 PolarHBondContact O-N 3.01Å; N2146-H2148 VanDerWaalsContact C-N 3.31Å; N2146-H2148 PolarHBondContact O-N 2.74Å; H2148-E2150 PolarHBondContact O-N 3.19Å; H2148-E2150 VanDerWaalsContact O-N 3.16Å
2149S90.5Very high91.9Very high54.4 Ų54.441.6 Ų41.638%0.3822%0.217SC..THydrogen-bonded Turntrans-7911.2176.669.70000114.8L2145 N2146 Q2151L2145-S2149 PolarHBondContact O-N 3.19Å; L2145-S2149 PolarHBondContact O-OG 3.19Å; N2146-S2149 WeakPolarHBondContact CA-OG 3.33Å; N2146-S2149 CarbonylContact O-C 3.55Å; N2146-S2149 PolarHBondContact O-N 2.88Å; N2146-S2149 PolarHBondContact O-OG 3.45Å; S2149-Q2151 PolarHBondContact O-N 3.09Å; S2149-Q2151 VanDerWaalsContact O-N 3.13Å; S2149-Q2151 PolarHBondContact OG-NE2 3.14Å; S2149-Q2151 VanDerWaalsContact OG-NE2 3.13Å
2150E89.9Confident92Very high128.6 Ų128.645.5 Ų45.560%0.60124%0.236SC*.THydrogen-bonded Turntrans60.319.3177.8-51.1-167.6157.400115.7N2146 I2147 H2148 Y2152 K2201N2146-E2150 CarbonylContact O-C 3.49Å; N2146-E2150 PolarHBondContact O-N 3.27Å; N2146-E2150 VanDerWaalsContact O-N 3.14Å; I2147-E2150 PolarHBondContact O-N 3.2Å; H2148-E2150 PolarHBondContact O-N 3.19Å; H2148-E2150 VanDerWaalsContact O-N 3.16Å; E2150-Y2152 VanDerWaalsContact C-N 3.3Å; E2150-Y2152 HydrophobicContact CB-CE1 4.41Å; E2150-Y2152 HydrophobicContact CB-CE2 4.31Å; E2150-Y2152 WeakPolarHBondContact CB-OH 3.36Å; E2150-Y2152 WeakPolarHBondContact CG-OH 3.38Å; E2150-Y2152 VanDerWaalsContact O-CD2 3.3Å; E2150-Y2152 WeakPolarHBondContact O-CD2 3.39Å; E2150-Y2152 WeakPolarHBondContact O-CE2 3.32Å; E2150-Y2152 PolarHBondContact O-N 3.14Å; E2150-Y2152 VanDerWaalsContact O-N 3.14Å; E2150-Y2152 PolarHBondContact OE1-OH 3.24Å; E2150-K2201 IonicContact OE1-NZ 3.6Å; E2150-K2201 PolarHBondContact OE1-NZ 2.87Å
2151Q93.3Very high92Very high83 Ų8349.3 Ų49.339%0.38825%0.252SS..  trans-89.969.1176.5-66.5-178.242.500111.1N2146 S2149 A2153 K2154 A2155N2146-Q2151 HydrophobicContact CB-CB 4.33Å; N2146-Q2151 PolarHBondContact O-N 3.11Å; S2149-Q2151 PolarHBondContact O-N 3.09Å; S2149-Q2151 VanDerWaalsContact O-N 3.13Å; S2149-Q2151 PolarHBondContact OG-NE2 3.14Å; S2149-Q2151 VanDerWaalsContact OG-NE2 3.13Å; Q2151-A2153 VanDerWaalsContact C-N 3.33Å; Q2151-A2153 PolarHBondContact O-N 3.19Å; Q2151-A2153 VanDerWaalsContact O-N 3.17Å; Q2151-K2154 HydrophobicContact CB-CD 4.39Å; Q2151-K2154 PolarHBondContact O-N 3.11Å; Q2151-K2154 VanDerWaalsContact O-N 3.13Å; Q2151-A2155 PolarHBondContact O-N 3.17Å; Q2151-A2155 VanDerWaalsContact O-N 3.09Å
2152Y92.9Very high92Very high50 Ų5049.1 Ų49.120%0.19625%0.251CS..Hα-helixtrans-61.7-37.6-169.9-53.2-58000115E2150 A2155 C2156 I2198 K2201 L2202E2150-Y2152 VanDerWaalsContact C-N 3.3Å; E2150-Y2152 HydrophobicContact CB-CE1 4.41Å; E2150-Y2152 HydrophobicContact CB-CE2 4.31Å; E2150-Y2152 WeakPolarHBondContact CB-OH 3.36Å; E2150-Y2152 WeakPolarHBondContact CG-OH 3.38Å; E2150-Y2152 VanDerWaalsContact O-CD2 3.3Å; E2150-Y2152 WeakPolarHBondContact O-CD2 3.39Å; E2150-Y2152 WeakPolarHBondContact O-CE2 3.32Å; E2150-Y2152 PolarHBondContact O-N 3.14Å; E2150-Y2152 VanDerWaalsContact O-N 3.14Å; E2150-Y2152 PolarHBondContact OE1-OH 3.24Å; Y2152-A2155 WeakPolarHBondContact O-CB 3.29Å; Y2152-A2155 PolarHBondContact O-N 3.15Å; Y2152-C2156 PolarHBondContact O-N 3.21Å; Y2152-C2156 PolarHBondContact O-SG 3.12Å; Y2152-C2156 VanDerWaalsContact O-SG 3.37Å; Y2152-I2198 HydrophobicContact CD1-CB 4.46Å; Y2152-I2198 HydrophobicContact CD1-CG1 4.16Å; Y2152-I2198 HydrophobicContact CD1-CG2 3.85Å; Y2152-I2198 HydrophobicContact CG-CG2 4.06Å; Y2152-K2201 HydrophobicContact CE1-CB 4.46Å; Y2152-K2201 HydrophobicContact CE1-CD 4.02Å; Y2152-K2201 WeakPolarHBondContact OH-CD 3.37Å; Y2152-L2202 HydrophobicContact CD2-CD1 4.37Å; Y2152-L2202 HydrophobicContact CD2-CD2 3.92Å; Y2152-L2202 HydrophobicContact CD2-CG 4.4Å; Y2152-L2202 HydrophobicContact CE2-CD2 3.81Å; Y2152-L2202 HydrophobicContact CE2-CG 4.39Å
2153A92.1Very high92Very high75 Ų7549.5 Ų49.562%0.6225%0.253SS*.Hα-helixtrans-61.9-49.5179.400000111.7Q2151 A2155 C2156 D2157Q2151-A2153 VanDerWaalsContact C-N 3.33Å; Q2151-A2153 PolarHBondContact O-N 3.19Å; Q2151-A2153 VanDerWaalsContact O-N 3.17Å; A2153-A2155 VanDerWaalsContact C-N 3.29Å; A2153-A2155 PolarHBondContact O-N 3.14Å; A2153-C2156 WeakPolarHBondContact O-CB 3.39Å; A2153-C2156 PolarHBondContact O-N 3.11Å; A2153-C2156 VanDerWaalsContact O-N 3.12Å; A2153-D2157 PolarHBondContact O-N 2.97Å; A2153-D2157 VanDerWaalsContact O-N 3.12Å
2154K92.2Very high92Very high107.6 Ų107.653.5 Ų53.547%0.46827%0.274SS..Hα-helixtrans-63.8-35.9176-64.1-175.5-171.2166.50112.1N2146 Q2151 C2156 D2157 F2158N2146-K2154 HydrophobicContact CB-CB 4.43Å; N2146-K2154 WeakPolarHBondContact OD1-CB 3.31Å; N2146-K2154 WeakPolarHBondContact OD1-CD 3.32Å; Q2151-K2154 HydrophobicContact CB-CD 4.39Å; Q2151-K2154 PolarHBondContact O-N 3.11Å; Q2151-K2154 VanDerWaalsContact O-N 3.13Å; K2154-C2156 VanDerWaalsContact C-N 3.34Å; K2154-C2156 PolarHBondContact O-N 3.29Å; K2154-D2157 PolarHBondContact O-N 3.07Å; K2154-F2158 WeakPolarHBondContact O-CD2 3.39Å; K2154-F2158 PolarHBondContact O-N 3.1Å; K2154-F2158 VanDerWaalsContact O-N 3.09Å
2155A92.5Very high91.8Very high0 Ų054.7 Ų54.70%028%0.282CS..Hα-helixtrans-60-45.3174.500000111.5N2146 I2147 Q2151 Y2152 A2153 D2157 F2158 I2159 I2198N2146-A2155 HydrophobicContact CB-CB 3.82Å; I2147-A2155 HydrophobicContact CG1-CB 3.72Å; Q2151-A2155 PolarHBondContact O-N 3.17Å; Q2151-A2155 VanDerWaalsContact O-N 3.09Å; Y2152-A2155 WeakPolarHBondContact O-CB 3.29Å; Y2152-A2155 PolarHBondContact O-N 3.15Å; A2153-A2155 VanDerWaalsContact C-N 3.29Å; A2153-A2155 PolarHBondContact O-N 3.14Å; A2155-D2157 VanDerWaalsContact C-N 3.34Å; A2155-D2157 PolarHBondContact O-N 3.03Å; A2155-F2158 PolarHBondContact O-N 3.01Å; A2155-I2159 VanDerWaalsContact O-CG1 3.26Å; A2155-I2159 WeakPolarHBondContact O-CG1 3.4Å; A2155-I2159 PolarHBondContact O-N 3.14Å; A2155-I2198 HydrophobicContact CB-CD1 3.99Å
2156C93.2Very high91.7Very high47.2 Ų47.253.5 Ų53.532%0.31928%0.275SS..Hα-helixtrans-60.3-42.2175.1-680000112.1Y2152 A2153 K2154 F2158 I2159 M2160Y2152-C2156 PolarHBondContact O-N 3.21Å; Y2152-C2156 PolarHBondContact O-SG 3.12Å; Y2152-C2156 VanDerWaalsContact O-SG 3.37Å; A2153-C2156 WeakPolarHBondContact O-CB 3.39Å; A2153-C2156 PolarHBondContact O-N 3.11Å; A2153-C2156 VanDerWaalsContact O-N 3.12Å; K2154-C2156 VanDerWaalsContact C-N 3.34Å; K2154-C2156 PolarHBondContact O-N 3.29Å; C2156-F2158 VanDerWaalsContact C-N 3.33Å; C2156-F2158 PolarHBondContact O-N 3.18Å; C2156-I2159 WeakPolarHBondContact O-CB 3.34Å; C2156-I2159 PolarHBondContact O-N 3.13Å; C2156-I2159 VanDerWaalsContact O-N 3.13Å; C2156-M2160 WeakPolarHBondContact O-CG 3.36Å; C2156-M2160 PolarHBondContact O-N 3.2Å
2157D93.2Very high91.6Very high97.6 Ų97.655.8 Ų55.852%0.52229%0.287SS..Hα-helixtrans-59.7-43.7176.6-62.2-28000111.7A2153 K2154 A2155 M2160 K2161A2153-D2157 PolarHBondContact O-N 2.97Å; A2153-D2157 VanDerWaalsContact O-N 3.12Å; K2154-D2157 PolarHBondContact O-N 3.07Å; A2155-D2157 VanDerWaalsContact C-N 3.34Å; A2155-D2157 PolarHBondContact O-N 3.03Å; D2157-M2160 PolarHBondContact O-N 3.15Å; D2157-K2161 WeakPolarHBondContact O-CG 3.33Å; D2157-K2161 PolarHBondContact O-N 2.96Å; D2157-K2161 VanDerWaalsContact O-N 3.16Å
2158F92.9Very high91.3Very high41.2 Ų41.259.2 Ų59.218%0.18131%0.311CS..Hα-helixtrans-69.4-33.4175.8-76-63.1000113.1A2132 R2142 A2143 N2146 K2154 A2155 C2156 M2160 K2161 A2162A2132-F2158 HydrophobicContact CB-CE1 4.32Å; R2142-F2158 HydrophobicContact CB-CB 4.47Å; R2142-F2158 HydrophobicContact CB-CD1 4.03Å; R2142-F2158 HydrophobicContact CB-CD2 4.02Å; R2142-F2158 HydrophobicContact CB-CE1 4.18Å; R2142-F2158 HydrophobicContact CB-CE2 4.18Å; R2142-F2158 HydrophobicContact CB-CG 3.96Å; R2142-F2158 HydrophobicContact CB-CZ 4.26Å; A2143-F2158 HydrophobicContact CB-CB 3.92Å; N2146-F2158 WeakPolarHBondContact ND2-CD2 3.28Å; N2146-F2158 WeakPolarHBondContact ND2-CE2 3.26Å; K2154-F2158 WeakPolarHBondContact O-CD2 3.39Å; K2154-F2158 PolarHBondContact O-N 3.1Å; K2154-F2158 VanDerWaalsContact O-N 3.09Å; A2155-F2158 PolarHBondContact O-N 3.01Å; C2156-F2158 VanDerWaalsContact C-N 3.33Å; C2156-F2158 PolarHBondContact O-N 3.18Å; F2158-M2160 VanDerWaalsContact C-N 3.33Å; F2158-K2161 HydrophobicContact CD1-CD 4.23Å; F2158-K2161 PolarHBondContact O-N 3.02Å; F2158-A2162 WeakPolarHBondContact O-CB 3.32Å; F2158-A2162 PolarHBondContact O-N 3.15Å
2159I93.7Very high90.9Very high0 Ų058.5 Ų58.50%031%0.31CS..Hα-helixtrans-63.5-42.3172.5-69.6165.8000110.4A2143 A2155 C2156 A2162 R2163 L2191 A2194 E2195 I2198A2143-I2159 HydrophobicContact CB-CD1 4.45Å; A2143-I2159 HydrophobicContact CB-CG1 3.74Å; A2155-I2159 VanDerWaalsContact O-CG1 3.26Å; A2155-I2159 WeakPolarHBondContact O-CG1 3.4Å; A2155-I2159 PolarHBondContact O-N 3.14Å; C2156-I2159 WeakPolarHBondContact O-CB 3.34Å; C2156-I2159 PolarHBondContact O-N 3.13Å; C2156-I2159 VanDerWaalsContact O-N 3.13Å; I2159-A2162 WeakPolarHBondContact O-CB 3.12Å; I2159-A2162 PolarHBondContact O-N 3.14Å; I2159-R2163 WeakPolarHBondContact O-CG 3.26Å; I2159-R2163 PolarHBondContact O-N 3.31Å; I2159-L2191 HydrophobicContact CG2-CB 4.18Å; I2159-L2191 HydrophobicContact CG2-CD2 4.33Å; I2159-A2194 HydrophobicContact CD1-CB 3.92Å; I2159-A2194 HydrophobicContact CG1-CB 4.42Å; I2159-E2195 HydrophobicContact CD1-CG 3.96Å; I2159-E2195 HydrophobicContact CG2-CG 4Å; I2159-I2198 HydrophobicContact CD1-CD1 4.04Å
2160M92.3Very high90.6Very high84.2 Ų84.256.8 Ų56.842%0.41530%0.297SS..Hα-helixtrans-61.9-46175.3-68.9-130.682.900111.5C2156 D2157 F2158 A2162 R2163 D2164 E2195C2156-M2160 WeakPolarHBondContact O-CG 3.36Å; C2156-M2160 PolarHBondContact O-N 3.2Å; D2157-M2160 PolarHBondContact O-N 3.15Å; F2158-M2160 VanDerWaalsContact C-N 3.33Å; M2160-A2162 VanDerWaalsContact C-N 3.31Å; M2160-A2162 PolarHBondContact O-N 3.18Å; M2160-R2163 VanDerWaalsContact CE-NH1 3.33Å; M2160-R2163 CarbonylContact O-C 3.48Å; M2160-R2163 WeakPolarHBondContact O-CA 3.32Å; M2160-R2163 WeakPolarHBondContact O-CB 3.34Å; M2160-R2163 PolarHBondContact O-N 3.17Å; M2160-R2163 VanDerWaalsContact O-N 3.16Å; M2160-D2164 PolarHBondContact O-N 3.16Å; M2160-E2195 VanDerWaalsContact CE-OE1 3.28Å; M2160-E2195 WeakPolarHBondContact CE-OE1 3.33Å
2161K90.9Very high90.3Very high82.6 Ų82.653.7 Ų53.736%0.35929%0.287SS..Hα-helixtrans-58.2-41174.6-70.8-179176.1-161.70112.7D2133 A2139 D2157 F2158 R2163 D2164 V2165D2133-K2161 WeakPolarHBondContact OD1-CE 3.43Å; D2133-K2161 IonicContact OD1-NZ 3.12Å; D2133-K2161 PolarHBondContact OD1-NZ 3.41Å; A2139-K2161 HydrophobicContact CB-CB 4.33Å; D2157-K2161 WeakPolarHBondContact O-CG 3.33Å; D2157-K2161 PolarHBondContact O-N 2.96Å; D2157-K2161 VanDerWaalsContact O-N 3.16Å; F2158-K2161 HydrophobicContact CD1-CD 4.23Å; F2158-K2161 PolarHBondContact O-N 3.02Å; K2161-R2163 VanDerWaalsContact C-N 3.31Å; K2161-R2163 PolarHBondContact O-N 3.23Å; K2161-D2164 PolarHBondContact O-N 3.16Å; K2161-V2165 WeakPolarHBondContact O-CG2 3.35Å; K2161-V2165 PolarHBondContact O-N 3.28Å
2162A92Very high89.6Confident0 Ų052.3 Ų52.30%029%0.289CS..Hα-helixtrans-65-35176.100000112.2F2136 A2139 F2158 I2159 M2160 V2165 L2166 L2191F2136-A2162 HydrophobicContact CD2-CB 4.12Å; F2136-A2162 HydrophobicContact CE2-CB 4.28Å; A2139-A2162 HydrophobicContact CB-CB 3.78Å; F2158-A2162 WeakPolarHBondContact O-CB 3.32Å; F2158-A2162 PolarHBondContact O-N 3.15Å; I2159-A2162 WeakPolarHBondContact O-CB 3.12Å; I2159-A2162 PolarHBondContact O-N 3.14Å; M2160-A2162 VanDerWaalsContact C-N 3.31Å; M2160-A2162 PolarHBondContact O-N 3.18Å; A2162-V2165 PolarHBondContact O-N 3.19Å; A2162-L2166 VanDerWaalsContact O-CB 3.31Å; A2162-L2166 WeakPolarHBondContact O-CB 3.46Å; A2162-L2166 WeakPolarHBondContact O-CG 3.39Å; A2162-L2166 PolarHBondContact O-N 3.21Å; A2162-L2166 VanDerWaalsContact O-N 3.13Å; A2162-L2191 HydrophobicContact CB-CD1 3.71Å; A2162-L2191 HydrophobicContact CB-CD2 3.59Å; A2162-L2191 HydrophobicContact CB-CG 4.31Å
2163R92.7Very high88.6Confident52.4 Ų52.451.9 Ų51.920%0.19829%0.29CS..Hα-helixtrans-66-42.4172.9-73.3-171.3174.7133.92.4112.1I2159 M2160 K2161 V2165 L2166 D2167 L2191 S2192 E2195I2159-R2163 WeakPolarHBondContact O-CG 3.26Å; I2159-R2163 PolarHBondContact O-N 3.31Å; M2160-R2163 VanDerWaalsContact CE-NH1 3.33Å; M2160-R2163 CarbonylContact O-C 3.48Å; M2160-R2163 WeakPolarHBondContact O-CA 3.32Å; M2160-R2163 WeakPolarHBondContact O-CB 3.34Å; M2160-R2163 PolarHBondContact O-N 3.17Å; M2160-R2163 VanDerWaalsContact O-N 3.16Å; K2161-R2163 VanDerWaalsContact C-N 3.31Å; K2161-R2163 PolarHBondContact O-N 3.23Å; R2163-V2165 VanDerWaalsContact C-N 3.27Å; R2163-V2165 PolarHBondContact O-N 3.05Å; R2163-L2166 PolarHBondContact O-N 3.16Å; R2163-L2166 VanDerWaalsContact O-N 3.12Å; R2163-D2167 WeakPolarHBondContact O-CB 3.38Å; R2163-D2167 PolarHBondContact O-N 3.19Å; R2163-L2191 HydrophobicContact CB-CD1 4.34Å; R2163-L2191 HydrophobicContact CG-CB 4.48Å; R2163-L2191 HydrophobicContact CG-CD1 3.53Å; R2163-L2191 VanDerWaalsContact CG-CD1 3.47Å; R2163-S2192 PolarHBondContact NH2-OG 3.36Å; R2163-E2195 IonicContact CZ-OE1 3.25Å; R2163-E2195 VanDerWaalsContact CZ-OE1 3.24Å; R2163-E2195 IonicContact CZ-OE2 3.19Å; R2163-E2195 VanDerWaalsContact NH1-CD 3.3Å; R2163-E2195 IonicContact NH1-OE1 3.06Å; R2163-E2195 PolarHBondContact NH1-OE1 3.21Å; R2163-E2195 IonicContact NH1-OE2 3.2Å; R2163-E2195 PolarHBondContact NH1-OE2 3.18Å; R2163-E2195 VanDerWaalsContact NH2-CD 3.31Å; R2163-E2195 IonicContact NH2-OE1 3.21Å; R2163-E2195 PolarHBondContact NH2-OE1 3.03Å; R2163-E2195 VanDerWaalsContact NH2-OE1 3.08Å; R2163-E2195 IonicContact NH2-OE2 3.47Å; R2163-E2195 PolarHBondContact NH2-OE2 3.07Å
2164D90.5Very high87.5Confident85.6 Ų85.650.3 Ų50.346%0.45828%0.277SS..Hα-helixtrans-59.6-39.3178.9-66-22.7000111.6K1326 Q1330 M2160 K2161 D2167 S2168K1326-D2164 VanDerWaalsContact CE-CG 3.48Å; K1326-D2164 WeakPolarHBondContact CE-OD1 3.22Å; K1326-D2164 WeakPolarHBondContact CE-OD2 3.36Å; K1326-D2164 IonicContact NZ-OD1 2.78Å; K1326-D2164 PolarHBondContact NZ-OD1 3.28Å; K1326-D2164 IonicContact NZ-OD2 2.67Å; K1326-D2164 PolarHBondContact NZ-OD2 2.96Å; Q1330-D2164 PolarHBondContact NE2-OD1 3.23Å; M2160-D2164 PolarHBondContact O-N 3.16Å; K2161-D2164 PolarHBondContact O-N 3.16Å; D2164-D2167 WeakPolarHBondContact O-CB 3.23Å; D2164-D2167 PolarHBondContact O-N 3.05Å; D2164-S2168 PolarHBondContact O-N 3.29Å
2165V89.1Confident86.3Confident27.2 Ų27.252.9 Ų52.917%0.16529%0.291CS..Hα-helixtrans-65.3-46.6174.2177.60000111.1D2133 F2136 K2161 A2162 R2163 D2167 S2168 N2169D2133-V2165 WeakPolarHBondContact O-CG2 3.27Å; F2136-V2165 HydrophobicContact CB-CG1 4.2Å; K2161-V2165 WeakPolarHBondContact O-CG2 3.35Å; K2161-V2165 PolarHBondContact O-N 3.28Å; A2162-V2165 PolarHBondContact O-N 3.19Å; R2163-V2165 VanDerWaalsContact C-N 3.27Å; R2163-V2165 PolarHBondContact O-N 3.05Å; V2165-D2167 VanDerWaalsContact C-N 3.29Å; V2165-D2167 PolarHBondContact O-N 3.09Å; V2165-S2168 PolarHBondContact O-N 2.78Å; V2165-S2168 PolarHBondContact O-OG 3.16Å; V2165-N2169 PolarHBondContact O-N 3.34Å
2166L89.3Confident85.2Confident4.4 Ų4.456.9 Ų56.92%0.02331%0.309CS..Hα-helixtrans-66.7-34.6-180-86.9166.6000113.1F2136 A2162 R2163 S2168 N2169 L2170 D2184 G2187 T2188 L2191F2136-L2166 HydrophobicContact CD2-CB 4.31Å; F2136-L2166 HydrophobicContact CD2-CD1 3.97Å; F2136-L2166 HydrophobicContact CD2-CD2 3.96Å; F2136-L2166 HydrophobicContact CD2-CG 3.64Å; F2136-L2166 HydrophobicContact CE2-CD1 3.51Å; F2136-L2166 VanDerWaalsContact CE2-CD1 3.42Å; F2136-L2166 HydrophobicContact CE2-CD2 4.14Å; F2136-L2166 HydrophobicContact CE2-CG 3.87Å; F2136-L2166 HydrophobicContact CG-CD2 4.2Å; F2136-L2166 HydrophobicContact CG-CG 4.45Å; F2136-L2166 HydrophobicContact CZ-CD1 4.35Å; A2162-L2166 VanDerWaalsContact O-CB 3.31Å; A2162-L2166 WeakPolarHBondContact O-CB 3.46Å; A2162-L2166 WeakPolarHBondContact O-CG 3.39Å; A2162-L2166 PolarHBondContact O-N 3.21Å; A2162-L2166 VanDerWaalsContact O-N 3.13Å; R2163-L2166 PolarHBondContact O-N 3.16Å; R2163-L2166 VanDerWaalsContact O-N 3.12Å; L2166-S2168 VanDerWaalsContact C-N 3.31Å; L2166-S2168 PolarHBondContact O-N 3.03Å; L2166-N2169 PolarHBondContact O-N 3.24Å; L2166-N2169 VanDerWaalsContact O-N 3.12Å; L2166-L2170 HydrophobicContact CB-CD1 4.49Å; L2166-L2170 VanDerWaalsContact O-CB 3.27Å; L2166-L2170 WeakPolarHBondContact O-CB 3.39Å; L2166-L2170 WeakPolarHBondContact O-CG 3.34Å; L2166-L2170 PolarHBondContact O-N 3.17Å; L2166-D2184 HydrophobicContact CD1-CB 3.76Å; L2166-D2184 HydrophobicContact CD2-CB 4.1Å; L2166-G2187 VanDerWaalsContact CD1-C 3.47Å; L2166-T2188 HydrophobicContact CB-CG2 4.34Å; L2166-T2188 HydrophobicContact CD1-CG2 3.76Å; L2166-T2188 HydrophobicContact CD2-CG2 3.38Å; L2166-T2188 HydrophobicContact CG-CG2 4.1Å; L2166-L2191 HydrophobicContact CD1-CD1 3.83Å; L2166-L2191 HydrophobicContact CD2-CD1 4.21Å
2167D89.2Confident84.1Confident67 Ų6756.8 Ų56.836%0.35831%0.309SS..Hα-helixtrans-58.5-44.5178.6-171.638000111.4L1320 R1329 L1333 R2163 D2164 V2165 N2169 L2170 T2171L1320-D2167 VanDerWaalsContact CD1-OD1 3.28Å; L1320-D2167 WeakPolarHBondContact CD1-OD1 3.33Å; R1329-D2167 IonicContact CZ-OD1 3.44Å; R1329-D2167 IonicContact CZ-OD2 3.49Å; R1329-D2167 IonicContact NE-OD1 3.61Å; R1329-D2167 PolarHBondContact NE-OD1 3.48Å; R1329-D2167 IonicContact NE-OD2 3.79Å; R1329-D2167 PolarHBondContact NE-OD2 2.88Å; R1329-D2167 VanDerWaalsContact NH2-CG 3.3Å; R1329-D2167 IonicContact NH2-OD1 3.74Å; R1329-D2167 PolarHBondContact NH2-OD1 2.99Å; R1329-D2167 IonicContact NH2-OD2 2.98Å; R1329-D2167 PolarHBondContact NH2-OD2 3.17Å; L1333-D2167 HydrophobicContact CD1-CB 3.5Å; R2163-D2167 WeakPolarHBondContact O-CB 3.38Å; R2163-D2167 PolarHBondContact O-N 3.19Å; D2164-D2167 WeakPolarHBondContact O-CB 3.23Å; D2164-D2167 PolarHBondContact O-N 3.05Å; V2165-D2167 VanDerWaalsContact C-N 3.29Å; V2165-D2167 PolarHBondContact O-N 3.09Å; D2167-N2169 VanDerWaalsContact C-N 3.33Å; D2167-N2169 PolarHBondContact O-N 3.04Å; D2167-L2170 PolarHBondContact O-N 3.06Å; D2167-T2171 VanDerWaalsContact O-CB 3.32Å; D2167-T2171 WeakPolarHBondContact O-CB 3.42Å; D2167-T2171 PolarHBondContact O-N 3.18Å; D2167-T2171 PolarHBondContact O-OG1 3.15Å; D2167-T2171 PolarHBondContact OD1-OG1 2.77Å
2168S85.1Confident83.4Confident71.8 Ų71.856.7 Ų56.750%0.50230%0.302SS..Hα-helixtrans-62.4-39.4177.773.20000112.9D2164 V2165 L2166 A2172D2164-S2168 PolarHBondContact O-N 3.29Å; V2165-S2168 PolarHBondContact O-N 2.78Å; V2165-S2168 PolarHBondContact O-OG 3.16Å; L2166-S2168 VanDerWaalsContact C-N 3.31Å; L2166-S2168 PolarHBondContact O-N 3.03Å; S2168-A2172 WeakPolarHBondContact O-CB 3.13Å; S2168-A2172 PolarHBondContact O-N 3.11Å
2169N82.4Confident82.7Confident67.8 Ų67.859.2 Ų59.236%0.36332%0.317SS..Hα-helixtrans-73.6-47.2178.2-69.7-18.3000111.8V2165 L2166 D2167 T2171 A2172 M2173V2165-N2169 PolarHBondContact O-N 3.34Å; L2166-N2169 PolarHBondContact O-N 3.24Å; L2166-N2169 VanDerWaalsContact O-N 3.12Å; D2167-N2169 VanDerWaalsContact C-N 3.33Å; D2167-N2169 PolarHBondContact O-N 3.04Å; N2169-T2171 VanDerWaalsContact C-N 3.31Å; N2169-T2171 PolarHBondContact O-N 3.04Å; N2169-A2172 CarbonylContact O-C 3.56Å; N2169-A2172 PolarHBondContact O-N 3.04Å; N2169-A2172 VanDerWaalsContact O-N 3.15Å; N2169-M2173 WeakPolarHBondContact O-CB 3.34Å; N2169-M2173 WeakPolarHBondContact O-CG 3.39Å; N2169-M2173 PolarHBondContact O-N 3.06Å; N2169-M2173 VanDerWaalsContact O-N 3.08Å
2170L84.2Confident81.8Confident19.8 Ų19.863.3 Ų63.310%0.10433%0.333CS..Hα-helixtrans-65.4-40.5-176.5-111.9152.2000111.4L1320 L1333 L2166 D2167 A2172 M2173 A2174 A2181 D2184 L2185 T2188L1320-L2170 HydrophobicContact CD2-CB 3.69Å; L1333-L2170 HydrophobicContact CD2-CD1 3.4Å; L1333-L2170 VanDerWaalsContact CD2-CD1 3.4Å; L2166-L2170 HydrophobicContact CB-CD1 4.49Å; L2166-L2170 VanDerWaalsContact O-CB 3.27Å; L2166-L2170 WeakPolarHBondContact O-CB 3.39Å; L2166-L2170 WeakPolarHBondContact O-CG 3.34Å; L2166-L2170 PolarHBondContact O-N 3.17Å; D2167-L2170 PolarHBondContact O-N 3.06Å; L2170-A2172 VanDerWaalsContact C-N 3.3Å; L2170-A2172 PolarHBondContact O-N 3.19Å; L2170-M2173 PolarHBondContact O-N 3.36Å; L2170-M2173 VanDerWaalsContact O-N 3.14Å; L2170-A2174 HydrophobicContact CD2-CB 4.18Å; L2170-A2174 WeakPolarHBondContact O-CB 3.44Å; L2170-A2174 PolarHBondContact O-N 3.39Å; L2170-A2181 HydrophobicContact CD1-CB 3.95Å; L2170-A2181 HydrophobicContact CD2-CB 3.94Å; L2170-D2184 HydrophobicContact CB-CB 4.31Å; L2170-D2184 HydrophobicContact CD1-CB 4.23Å; L2170-D2184 HydrophobicContact CD2-CB 3.54Å; L2170-D2184 HydrophobicContact CG-CB 3.93Å; L2170-L2185 HydrophobicContact CD1-CD2 4.23Å; L2170-L2185 HydrophobicContact CD1-CG 4.18Å; L2170-L2185 HydrophobicContact CD2-CD2 4.28Å; L2170-L2185 HydrophobicContact CD2-CG 4.12Å; L2170-T2188 HydrophobicContact CD1-CG2 3.61Å; L2170-T2188 HydrophobicContact CD2-CG2 4.11Å
2171T82.8Confident81.4Confident62.8 Ų62.859.4 Ų59.439%0.38531%0.314SS..Hα-helixtrans-59.2-41.7175.2-59.30000111.3R1329 D2167 N2169 M2173R1329-T2171 PolarHBondContact NH2-OG1 2.72Å; D2167-T2171 VanDerWaalsContact O-CB 3.32Å; D2167-T2171 WeakPolarHBondContact O-CB 3.42Å; D2167-T2171 PolarHBondContact O-N 3.18Å; D2167-T2171 PolarHBondContact O-OG1 3.15Å; D2167-T2171 PolarHBondContact OD1-OG1 2.77Å; N2169-T2171 VanDerWaalsContact C-N 3.31Å; N2169-T2171 PolarHBondContact O-N 3.04Å; T2171-M2173 VanDerWaalsContact C-N 3.27Å; T2171-M2173 PolarHBondContact O-N 3.31Å
2172A77.6Confident81.2Confident53.8 Ų53.856.6 Ų56.645%0.44530%0.301SS..Hα-helixtrans-74.6-27.8179.200000113.8R1976 S2168 N2169 L2170R1976-A2172 PolarHBondContact NH1-O 3.36Å; S2168-A2172 WeakPolarHBondContact O-CB 3.13Å; S2168-A2172 PolarHBondContact O-N 3.11Å; N2169-A2172 CarbonylContact O-C 3.56Å; N2169-A2172 PolarHBondContact O-N 3.04Å; N2169-A2172 VanDerWaalsContact O-N 3.15Å; L2170-A2172 VanDerWaalsContact C-N 3.3Å; L2170-A2172 PolarHBondContact O-N 3.19Å
2173M72.8Confident80.9Confident41.4 Ų41.459.9 Ų59.920%0.20433%0.328CS..Hα-helixtrans-101.1-27.4-173.3-69.7-168.259.700114.1N2169 L2170 T2171 E2175 E2176 S2177 R2180 A2181 D2184N2169-M2173 WeakPolarHBondContact O-CB 3.34Å; N2169-M2173 WeakPolarHBondContact O-CG 3.39Å; N2169-M2173 PolarHBondContact O-N 3.06Å; N2169-M2173 VanDerWaalsContact O-N 3.08Å; L2170-M2173 PolarHBondContact O-N 3.36Å; L2170-M2173 VanDerWaalsContact O-N 3.14Å; T2171-M2173 VanDerWaalsContact C-N 3.27Å; T2171-M2173 PolarHBondContact O-N 3.31Å; M2173-E2175 VanDerWaalsContact C-N 3.26Å; M2173-E2175 PolarHBondContact O-N 3.16Å; M2173-E2175 VanDerWaalsContact O-N 3.11Å; M2173-E2176 WeakPolarHBondContact O-CB 3.12Å; M2173-E2176 PolarHBondContact O-N 3.06Å; M2173-E2176 VanDerWaalsContact O-N 3.12Å; M2173-S2177 PolarHBondContact O-N 2.89Å; M2173-R2180 HydrophobicContact CE-CB 4.15Å; M2173-R2180 HydrophobicContact CE-CG 3.83Å; M2173-R2180 WeakPolarHBondContact CE-O 3.34Å; M2173-R2180 HydrophobicContact SD-CG 4.1Å; M2173-R2180 PolarHBondContact SD-NE 3.01Å; M2173-A2181 HydrophobicContact CB-CB 4.35Å; M2173-D2184 WeakPolarHBondContact CE-OD2 3.32Å
2174A68.7Low80.7Confident41.8 Ų41.858.8 Ų58.835%0.34533%0.326SS..THydrogen-bonded Turntrans-65.9-20.917900000113L1317 K1321 L2170 E2176 A2181L1317-A2174 HydrophobicContact CD2-CB 4.24Å; K1321-A2174 PolarHBondContact NZ-O 3.42Å; L2170-A2174 HydrophobicContact CD2-CB 4.18Å; L2170-A2174 WeakPolarHBondContact O-CB 3.44Å; L2170-A2174 PolarHBondContact O-N 3.39Å; A2174-E2176 VanDerWaalsContact C-N 3.31Å; A2174-E2176 PolarHBondContact O-N 3.09Å; A2174-A2181 HydrophobicContact CB-CB 4.4Å
2175E68.4Low80.7Confident161.8 Ų161.856.3 Ų56.376%0.75631%0.313SS*.THydrogen-bonded Turntrans-68.6-29.5173-66.5-170.5162.700113.1M2173M2173-E2175 VanDerWaalsContact C-N 3.26Å; M2173-E2175 PolarHBondContact O-N 3.16Å; M2173-E2175 VanDerWaalsContact O-N 3.11Å
2176E67.7Low80.8Confident84.4 Ų84.455.2 Ų55.239%0.39431%0.307SS..THydrogen-bonded Turntrans-89.4-53.1-174.4-66.1-176.9-175.800112.6R1976 M2173 A2174 R2180R1976-E2176 WeakPolarHBondContact CD-OE1 3.49Å; R1976-E2176 WeakPolarHBondContact CG-OE1 3.36Å; R1976-E2176 IonicContact CZ-OE1 3.15Å; R1976-E2176 VanDerWaalsContact CZ-OE1 3.32Å; R1976-E2176 IonicContact NE-OE1 2.66Å; R1976-E2176 PolarHBondContact NE-OE1 2.91Å; R1976-E2176 VanDerWaalsContact NE-OE1 3.16Å; R1976-E2176 IonicContact NH1-OE1 2.69Å; R1976-E2176 PolarHBondContact NH1-OE1 3.1Å; M2173-E2176 WeakPolarHBondContact O-CB 3.12Å; M2173-E2176 PolarHBondContact O-N 3.06Å; M2173-E2176 VanDerWaalsContact O-N 3.12Å; A2174-E2176 VanDerWaalsContact C-N 3.31Å; A2174-E2176 PolarHBondContact O-N 3.09Å; E2176-R2180 IonicContact OE1-CZ 2.74Å; E2176-R2180 IonicContact OE1-NH1 3.59Å; E2176-R2180 PolarHBondContact OE1-NH1 3.26Å; E2176-R2180 WeakPolarHBondContact OE2-CD 3.33Å; E2176-R2180 IonicContact OE2-CZ 3.41Å; E2176-R2180 VanDerWaalsContact OE2-CZ 3.24Å; E2176-R2180 IonicContact OE2-NE 3.76Å; E2176-R2180 PolarHBondContact OE2-NE 3.06Å; E2176-R2180 IonicContact OE2-NH1 3.19Å; E2176-R2180 PolarHBondContact OE2-NH1 3.24Å; E2176-R2180 IonicContact OE2-NH2 3.61Å; E2176-R2180 PolarHBondContact OE2-NH2 2.71Å
2177S70.1Confident81Confident44.6 Ų44.655.2 Ų55.231%0.31231%0.308SS..  trans-168.4145.8176.863.70000113.2M2173 N2179 R2180 A2181M2173-S2177 PolarHBondContact O-N 2.89Å; S2177-N2179 VanDerWaalsContact C-N 3.3Å; S2177-N2179 PolarHBondContact O-N 2.91Å; S2177-R2180 PolarHBondContact O-N 3.09Å; S2177-R2180 VanDerWaalsContact O-N 3.15Å; S2177-R2180 WeakPolarHBondContact OG-CB 3.25Å; S2177-R2180 WeakPolarHBondContact OG-CD 3.06Å; S2177-R2180 WeakPolarHBondContact OG-CG 3.39Å; S2177-R2180 PolarHBondContact OG-N 3.22Å; S2177-A2181 PolarHBondContact O-N 2.97Å; S2177-A2181 VanDerWaalsContact O-N 3.16Å
2178Y79.2Confident81.2Confident95.8 Ų95.853.4 Ų53.438%0.37630%0.299SS..Hα-helixtrans-55.4-40.6171.3179-98.7000112.6L1313 L1317 L1342 P1344 F1347 R2180 A2181 Y2182 L2185L1313-Y2178 HydrophobicContact CD1-CE2 4.33Å; L1313-Y2178 HydrophobicContact CD2-CD2 3.91Å; L1313-Y2178 HydrophobicContact CD2-CE2 3.37Å; L1313-Y2178 HydrophobicContact CG-CE2 4.26Å; L1317-Y2178 HydrophobicContact CD1-CD2 4.25Å; L1342-Y2178 PolarHBondContact N-OH 2.93Å; L1342-Y2178 VanDerWaalsContact O-CE1 3.28Å; L1342-Y2178 WeakPolarHBondContact O-CE1 3.3Å; L1342-Y2178 PolarHBondContact O-OH 3.38Å; P1344-Y2178 HydrophobicContact CB-CD1 4.08Å; P1344-Y2178 HydrophobicContact CB-CE1 4.18Å; P1344-Y2178 HydrophobicContact CG-CD1 4.23Å; P1344-Y2178 HydrophobicContact CG-CE1 4.04Å; F1347-Y2178 HydrophobicContact CB-CD1 4.3Å; F1347-Y2178 HydrophobicContact CB-CE1 4.11Å; F1347-Y2178 AromaticContact CD1-CD1 3.89Å; F1347-Y2178 HydrophobicContact CD1-CD1 3.89Å; F1347-Y2178 HydrophobicContact CD1-CE1 4.48Å; F1347-Y2178 AromaticContact CD1-CG 3.99Å; F1347-Y2178 HydrophobicContact CD1-CG 3.99Å; F1347-Y2178 HydrophobicContact CE1-CG 4.19Å; F1347-Y2178 HydrophobicContact CG-CD1 4.17Å; F1347-Y2178 HydrophobicContact CG-CE1 4.3Å; F1347-Y2178 HydrophobicContact CG-CG 4.44Å; Y2178-R2180 VanDerWaalsContact C-N 3.27Å; Y2178-R2180 PolarHBondContact O-N 3.02Å; Y2178-A2181 CarbonylContact O-C 3.57Å; Y2178-A2181 PolarHBondContact O-N 2.95Å; Y2178-Y2182 AromaticContact CE1-CD2 3.99Å; Y2178-Y2182 HydrophobicContact CE1-CD2 4.12Å; Y2178-Y2182 WeakPolarHBondContact O-CB 3.35Å; Y2178-Y2182 PolarHBondContact O-N 3.14Å; Y2178-L2185 HydrophobicContact CD2-CD1 3.93Å; Y2178-L2185 HydrophobicContact CE2-CD1 3.41Å; Y2178-L2185 VanDerWaalsContact CE2-CD1 3.43Å
2179N77.5Confident81.6Confident93.8 Ų93.850.9 Ų50.950%0.50228%0.279SS..Hα-helixtrans-60.6-33.3179.5-70.5-20.8000112.8P1344 S2177 Y2182P1344-N2179 WeakPolarHBondContact CB-OD1 3.2Å; S2177-N2179 VanDerWaalsContact C-N 3.3Å; S2177-N2179 PolarHBondContact O-N 2.91Å; N2179-Y2182 WeakPolarHBondContact O-CB 3.34Å; N2179-Y2182 PolarHBondContact O-N 3.36Å
2180R76.1Confident82.1Confident85.8 Ų85.847.7 Ų47.732%0.32426%0.262SS..Hα-helixtrans-77.8-39.5177.9-127-179.6162.8-175.2-6.5111.7Y1978 K2013 M2173 E2176 S2177 Y2178 Y2182Y1978-R2180 PolarHBondContact OH-NH1 3.14Å; Y1978-R2180 PolarHBondContact OH-NH2 2.96Å; K2013-R2180 PolarHBondContact O-NH2 3.26Å; M2173-R2180 HydrophobicContact CE-CB 4.15Å; M2173-R2180 HydrophobicContact CE-CG 3.83Å; M2173-R2180 WeakPolarHBondContact CE-O 3.34Å; M2173-R2180 HydrophobicContact SD-CG 4.1Å; M2173-R2180 PolarHBondContact SD-NE 3.01Å; E2176-R2180 IonicContact OE1-CZ 2.74Å; E2176-R2180 IonicContact OE1-NH1 3.59Å; E2176-R2180 PolarHBondContact OE1-NH1 3.26Å; E2176-R2180 WeakPolarHBondContact OE2-CD 3.33Å; E2176-R2180 IonicContact OE2-CZ 3.41Å; E2176-R2180 VanDerWaalsContact OE2-CZ 3.24Å; E2176-R2180 IonicContact OE2-NE 3.76Å; E2176-R2180 PolarHBondContact OE2-NE 3.06Å; E2176-R2180 IonicContact OE2-NH1 3.19Å; E2176-R2180 PolarHBondContact OE2-NH1 3.24Å; E2176-R2180 IonicContact OE2-NH2 3.61Å; E2176-R2180 PolarHBondContact OE2-NH2 2.71Å; S2177-R2180 PolarHBondContact O-N 3.09Å; S2177-R2180 VanDerWaalsContact O-N 3.15Å; S2177-R2180 WeakPolarHBondContact OG-CB 3.25Å; S2177-R2180 WeakPolarHBondContact OG-CD 3.06Å; S2177-R2180 WeakPolarHBondContact OG-CG 3.39Å; S2177-R2180 PolarHBondContact OG-N 3.22Å; Y2178-R2180 VanDerWaalsContact C-N 3.27Å; Y2178-R2180 PolarHBondContact O-N 3.02Å; R2180-Y2182 VanDerWaalsContact C-N 3.27Å; R2180-Y2182 PolarHBondContact O-N 3.04Å
2181A83.8Confident82.6Confident2 Ų246.8 Ų46.82%0.01726%0.257CS..Hα-helixtrans-74.6-9.4176.900000114L2170 M2173 A2174 S2177 Y2178 A2183 D2184 L2185L2170-A2181 HydrophobicContact CD1-CB 3.95Å; L2170-A2181 HydrophobicContact CD2-CB 3.94Å; M2173-A2181 HydrophobicContact CB-CB 4.35Å; A2174-A2181 HydrophobicContact CB-CB 4.4Å; S2177-A2181 PolarHBondContact O-N 2.97Å; S2177-A2181 VanDerWaalsContact O-N 3.16Å; Y2178-A2181 CarbonylContact O-C 3.57Å; Y2178-A2181 PolarHBondContact O-N 2.95Å; A2181-A2183 VanDerWaalsContact C-N 3.27Å; A2181-A2183 PolarHBondContact O-N 3.17Å; A2181-D2184 PolarHBondContact O-N 3.07Å; A2181-D2184 VanDerWaalsContact O-N 3.17Å; A2181-L2185 HydrophobicContact CB-CD1 4.44Å; A2181-L2185 WeakPolarHBondContact O-CB 3.47Å; A2181-L2185 WeakPolarHBondContact O-CG 3.28Å; A2181-L2185 PolarHBondContact O-N 3.2Å
2182Y86.9Confident83.2Confident24.6 Ų24.644.9 Ų44.910%0.09625%0.246CC..Hα-helixtrans-58.8-40.2-173.3-178.2-100.3000113.7A1341 L1342 P1344 Y2178 N2179 R2180 D2184 L2185 V2186 N2222 V2224 D2227A1341-Y2182 HydrophobicContact CB-CE2 3.91Å; A1341-Y2182 PolarHBondContact O-OH 3.46Å; L1342-Y2182 WeakPolarHBondContact O-CE2 3.46Å; P1344-Y2182 HydrophobicContact CG-CD2 3.79Å; P1344-Y2182 HydrophobicContact CG-CE2 4.26Å; P1344-Y2182 HydrophobicContact CG-CG 3.96Å; Y2178-Y2182 AromaticContact CE1-CD2 3.99Å; Y2178-Y2182 HydrophobicContact CE1-CD2 4.12Å; Y2178-Y2182 WeakPolarHBondContact O-CB 3.35Å; Y2178-Y2182 PolarHBondContact O-N 3.14Å; N2179-Y2182 WeakPolarHBondContact O-CB 3.34Å; N2179-Y2182 PolarHBondContact O-N 3.36Å; R2180-Y2182 VanDerWaalsContact C-N 3.27Å; R2180-Y2182 PolarHBondContact O-N 3.04Å; Y2182-D2184 VanDerWaalsContact C-N 3.35Å; Y2182-D2184 PolarHBondContact O-N 3.36Å; Y2182-L2185 WeakPolarHBondContact O-CB 3.3Å; Y2182-L2185 PolarHBondContact O-N 3.17Å; Y2182-L2185 VanDerWaalsContact O-N 3.16Å; Y2182-V2186 HydrophobicContact CD1-CG2 4.27Å; Y2182-V2186 HydrophobicContact CE1-CG2 3.7Å; Y2182-V2186 HydrophobicContact CE2-CG2 4.29Å; Y2182-V2186 WeakPolarHBondContact O-CG2 3.45Å; Y2182-V2186 PolarHBondContact O-N 3.13Å; Y2182-N2222 WeakPolarHBondContact CD2-ND2 2.99Å; Y2182-N2222 HydrophobicContact CE1-CB 4.08Å; Y2182-N2222 HydrophobicContact CE2-CB 4.32Å; Y2182-N2222 WeakPolarHBondContact CE2-ND2 3.23Å; Y2182-N2222 VanDerWaalsContact CZ-ND2 3.26Å; Y2182-N2222 WeakPolarHBondContact OH-CB 3.41Å; Y2182-N2222 PolarHBondContact OH-N 3.42Å; Y2182-N2222 VanDerWaalsContact OH-N 3.08Å; Y2182-V2224 HydrophobicContact CE1-CG2 4.49Å; Y2182-D2227 WeakPolarHBondContact CE1-OD2 3.42Å; Y2182-D2227 PolarHBondContact OH-OD2 3.24Å; Y2182-D2227 VanDerWaalsContact OH-OD2 3.05Å
2183A85.6Confident84Confident68.8 Ų68.842.3 Ų42.357%0.56923%0.225SC*.Hα-helixtrans-63.6-42.8178.300000112A2181 L2185 V2186 G2187A2181-A2183 VanDerWaalsContact C-N 3.27Å; A2181-A2183 PolarHBondContact O-N 3.17Å; A2183-L2185 VanDerWaalsContact C-N 3.33Å; A2183-L2185 PolarHBondContact O-N 3.04Å; A2183-V2186 WeakPolarHBondContact O-CB 3.29Å; A2183-V2186 PolarHBondContact O-N 3.17Å; A2183-G2187 PolarHBondContact O-N 3Å; A2183-G2187 VanDerWaalsContact O-N 3.12Å
2184D88.6Confident85Confident28.8 Ų28.840.4 Ų40.415%0.15422%0.216CC..Hα-helixtrans-67.6-35.2175.8-63.1-51.7000111.3L2166 L2170 M2173 A2181 Y2182 V2186 G2187 T2188L2166-D2184 HydrophobicContact CD1-CB 3.76Å; L2166-D2184 HydrophobicContact CD2-CB 4.1Å; L2170-D2184 HydrophobicContact CB-CB 4.31Å; L2170-D2184 HydrophobicContact CD1-CB 4.23Å; L2170-D2184 HydrophobicContact CD2-CB 3.54Å; L2170-D2184 HydrophobicContact CG-CB 3.93Å; M2173-D2184 WeakPolarHBondContact CE-OD2 3.32Å; A2181-D2184 PolarHBondContact O-N 3.07Å; A2181-D2184 VanDerWaalsContact O-N 3.17Å; Y2182-D2184 VanDerWaalsContact C-N 3.35Å; Y2182-D2184 PolarHBondContact O-N 3.36Å; D2184-V2186 PolarHBondContact O-N 3.39Å; D2184-G2187 CarbonylContact O-C 3.58Å; D2184-G2187 VanDerWaalsContact O-CA 3.31Å; D2184-G2187 WeakPolarHBondContact O-CA 3.38Å; D2184-G2187 PolarHBondContact O-N 3.3Å; D2184-G2187 VanDerWaalsContact O-N 3.1Å; D2184-T2188 WeakPolarHBondContact O-CG2 3.27Å; D2184-T2188 PolarHBondContact O-N 2.92Å
2185L90.4Very high86.2Confident34.6 Ų34.640.1 Ų40.118%0.18121%0.208CC..Hα-helixtrans-63.3-40.5172.8-73.3170.7000112.2L1336 A1341 L2170 Y2178 A2181 Y2182 A2183 G2187 T2188 Q2189L1336-L2185 HydrophobicContact CB-CD2 4.26Å; L1336-L2185 HydrophobicContact CD1-CD2 4.13Å; L1336-L2185 HydrophobicContact CD2-CD2 4.39Å; A1341-L2185 HydrophobicContact CB-CB 4.05Å; L2170-L2185 HydrophobicContact CD1-CD2 4.23Å; L2170-L2185 HydrophobicContact CD1-CG 4.18Å; L2170-L2185 HydrophobicContact CD2-CD2 4.28Å; L2170-L2185 HydrophobicContact CD2-CG 4.12Å; Y2178-L2185 HydrophobicContact CD2-CD1 3.93Å; Y2178-L2185 HydrophobicContact CE2-CD1 3.41Å; Y2178-L2185 VanDerWaalsContact CE2-CD1 3.43Å; A2181-L2185 HydrophobicContact CB-CD1 4.44Å; A2181-L2185 WeakPolarHBondContact O-CB 3.47Å; A2181-L2185 WeakPolarHBondContact O-CG 3.28Å; A2181-L2185 PolarHBondContact O-N 3.2Å; Y2182-L2185 WeakPolarHBondContact O-CB 3.3Å; Y2182-L2185 PolarHBondContact O-N 3.17Å; Y2182-L2185 VanDerWaalsContact O-N 3.16Å; A2183-L2185 VanDerWaalsContact C-N 3.33Å; A2183-L2185 PolarHBondContact O-N 3.04Å; L2185-G2187 VanDerWaalsContact C-N 3.27Å; L2185-G2187 PolarHBondContact O-N 3.17Å; L2185-T2188 WeakPolarHBondContact CA-OG1 3.43Å; L2185-T2188 PolarHBondContact O-N 3.21Å; L2185-T2188 VanDerWaalsContact O-N 3.12Å; L2185-T2188 PolarHBondContact O-OG1 3.19Å; L2185-Q2189 PolarHBondContact O-N 3.14Å
2186V91.2Very high87.4Confident4.6 Ų4.633.3 Ų33.33%0.02818%0.176CC..Hα-helixtrans-60.5-40.2170.8173.30000110.2A1341 Y2182 A2183 D2184 T2188 Q2189 L2190 D2227 I2231A1341-V2186 HydrophobicContact CB-CG2 3.86Å; Y2182-V2186 HydrophobicContact CD1-CG2 4.27Å; Y2182-V2186 HydrophobicContact CE1-CG2 3.7Å; Y2182-V2186 HydrophobicContact CE2-CG2 4.29Å; Y2182-V2186 WeakPolarHBondContact O-CG2 3.45Å; Y2182-V2186 PolarHBondContact O-N 3.13Å; A2183-V2186 WeakPolarHBondContact O-CB 3.29Å; A2183-V2186 PolarHBondContact O-N 3.17Å; D2184-V2186 PolarHBondContact O-N 3.39Å; V2186-T2188 PolarHBondContact O-N 3.23Å; V2186-Q2189 WeakPolarHBondContact O-CB 3.31Å; V2186-Q2189 PolarHBondContact O-N 3.21Å; V2186-Q2189 VanDerWaalsContact O-N 3.16Å; V2186-L2190 HydrophobicContact CG1-CD1 4.36Å; V2186-L2190 HydrophobicContact CG1-CG 4.46Å; V2186-L2190 WeakPolarHBondContact O-CG 3.3Å; V2186-L2190 PolarHBondContact O-N 3.05Å; V2186-D2227 HydrophobicContact CG1-CB 4.01Å; V2186-D2227 HydrophobicContact CG2-CB 4.4Å; V2186-I2231 HydrophobicContact CG1-CD1 4.4Å
2187G92.5Very high88.6Confident4.4 Ų4.429.3 Ų29.35%0.04516%0.157CC..Hα-helixtrans-55.1-47.4169.900000113L2166 A2183 D2184 L2185 Q2189 L2190 L2191L2166-G2187 VanDerWaalsContact CD1-C 3.47Å; A2183-G2187 PolarHBondContact O-N 3Å; A2183-G2187 VanDerWaalsContact O-N 3.12Å; D2184-G2187 CarbonylContact O-C 3.58Å; D2184-G2187 VanDerWaalsContact O-CA 3.31Å; D2184-G2187 WeakPolarHBondContact O-CA 3.38Å; D2184-G2187 PolarHBondContact O-N 3.3Å; D2184-G2187 VanDerWaalsContact O-N 3.1Å; L2185-G2187 VanDerWaalsContact C-N 3.27Å; L2185-G2187 PolarHBondContact O-N 3.17Å; G2187-Q2189 VanDerWaalsContact C-N 3.31Å; G2187-Q2189 PolarHBondContact O-N 3.14Å; G2187-L2190 WeakPolarHBondContact O-CB 3.25Å; G2187-L2190 PolarHBondContact O-N 3.18Å; G2187-L2191 WeakPolarHBondContact O-CG 3.41Å; G2187-L2191 PolarHBondContact O-N 3.19Å; G2187-L2191 VanDerWaalsContact O-N 3.09Å
2188T92.8Very high89.7Confident28 Ų2827.6 Ų27.617%0.17214%0.144CC..Hα-helixtrans-63.8-3617765.60000112.5L1333 G1337 L2166 L2170 D2184 L2185 V2186 L2191 S2192L1333-T2188 HydrophobicContact CD2-CG2 3.89Å; G1337-T2188 WeakPolarHBondContact CA-O 3.03Å; L2166-T2188 HydrophobicContact CB-CG2 4.34Å; L2166-T2188 HydrophobicContact CD1-CG2 3.76Å; L2166-T2188 HydrophobicContact CD2-CG2 3.38Å; L2166-T2188 HydrophobicContact CG-CG2 4.1Å; L2170-T2188 HydrophobicContact CD1-CG2 3.61Å; L2170-T2188 HydrophobicContact CD2-CG2 4.11Å; D2184-T2188 WeakPolarHBondContact O-CG2 3.27Å; D2184-T2188 PolarHBondContact O-N 2.92Å; L2185-T2188 WeakPolarHBondContact CA-OG1 3.43Å; L2185-T2188 PolarHBondContact O-N 3.21Å; L2185-T2188 VanDerWaalsContact O-N 3.12Å; L2185-T2188 PolarHBondContact O-OG1 3.19Å; V2186-T2188 PolarHBondContact O-N 3.23Å; T2188-L2191 PolarHBondContact O-N 3.07Å; T2188-S2192 WeakPolarHBondContact O-CB 3.38Å; T2188-S2192 PolarHBondContact O-N 3.16Å; T2188-S2192 PolarHBondContact O-OG 3.05Å
2189Q93.6Very high90.2Very high18.8 Ų18.825.5 Ų25.59%0.08814%0.138CC..Hα-helixtrans-65.7-44.2174.4176.1174.1-19.400111.3L2185 V2186 G2187 L2191 S2192 E2193 R2217 C2221L2185-Q2189 PolarHBondContact O-N 3.14Å; V2186-Q2189 WeakPolarHBondContact O-CB 3.31Å; V2186-Q2189 PolarHBondContact O-N 3.21Å; V2186-Q2189 VanDerWaalsContact O-N 3.16Å; G2187-Q2189 VanDerWaalsContact C-N 3.31Å; G2187-Q2189 PolarHBondContact O-N 3.14Å; Q2189-L2191 VanDerWaalsContact C-N 3.3Å; Q2189-L2191 PolarHBondContact O-N 3.06Å; Q2189-S2192 WeakPolarHBondContact CA-OG 3.26Å; Q2189-S2192 PolarHBondContact O-N 3.04Å; Q2189-S2192 VanDerWaalsContact O-N 3.16Å; Q2189-S2192 PolarHBondContact O-OG 3.4Å; Q2189-E2193 HydrophobicContact CG-CG 4.37Å; Q2189-E2193 PolarHBondContact NE2-OE1 3.06Å; Q2189-E2193 WeakPolarHBondContact O-CB 3.37Å; Q2189-E2193 VanDerWaalsContact O-CG 3.25Å; Q2189-E2193 WeakPolarHBondContact O-CG 3.32Å; Q2189-E2193 PolarHBondContact O-N 3.21Å; Q2189-R2217 VanDerWaalsContact CD-CD 3.43Å; Q2189-R2217 HydrophobicContact CG-CG 4.5Å; Q2189-R2217 VanDerWaalsContact NE2-CD 3.33Å; Q2189-C2221 PolarHBondContact NE2-SG 3.22Å; Q2189-C2221 VanDerWaalsContact NE2-SG 3.45Å; Q2189-C2221 PolarHBondContact OE1-SG 3.14Å; Q2189-C2221 VanDerWaalsContact OE1-SG 3.37Å
2190L94.4Very high90.9Very high2.2 Ų2.221.5 Ų21.51%0.01212%0.116CC..Hα-helixtrans-58.5-41.9175.9-73.6168.6000111.6F2140 V2186 G2187 E2193 A2194 Q2230 I2231 L2234F2140-L2190 HydrophobicContact CE2-CB 4.04Å; F2140-L2190 HydrophobicContact CZ-CB 4.41Å; F2140-L2190 HydrophobicContact CZ-CD1 4.42Å; V2186-L2190 HydrophobicContact CG1-CD1 4.36Å; V2186-L2190 HydrophobicContact CG1-CG 4.46Å; V2186-L2190 WeakPolarHBondContact O-CG 3.3Å; V2186-L2190 PolarHBondContact O-N 3.05Å; G2187-L2190 WeakPolarHBondContact O-CB 3.25Å; G2187-L2190 PolarHBondContact O-N 3.18Å; L2190-E2193 PolarHBondContact O-N 3.17Å; L2190-A2194 WeakPolarHBondContact O-CB 3.38Å; L2190-A2194 PolarHBondContact O-N 3.16Å; L2190-Q2230 HydrophobicContact CD1-CB 4.31Å; L2190-Q2230 HydrophobicContact CD2-CB 4.2Å; L2190-I2231 HydrophobicContact CD2-CB 4.36Å; L2190-I2231 HydrophobicContact CD2-CG1 3.72Å; L2190-I2231 HydrophobicContact CG-CG1 4.38Å; L2190-L2234 HydrophobicContact CB-CD2 4.48Å; L2190-L2234 HydrophobicContact CD2-CD2 4.08Å; L2190-L2234 WeakPolarHBondContact O-CD2 3.37Å
2191L94.7Very high91.6Very high0.2 Ų0.220.1 Ų20.10%0.00111%0.112CC..Hα-helixtrans-65.6-41.1176.2-65.8-178000112.6F2136 F2140 I2159 A2162 R2163 L2166 G2187 T2188 Q2189 A2194 E2195F2136-L2191 HydrophobicContact CE2-CD1 3.95Å; F2136-L2191 HydrophobicContact CE2-CD2 4.15Å; F2136-L2191 HydrophobicContact CE2-CG 4.02Å; F2140-L2191 HydrophobicContact CD2-CD2 3.89Å; I2159-L2191 HydrophobicContact CG2-CB 4.18Å; I2159-L2191 HydrophobicContact CG2-CD2 4.33Å; A2162-L2191 HydrophobicContact CB-CD1 3.71Å; A2162-L2191 HydrophobicContact CB-CD2 3.59Å; A2162-L2191 HydrophobicContact CB-CG 4.31Å; R2163-L2191 HydrophobicContact CB-CD1 4.34Å; R2163-L2191 HydrophobicContact CG-CB 4.48Å; R2163-L2191 HydrophobicContact CG-CD1 3.53Å; R2163-L2191 VanDerWaalsContact CG-CD1 3.47Å; L2166-L2191 HydrophobicContact CD1-CD1 3.83Å; L2166-L2191 HydrophobicContact CD2-CD1 4.21Å; G2187-L2191 WeakPolarHBondContact O-CG 3.41Å; G2187-L2191 PolarHBondContact O-N 3.19Å; G2187-L2191 VanDerWaalsContact O-N 3.09Å; T2188-L2191 PolarHBondContact O-N 3.07Å; Q2189-L2191 VanDerWaalsContact C-N 3.3Å; Q2189-L2191 PolarHBondContact O-N 3.06Å; L2191-A2194 WeakPolarHBondContact O-CB 3.31Å; L2191-A2194 PolarHBondContact O-N 3.1Å; L2191-E2195 PolarHBondContact O-N 3.15Å; L2191-E2195 VanDerWaalsContact O-N 3.13Å
2192S94.1Very high91.9Very high22.2 Ų22.224.8 Ų24.816%0.15514%0.136CC..Hα-helixtrans-67.6-38.9176.4-47.80000112.1R1334 R2163 T2188 Q2189 A2194 E2195 E2196R1334-S2192 PolarHBondContact O-OG 2.94Å; R2163-S2192 PolarHBondContact NH2-OG 3.36Å; T2188-S2192 WeakPolarHBondContact O-CB 3.38Å; T2188-S2192 PolarHBondContact O-N 3.16Å; T2188-S2192 PolarHBondContact O-OG 3.05Å; Q2189-S2192 WeakPolarHBondContact CA-OG 3.26Å; Q2189-S2192 PolarHBondContact O-N 3.04Å; Q2189-S2192 VanDerWaalsContact O-N 3.16Å; Q2189-S2192 PolarHBondContact O-OG 3.4Å; S2192-A2194 VanDerWaalsContact C-N 3.31Å; S2192-A2194 PolarHBondContact O-N 3.14Å; S2192-E2195 PolarHBondContact O-N 3.07Å; S2192-E2196 VanDerWaalsContact O-CG 3.3Å; S2192-E2196 WeakPolarHBondContact O-CG 3.29Å; S2192-E2196 PolarHBondContact O-N 3.38Å; S2192-E2196 VanDerWaalsContact O-N 3.08Å
2193E94.2Very high92.1Very high0 Ų026.7 Ų26.70%015%0.148CC..Hα-helixtrans-67.9-31173.8-72.9-156.1-159.100111.8Q2189 L2190 E2196 V2197 W2214 R2217 I2231 L2234 R2235Q2189-E2193 HydrophobicContact CG-CG 4.37Å; Q2189-E2193 PolarHBondContact NE2-OE1 3.06Å; Q2189-E2193 WeakPolarHBondContact O-CB 3.37Å; Q2189-E2193 VanDerWaalsContact O-CG 3.25Å; Q2189-E2193 WeakPolarHBondContact O-CG 3.32Å; Q2189-E2193 PolarHBondContact O-N 3.21Å; L2190-E2193 PolarHBondContact O-N 3.17Å; E2193-E2196 CarbonylContact O-C 3.55Å; E2193-E2196 PolarHBondContact O-N 3.21Å; E2193-V2197 WeakPolarHBondContact O-CB 3.38Å; E2193-V2197 VanDerWaalsContact O-CG2 3.27Å; E2193-V2197 WeakPolarHBondContact O-CG2 3.39Å; E2193-V2197 PolarHBondContact O-N 3.12Å; E2193-W2214 VanDerWaalsContact CD-CD1 3.4Å; E2193-W2214 PolarHBondContact OE2-NE1 3.45Å; E2193-R2217 WeakPolarHBondContact OE1-CD 3.2Å; E2193-R2217 IonicContact OE1-CZ 3.41Å; E2193-R2217 IonicContact OE1-NH1 3.15Å; E2193-R2217 PolarHBondContact OE1-NH1 3.31Å; E2193-R2217 VanDerWaalsContact OE1-NH1 3.15Å; E2193-I2231 WeakPolarHBondContact OE2-CG2 3.25Å; E2193-L2234 HydrophobicContact CB-CD2 3.79Å; E2193-R2235 VanDerWaalsContact CD-NH2 3.31Å; E2193-R2235 IonicContact OE1-CZ 2.99Å; E2193-R2235 IonicContact OE1-NH2 2.94Å; E2193-R2235 PolarHBondContact OE1-NH2 3.21Å; E2193-R2235 IonicContact OE2-CZ 3.18Å; E2193-R2235 VanDerWaalsContact OE2-CZ 3.28Å; E2193-R2235 IonicContact OE2-NE 3.44Å; E2193-R2235 PolarHBondContact OE2-NE 3.34Å; E2193-R2235 IonicContact OE2-NH2 3.33Å; E2193-R2235 PolarHBondContact OE2-NH2 3.29Å; E2193-R2235 VanDerWaalsContact OE2-NH2 3.12Å
2194A94.3Very high92.1Very high0.8 Ų0.827.3 Ų27.31%0.00715%0.146CC..Hα-helixtrans-65.8-39.8174.200000111.8I2147 I2159 L2190 L2191 S2192 E2196 V2197 I2198 L2234I2147-A2194 HydrophobicContact CD1-CB 4.08Å; I2159-A2194 HydrophobicContact CD1-CB 3.92Å; I2159-A2194 HydrophobicContact CG1-CB 4.42Å; L2190-A2194 WeakPolarHBondContact O-CB 3.38Å; L2190-A2194 PolarHBondContact O-N 3.16Å; L2191-A2194 WeakPolarHBondContact O-CB 3.31Å; L2191-A2194 PolarHBondContact O-N 3.1Å; S2192-A2194 VanDerWaalsContact C-N 3.31Å; S2192-A2194 PolarHBondContact O-N 3.14Å; A2194-E2196 VanDerWaalsContact C-N 3.34Å; A2194-V2197 WeakPolarHBondContact O-CB 3.44Å; A2194-V2197 PolarHBondContact O-N 3.27Å; A2194-I2198 WeakPolarHBondContact O-CG1 3.32Å; A2194-I2198 PolarHBondContact O-N 3.15Å; A2194-I2198 VanDerWaalsContact O-N 3.14Å; A2194-L2234 HydrophobicContact CB-CD1 4.29Å; A2194-L2234 HydrophobicContact CB-CD2 4.23Å
2195E93.6Very high92.1Very high36.4 Ų36.434.1 Ų34.117%0.1718%0.177CC..Hα-helixtrans-66.1-40.5171.9-66.9-178.8155.700112.1R1334 I2159 M2160 R2163 L2191 S2192 V2197 I2198 Q2199R1334-E2195 IonicContact CZ-OE2 3.03Å; R1334-E2195 IonicContact NE-OE2 3.77Å; R1334-E2195 PolarHBondContact NE-OE2 2.86Å; R1334-E2195 IonicContact NH2-OE1 2.7Å; R1334-E2195 IonicContact NH2-OE2 3.5Å; R1334-E2195 PolarHBondContact NH2-OE2 2.89Å; I2159-E2195 HydrophobicContact CD1-CG 3.96Å; I2159-E2195 HydrophobicContact CG2-CG 4Å; M2160-E2195 VanDerWaalsContact CE-OE1 3.28Å; M2160-E2195 WeakPolarHBondContact CE-OE1 3.33Å; R2163-E2195 IonicContact CZ-OE1 3.25Å; R2163-E2195 VanDerWaalsContact CZ-OE1 3.24Å; R2163-E2195 IonicContact CZ-OE2 3.19Å; R2163-E2195 VanDerWaalsContact NH1-CD 3.3Å; R2163-E2195 IonicContact NH1-OE1 3.06Å; R2163-E2195 PolarHBondContact NH1-OE1 3.21Å; R2163-E2195 IonicContact NH1-OE2 3.2Å; R2163-E2195 PolarHBondContact NH1-OE2 3.18Å; R2163-E2195 VanDerWaalsContact NH2-CD 3.31Å; R2163-E2195 IonicContact NH2-OE1 3.21Å; R2163-E2195 PolarHBondContact NH2-OE1 3.03Å; R2163-E2195 VanDerWaalsContact NH2-OE1 3.08Å; R2163-E2195 IonicContact NH2-OE2 3.47Å; R2163-E2195 PolarHBondContact NH2-OE2 3.07Å; L2191-E2195 PolarHBondContact O-N 3.15Å; L2191-E2195 VanDerWaalsContact O-N 3.13Å; S2192-E2195 PolarHBondContact O-N 3.07Å; E2195-V2197 VanDerWaalsContact C-N 3.3Å; E2195-V2197 PolarHBondContact O-N 3.05Å; E2195-I2198 WeakPolarHBondContact O-CB 3.31Å; E2195-I2198 PolarHBondContact O-N 3.16Å; E2195-Q2199 VanDerWaalsContact O-CG 3.31Å; E2195-Q2199 WeakPolarHBondContact O-CG 3.41Å; E2195-Q2199 PolarHBondContact O-N 3.06Å
2196E93.8Very high91.9Very high18.8 Ų18.836.5 Ų36.59%0.08818%0.183CC..Hα-helixtrans-65-34175.6-7117016900111.6S2192 E2193 A2194 Q2199 Y2200 L2210 W2214 R2217S2192-E2196 VanDerWaalsContact O-CG 3.3Å; S2192-E2196 WeakPolarHBondContact O-CG 3.29Å; S2192-E2196 PolarHBondContact O-N 3.38Å; S2192-E2196 VanDerWaalsContact O-N 3.08Å; E2193-E2196 CarbonylContact O-C 3.55Å; E2193-E2196 PolarHBondContact O-N 3.21Å; A2194-E2196 VanDerWaalsContact C-N 3.34Å; E2196-Q2199 CarbonylContact O-C 3.59Å; E2196-Q2199 WeakPolarHBondContact O-CB 3.34Å; E2196-Q2199 PolarHBondContact O-N 3.07Å; E2196-Y2200 VanDerWaalsContact O-CB 3.24Å; E2196-Y2200 WeakPolarHBondContact O-CB 3.36Å; E2196-Y2200 PolarHBondContact O-N 3.22Å; E2196-L2210 HydrophobicContact CB-CD1 4.48Å; E2196-L2210 HydrophobicContact CB-CD2 4.06Å; E2196-L2210 HydrophobicContact CG-CD2 3.95Å; E2196-W2214 HydrophobicContact CB-CZ2 3.91Å; E2196-W2214 VanDerWaalsContact OE2-CD1 3.3Å; E2196-W2214 PolarHBondContact OE2-NE1 3.02Å; E2196-R2217 VanDerWaalsContact CD-NH1 3.33Å; E2196-R2217 IonicContact OE1-CZ 3.02Å; E2196-R2217 IonicContact OE1-NH1 3.18Å; E2196-R2217 PolarHBondContact OE1-NH1 2.93Å; E2196-R2217 VanDerWaalsContact OE1-NH1 3.1Å; E2196-R2217 IonicContact OE1-NH2 3.63Å; E2196-R2217 PolarHBondContact OE1-NH2 3.13Å; E2196-R2217 IonicContact OE2-CZ 3.25Å; E2196-R2217 IonicContact OE2-NH1 3.18Å; E2196-R2217 PolarHBondContact OE2-NH1 3.15Å; E2196-R2217 IonicContact OE2-NH2 3.41Å; E2196-R2217 PolarHBondContact OE2-NH2 3.13Å
2197V93.6Very high91.8Very high0 Ų040.9 Ų40.90%020%0.199CC..Hα-helixtrans-63-42.6172.2158.10000111.2I2147 E2193 A2194 E2195 Q2199 Y2200 K2201 W2214 L2234 L2237 V2238I2147-V2197 HydrophobicContact CG2-CG1 3.78Å; E2193-V2197 WeakPolarHBondContact O-CB 3.38Å; E2193-V2197 VanDerWaalsContact O-CG2 3.27Å; E2193-V2197 WeakPolarHBondContact O-CG2 3.39Å; E2193-V2197 PolarHBondContact O-N 3.12Å; A2194-V2197 WeakPolarHBondContact O-CB 3.44Å; A2194-V2197 PolarHBondContact O-N 3.27Å; E2195-V2197 VanDerWaalsContact C-N 3.3Å; E2195-V2197 PolarHBondContact O-N 3.05Å; V2197-Q2199 VanDerWaalsContact C-N 3.32Å; V2197-Q2199 PolarHBondContact O-N 3.48Å; V2197-Y2200 PolarHBondContact O-N 3.24Å; V2197-K2201 PolarHBondContact O-N 3.42Å; V2197-K2201 VanDerWaalsContact O-N 3.11Å; V2197-W2214 HydrophobicContact CG2-CH2 3.98Å; V2197-W2214 HydrophobicContact CG2-CZ2 3.98Å; V2197-L2234 HydrophobicContact CG2-CG 4.5Å; V2197-L2237 HydrophobicContact CG1-CB 4.26Å; V2197-L2237 HydrophobicContact CG1-CD1 4.34Å; V2197-V2238 HydrophobicContact CB-CG2 4.38Å; V2197-V2238 HydrophobicContact CG1-CG1 3.8Å; V2197-V2238 HydrophobicContact CG1-CG2 3.74Å; V2197-V2238 HydrophobicContact CG2-CG2 4.18Å
2198I92.8Very high91.4Very high8.6 Ų8.643.9 Ų43.94%0.04422%0.219CC..Hα-helixtrans-61.3-46.3172.6-64.5169.3000110I2147 Y2152 A2155 I2159 A2194 E2195 Y2200 K2201 L2202I2147-I2198 HydrophobicContact CD1-CD1 4.12Å; I2147-I2198 HydrophobicContact CD1-CG1 4.04Å; I2147-I2198 HydrophobicContact CG1-CD1 3.95Å; I2147-I2198 HydrophobicContact CG1-CG1 3.81Å; Y2152-I2198 HydrophobicContact CD1-CB 4.46Å; Y2152-I2198 HydrophobicContact CD1-CG1 4.16Å; Y2152-I2198 HydrophobicContact CD1-CG2 3.85Å; Y2152-I2198 HydrophobicContact CG-CG2 4.06Å; A2155-I2198 HydrophobicContact CB-CD1 3.99Å; I2159-I2198 HydrophobicContact CD1-CD1 4.04Å; A2194-I2198 WeakPolarHBondContact O-CG1 3.32Å; A2194-I2198 PolarHBondContact O-N 3.15Å; A2194-I2198 VanDerWaalsContact O-N 3.14Å; E2195-I2198 WeakPolarHBondContact O-CB 3.31Å; E2195-I2198 PolarHBondContact O-N 3.16Å; I2198-Y2200 VanDerWaalsContact C-N 3.3Å; I2198-Y2200 PolarHBondContact O-N 3.15Å; I2198-K2201 PolarHBondContact O-N 3.08Å; I2198-L2202 HydrophobicContact CG2-CD1 3.77Å; I2198-L2202 HydrophobicContact CG2-CG 4.43Å; I2198-L2202 WeakPolarHBondContact O-CG 3.27Å; I2198-L2202 PolarHBondContact O-N 3.06Å
2199Q90.8Very high91.3Very high51.6 Ų51.646.9 Ų46.924%0.24123%0.233CC..Hα-helixtrans-62.6-35.7177.3-68.9171.718.900112.4E2195 E2196 V2197 L2202 I2203 R2206 L2210E2195-Q2199 VanDerWaalsContact O-CG 3.31Å; E2195-Q2199 WeakPolarHBondContact O-CG 3.41Å; E2195-Q2199 PolarHBondContact O-N 3.06Å; E2196-Q2199 CarbonylContact O-C 3.59Å; E2196-Q2199 WeakPolarHBondContact O-CB 3.34Å; E2196-Q2199 PolarHBondContact O-N 3.07Å; V2197-Q2199 VanDerWaalsContact C-N 3.32Å; V2197-Q2199 PolarHBondContact O-N 3.48Å; Q2199-L2202 PolarHBondContact O-N 3.24Å; Q2199-I2203 WeakPolarHBondContact O-CA 3.4Å; Q2199-I2203 WeakPolarHBondContact O-CB 3.37Å; Q2199-I2203 PolarHBondContact O-N 3.17Å; Q2199-R2206 VanDerWaalsContact OE1-CZ 3.22Å; Q2199-L2210 HydrophobicContact CB-CD1 4.43Å
2200Y91.6Very high91.1Very high11 Ų1146.2 Ų46.24%0.04323%0.23CC..Hα-helixtrans-65.8-39.9177.2-171.3-72.9000111.9E2196 V2197 I2198 R2207 L2210 R2211 W2214 V2238 L2239E2196-Y2200 VanDerWaalsContact O-CB 3.24Å; E2196-Y2200 WeakPolarHBondContact O-CB 3.36Å; E2196-Y2200 PolarHBondContact O-N 3.22Å; V2197-Y2200 PolarHBondContact O-N 3.24Å; I2198-Y2200 VanDerWaalsContact C-N 3.3Å; I2198-Y2200 PolarHBondContact O-N 3.15Å; Y2200-R2207 HydrophobicContact CD1-CG 3.94Å; Y2200-R2207 HydrophobicContact CD2-CB 4Å; Y2200-R2207 HydrophobicContact CD2-CG 3.75Å; Y2200-R2207 HydrophobicContact CE1-CB 4.4Å; Y2200-R2207 HydrophobicContact CE1-CG 3.79Å; Y2200-R2207 HydrophobicContact CE2-CB 3.5Å; Y2200-R2207 VanDerWaalsContact CE2-CB 3.49Å; Y2200-R2207 HydrophobicContact CE2-CG 3.56Å; Y2200-R2207 HydrophobicContact CG-CG 3.95Å; Y2200-R2207 PolarHBondContact O-NE 3.02Å; Y2200-R2207 PolarHBondContact O-NH2 3.16Å; Y2200-L2210 HydrophobicContact CD2-CB 4.3Å; Y2200-L2210 HydrophobicContact CD2-CD1 4.22Å; Y2200-R2211 HydrophobicContact CE2-CG 4.16Å; Y2200-R2211 PolarHBondContact OH-NE 3.18Å; Y2200-R2211 VanDerWaalsContact OH-NE 3.12Å; Y2200-R2211 PolarHBondContact OH-NH2 3.37Å; Y2200-W2214 AromaticContact CD2-CH2 3.84Å; Y2200-W2214 HydrophobicContact CD2-CH2 3.84Å; Y2200-W2214 AromaticContact CD2-CZ3 3.94Å; Y2200-W2214 HydrophobicContact CD2-CZ3 4.03Å; Y2200-W2214 HydrophobicContact CE2-CH2 4.46Å; Y2200-W2214 HydrophobicContact CE2-CZ3 4.31Å; Y2200-W2214 HydrophobicContact CG-CH2 4.17Å; Y2200-W2214 HydrophobicContact CG-CZ3 4.48Å; Y2200-V2238 HydrophobicContact CD1-CB 4.17Å; Y2200-V2238 HydrophobicContact CD1-CG1 3.26Å; Y2200-V2238 HydrophobicContact CD1-CG2 3.81Å; Y2200-V2238 HydrophobicContact CD2-CG1 4.26Å; Y2200-V2238 HydrophobicContact CE1-CB 3.79Å; Y2200-V2238 HydrophobicContact CE1-CG1 3.12Å; Y2200-V2238 HydrophobicContact CE1-CG2 4.17Å; Y2200-V2238 HydrophobicContact CE2-CG1 4.34Å; Y2200-V2238 HydrophobicContact CG-CG1 3.69Å; Y2200-V2238 HydrophobicContact CG-CG2 4.28Å; Y2200-L2239 HydrophobicContact CE1-CD2 4.4Å; Y2200-L2239 HydrophobicContact CE2-CD2 4.22Å; Y2200-L2239 VanDerWaalsContact OH-CD2 3.24Å; Y2200-L2239 WeakPolarHBondContact OH-CD2 3.18Å
2201K89.4Confident90.9Very high55.2 Ų55.250.9 Ų50.924%0.2425%0.248CC..Hα-helixtrans-66.9-43.6174.2-74.7-165.4172.8-168.70111.5I2147 E2150 Y2152 V2197 I2198 R2207 V2238I2147-K2201 PolarHBondContact O-NZ 3.26Å; I2147-K2201 VanDerWaalsContact O-NZ 3.12Å; E2150-K2201 IonicContact OE1-NZ 3.6Å; E2150-K2201 PolarHBondContact OE1-NZ 2.87Å; Y2152-K2201 HydrophobicContact CE1-CB 4.46Å; Y2152-K2201 HydrophobicContact CE1-CD 4.02Å; Y2152-K2201 WeakPolarHBondContact OH-CD 3.37Å; V2197-K2201 PolarHBondContact O-N 3.42Å; V2197-K2201 VanDerWaalsContact O-N 3.11Å; I2198-K2201 PolarHBondContact O-N 3.08Å; K2201-R2207 PolarHBondContact O-NH2 3.15Å; K2201-V2238 HydrophobicContact CD-CG1 4.21Å; K2201-V2238 HydrophobicContact CD-CG2 4.26Å; K2201-V2238 HydrophobicContact CG-CG1 3.48Å; K2201-V2238 VanDerWaalsContact CG-CG1 3.42Å; K2201-V2238 HydrophobicContact CG-CG2 3.9Å
2202L90.7Very high90.5Very high101.4 Ų101.457.8 Ų57.853%0.53128%0.28SS..Hα-helixtrans-80-32.5-174.6-66.9175.1000114.7Y2152 I2198 Q2199Y2152-L2202 HydrophobicContact CD2-CD1 4.37Å; Y2152-L2202 HydrophobicContact CD2-CD2 3.92Å; Y2152-L2202 HydrophobicContact CD2-CG 4.4Å; Y2152-L2202 HydrophobicContact CE2-CD2 3.81Å; Y2152-L2202 HydrophobicContact CE2-CG 4.39Å; I2198-L2202 HydrophobicContact CG2-CD1 3.77Å; I2198-L2202 HydrophobicContact CG2-CG 4.43Å; I2198-L2202 WeakPolarHBondContact O-CG 3.27Å; I2198-L2202 PolarHBondContact O-N 3.06Å; Q2199-L2202 PolarHBondContact O-N 3.24Å
2203I90.7Very high90.4Very high64.8 Ų64.858 Ų5833%0.33228%0.283SS..  trans-125.494.9-169.3-49.9173.8000110.5Q2199 E2205 R2206Q2199-I2203 WeakPolarHBondContact O-CA 3.4Å; Q2199-I2203 WeakPolarHBondContact O-CB 3.37Å; Q2199-I2203 PolarHBondContact O-N 3.17Å; I2203-E2205 VanDerWaalsContact C-N 3.3Å; I2203-E2205 HydrophobicContact CG2-CB 4.45Å; I2203-E2205 PolarHBondContact O-N 3.18Å; I2203-R2206 HydrophobicContact CB-CG 4.45Å; I2203-R2206 HydrophobicContact CG2-CB 4.33Å; I2203-R2206 HydrophobicContact CG2-CG 3.85Å; I2203-R2206 PolarHBondContact O-N 3.18Å
2204P87Confident90.3Very high81.6 Ų81.658.1 Ų58.153%0.5328%0.284SS..G310 helixtrans-59.8-34.9-177.7-1723.3000114.4R2206 R2207P2204-R2206 VanDerWaalsContact C-N 3.26Å; P2204-R2206 PolarHBondContact O-N 2.99Å; P2204-R2207 VanDerWaalsContact O-CB 3.32Å; P2204-R2207 WeakPolarHBondContact O-CB 3.3Å; P2204-R2207 WeakPolarHBondContact O-CD 3.42Å; P2204-R2207 VanDerWaalsContact O-CG 3.24Å; P2204-R2207 WeakPolarHBondContact O-CG 3.3Å; P2204-R2207 PolarHBondContact O-N 2.95Å
2205E87Confident90Very high171 Ų17159.9 Ų59.980%0.79929%0.292SS*.G310 helixtrans-62.8-28.1-177.7-62.6173.9178.800113.3I2203 R2207I2203-E2205 VanDerWaalsContact C-N 3.3Å; I2203-E2205 HydrophobicContact CG2-CB 4.45Å; I2203-E2205 PolarHBondContact O-N 3.18Å; E2205-R2207 VanDerWaalsContact C-N 3.33Å
2206R86.8Confident89.8Confident85.8 Ų85.861.7 Ų61.732%0.32431%0.308SS..G310 helixtrans-86.6-5.8-177.6-65.8-171.676.4-159-3113.6Q2199 I2203 P2204 S2208 I2209 L2210Q2199-R2206 VanDerWaalsContact OE1-CZ 3.22Å; I2203-R2206 HydrophobicContact CB-CG 4.45Å; I2203-R2206 HydrophobicContact CG2-CB 4.33Å; I2203-R2206 HydrophobicContact CG2-CG 3.85Å; I2203-R2206 PolarHBondContact O-N 3.18Å; P2204-R2206 VanDerWaalsContact C-N 3.26Å; P2204-R2206 PolarHBondContact O-N 2.99Å; R2206-S2208 VanDerWaalsContact C-N 3.34Å; R2206-S2208 PolarHBondContact O-N 3.3Å; R2206-I2209 PolarHBondContact O-N 3.06Å; R2206-L2210 HydrophobicContact CB-CD1 4.28Å; R2206-L2210 HydrophobicContact CB-CG 4.42Å; R2206-L2210 WeakPolarHBondContact O-CB 3.33Å; R2206-L2210 VanDerWaalsContact O-CG 3.3Å; R2206-L2210 WeakPolarHBondContact O-CG 3.45Å; R2206-L2210 PolarHBondContact O-N 3.1Å
2207R88.5Confident89.7Confident96 Ų9663.8 Ų63.836%0.36232%0.316SS..Hα-helixtrans-59.7-39.9-172.9-69.2179.7176.6171.42.9113.5Y2200 K2201 P2204 E2205 R2211Y2200-R2207 HydrophobicContact CD1-CG 3.94Å; Y2200-R2207 HydrophobicContact CD2-CB 4Å; Y2200-R2207 HydrophobicContact CD2-CG 3.75Å; Y2200-R2207 HydrophobicContact CE1-CB 4.4Å; Y2200-R2207 HydrophobicContact CE1-CG 3.79Å; Y2200-R2207 HydrophobicContact CE2-CB 3.5Å; Y2200-R2207 VanDerWaalsContact CE2-CB 3.49Å; Y2200-R2207 HydrophobicContact CE2-CG 3.56Å; Y2200-R2207 HydrophobicContact CG-CG 3.95Å; Y2200-R2207 PolarHBondContact O-NE 3.02Å; Y2200-R2207 PolarHBondContact O-NH2 3.16Å; K2201-R2207 PolarHBondContact O-NH2 3.15Å; P2204-R2207 VanDerWaalsContact O-CB 3.32Å; P2204-R2207 WeakPolarHBondContact O-CB 3.3Å; P2204-R2207 WeakPolarHBondContact O-CD 3.42Å; P2204-R2207 VanDerWaalsContact O-CG 3.24Å; P2204-R2207 WeakPolarHBondContact O-CG 3.3Å; P2204-R2207 PolarHBondContact O-N 2.95Å; E2205-R2207 VanDerWaalsContact C-N 3.33Å; R2207-R2211 WeakPolarHBondContact O-CB 3.38Å; R2207-R2211 VanDerWaalsContact O-CG 3.29Å; R2207-R2211 WeakPolarHBondContact O-CG 3.42Å; R2207-R2211 PolarHBondContact O-N 3.14Å; R2207-R2211 VanDerWaalsContact O-N 3.12Å; R2207-R2211 PolarHBondContact O-NE 3.08Å
2208S85.6Confident89.5Confident67.2 Ų67.263.9 Ų63.947%0.4732%0.316SS..Hα-helixtrans-65.6-49.4178.252.50000111.8R2206 L2210 R2211 E2212R2206-S2208 VanDerWaalsContact C-N 3.34Å; R2206-S2208 PolarHBondContact O-N 3.3Å; S2208-L2210 VanDerWaalsContact C-N 3.33Å; S2208-L2210 PolarHBondContact O-N 2.88Å; S2208-R2211 PolarHBondContact O-N 3.09Å; S2208-E2212 PolarHBondContact O-N 3.1Å; S2208-E2212 VanDerWaalsContact O-N 3.09Å
2209I90Very high89.2Confident90.8 Ų90.868.1 Ų68.147%0.46634%0.338SS..Hα-helixtrans-61.1-43.9179.7-58.4172000110.7R2206 R2211 E2212 A2213R2206-I2209 PolarHBondContact O-N 3.06Å; I2209-R2211 VanDerWaalsContact C-N 3.35Å; I2209-R2211 PolarHBondContact O-N 3.11Å; I2209-E2212 PolarHBondContact O-N 3.19Å; I2209-A2213 WeakPolarHBondContact O-CB 3.3Å; I2209-A2213 PolarHBondContact O-N 3.1Å
2210L90.4Very high89Confident4.8 Ų4.868.2 Ų68.23%0.02535%0.353CS..Hα-helixtrans-64.6-41.5178.2-70.1175.9000111.9E2196 Q2199 Y2200 R2206 S2208 E2212 A2213 W2214E2196-L2210 HydrophobicContact CB-CD1 4.48Å; E2196-L2210 HydrophobicContact CB-CD2 4.06Å; E2196-L2210 HydrophobicContact CG-CD2 3.95Å; Q2199-L2210 HydrophobicContact CB-CD1 4.43Å; Y2200-L2210 HydrophobicContact CD2-CB 4.3Å; Y2200-L2210 HydrophobicContact CD2-CD1 4.22Å; R2206-L2210 HydrophobicContact CB-CD1 4.28Å; R2206-L2210 HydrophobicContact CB-CG 4.42Å; R2206-L2210 WeakPolarHBondContact O-CB 3.33Å; R2206-L2210 VanDerWaalsContact O-CG 3.3Å; R2206-L2210 WeakPolarHBondContact O-CG 3.45Å; R2206-L2210 PolarHBondContact O-N 3.1Å; S2208-L2210 VanDerWaalsContact C-N 3.33Å; S2208-L2210 PolarHBondContact O-N 2.88Å; L2210-E2212 VanDerWaalsContact C-N 3.33Å; L2210-E2212 PolarHBondContact O-N 3.08Å; L2210-A2213 PolarHBondContact O-N 3.14Å; L2210-W2214 HydrophobicContact CB-CZ2 4.37Å; L2210-W2214 VanDerWaalsContact O-CB 3.29Å; L2210-W2214 WeakPolarHBondContact O-CB 3.3Å; L2210-W2214 VanDerWaalsContact O-CG 3.22Å; L2210-W2214 PolarHBondContact O-N 3.12Å
2211R88.7Confident88.7Confident101.6 Ų101.668.3 Ų68.338%0.38336%0.355SS..Hα-helixtrans-59.7-42.8174.9-75.9177.5-137-176.4-3112.1Y2200 R2207 S2208 I2209 Q2215 L2239 E2243Y2200-R2211 HydrophobicContact CE2-CG 4.16Å; Y2200-R2211 PolarHBondContact OH-NE 3.18Å; Y2200-R2211 VanDerWaalsContact OH-NE 3.12Å; Y2200-R2211 PolarHBondContact OH-NH2 3.37Å; R2207-R2211 WeakPolarHBondContact O-CB 3.38Å; R2207-R2211 VanDerWaalsContact O-CG 3.29Å; R2207-R2211 WeakPolarHBondContact O-CG 3.42Å; R2207-R2211 PolarHBondContact O-N 3.14Å; R2207-R2211 VanDerWaalsContact O-N 3.12Å; R2207-R2211 PolarHBondContact O-NE 3.08Å; S2208-R2211 PolarHBondContact O-N 3.09Å; I2209-R2211 VanDerWaalsContact C-N 3.35Å; I2209-R2211 PolarHBondContact O-N 3.11Å; R2211-Q2215 WeakPolarHBondContact O-CB 3.27Å; R2211-Q2215 PolarHBondContact O-N 3.17Å; R2211-L2239 HydrophobicContact CG-CD1 4.38Å; R2211-L2239 HydrophobicContact CG-CD2 4.35Å; R2211-E2243 IonicContact CZ-OE1 3.52Å; R2211-E2243 IonicContact NH1-OE1 3.87Å; R2211-E2243 PolarHBondContact NH1-OE1 3.45Å; R2211-E2243 IonicContact NH2-OE1 3.59Å; R2211-E2243 PolarHBondContact NH2-OE1 3.03Å; R2211-E2243 IonicContact NH2-OE2 3.23Å; R2211-E2243 PolarHBondContact NH2-OE2 3.05Å
2212E87.2Confident88.5Confident143.4 Ų143.469 Ų6967%0.6736%0.362SS*.Hα-helixtrans-66.7-42.9176.1-70.1-174.9174.300112.3S2208 I2209 L2210 W2214 Q2215 S2216S2208-E2212 PolarHBondContact O-N 3.1Å; S2208-E2212 VanDerWaalsContact O-N 3.09Å; I2209-E2212 PolarHBondContact O-N 3.19Å; L2210-E2212 VanDerWaalsContact C-N 3.33Å; L2210-E2212 PolarHBondContact O-N 3.08Å; E2212-W2214 PolarHBondContact O-N 2.94Å; E2212-Q2215 PolarHBondContact O-N 3.14Å; E2212-S2216 WeakPolarHBondContact O-CB 3.33Å; E2212-S2216 PolarHBondContact O-N 3.37Å; E2212-S2216 PolarHBondContact O-OG 3.19Å
2213A90.7Very high88.1Confident27.2 Ų27.268 Ų6823%0.22536%0.363CS..Hα-helixtrans-61-47.5176.200000111.5I2209 L2210 Q2215 S2216 R2217I2209-A2213 WeakPolarHBondContact O-CB 3.3Å; I2209-A2213 PolarHBondContact O-N 3.1Å; L2210-A2213 PolarHBondContact O-N 3.14Å; A2213-Q2215 VanDerWaalsContact C-N 3.32Å; A2213-Q2215 PolarHBondContact O-N 3.08Å; A2213-S2216 WeakPolarHBondContact CA-OG 3.48Å; A2213-S2216 PolarHBondContact O-N 3.21Å; A2213-S2216 PolarHBondContact O-OG 3.11Å; A2213-R2217 VanDerWaalsContact O-CB 3.29Å; A2213-R2217 WeakPolarHBondContact O-CB 3.34Å; A2213-R2217 PolarHBondContact O-N 3.09Å
2214W92.8Very high87.7Confident2.2 Ų2.267.4 Ų67.41%0.00836%0.362CS..Hα-helixtrans-59.6-41175.8-73.3-11.1000112.8E2193 E2196 V2197 Y2200 L2210 E2212 L2218 R2235 V2238 L2239E2193-W2214 VanDerWaalsContact CD-CD1 3.4Å; E2193-W2214 PolarHBondContact OE2-NE1 3.45Å; E2196-W2214 HydrophobicContact CB-CZ2 3.91Å; E2196-W2214 VanDerWaalsContact OE2-CD1 3.3Å; E2196-W2214 PolarHBondContact OE2-NE1 3.02Å; V2197-W2214 HydrophobicContact CG2-CH2 3.98Å; V2197-W2214 HydrophobicContact CG2-CZ2 3.98Å; Y2200-W2214 AromaticContact CD2-CH2 3.84Å; Y2200-W2214 HydrophobicContact CD2-CH2 3.84Å; Y2200-W2214 AromaticContact CD2-CZ3 3.94Å; Y2200-W2214 HydrophobicContact CD2-CZ3 4.03Å; Y2200-W2214 HydrophobicContact CE2-CH2 4.46Å; Y2200-W2214 HydrophobicContact CE2-CZ3 4.31Å; Y2200-W2214 HydrophobicContact CG-CH2 4.17Å; Y2200-W2214 HydrophobicContact CG-CZ3 4.48Å; L2210-W2214 HydrophobicContact CB-CZ2 4.37Å; L2210-W2214 VanDerWaalsContact O-CB 3.29Å; L2210-W2214 WeakPolarHBondContact O-CB 3.3Å; L2210-W2214 VanDerWaalsContact O-CG 3.22Å; L2210-W2214 PolarHBondContact O-N 3.12Å; E2212-W2214 PolarHBondContact O-N 2.94Å; W2214-L2218 VanDerWaalsContact O-CB 3.31Å; W2214-L2218 WeakPolarHBondContact O-CB 3.34Å; W2214-L2218 PolarHBondContact O-N 2.99Å; W2214-L2218 VanDerWaalsContact O-N 3.1Å; W2214-R2235 HydrophobicContact CD2-CG 4.38Å; W2214-R2235 HydrophobicContact CE3-CG 4.21Å; W2214-R2235 HydrophobicContact CZ3-CG 4.48Å; W2214-R2235 VanDerWaalsContact O-CZ 3.31Å; W2214-R2235 PolarHBondContact O-NH1 3.11Å; W2214-R2235 VanDerWaalsContact O-NH1 3.13Å; W2214-R2235 PolarHBondContact O-NH2 3.21Å; W2214-V2238 HydrophobicContact CH2-CG2 3.98Å; W2214-V2238 HydrophobicContact CZ3-CG2 4.27Å; W2214-L2239 HydrophobicContact CE3-CD1 3.83Å; W2214-L2239 HydrophobicContact CZ3-CD1 3.72Å; W2214-L2239 HydrophobicContact CZ3-CD2 4.47Å; W2214-L2239 HydrophobicContact CZ3-CG 4.12Å
2215Q87.9Confident87.6Confident38.8 Ų38.864 Ų6418%0.18134%0.34CS..Hα-helixtrans-69.1-39.2178.4-174.7120.482.700112.3R2211 E2212 A2213 L2219 D2244 S2247 R2250R2211-Q2215 WeakPolarHBondContact O-CB 3.27Å; R2211-Q2215 PolarHBondContact O-N 3.17Å; E2212-Q2215 PolarHBondContact O-N 3.14Å; A2213-Q2215 VanDerWaalsContact C-N 3.32Å; A2213-Q2215 PolarHBondContact O-N 3.08Å; Q2215-L2219 WeakPolarHBondContact O-CG 3.47Å; Q2215-L2219 PolarHBondContact O-N 3.13Å; Q2215-D2244 PolarHBondContact NE2-OD1 2.89Å; Q2215-D2244 VanDerWaalsContact NE2-OD1 3.12Å; Q2215-S2247 PolarHBondContact NE2-OG 3.15Å; Q2215-S2247 PolarHBondContact OE1-OG 2.87Å; Q2215-R2250 VanDerWaalsContact NE2-NH1 3.15Å
2216S88.9Confident87.4Confident73.4 Ų73.458.5 Ų58.551%0.51331%0.314SS..Hα-helixtrans-70.8-42.5176.6119.40000111.9E2212 A2213 L2218 L2219 G2220E2212-S2216 WeakPolarHBondContact O-CB 3.33Å; E2212-S2216 PolarHBondContact O-N 3.37Å; E2212-S2216 PolarHBondContact O-OG 3.19Å; A2213-S2216 WeakPolarHBondContact CA-OG 3.48Å; A2213-S2216 PolarHBondContact O-N 3.21Å; A2213-S2216 PolarHBondContact O-OG 3.11Å; S2216-L2218 PolarHBondContact O-N 3.45Å; S2216-L2219 WeakPolarHBondContact O-CB 3.37Å; S2216-L2219 PolarHBondContact O-N 3.12Å; S2216-G2220 PolarHBondContact O-N 3.26Å; S2216-G2220 VanDerWaalsContact O-N 3.09Å
2217R92.4Very high87.4Confident63.6 Ų63.655.6 Ų55.624%0.2431%0.305CS..Hα-helixtrans-64.2-43.8178.5-161.6-176.7-66137.2-7.3112Q2189 E2193 E2196 A2213 L2219 G2220 C2221Q2189-R2217 VanDerWaalsContact CD-CD 3.43Å; Q2189-R2217 HydrophobicContact CG-CG 4.5Å; Q2189-R2217 VanDerWaalsContact NE2-CD 3.33Å; E2193-R2217 WeakPolarHBondContact OE1-CD 3.2Å; E2193-R2217 IonicContact OE1-CZ 3.41Å; E2193-R2217 IonicContact OE1-NH1 3.15Å; E2193-R2217 PolarHBondContact OE1-NH1 3.31Å; E2193-R2217 VanDerWaalsContact OE1-NH1 3.15Å; E2196-R2217 VanDerWaalsContact CD-NH1 3.33Å; E2196-R2217 IonicContact OE1-CZ 3.02Å; E2196-R2217 IonicContact OE1-NH1 3.18Å; E2196-R2217 PolarHBondContact OE1-NH1 2.93Å; E2196-R2217 VanDerWaalsContact OE1-NH1 3.1Å; E2196-R2217 IonicContact OE1-NH2 3.63Å; E2196-R2217 PolarHBondContact OE1-NH2 3.13Å; E2196-R2217 IonicContact OE2-CZ 3.25Å; E2196-R2217 IonicContact OE2-NH1 3.18Å; E2196-R2217 PolarHBondContact OE2-NH1 3.15Å; E2196-R2217 IonicContact OE2-NH2 3.41Å; E2196-R2217 PolarHBondContact OE2-NH2 3.13Å; A2213-R2217 VanDerWaalsContact O-CB 3.29Å; A2213-R2217 WeakPolarHBondContact O-CB 3.34Å; A2213-R2217 PolarHBondContact O-N 3.09Å; R2217-L2219 VanDerWaalsContact C-N 3.26Å; R2217-L2219 PolarHBondContact O-N 3.2Å; R2217-G2220 WeakPolarHBondContact O-CA 3.33Å; R2217-G2220 PolarHBondContact O-N 3.19Å; R2217-C2221 PolarHBondContact O-N 3.11Å; R2217-C2221 PolarHBondContact O-SG 3.06Å; R2217-C2221 VanDerWaalsContact O-SG 3.36Å
2218L89.7Confident87.5Confident1.8 Ų1.851.9 Ų51.91%0.00929%0.291CS..Hα-helixtrans-61.3-33176.9-173.966.2000112.4W2214 S2216 G2220 C2221 W2228 I2231 I2232W2214-L2218 VanDerWaalsContact O-CB 3.31Å; W2214-L2218 WeakPolarHBondContact O-CB 3.34Å; W2214-L2218 PolarHBondContact O-N 2.99Å; W2214-L2218 VanDerWaalsContact O-N 3.1Å; S2216-L2218 PolarHBondContact O-N 3.45Å; L2218-G2220 VanDerWaalsContact C-N 3.29Å; L2218-G2220 PolarHBondContact O-N 2.94Å; L2218-C2221 PolarHBondContact O-N 3.16Å; L2218-W2228 HydrophobicContact CD1-CD2 3.68Å; L2218-W2228 HydrophobicContact CD1-CE3 3.93Å; L2218-W2228 HydrophobicContact CD1-CG 4.02Å; L2218-W2228 HydrophobicContact CD1-CH2 4.38Å; L2218-W2228 HydrophobicContact CD1-CZ2 4.25Å; L2218-W2228 HydrophobicContact CD1-CZ3 4.27Å; L2218-W2228 HydrophobicContact CD2-CD2 4.42Å; L2218-W2228 HydrophobicContact CD2-CE3 3.97Å; L2218-W2228 HydrophobicContact CD2-CH2 4.27Å; L2218-W2228 HydrophobicContact CD2-CZ3 3.81Å; L2218-W2228 HydrophobicContact CG-CD2 4.14Å; L2218-W2228 HydrophobicContact CG-CE3 4Å; L2218-W2228 HydrophobicContact CG-CH2 3.9Å; L2218-W2228 HydrophobicContact CG-CZ2 4.04Å; L2218-W2228 HydrophobicContact CG-CZ3 3.88Å; L2218-W2228 VanDerWaalsContact O-CZ2 3.27Å; L2218-W2228 WeakPolarHBondContact O-CZ2 3.35Å; L2218-I2231 HydrophobicContact CD1-CB 4.47Å; L2218-I2231 HydrophobicContact CD1-CD1 4.39Å; L2218-I2231 HydrophobicContact CD1-CG2 4.18Å; L2218-I2232 HydrophobicContact CD2-CD1 4.31Å; L2218-I2232 HydrophobicContact CD2-CG1 4.28Å
2219L85.9Confident87.6Confident96.2 Ų96.249.5 Ų49.550%0.50427%0.274SS..Hα-helixtrans-69.4-24174-82.1173.8000113.6Q2215 S2216 R2217 R2250Q2215-L2219 WeakPolarHBondContact O-CG 3.47Å; Q2215-L2219 PolarHBondContact O-N 3.13Å; S2216-L2219 WeakPolarHBondContact O-CB 3.37Å; S2216-L2219 PolarHBondContact O-N 3.12Å; R2217-L2219 VanDerWaalsContact C-N 3.26Å; R2217-L2219 PolarHBondContact O-N 3.2Å; L2219-R2250 VanDerWaalsContact CD1-NH1 3.34Å; L2219-R2250 VanDerWaalsContact CD2-NH1 3.31Å; L2219-R2250 VanDerWaalsContact CG-NH1 3.3Å
2220G86Confident87.5Confident54.4 Ų54.447.1 Ų47.156%0.56126%0.261SS*.Hα-helixtrans-82.2-20.7175.300000113.9S2216 R2217 L2218S2216-G2220 PolarHBondContact O-N 3.26Å; S2216-G2220 VanDerWaalsContact O-N 3.09Å; R2217-G2220 WeakPolarHBondContact O-CA 3.33Å; R2217-G2220 PolarHBondContact O-N 3.19Å; L2218-G2220 VanDerWaalsContact C-N 3.29Å; L2218-G2220 PolarHBondContact O-N 2.94Å
2221C87Confident87.6Confident13.4 Ų13.446.8 Ų46.89%0.09126%0.26CS..SBendtrans-68.1150.7178.5-59.90000112Q2189 R2217 L2218Q2189-C2221 PolarHBondContact NE2-SG 3.22Å; Q2189-C2221 VanDerWaalsContact NE2-SG 3.45Å; Q2189-C2221 PolarHBondContact OE1-SG 3.14Å; Q2189-C2221 VanDerWaalsContact OE1-SG 3.37Å; R2217-C2221 PolarHBondContact O-N 3.11Å; R2217-C2221 PolarHBondContact O-SG 3.06Å; R2217-C2221 VanDerWaalsContact O-SG 3.36Å; L2218-C2221 PolarHBondContact O-N 3.16Å
2222N83.7Confident87.6Confident69 Ų6942 Ų4237%0.36924%0.242SC..  trans-59.3148.2168.6-84.9-24.1000109.7Y2182 V2224 W2228Y2182-N2222 WeakPolarHBondContact CD2-ND2 2.99Å; Y2182-N2222 HydrophobicContact CE1-CB 4.08Å; Y2182-N2222 HydrophobicContact CE2-CB 4.32Å; Y2182-N2222 WeakPolarHBondContact CE2-ND2 3.23Å; Y2182-N2222 VanDerWaalsContact CZ-ND2 3.26Å; Y2182-N2222 WeakPolarHBondContact OH-CB 3.41Å; Y2182-N2222 PolarHBondContact OH-N 3.42Å; Y2182-N2222 VanDerWaalsContact OH-N 3.08Å; N2222-V2224 HydrophobicContact CB-CG2 4.2Å; N2222-V2224 WeakPolarHBondContact ND2-CG2 3.39Å; N2222-V2224 PolarHBondContact O-N 3.02Å; N2222-W2228 PolarHBondContact O-NE1 3.14Å
2223S82.3Confident87.7Confident81.4 Ų81.435.9 Ų35.957%0.56921%0.213SC*.  trans-80.352.7-177.752.40000112.5
2224V83.4Confident87.7Confident51.4 Ų51.434.6 Ų34.631%0.31220%0.202SC..  trans-93.6133.1175.11800000108.7Y2182 N2222 E2226 D2227 W2228Y2182-V2224 HydrophobicContact CE1-CG2 4.49Å; N2222-V2224 HydrophobicContact CB-CG2 4.2Å; N2222-V2224 WeakPolarHBondContact ND2-CG2 3.39Å; N2222-V2224 PolarHBondContact O-N 3.02Å; V2224-E2226 HydrophobicContact CG1-CB 4.32Å; V2224-E2226 VanDerWaalsContact CG1-OE2 3.29Å; V2224-E2226 WeakPolarHBondContact CG1-OE2 3.38Å; V2224-E2226 PolarHBondContact O-N 3.31Å; V2224-D2227 HydrophobicContact CB-CB 4.34Å; V2224-D2227 WeakPolarHBondContact CB-OD2 3.35Å; V2224-D2227 HydrophobicContact CG1-CB 4.45Å; V2224-D2227 WeakPolarHBondContact CG1-OD1 3.18Å; V2224-W2228 WeakPolarHBondContact O-CB 3.3Å; V2224-W2228 PolarHBondContact O-N 3.15Å; V2224-W2228 VanDerWaalsContact O-N 3.13Å
2225I84.1Confident87.7Confident10.4 Ų10.434.7 Ų34.75%0.05320%0.203CC..Hα-helixtrans-74.6-37.3-171.2-65.7158.6000111.3D2227 W2228 S2229 F2251 L2254 S2258 R2260 L2263I2225-D2227 VanDerWaalsContact C-N 3.34Å; I2225-W2228 PolarHBondContact O-N 3.07Å; I2225-S2229 VanDerWaalsContact O-CB 3.24Å; I2225-S2229 WeakPolarHBondContact O-CB 3.43Å; I2225-S2229 PolarHBondContact O-N 3.19Å; I2225-S2229 PolarHBondContact O-OG 3.15Å; I2225-F2251 HydrophobicContact CG2-CE2 3.87Å; I2225-F2251 HydrophobicContact CG2-CZ 4.06Å; I2225-F2251 WeakPolarHBondContact O-CE2 3.36Å; I2225-L2254 HydrophobicContact CD1-CG 4.33Å; I2225-L2254 HydrophobicContact CG1-CD2 4.03Å; I2225-L2254 HydrophobicContact CG1-CG 3.94Å; I2225-S2258 VanDerWaalsContact CD1-CB 3.45Å; I2225-S2258 WeakPolarHBondContact CD1-OG 3.31Å; I2225-R2260 HydrophobicContact CD1-CG 4.24Å; I2225-R2260 VanDerWaalsContact CG2-NH1 3.35Å; I2225-L2263 HydrophobicContact CG2-CD1 4.22Å; I2225-L2263 HydrophobicContact CG2-CD2 3.87Å
2226E83Confident87.7Confident55.2 Ų55.234.9 Ų34.926%0.25821%0.209SC..Hα-helixtrans-61-50.2179.1-69.4108.5-155.200110.7W2048 A2080 V2224 W2228 S2229 Q2230 R2260W2048-E2226 PolarHBondContact NE1-OE1 3.18Å; A2080-E2226 VanDerWaalsContact O-OE1 3.12Å; V2224-E2226 HydrophobicContact CG1-CB 4.32Å; V2224-E2226 VanDerWaalsContact CG1-OE2 3.29Å; V2224-E2226 WeakPolarHBondContact CG1-OE2 3.38Å; V2224-E2226 PolarHBondContact O-N 3.31Å; E2226-W2228 PolarHBondContact O-N 3.16Å; E2226-S2229 WeakPolarHBondContact O-CB 3.43Å; E2226-S2229 PolarHBondContact O-N 3.24Å; E2226-S2229 PolarHBondContact O-OG 3.02Å; E2226-Q2230 WeakPolarHBondContact O-CG 3.19Å; E2226-Q2230 PolarHBondContact O-N 3.21Å; E2226-Q2230 VanDerWaalsContact O-N 3.1Å; E2226-R2260 IonicContact OE1-CZ 3.11Å; E2226-R2260 VanDerWaalsContact OE1-CZ 3.27Å; E2226-R2260 IonicContact OE1-NH1 3.41Å; E2226-R2260 PolarHBondContact OE1-NH1 3.12Å; E2226-R2260 IonicContact OE1-NH2 3.3Å; E2226-R2260 PolarHBondContact OE1-NH2 3.11Å; E2226-R2260 IonicContact OE2-CZ 3.45Å; E2226-R2260 IonicContact OE2-NH1 2.7Å; E2226-R2260 IonicContact OE2-NH2 2.68Å; E2226-R2260 PolarHBondContact OE2-NH2 3.41Å
2227D86.6Confident87.7Confident24.8 Ų24.832.8 Ų32.813%0.13319%0.191CC..Hα-helixtrans-60.9-49.8177.9-54.2-10.2000111.4Y2182 V2186 V2224 I2225 S2229 Q2230 I2231Y2182-D2227 WeakPolarHBondContact CE1-OD2 3.42Å; Y2182-D2227 PolarHBondContact OH-OD2 3.24Å; Y2182-D2227 VanDerWaalsContact OH-OD2 3.05Å; V2186-D2227 HydrophobicContact CG1-CB 4.01Å; V2186-D2227 HydrophobicContact CG2-CB 4.4Å; V2224-D2227 HydrophobicContact CB-CB 4.34Å; V2224-D2227 WeakPolarHBondContact CB-OD2 3.35Å; V2224-D2227 HydrophobicContact CG1-CB 4.45Å; V2224-D2227 WeakPolarHBondContact CG1-OD1 3.18Å; I2225-D2227 VanDerWaalsContact C-N 3.34Å; D2227-S2229 VanDerWaalsContact C-N 3.29Å; D2227-S2229 PolarHBondContact O-N 3.31Å; D2227-Q2230 PolarHBondContact O-N 3.14Å; D2227-I2231 WeakPolarHBondContact O-CB 3.19Å; D2227-I2231 WeakPolarHBondContact O-CD1 3.38Å; D2227-I2231 VanDerWaalsContact O-CG1 3.27Å; D2227-I2231 WeakPolarHBondContact O-CG1 3.38Å; D2227-I2231 PolarHBondContact O-N 3.18Å
2228W90.4Very high87.4Confident18.2 Ų18.231.1 Ų31.17%0.06919%0.188CC..Hα-helixtrans-61.7-39178.7-81.952.1000111.7L2218 N2222 V2224 I2225 E2226 I2231 I2232 R2250 F2251 L2254L2218-W2228 HydrophobicContact CD1-CD2 3.68Å; L2218-W2228 HydrophobicContact CD1-CE3 3.93Å; L2218-W2228 HydrophobicContact CD1-CG 4.02Å; L2218-W2228 HydrophobicContact CD1-CH2 4.38Å; L2218-W2228 HydrophobicContact CD1-CZ2 4.25Å; L2218-W2228 HydrophobicContact CD1-CZ3 4.27Å; L2218-W2228 HydrophobicContact CD2-CD2 4.42Å; L2218-W2228 HydrophobicContact CD2-CE3 3.97Å; L2218-W2228 HydrophobicContact CD2-CH2 4.27Å; L2218-W2228 HydrophobicContact CD2-CZ3 3.81Å; L2218-W2228 HydrophobicContact CG-CD2 4.14Å; L2218-W2228 HydrophobicContact CG-CE3 4Å; L2218-W2228 HydrophobicContact CG-CH2 3.9Å; L2218-W2228 HydrophobicContact CG-CZ2 4.04Å; L2218-W2228 HydrophobicContact CG-CZ3 3.88Å; L2218-W2228 VanDerWaalsContact O-CZ2 3.27Å; L2218-W2228 WeakPolarHBondContact O-CZ2 3.35Å; N2222-W2228 PolarHBondContact O-NE1 3.14Å; V2224-W2228 WeakPolarHBondContact O-CB 3.3Å; V2224-W2228 PolarHBondContact O-N 3.15Å; V2224-W2228 VanDerWaalsContact O-N 3.13Å; I2225-W2228 PolarHBondContact O-N 3.07Å; E2226-W2228 PolarHBondContact O-N 3.16Å; W2228-I2231 PolarHBondContact O-N 3.18Å; W2228-I2232 HydrophobicContact CE3-CD1 4.29Å; W2228-I2232 VanDerWaalsContact O-CB 3.3Å; W2228-I2232 WeakPolarHBondContact O-CB 3.29Å; W2228-I2232 WeakPolarHBondContact O-CD1 3.46Å; W2228-I2232 VanDerWaalsContact O-CG1 3.23Å; W2228-I2232 WeakPolarHBondContact O-CG1 3.35Å; W2228-I2232 PolarHBondContact O-N 3.11Å; W2228-R2250 HydrophobicContact CH2-CB 4.44Å; W2228-R2250 HydrophobicContact CZ3-CB 4.04Å; W2228-F2251 HydrophobicContact CB-CD2 3.68Å; W2228-F2251 HydrophobicContact CB-CE2 3.84Å; W2228-F2251 HydrophobicContact CE3-CB 4.3Å; W2228-F2251 HydrophobicContact CE3-CD2 4.27Å; W2228-L2254 HydrophobicContact CB-CD2 4.32Å; W2228-L2254 HydrophobicContact CD2-CD2 4.12Å; W2228-L2254 HydrophobicContact CE3-CD2 4.41Å; W2228-L2254 HydrophobicContact CG-CD2 4.19Å
2229S88.4Confident87.3Confident17 Ų1731.4 Ų31.412%0.11919%0.189CC..Hα-helixtrans-61.6-46.7177.3175.60000110.8I2225 E2226 D2227 Q2233I2225-S2229 VanDerWaalsContact O-CB 3.24Å; I2225-S2229 WeakPolarHBondContact O-CB 3.43Å; I2225-S2229 PolarHBondContact O-N 3.19Å; I2225-S2229 PolarHBondContact O-OG 3.15Å; E2226-S2229 WeakPolarHBondContact O-CB 3.43Å; E2226-S2229 PolarHBondContact O-N 3.24Å; E2226-S2229 PolarHBondContact O-OG 3.02Å; D2227-S2229 VanDerWaalsContact C-N 3.29Å; D2227-S2229 PolarHBondContact O-N 3.31Å; S2229-Q2233 VanDerWaalsContact O-CB 3.28Å; S2229-Q2233 WeakPolarHBondContact O-CB 3.35Å; S2229-Q2233 WeakPolarHBondContact O-CG 3.44Å; S2229-Q2233 PolarHBondContact O-N 3.01Å
2230Q88.4Confident87.1Confident40 Ų4032 Ų3219%0.18719%0.19CC..Hα-helixtrans-66-43.3179.9-70.8-178.5-13.200112.2L2190 E2226 D2227 I2232 Q2233 L2234L2190-Q2230 HydrophobicContact CD1-CB 4.31Å; L2190-Q2230 HydrophobicContact CD2-CB 4.2Å; E2226-Q2230 WeakPolarHBondContact O-CG 3.19Å; E2226-Q2230 PolarHBondContact O-N 3.21Å; E2226-Q2230 VanDerWaalsContact O-N 3.1Å; D2227-Q2230 PolarHBondContact O-N 3.14Å; Q2230-I2232 PolarHBondContact O-N 3.4Å; Q2230-Q2233 PolarHBondContact O-N 3.01Å; Q2230-L2234 WeakPolarHBondContact O-CB 3.45Å; Q2230-L2234 PolarHBondContact O-N 3.13Å
2231I91.5Very high86.8Confident0.2 Ų0.231.8 Ų31.80%0.00118%0.179CC..Hα-helixtrans-63.5-46.9179-67.1165000110.7V2186 L2190 E2193 L2218 D2227 W2228 Q2233 L2234 R2235V2186-I2231 HydrophobicContact CG1-CD1 4.4Å; L2190-I2231 HydrophobicContact CD2-CB 4.36Å; L2190-I2231 HydrophobicContact CD2-CG1 3.72Å; L2190-I2231 HydrophobicContact CG-CG1 4.38Å; E2193-I2231 WeakPolarHBondContact OE2-CG2 3.25Å; L2218-I2231 HydrophobicContact CD1-CB 4.47Å; L2218-I2231 HydrophobicContact CD1-CD1 4.39Å; L2218-I2231 HydrophobicContact CD1-CG2 4.18Å; D2227-I2231 WeakPolarHBondContact O-CB 3.19Å; D2227-I2231 WeakPolarHBondContact O-CD1 3.38Å; D2227-I2231 VanDerWaalsContact O-CG1 3.27Å; D2227-I2231 WeakPolarHBondContact O-CG1 3.38Å; D2227-I2231 PolarHBondContact O-N 3.18Å; W2228-I2231 PolarHBondContact O-N 3.18Å; I2231-Q2233 VanDerWaalsContact C-N 3.33Å; I2231-Q2233 PolarHBondContact O-N 3.32Å; I2231-L2234 WeakPolarHBondContact O-CB 3.35Å; I2231-L2234 PolarHBondContact O-N 3.24Å; I2231-R2235 VanDerWaalsContact CG2-CZ 3.49Å; I2231-R2235 VanDerWaalsContact CG2-NH2 3.33Å; I2231-R2235 WeakPolarHBondContact O-CG 3.33Å; I2231-R2235 PolarHBondContact O-N 3.06Å; I2231-R2235 VanDerWaalsContact O-N 3.14Å
2232I90Very high86.3Confident0.8 Ų0.837.2 Ų37.20%0.00420%0.198CC..Hα-helixtrans-68.3-37.5-179.8-66.1170.1000110.9L2218 W2228 Q2230 L2234 R2235 S2236 W2248 F2251L2218-I2232 HydrophobicContact CD2-CD1 4.31Å; L2218-I2232 HydrophobicContact CD2-CG1 4.28Å; W2228-I2232 HydrophobicContact CE3-CD1 4.29Å; W2228-I2232 VanDerWaalsContact O-CB 3.3Å; W2228-I2232 WeakPolarHBondContact O-CB 3.29Å; W2228-I2232 WeakPolarHBondContact O-CD1 3.46Å; W2228-I2232 VanDerWaalsContact O-CG1 3.23Å; W2228-I2232 WeakPolarHBondContact O-CG1 3.35Å; W2228-I2232 PolarHBondContact O-N 3.11Å; Q2230-I2232 PolarHBondContact O-N 3.4Å; I2232-L2234 VanDerWaalsContact C-N 3.32Å; I2232-L2234 PolarHBondContact O-N 3.23Å; I2232-R2235 WeakPolarHBondContact O-CB 3.37Å; I2232-R2235 PolarHBondContact O-N 3.12Å; I2232-S2236 PolarHBondContact O-N 3.18Å; I2232-S2236 VanDerWaalsContact O-N 3.07Å; I2232-W2248 HydrophobicContact CG2-CD2 3.66Å; I2232-W2248 HydrophobicContact CG2-CE3 3.89Å; I2232-W2248 HydrophobicContact CG2-CG 4.42Å; I2232-W2248 HydrophobicContact CG2-CH2 3.54Å; I2232-W2248 VanDerWaalsContact CG2-CH2 3.48Å; I2232-W2248 HydrophobicContact CG2-CZ2 3.27Å; I2232-W2248 VanDerWaalsContact CG2-CZ2 3.44Å; I2232-W2248 HydrophobicContact CG2-CZ3 3.83Å; I2232-F2251 HydrophobicContact CD1-CB 3.64Å; I2232-F2251 HydrophobicContact CD1-CD1 4.4Å; I2232-F2251 HydrophobicContact CD1-CD2 4.1Å; I2232-F2251 HydrophobicContact CD1-CG 3.83Å
2233Q88.5Confident86.1Confident15.2 Ų15.237.6 Ų37.67%0.07120%0.198CC..Hα-helixtrans-64.5-36.5175.4-157.1177.13.600112.3W2084 W2115 A2116 S2229 Q2230 I2231 R2235 S2236W2084-Q2233 VanDerWaalsContact CZ2-NE2 3.27Å; W2115-Q2233 VanDerWaalsContact CD2-CD 3.46Å; W2115-Q2233 HydrophobicContact CD2-CG 3.87Å; W2115-Q2233 VanDerWaalsContact CE3-CD 3.46Å; W2115-Q2233 HydrophobicContact CE3-CG 4.11Å; W2115-Q2233 HydrophobicContact CG-CG 4.45Å; W2115-Q2233 HydrophobicContact CH2-CB 4.27Å; W2115-Q2233 HydrophobicContact CH2-CG 4.06Å; W2115-Q2233 HydrophobicContact CZ2-CB 4.31Å; W2115-Q2233 HydrophobicContact CZ2-CG 3.79Å; W2115-Q2233 WeakPolarHBondContact CZ2-O 3.38Å; W2115-Q2233 HydrophobicContact CZ3-CB 4.37Å; W2115-Q2233 HydrophobicContact CZ3-CG 4.2Å; W2115-Q2233 PolarHBondContact O-NE2 3.09Å; A2116-Q2233 VanDerWaalsContact CA-NE2 3.28Å; S2229-Q2233 VanDerWaalsContact O-CB 3.28Å; S2229-Q2233 WeakPolarHBondContact O-CB 3.35Å; S2229-Q2233 WeakPolarHBondContact O-CG 3.44Å; S2229-Q2233 PolarHBondContact O-N 3.01Å; Q2230-Q2233 PolarHBondContact O-N 3.01Å; I2231-Q2233 VanDerWaalsContact C-N 3.33Å; I2231-Q2233 PolarHBondContact O-N 3.32Å; Q2233-R2235 VanDerWaalsContact C-N 3.34Å; Q2233-R2235 PolarHBondContact O-N 3.26Å; Q2233-S2236 WeakPolarHBondContact CA-OG 3.49Å; Q2233-S2236 WeakPolarHBondContact O-CB 3.3Å; Q2233-S2236 PolarHBondContact O-N 3.18Å; Q2233-S2236 VanDerWaalsContact O-N 3.14Å; Q2233-S2236 PolarHBondContact O-OG 2.97Å
2234L91.1Very high86.1Confident0 Ų034.5 Ų34.50%018%0.175CC..Hα-helixtrans-62.5-42.5171.8-176.565.1000111.9W2115 F2140 V2144 L2190 E2193 A2194 V2197 Q2230 I2231 I2232 S2236 L2237W2115-L2234 HydrophobicContact CH2-CB 4.18Å; W2115-L2234 HydrophobicContact CH2-CD1 4.38Å; W2115-L2234 HydrophobicContact CZ2-CB 4.44Å; W2115-L2234 HydrophobicContact CZ2-CD1 4.46Å; F2140-L2234 HydrophobicContact CE2-CD1 4.43Å; F2140-L2234 HydrophobicContact CZ-CD1 4.38Å; V2144-L2234 HydrophobicContact CG2-CD1 4.12Å; L2190-L2234 HydrophobicContact CB-CD2 4.48Å; L2190-L2234 HydrophobicContact CD2-CD2 4.08Å; L2190-L2234 WeakPolarHBondContact O-CD2 3.37Å; E2193-L2234 HydrophobicContact CB-CD2 3.79Å; A2194-L2234 HydrophobicContact CB-CD1 4.29Å; A2194-L2234 HydrophobicContact CB-CD2 4.23Å; V2197-L2234 HydrophobicContact CG2-CG 4.5Å; Q2230-L2234 WeakPolarHBondContact O-CB 3.45Å; Q2230-L2234 PolarHBondContact O-N 3.13Å; I2231-L2234 WeakPolarHBondContact O-CB 3.35Å; I2231-L2234 PolarHBondContact O-N 3.24Å; I2232-L2234 VanDerWaalsContact C-N 3.32Å; I2232-L2234 PolarHBondContact O-N 3.23Å; L2234-S2236 VanDerWaalsContact C-N 3.27Å; L2234-S2236 PolarHBondContact O-N 3.3Å; L2234-L2237 HydrophobicContact CD1-CD1 3.86Å; L2234-L2237 WeakPolarHBondContact O-CB 3.27Å; L2234-L2237 WeakPolarHBondContact O-CD1 3.4Å; L2234-L2237 VanDerWaalsContact O-CG 3.3Å; L2234-L2237 WeakPolarHBondContact O-CG 3.33Å; L2234-L2237 PolarHBondContact O-N 3.19Å
2235R91.6Very high86.1Confident2.6 Ų2.636 Ų361%0.0118%0.175CC..Hα-helixtrans-65.4-29.5176.4-65.6169.2-171.4-170.7-1.4112.7E2193 W2214 I2231 I2232 Q2233 L2237 V2238 L2239 D2244E2193-R2235 VanDerWaalsContact CD-NH2 3.31Å; E2193-R2235 IonicContact OE1-CZ 2.99Å; E2193-R2235 IonicContact OE1-NH2 2.94Å; E2193-R2235 PolarHBondContact OE1-NH2 3.21Å; E2193-R2235 IonicContact OE2-CZ 3.18Å; E2193-R2235 VanDerWaalsContact OE2-CZ 3.28Å; E2193-R2235 IonicContact OE2-NE 3.44Å; E2193-R2235 PolarHBondContact OE2-NE 3.34Å; E2193-R2235 IonicContact OE2-NH2 3.33Å; E2193-R2235 PolarHBondContact OE2-NH2 3.29Å; E2193-R2235 VanDerWaalsContact OE2-NH2 3.12Å; W2214-R2235 HydrophobicContact CD2-CG 4.38Å; W2214-R2235 HydrophobicContact CE3-CG 4.21Å; W2214-R2235 HydrophobicContact CZ3-CG 4.48Å; W2214-R2235 VanDerWaalsContact O-CZ 3.31Å; W2214-R2235 PolarHBondContact O-NH1 3.11Å; W2214-R2235 VanDerWaalsContact O-NH1 3.13Å; W2214-R2235 PolarHBondContact O-NH2 3.21Å; I2231-R2235 VanDerWaalsContact CG2-CZ 3.49Å; I2231-R2235 VanDerWaalsContact CG2-NH2 3.33Å; I2231-R2235 WeakPolarHBondContact O-CG 3.33Å; I2231-R2235 PolarHBondContact O-N 3.06Å; I2231-R2235 VanDerWaalsContact O-N 3.14Å; I2232-R2235 WeakPolarHBondContact O-CB 3.37Å; I2232-R2235 PolarHBondContact O-N 3.12Å; Q2233-R2235 VanDerWaalsContact C-N 3.34Å; Q2233-R2235 PolarHBondContact O-N 3.26Å; R2235-L2237 PolarHBondContact O-N 3.17Å; R2235-L2237 VanDerWaalsContact O-N 3.1Å; R2235-V2238 WeakPolarHBondContact O-CG2 3.13Å; R2235-V2238 PolarHBondContact O-N 3.09Å; R2235-V2238 VanDerWaalsContact O-N 3.11Å; R2235-L2239 HydrophobicContact CB-CD1 4.46Å; R2235-L2239 PolarHBondContact O-N 2.94Å; R2235-D2244 IonicContact NH1-OD2 3.54Å
2236S89.2Confident86.1Confident44.6 Ų44.642 Ų4231%0.31220%0.197SC..THydrogen-bonded Turntrans-67.4-7.2178.172.20000114.7I2232 Q2233 L2234 V2238 L2239I2232-S2236 PolarHBondContact O-N 3.18Å; I2232-S2236 VanDerWaalsContact O-N 3.07Å; Q2233-S2236 WeakPolarHBondContact CA-OG 3.49Å; Q2233-S2236 WeakPolarHBondContact O-CB 3.3Å; Q2233-S2236 PolarHBondContact O-N 3.18Å; Q2233-S2236 VanDerWaalsContact O-N 3.14Å; Q2233-S2236 PolarHBondContact O-OG 2.97Å; L2234-S2236 VanDerWaalsContact C-N 3.27Å; L2234-S2236 PolarHBondContact O-N 3.3Å; S2236-V2238 PolarHBondContact O-N 3.2Å; S2236-L2239 WeakPolarHBondContact CA-O 3.35Å
2237L88Confident86.3Confident27.6 Ų27.639.4 Ų39.415%0.14519%0.185CC..THydrogen-bonded Turntrans-65.1-18.6167.7-72.2160.9000113.4W2115 W2120 V2144 I2147 V2197 L2234 R2235W2115-L2237 HydrophobicContact CZ2-CD1 3.66Å; W2120-L2237 HydrophobicContact CH2-CD1 4.22Å; W2120-L2237 HydrophobicContact CH2-CD2 3.87Å; W2120-L2237 HydrophobicContact CH2-CG 4.24Å; W2120-L2237 HydrophobicContact CZ2-CD2 3.96Å; V2144-L2237 HydrophobicContact CG1-CD1 4.19Å; V2144-L2237 HydrophobicContact CG1-CD2 4.23Å; I2147-L2237 HydrophobicContact CB-CD1 4.5Å; I2147-L2237 HydrophobicContact CB-CD2 4.26Å; I2147-L2237 HydrophobicContact CG2-CD1 3.98Å; I2147-L2237 HydrophobicContact CG2-CD2 3.75Å; V2197-L2237 HydrophobicContact CG1-CB 4.26Å; V2197-L2237 HydrophobicContact CG1-CD1 4.34Å; L2234-L2237 HydrophobicContact CD1-CD1 3.86Å; L2234-L2237 WeakPolarHBondContact O-CB 3.27Å; L2234-L2237 WeakPolarHBondContact O-CD1 3.4Å; L2234-L2237 VanDerWaalsContact O-CG 3.3Å; L2234-L2237 WeakPolarHBondContact O-CG 3.33Å; L2234-L2237 PolarHBondContact O-N 3.19Å; R2235-L2237 PolarHBondContact O-N 3.17Å; R2235-L2237 VanDerWaalsContact O-N 3.1Å
2238V87.1Confident86.5Confident29 Ų2940.2 Ų40.218%0.17619%0.186CC..THydrogen-bonded Turntrans-137.1-29.4-172.1-147.50000113.2V2197 Y2200 K2201 W2214 R2235 S2236V2197-V2238 HydrophobicContact CB-CG2 4.38Å; V2197-V2238 HydrophobicContact CG1-CG1 3.8Å; V2197-V2238 HydrophobicContact CG1-CG2 3.74Å; V2197-V2238 HydrophobicContact CG2-CG2 4.18Å; Y2200-V2238 HydrophobicContact CD1-CB 4.17Å; Y2200-V2238 HydrophobicContact CD1-CG1 3.26Å; Y2200-V2238 HydrophobicContact CD1-CG2 3.81Å; Y2200-V2238 HydrophobicContact CD2-CG1 4.26Å; Y2200-V2238 HydrophobicContact CE1-CB 3.79Å; Y2200-V2238 HydrophobicContact CE1-CG1 3.12Å; Y2200-V2238 HydrophobicContact CE1-CG2 4.17Å; Y2200-V2238 HydrophobicContact CE2-CG1 4.34Å; Y2200-V2238 HydrophobicContact CG-CG1 3.69Å; Y2200-V2238 HydrophobicContact CG-CG2 4.28Å; K2201-V2238 HydrophobicContact CD-CG1 4.21Å; K2201-V2238 HydrophobicContact CD-CG2 4.26Å; K2201-V2238 HydrophobicContact CG-CG1 3.48Å; K2201-V2238 VanDerWaalsContact CG-CG1 3.42Å; K2201-V2238 HydrophobicContact CG-CG2 3.9Å; W2214-V2238 HydrophobicContact CH2-CG2 3.98Å; W2214-V2238 HydrophobicContact CZ3-CG2 4.27Å; R2235-V2238 WeakPolarHBondContact O-CG2 3.13Å; R2235-V2238 PolarHBondContact O-N 3.09Å; R2235-V2238 VanDerWaalsContact O-N 3.11Å; S2236-V2238 PolarHBondContact O-N 3.2Å
2239L86.2Confident86.4Confident7.2 Ų7.241.2 Ų41.24%0.03819%0.192CC..SBendtrans-106.1122.5178.1-63178.7000110.1Y2200 R2211 W2214 R2235 S2236 E2243 D2244Y2200-L2239 HydrophobicContact CE1-CD2 4.4Å; Y2200-L2239 HydrophobicContact CE2-CD2 4.22Å; Y2200-L2239 VanDerWaalsContact OH-CD2 3.24Å; Y2200-L2239 WeakPolarHBondContact OH-CD2 3.18Å; R2211-L2239 HydrophobicContact CG-CD1 4.38Å; R2211-L2239 HydrophobicContact CG-CD2 4.35Å; W2214-L2239 HydrophobicContact CE3-CD1 3.83Å; W2214-L2239 HydrophobicContact CZ3-CD1 3.72Å; W2214-L2239 HydrophobicContact CZ3-CD2 4.47Å; W2214-L2239 HydrophobicContact CZ3-CG 4.12Å; R2235-L2239 HydrophobicContact CB-CD1 4.46Å; R2235-L2239 PolarHBondContact O-N 2.94Å; S2236-L2239 WeakPolarHBondContact CA-O 3.35Å; L2239-E2243 HydrophobicContact CB-CB 4.45Å; L2239-E2243 HydrophobicContact CD2-CB 4.33Å; L2239-E2243 WeakPolarHBondContact CD2-OE2 3.39Å; L2239-D2244 HydrophobicContact CB-CB 4.22Å; L2239-D2244 HydrophobicContact CD1-CB 4.16Å
2240E82.4Confident86.3Confident108.6 Ų108.645.6 Ų45.651%0.50721%0.206SC..  trans-69.5153.4170-66.2-165.7-174.500110.5Y2242 E2243 D2244E2240-Y2242 HydrophobicContact CB-CD1 3.68Å; E2240-Y2242 HydrophobicContact CB-CE1 3.32Å; E2240-Y2242 HydrophobicContact CB-CE2 4.43Å; E2240-Y2242 HydrophobicContact CB-CG 4.44Å; E2240-Y2242 HydrophobicContact CG-CE1 3.97Å; E2240-Y2242 PolarHBondContact O-N 3.14Å; E2240-Y2242 VanDerWaalsContact O-N 3.07Å; E2240-Y2242 VanDerWaalsContact OE1-CE1 3.24Å; E2240-Y2242 WeakPolarHBondContact OE1-CE1 3.24Å; E2240-Y2242 VanDerWaalsContact OE1-CZ 3.3Å; E2240-Y2242 PolarHBondContact OE1-OH 3.16Å; E2240-Y2242 WeakPolarHBondContact OE2-CE1 3.39Å; E2240-Y2242 PolarHBondContact OE2-OH 3.09Å; E2240-E2243 HydrophobicContact CB-CG 4.43Å; E2240-E2243 WeakPolarHBondContact O-CB 3.45Å; E2240-E2243 PolarHBondContact O-N 3.02Å; E2240-D2244 PolarHBondContact O-N 3.1Å
2241P79.5Confident86.4Confident50.8 Ų50.843.8 Ų43.833%0.3320%0.198SC..THydrogen-bonded Turntrans-55.3-28.5-175.2-28.235.6000114.8R2245 L2271P2241-R2245 PolarHBondContact O-N 2.88Å; P2241-L2271 HydrophobicContact CB-CD2 3.84Å; P2241-L2271 VanDerWaalsContact O-CD2 3.28Å; P2241-L2271 WeakPolarHBondContact O-CD2 3.45Å
2242Y76.4Confident86.3Confident128.2 Ų128.243.9 Ų43.950%0.50320%0.199SC..THydrogen-bonded Turntrans-73.1-29.1176.466.4-100.1000113.2E2240 R2245E2240-Y2242 HydrophobicContact CB-CD1 3.68Å; E2240-Y2242 HydrophobicContact CB-CE1 3.32Å; E2240-Y2242 HydrophobicContact CB-CE2 4.43Å; E2240-Y2242 HydrophobicContact CB-CG 4.44Å; E2240-Y2242 HydrophobicContact CG-CE1 3.97Å; E2240-Y2242 PolarHBondContact O-N 3.14Å; E2240-Y2242 VanDerWaalsContact O-N 3.07Å; E2240-Y2242 VanDerWaalsContact OE1-CE1 3.24Å; E2240-Y2242 WeakPolarHBondContact OE1-CE1 3.24Å; E2240-Y2242 VanDerWaalsContact OE1-CZ 3.3Å; E2240-Y2242 PolarHBondContact OE1-OH 3.16Å; E2240-Y2242 WeakPolarHBondContact OE2-CE1 3.39Å; E2240-Y2242 PolarHBondContact OE2-OH 3.09Å; Y2242-R2245 WeakPolarHBondContact O-CB 3.31Å
2243E79.9Confident86.2Confident75.8 Ų75.844.7 Ų44.735%0.35421%0.207SC..THydrogen-bonded Turntrans-72.4-39.5179.3-61.6-163.213000111.5R2211 L2239 E2240 R2245R2211-E2243 IonicContact CZ-OE1 3.52Å; R2211-E2243 IonicContact NH1-OE1 3.87Å; R2211-E2243 PolarHBondContact NH1-OE1 3.45Å; R2211-E2243 IonicContact NH2-OE1 3.59Å; R2211-E2243 PolarHBondContact NH2-OE1 3.03Å; R2211-E2243 IonicContact NH2-OE2 3.23Å; R2211-E2243 PolarHBondContact NH2-OE2 3.05Å; L2239-E2243 HydrophobicContact CB-CB 4.45Å; L2239-E2243 HydrophobicContact CD2-CB 4.33Å; L2239-E2243 WeakPolarHBondContact CD2-OE2 3.39Å; E2240-E2243 HydrophobicContact CB-CG 4.43Å; E2240-E2243 WeakPolarHBondContact O-CB 3.45Å; E2240-E2243 PolarHBondContact O-N 3.02Å; E2243-R2245 VanDerWaalsContact C-N 3.31Å; E2243-R2245 PolarHBondContact O-N 3.04Å
2244D82.4Confident86.2Confident17.2 Ų17.244.8 Ų44.89%0.09221%0.208CC..THydrogen-bonded Turntrans-101.338.9176.7-161.39.2000113.3Q2215 R2235 L2239 E2240 R2246 S2247 W2248Q2215-D2244 PolarHBondContact NE2-OD1 2.89Å; Q2215-D2244 VanDerWaalsContact NE2-OD1 3.12Å; R2235-D2244 IonicContact NH1-OD2 3.54Å; L2239-D2244 HydrophobicContact CB-CB 4.22Å; L2239-D2244 HydrophobicContact CD1-CB 4.16Å; E2240-D2244 PolarHBondContact O-N 3.1Å; D2244-R2246 PolarHBondContact O-N 3.01Å; D2244-R2246 VanDerWaalsContact O-N 3.11Å; D2244-S2247 VanDerWaalsContact CG-CB 3.4Å; D2244-S2247 VanDerWaalsContact CG-OG 3.27Å; D2244-S2247 PolarHBondContact O-N 3.17Å; D2244-S2247 VanDerWaalsContact O-N 3.13Å; D2244-S2247 VanDerWaalsContact OD1-CB 3.25Å; D2244-S2247 WeakPolarHBondContact OD1-CB 3.41Å; D2244-S2247 PolarHBondContact OD1-N 3.28Å; D2244-S2247 PolarHBondContact OD1-OG 3.19Å; D2244-S2247 VanDerWaalsContact OD2-CB 3.22Å; D2244-S2247 WeakPolarHBondContact OD2-CB 3.32Å; D2244-S2247 PolarHBondContact OD2-OG 3Å; D2244-W2248 VanDerWaalsContact O-CD1 3.29Å; D2244-W2248 PolarHBondContact O-N 3.07Å; D2244-W2248 VanDerWaalsContact O-N 3.13Å
2245R82.9Confident86.1Confident82.8 Ų82.844.8 Ų44.831%0.31221%0.208SC..Hα-helixtrans-47.1-41.3179.2140.4-178.8140.3-155.9-2.5113.5P2241 Y2242 E2243 L2249 D2289P2241-R2245 PolarHBondContact O-N 2.88Å; Y2242-R2245 WeakPolarHBondContact O-CB 3.31Å; E2243-R2245 VanDerWaalsContact C-N 3.31Å; E2243-R2245 PolarHBondContact O-N 3.04Å; R2245-L2249 HydrophobicContact CG-CD1 3.8Å; R2245-L2249 HydrophobicContact CG-CG 4.38Å; R2245-L2249 VanDerWaalsContact O-CB 3.3Å; R2245-L2249 WeakPolarHBondContact O-CB 3.35Å; R2245-L2249 VanDerWaalsContact O-CG 3.26Å; R2245-L2249 WeakPolarHBondContact O-CG 3.37Å; R2245-L2249 PolarHBondContact O-N 3.16Å; R2245-D2289 WeakPolarHBondContact CD-OD2 3.29Å; R2245-D2289 IonicContact CZ-OD2 2.76Å; R2245-D2289 IonicContact NE-OD2 3.07Å; R2245-D2289 IonicContact NH1-OD1 3.3Å; R2245-D2289 IonicContact NH1-OD2 3.23Å; R2245-D2289 PolarHBondContact NH1-OD2 3.14Å
2246R84.6Confident85.9Confident137 Ų13747.4 Ų47.452%0.51722%0.218SC..Hα-helixtrans-68.4-40-175-73.3-179.3177.1166.50.4111.9D2244 R2250 E2372D2244-R2246 PolarHBondContact O-N 3.01Å; D2244-R2246 VanDerWaalsContact O-N 3.11Å; R2246-R2250 WeakPolarHBondContact O-CB 3.38Å; R2246-R2250 VanDerWaalsContact O-CG 3.29Å; R2246-R2250 WeakPolarHBondContact O-CG 3.39Å; R2246-R2250 PolarHBondContact O-N 3.1Å; R2246-E2372 IonicContact CZ-OE1 3.25Å; R2246-E2372 VanDerWaalsContact NH2-CD 3.27Å; R2246-E2372 IonicContact NH2-OE1 2.78Å; R2246-E2372 PolarHBondContact NH2-OE1 3.18Å; R2246-E2372 IonicContact NH2-OE2 3.28Å; R2246-E2372 PolarHBondContact NH2-OE2 2.79Å
2247S87.6Confident85.8Confident0.4 Ų0.454.1 Ų54.10%0.00324%0.237CC..Hα-helixtrans-72.4-45178.4-54.90000110.9Q2215 D2244 L2249 R2250 F2251Q2215-S2247 PolarHBondContact NE2-OG 3.15Å; Q2215-S2247 PolarHBondContact OE1-OG 2.87Å; D2244-S2247 VanDerWaalsContact CG-CB 3.4Å; D2244-S2247 VanDerWaalsContact CG-OG 3.27Å; D2244-S2247 PolarHBondContact O-N 3.17Å; D2244-S2247 VanDerWaalsContact O-N 3.13Å; D2244-S2247 VanDerWaalsContact OD1-CB 3.25Å; D2244-S2247 WeakPolarHBondContact OD1-CB 3.41Å; D2244-S2247 PolarHBondContact OD1-N 3.28Å; D2244-S2247 PolarHBondContact OD1-OG 3.19Å; D2244-S2247 VanDerWaalsContact OD2-CB 3.22Å; D2244-S2247 WeakPolarHBondContact OD2-CB 3.32Å; D2244-S2247 PolarHBondContact OD2-OG 3Å; S2247-L2249 PolarHBondContact O-N 3.11Å; S2247-R2250 WeakPolarHBondContact O-CB 3.21Å; S2247-R2250 PolarHBondContact O-N 3.12Å; S2247-R2250 VanDerWaalsContact O-N 3.12Å; S2247-F2251 WeakPolarHBondContact O-CB 3.33Å; S2247-F2251 PolarHBondContact O-N 3.27Å
2248W89.4Confident85.5Confident41.8 Ų41.855.6 Ų55.616%0.15825%0.249CC..Hα-helixtrans-62.1-41.2177-75111.5000113.2I2232 D2244 R2250 F2251 A2252 V2267 L2271I2232-W2248 HydrophobicContact CG2-CD2 3.66Å; I2232-W2248 HydrophobicContact CG2-CE3 3.89Å; I2232-W2248 HydrophobicContact CG2-CG 4.42Å; I2232-W2248 HydrophobicContact CG2-CH2 3.54Å; I2232-W2248 VanDerWaalsContact CG2-CH2 3.48Å; I2232-W2248 HydrophobicContact CG2-CZ2 3.27Å; I2232-W2248 VanDerWaalsContact CG2-CZ2 3.44Å; I2232-W2248 HydrophobicContact CG2-CZ3 3.83Å; D2244-W2248 VanDerWaalsContact O-CD1 3.29Å; D2244-W2248 PolarHBondContact O-N 3.07Å; D2244-W2248 VanDerWaalsContact O-N 3.13Å; W2248-R2250 VanDerWaalsContact C-N 3.32Å; W2248-R2250 PolarHBondContact O-N 3.28Å; W2248-F2251 AromaticContact CE3-CD1 3.97Å; W2248-F2251 HydrophobicContact CE3-CD1 4.02Å; W2248-F2251 HydrophobicContact CZ3-CD1 4.09Å; W2248-F2251 HydrophobicContact CZ3-CE1 4.31Å; W2248-F2251 PolarHBondContact O-N 3.19Å; W2248-A2252 WeakPolarHBondContact O-CB 3.41Å; W2248-A2252 PolarHBondContact O-N 3.11Å; W2248-V2267 HydrophobicContact CB-CG1 4.39Å; W2248-V2267 HydrophobicContact CD2-CG1 4.46Å; W2248-V2267 HydrophobicContact CE3-CG1 3.61Å; W2248-V2267 HydrophobicContact CE3-CG2 4.25Å; W2248-V2267 HydrophobicContact CZ3-CG1 4.26Å; W2248-V2267 HydrophobicContact CZ3-CG2 4.08Å; W2248-L2271 HydrophobicContact CB-CD1 3.84Å; W2248-L2271 HydrophobicContact CB-CD2 4.13Å; W2248-L2271 HydrophobicContact CB-CG 4.36Å; W2248-L2271 HydrophobicContact CG-CD2 4.37Å
2249L88.3Confident85.2Confident37.8 Ų37.855.1 Ų55.120%0.19825%0.25CC..Hα-helixtrans-65.7-34.5175.6-75.7174.9000113R2245 S2247 G2253 L2268 L2271 A2291 I2292R2245-L2249 HydrophobicContact CG-CD1 3.8Å; R2245-L2249 HydrophobicContact CG-CG 4.38Å; R2245-L2249 VanDerWaalsContact O-CB 3.3Å; R2245-L2249 WeakPolarHBondContact O-CB 3.35Å; R2245-L2249 VanDerWaalsContact O-CG 3.26Å; R2245-L2249 WeakPolarHBondContact O-CG 3.37Å; R2245-L2249 PolarHBondContact O-N 3.16Å; S2247-L2249 PolarHBondContact O-N 3.11Å; L2249-G2253 PolarHBondContact O-N 3.19Å; L2249-L2268 HydrophobicContact CD2-CD2 3.87Å; L2249-L2271 HydrophobicContact CD2-CD1 4.15Å; L2249-L2271 HydrophobicContact CG-CD1 4.32Å; L2249-A2291 HydrophobicContact CD1-CB 4.02Å; L2249-I2292 HydrophobicContact CD1-CG1 4.24Å; L2249-I2292 HydrophobicContact CD2-CB 4.33Å; L2249-I2292 HydrophobicContact CD2-CG1 4.08Å; L2249-I2292 HydrophobicContact CD2-CG2 4.39Å; L2249-I2292 HydrophobicContact CG-CG1 4.44Å
2250R87.9Confident85Confident109.2 Ų109.256.5 Ų56.541%0.41226%0.255SS..Hα-helixtrans-69.7-41.8173.6-76.6175.2173.3173.2-4.1111.3Q2215 L2219 W2228 R2246 S2247 W2248 G2253 L2254Q2215-R2250 VanDerWaalsContact NE2-NH1 3.15Å; L2219-R2250 VanDerWaalsContact CD1-NH1 3.34Å; L2219-R2250 VanDerWaalsContact CD2-NH1 3.31Å; L2219-R2250 VanDerWaalsContact CG-NH1 3.3Å; W2228-R2250 HydrophobicContact CH2-CB 4.44Å; W2228-R2250 HydrophobicContact CZ3-CB 4.04Å; R2246-R2250 WeakPolarHBondContact O-CB 3.38Å; R2246-R2250 VanDerWaalsContact O-CG 3.29Å; R2246-R2250 WeakPolarHBondContact O-CG 3.39Å; R2246-R2250 PolarHBondContact O-N 3.1Å; S2247-R2250 WeakPolarHBondContact O-CB 3.21Å; S2247-R2250 PolarHBondContact O-N 3.12Å; S2247-R2250 VanDerWaalsContact O-N 3.12Å; W2248-R2250 VanDerWaalsContact C-N 3.32Å; W2248-R2250 PolarHBondContact O-N 3.28Å; R2250-G2253 CarbonylContact O-C 3.52Å; R2250-G2253 WeakPolarHBondContact O-CA 3.31Å; R2250-G2253 PolarHBondContact O-N 3.25Å; R2250-G2253 VanDerWaalsContact O-N 3.16Å; R2250-L2254 PolarHBondContact O-N 3.11Å
2251F89.7Confident85.2Confident2.6 Ų2.654.6 Ų54.61%0.01125%0.245CC..Hα-helixtrans-61.8-48.5175.5-179.9-114.1000111.9I2225 W2228 I2232 S2247 W2248 G2253 L2254 C2255 L2263 V2267I2225-F2251 HydrophobicContact CG2-CE2 3.87Å; I2225-F2251 HydrophobicContact CG2-CZ 4.06Å; I2225-F2251 WeakPolarHBondContact O-CE2 3.36Å; W2228-F2251 HydrophobicContact CB-CD2 3.68Å; W2228-F2251 HydrophobicContact CB-CE2 3.84Å; W2228-F2251 HydrophobicContact CE3-CB 4.3Å; W2228-F2251 HydrophobicContact CE3-CD2 4.27Å; I2232-F2251 HydrophobicContact CD1-CB 3.64Å; I2232-F2251 HydrophobicContact CD1-CD1 4.4Å; I2232-F2251 HydrophobicContact CD1-CD2 4.1Å; I2232-F2251 HydrophobicContact CD1-CG 3.83Å; S2247-F2251 WeakPolarHBondContact O-CB 3.33Å; S2247-F2251 PolarHBondContact O-N 3.27Å; W2248-F2251 AromaticContact CE3-CD1 3.97Å; W2248-F2251 HydrophobicContact CE3-CD1 4.02Å; W2248-F2251 HydrophobicContact CZ3-CD1 4.09Å; W2248-F2251 HydrophobicContact CZ3-CE1 4.31Å; W2248-F2251 PolarHBondContact O-N 3.19Å; F2251-G2253 VanDerWaalsContact C-N 3.28Å; F2251-G2253 PolarHBondContact O-N 3.16Å; F2251-L2254 CarbonylContact O-C 3.58Å; F2251-L2254 WeakPolarHBondContact O-CA 3.3Å; F2251-L2254 VanDerWaalsContact O-CB 3.31Å; F2251-L2254 WeakPolarHBondContact O-CB 3.35Å; F2251-L2254 PolarHBondContact O-N 3.08Å; F2251-L2254 VanDerWaalsContact O-N 3.12Å; F2251-C2255 VanDerWaalsContact CZ-SG 3.58Å; F2251-C2255 PolarHBondContact O-N 3.37Å; F2251-C2255 PolarHBondContact O-SG 3.21Å; F2251-C2255 VanDerWaalsContact O-SG 3.32Å; F2251-L2263 HydrophobicContact CE1-CD2 4.25Å; F2251-L2263 HydrophobicContact CZ-CD2 4.04Å; F2251-V2267 HydrophobicContact CD1-CG1 4.45Å; F2251-V2267 HydrophobicContact CD1-CG2 3.99Å; F2251-V2267 HydrophobicContact CE1-CG2 3.91Å
2252A89.5Confident85.5Confident3.4 Ų3.456.7 Ų56.73%0.02825%0.252CS..Hα-helixtrans-56.6-42.8171.500000111.4W2248 L2254 C2255 R2256 S2264 V2267 L2268W2248-A2252 WeakPolarHBondContact O-CB 3.41Å; W2248-A2252 PolarHBondContact O-N 3.11Å; A2252-L2254 VanDerWaalsContact C-N 3.31Å; A2252-L2254 PolarHBondContact O-N 3.23Å; A2252-C2255 PolarHBondContact O-N 3.29Å; A2252-R2256 VanDerWaalsContact O-CB 3.28Å; A2252-R2256 WeakPolarHBondContact O-CB 3.32Å; A2252-R2256 PolarHBondContact O-N 3.1Å; A2252-S2264 PolarHBondContact O-OG 3.1Å; A2252-S2264 VanDerWaalsContact O-OG 3.1Å; A2252-V2267 HydrophobicContact CB-CB 4.39Å; A2252-V2267 HydrophobicContact CB-CG1 4Å; A2252-L2268 HydrophobicContact CB-CD1 4.39Å; A2252-L2268 HydrophobicContact CB-CD2 4.01Å; A2252-L2268 HydrophobicContact CB-CG 3.96Å
2253G88.9Confident85.9Confident17.2 Ų17.251.1 Ų51.118%0.17723%0.231CC..Hα-helixtrans-60.1-34173.800000114.4L2249 R2250 F2251 R2257L2249-G2253 PolarHBondContact O-N 3.19Å; R2250-G2253 CarbonylContact O-C 3.52Å; R2250-G2253 WeakPolarHBondContact O-CA 3.31Å; R2250-G2253 PolarHBondContact O-N 3.25Å; R2250-G2253 VanDerWaalsContact O-N 3.16Å; F2251-G2253 VanDerWaalsContact C-N 3.28Å; F2251-G2253 PolarHBondContact O-N 3.16Å; G2253-R2257 WeakPolarHBondContact O-CG 3.38Å; G2253-R2257 PolarHBondContact O-N 3.25Å; G2253-R2257 VanDerWaalsContact O-N 3.14Å; G2253-R2257 PolarHBondContact O-NE 2.87Å; G2253-R2257 VanDerWaalsContact O-NE 3.13Å
2254L87.7Confident86.3Confident16.8 Ų16.847.5 Ų47.59%0.08821%0.214CC..Hα-helixtrans-73.4-49.6175.5-18062.4000111.3I2225 W2228 R2250 F2251 A2252 R2256 R2257 S2258I2225-L2254 HydrophobicContact CD1-CG 4.33Å; I2225-L2254 HydrophobicContact CG1-CD2 4.03Å; I2225-L2254 HydrophobicContact CG1-CG 3.94Å; W2228-L2254 HydrophobicContact CB-CD2 4.32Å; W2228-L2254 HydrophobicContact CD2-CD2 4.12Å; W2228-L2254 HydrophobicContact CE3-CD2 4.41Å; W2228-L2254 HydrophobicContact CG-CD2 4.19Å; R2250-L2254 PolarHBondContact O-N 3.11Å; F2251-L2254 CarbonylContact O-C 3.58Å; F2251-L2254 WeakPolarHBondContact O-CA 3.3Å; F2251-L2254 VanDerWaalsContact O-CB 3.31Å; F2251-L2254 WeakPolarHBondContact O-CB 3.35Å; F2251-L2254 PolarHBondContact O-N 3.08Å; F2251-L2254 VanDerWaalsContact O-N 3.12Å; A2252-L2254 VanDerWaalsContact C-N 3.31Å; A2252-L2254 PolarHBondContact O-N 3.23Å; L2254-R2256 VanDerWaalsContact C-N 3.28Å; L2254-R2256 PolarHBondContact O-N 3.27Å; L2254-R2257 WeakPolarHBondContact O-CA 3.34Å; L2254-R2257 WeakPolarHBondContact O-CB 3.43Å; L2254-R2257 PolarHBondContact O-N 3.19Å; L2254-R2257 VanDerWaalsContact O-N 3.13Å; L2254-S2258 PolarHBondContact O-N 3.28Å; L2254-S2258 VanDerWaalsContact O-N 3.12Å; L2254-S2258 PolarHBondContact O-OG 3.2Å
2255C87.9Confident86.5Confident0 Ų051.2 Ų51.20%023%0.227CC..Hα-helixtrans-55.5-40.4175.5-63.90000111.8F2251 A2252 R2257 S2258 G2259 R2260F2251-C2255 VanDerWaalsContact CZ-SG 3.58Å; F2251-C2255 PolarHBondContact O-N 3.37Å; F2251-C2255 PolarHBondContact O-SG 3.21Å; F2251-C2255 VanDerWaalsContact O-SG 3.32Å; A2252-C2255 PolarHBondContact O-N 3.29Å; C2255-R2257 PolarHBondContact O-N 3.37Å; C2255-S2258 WeakPolarHBondContact CA-OG 3.4Å; C2255-S2258 PolarHBondContact O-N 3.21Å; C2255-S2258 PolarHBondContact O-OG 3.14Å; C2255-G2259 PolarHBondContact O-N 3.19Å; C2255-R2260 HydrophobicContact CB-CB 4.45Å; C2255-R2260 CarbonylContact O-C 3.55Å; C2255-R2260 WeakPolarHBondContact O-CA 3.43Å; C2255-R2260 WeakPolarHBondContact O-CB 3.37Å; C2255-R2260 PolarHBondContact O-N 3.22Å
2256R89.1Confident86.6Confident58.4 Ų58.450.6 Ų50.622%0.2223%0.228CC..Hα-helixtrans-64.9-41.7174.5-172.9-172.164.382.516.3113A2252 L2254 S2258 G2259 F2261 K2298 L2299 A2302A2252-R2256 VanDerWaalsContact O-CB 3.28Å; A2252-R2256 WeakPolarHBondContact O-CB 3.32Å; A2252-R2256 PolarHBondContact O-N 3.1Å; L2254-R2256 VanDerWaalsContact C-N 3.28Å; L2254-R2256 PolarHBondContact O-N 3.27Å; R2256-S2258 VanDerWaalsContact C-N 3.3Å; R2256-S2258 PolarHBondContact O-N 2.91Å; R2256-G2259 PolarHBondContact O-N 3.19Å; R2256-F2261 HydrophobicContact CG-CD1 4.46Å; R2256-F2261 HydrophobicContact CG-CE1 4.4Å; R2256-F2261 WeakPolarHBondContact O-CE1 3.48Å; R2256-K2298 VanDerWaalsContact CD-O 3.27Å; R2256-K2298 WeakPolarHBondContact CD-O 3.33Å; R2256-K2298 PolarHBondContact NH1-O 3.01Å; R2256-K2298 VanDerWaalsContact NH1-O 3.11Å; R2256-L2299 HydrophobicContact CB-CD1 4.41Å; R2256-L2299 HydrophobicContact CG-CD1 4.13Å; R2256-A2302 HydrophobicContact CG-CB 3.73Å
2257R85.3Confident86.7Confident185 Ų18544.6 Ų44.670%0.69821%0.206SC*.Hα-helixtrans-68.3-32.1179.3-77.6-178.5-104.7-158.3-0.9112.7G2253 L2254 C2255 G2259G2253-R2257 WeakPolarHBondContact O-CG 3.38Å; G2253-R2257 PolarHBondContact O-N 3.25Å; G2253-R2257 VanDerWaalsContact O-N 3.14Å; G2253-R2257 PolarHBondContact O-NE 2.87Å; G2253-R2257 VanDerWaalsContact O-NE 3.13Å; L2254-R2257 WeakPolarHBondContact O-CA 3.34Å; L2254-R2257 WeakPolarHBondContact O-CB 3.43Å; L2254-R2257 PolarHBondContact O-N 3.19Å; L2254-R2257 VanDerWaalsContact O-N 3.13Å; C2255-R2257 PolarHBondContact O-N 3.37Å; R2257-G2259 VanDerWaalsContact C-N 3.29Å; R2257-G2259 PolarHBondContact O-N 3.05Å
2258S81.7Confident86.7Confident58.8 Ų58.844.7 Ų44.741%0.41121%0.206SC..THydrogen-bonded Turntrans-81.70.1176.366.10000114.5I2225 L2254 C2255 R2256 R2260I2225-S2258 VanDerWaalsContact CD1-CB 3.45Å; I2225-S2258 WeakPolarHBondContact CD1-OG 3.31Å; L2254-S2258 PolarHBondContact O-N 3.28Å; L2254-S2258 VanDerWaalsContact O-N 3.12Å; L2254-S2258 PolarHBondContact O-OG 3.2Å; C2255-S2258 WeakPolarHBondContact CA-OG 3.4Å; C2255-S2258 PolarHBondContact O-N 3.21Å; C2255-S2258 PolarHBondContact O-OG 3.14Å; R2256-S2258 VanDerWaalsContact C-N 3.3Å; R2256-S2258 PolarHBondContact O-N 2.91Å; S2258-R2260 VanDerWaalsContact C-N 3.33Å; S2258-R2260 PolarHBondContact O-N 3.12Å; S2258-R2260 WeakPolarHBondContact OG-CG 3.38Å; S2258-R2260 PolarHBondContact OG-N 3.09Å
2259G81.4Confident86.5Confident17.8 Ų17.844.6 Ų44.618%0.18421%0.208CC..THydrogen-bonded Turntrans75.615.4-177.800000115.3K2049 C2255 R2256 R2257 F2261K2049-G2259 PolarHBondContact NZ-O 3.24Å; C2255-G2259 PolarHBondContact O-N 3.19Å; R2256-G2259 PolarHBondContact O-N 3.19Å; R2257-G2259 VanDerWaalsContact C-N 3.29Å; R2257-G2259 PolarHBondContact O-N 3.05Å; G2259-F2261 VanDerWaalsContact C-N 3.32Å; G2259-F2261 PolarHBondContact O-N 3.15Å
2260R83.4Confident86.3Confident37.2 Ų37.248.7 Ų48.714%0.1423%0.23CC..  trans-90.466.8171.9-61.5-170.6-167.3177.51.4110.4A2080 I2225 E2226 C2255 S2258 I2262 L2263 S2264A2080-R2260 PolarHBondContact O-NE 3.05Å; A2080-R2260 PolarHBondContact O-NH1 3.05Å; A2080-R2260 PolarHBondContact O-NH2 3.29Å; I2225-R2260 HydrophobicContact CD1-CG 4.24Å; I2225-R2260 VanDerWaalsContact CG2-NH1 3.35Å; E2226-R2260 IonicContact OE1-CZ 3.11Å; E2226-R2260 VanDerWaalsContact OE1-CZ 3.27Å; E2226-R2260 IonicContact OE1-NH1 3.41Å; E2226-R2260 PolarHBondContact OE1-NH1 3.12Å; E2226-R2260 IonicContact OE1-NH2 3.3Å; E2226-R2260 PolarHBondContact OE1-NH2 3.11Å; E2226-R2260 IonicContact OE2-CZ 3.45Å; E2226-R2260 IonicContact OE2-NH1 2.7Å; E2226-R2260 IonicContact OE2-NH2 2.68Å; E2226-R2260 PolarHBondContact OE2-NH2 3.41Å; C2255-R2260 HydrophobicContact CB-CB 4.45Å; C2255-R2260 CarbonylContact O-C 3.55Å; C2255-R2260 WeakPolarHBondContact O-CA 3.43Å; C2255-R2260 WeakPolarHBondContact O-CB 3.37Å; C2255-R2260 PolarHBondContact O-N 3.22Å; S2258-R2260 VanDerWaalsContact C-N 3.33Å; S2258-R2260 PolarHBondContact O-N 3.12Å; S2258-R2260 WeakPolarHBondContact OG-CG 3.38Å; S2258-R2260 PolarHBondContact OG-N 3.09Å; R2260-I2262 PolarHBondContact O-N 3.04Å; R2260-L2263 HydrophobicContact CB-CB 4.48Å; R2260-L2263 PolarHBondContact O-N 3.25Å; R2260-S2264 PolarHBondContact O-N 3.2Å
2261F86.3Confident86.1Confident68.4 Ų68.444.6 Ų44.630%0.322%0.216SC..Hα-helixtrans-65-37.2-173.2-53.5-54.8000114R2256 G2259 L2263 S2264 R2265 L2299 A2302 V2303R2256-F2261 HydrophobicContact CG-CD1 4.46Å; R2256-F2261 HydrophobicContact CG-CE1 4.4Å; R2256-F2261 WeakPolarHBondContact O-CE1 3.48Å; G2259-F2261 VanDerWaalsContact C-N 3.32Å; G2259-F2261 PolarHBondContact O-N 3.15Å; F2261-L2263 PolarHBondContact O-N 3.41Å; F2261-S2264 CarbonylContact O-C 3.55Å; F2261-S2264 WeakPolarHBondContact O-CB 3.49Å; F2261-S2264 PolarHBondContact O-N 3Å; F2261-R2265 WeakPolarHBondContact O-CB 3.32Å; F2261-R2265 PolarHBondContact O-N 3.13Å; F2261-L2299 HydrophobicContact CB-CD1 4.15Å; F2261-L2299 HydrophobicContact CD1-CD1 4.03Å; F2261-L2299 HydrophobicContact CG-CD1 4.47Å; F2261-A2302 HydrophobicContact CD1-CB 4.36Å; F2261-A2302 HydrophobicContact CE1-CB 3.82Å; F2261-A2302 WeakPolarHBondContact CZ-O 3.28Å; F2261-V2303 HydrophobicContact CB-CG2 3.94Å; F2261-V2303 HydrophobicContact CD1-CG2 4.28Å; F2261-V2303 HydrophobicContact CD2-CG2 4.36Å; F2261-V2303 HydrophobicContact CG-CG2 3.99Å
2262I84.8Confident85.8Confident94.2 Ų94.245.3 Ų45.348%0.48322%0.22SC..Hα-helixtrans-60.8-48.9-179.5-61.5167.5000110.5R2260 S2264 R2265 Q2266R2260-I2262 PolarHBondContact O-N 3.04Å; I2262-S2264 VanDerWaalsContact C-N 3.32Å; I2262-S2264 PolarHBondContact O-N 3.31Å; I2262-R2265 WeakPolarHBondContact O-CA 3.39Å; I2262-R2265 WeakPolarHBondContact O-CB 3.42Å; I2262-R2265 PolarHBondContact O-N 3.12Å; I2262-R2265 VanDerWaalsContact O-N 3.13Å; I2262-Q2266 WeakPolarHBondContact O-CG 3.38Å; I2262-Q2266 PolarHBondContact O-N 3.1Å
2263L85Confident85.2Confident10.4 Ų10.448.5 Ų48.55%0.05425%0.253CS..Hα-helixtrans-62.9-42.5177.6-172.877.5000111.3I2225 F2251 R2260 F2261 R2265 Q2266 V2267I2225-L2263 HydrophobicContact CG2-CD1 4.22Å; I2225-L2263 HydrophobicContact CG2-CD2 3.87Å; F2251-L2263 HydrophobicContact CE1-CD2 4.25Å; F2251-L2263 HydrophobicContact CZ-CD2 4.04Å; R2260-L2263 HydrophobicContact CB-CB 4.48Å; R2260-L2263 PolarHBondContact O-N 3.25Å; F2261-L2263 PolarHBondContact O-N 3.41Å; L2263-R2265 VanDerWaalsContact C-N 3.26Å; L2263-R2265 PolarHBondContact O-N 2.98Å; L2263-Q2266 PolarHBondContact O-N 3.12Å; L2263-V2267 HydrophobicContact CD1-CG2 4.48Å; L2263-V2267 HydrophobicContact CD2-CG2 3.72Å; L2263-V2267 VanDerWaalsContact O-CG2 3.31Å; L2263-V2267 WeakPolarHBondContact O-CG2 3.37Å; L2263-V2267 PolarHBondContact O-N 3.24Å; L2263-V2267 VanDerWaalsContact O-N 3.1Å
2264S88Confident84.7Confident1.4 Ų1.451.1 Ų51.11%0.0126%0.262CS..Hα-helixtrans-62.1-33.6174.7-176.30000112.7A2252 R2260 F2261 I2262 L2268A2252-S2264 PolarHBondContact O-OG 3.1Å; A2252-S2264 VanDerWaalsContact O-OG 3.1Å; R2260-S2264 PolarHBondContact O-N 3.2Å; F2261-S2264 CarbonylContact O-C 3.55Å; F2261-S2264 WeakPolarHBondContact O-CB 3.49Å; F2261-S2264 PolarHBondContact O-N 3Å; I2262-S2264 VanDerWaalsContact C-N 3.32Å; I2262-S2264 PolarHBondContact O-N 3.31Å; S2264-L2268 WeakPolarHBondContact O-CB 3.4Å; S2264-L2268 VanDerWaalsContact O-CD1 3.28Å; S2264-L2268 WeakPolarHBondContact O-CD1 3.41Å; S2264-L2268 VanDerWaalsContact O-CG 3.25Å; S2264-L2268 WeakPolarHBondContact O-CG 3.39Å; S2264-L2268 PolarHBondContact O-N 3.12Å; S2264-L2268 VanDerWaalsContact O-N 3.16Å
2265R87.5Confident84Confident95.2 Ų95.254.5 Ų54.536%0.35928%0.28SS..Hα-helixtrans-68-52.4177.6-171.2175.1165.2153.12.6110.1F2261 I2262 L2263 V2267 L2268 E2269 D2275 L2299F2261-R2265 WeakPolarHBondContact O-CB 3.32Å; F2261-R2265 PolarHBondContact O-N 3.13Å; I2262-R2265 WeakPolarHBondContact O-CA 3.39Å; I2262-R2265 WeakPolarHBondContact O-CB 3.42Å; I2262-R2265 PolarHBondContact O-N 3.12Å; I2262-R2265 VanDerWaalsContact O-N 3.13Å; L2263-R2265 VanDerWaalsContact C-N 3.26Å; L2263-R2265 PolarHBondContact O-N 2.98Å; R2265-V2267 VanDerWaalsContact C-N 3.33Å; R2265-V2267 PolarHBondContact O-N 3.2Å; R2265-L2268 CarbonylContact O-C 3.56Å; R2265-L2268 WeakPolarHBondContact O-CA 3.31Å; R2265-L2268 PolarHBondContact O-N 3.28Å; R2265-L2268 VanDerWaalsContact O-N 3.09Å; R2265-E2269 VanDerWaalsContact C-OE2 3.27Å; R2265-E2269 HydrophobicContact CG-CG 4.29Å; R2265-E2269 VanDerWaalsContact CG-OE1 3.31Å; R2265-E2269 WeakPolarHBondContact CG-OE1 3.36Å; R2265-E2269 IonicContact CZ-OE1 3.36Å; R2265-E2269 IonicContact NE-OE1 3.29Å; R2265-E2269 PolarHBondContact NE-OE1 3.26Å; R2265-E2269 IonicContact NE-OE2 2.8Å; R2265-E2269 IonicContact NH2-OE1 3.01Å; R2265-E2269 PolarHBondContact NH2-OE1 3.18Å; R2265-E2269 WeakPolarHBondContact O-CB 3.44Å; R2265-E2269 WeakPolarHBondContact O-CG 3.43Å; R2265-E2269 PolarHBondContact O-N 3.25Å; R2265-D2275 IonicContact CZ-OD1 2.91Å; R2265-D2275 IonicContact NH2-OD1 3.04Å; R2265-D2275 PolarHBondContact NH2-OD1 2.98Å; R2265-D2275 IonicContact NH2-OD2 3.19Å; R2265-D2275 PolarHBondContact NH2-OD2 3.22Å; R2265-D2275 VanDerWaalsContact NH2-OD2 3.13Å; R2265-L2299 VanDerWaalsContact CA-CD2 3.44Å; R2265-L2299 HydrophobicContact CB-CD2 3.74Å; R2265-L2299 HydrophobicContact CG-CD2 4.24Å
2266Q85.4Confident83.3Confident70.4 Ų70.454.5 Ų54.533%0.32928%0.281SS..Hα-helixtrans-56.2-44.6178.6-70.9172.9-1900112.4I2262 L2263 L2268 E2269 N2270I2262-Q2266 WeakPolarHBondContact O-CG 3.38Å; I2262-Q2266 PolarHBondContact O-N 3.1Å; L2263-Q2266 PolarHBondContact O-N 3.12Å; Q2266-L2268 VanDerWaalsContact C-N 3.32Å; Q2266-L2268 PolarHBondContact O-N 3.21Å; Q2266-E2269 WeakPolarHBondContact CA-OE2 3.45Å; Q2266-E2269 PolarHBondContact N-OE2 2.66Å; Q2266-E2269 PolarHBondContact O-N 3.16Å; Q2266-N2270 VanDerWaalsContact O-CB 3.3Å; Q2266-N2270 WeakPolarHBondContact O-CB 3.44Å; Q2266-N2270 PolarHBondContact O-N 3.34Å; Q2266-N2270 PolarHBondContact O-ND2 3.46Å; Q2266-N2270 PolarHBondContact O-OD1 3.25Å
2267V86.2Confident82.5Confident9.6 Ų9.654.5 Ų54.56%0.05829%0.293CS..Hα-helixtrans-62.2-40.8177171.50000111.6W2248 F2251 A2252 L2263 R2265 N2270 L2271W2248-V2267 HydrophobicContact CB-CG1 4.39Å; W2248-V2267 HydrophobicContact CD2-CG1 4.46Å; W2248-V2267 HydrophobicContact CE3-CG1 3.61Å; W2248-V2267 HydrophobicContact CE3-CG2 4.25Å; W2248-V2267 HydrophobicContact CZ3-CG1 4.26Å; W2248-V2267 HydrophobicContact CZ3-CG2 4.08Å; F2251-V2267 HydrophobicContact CD1-CG1 4.45Å; F2251-V2267 HydrophobicContact CD1-CG2 3.99Å; F2251-V2267 HydrophobicContact CE1-CG2 3.91Å; A2252-V2267 HydrophobicContact CB-CB 4.39Å; A2252-V2267 HydrophobicContact CB-CG1 4Å; L2263-V2267 HydrophobicContact CD1-CG2 4.48Å; L2263-V2267 HydrophobicContact CD2-CG2 3.72Å; L2263-V2267 VanDerWaalsContact O-CG2 3.31Å; L2263-V2267 WeakPolarHBondContact O-CG2 3.37Å; L2263-V2267 PolarHBondContact O-N 3.24Å; L2263-V2267 VanDerWaalsContact O-N 3.1Å; R2265-V2267 VanDerWaalsContact C-N 3.33Å; R2265-V2267 PolarHBondContact O-N 3.2Å; V2267-N2270 PolarHBondContact O-N 3.22Å; V2267-L2271 HydrophobicContact CG1-CD1 4.39Å; V2267-L2271 WeakPolarHBondContact O-CB 3.19Å; V2267-L2271 VanDerWaalsContact O-CG 3.28Å; V2267-L2271 WeakPolarHBondContact O-CG 3.29Å; V2267-L2271 PolarHBondContact O-N 3.12Å; V2267-L2271 VanDerWaalsContact O-N 3.09Å
2268L86.8Confident81.9Confident2.2 Ų2.249.1 Ų49.11%0.01230%0.295CS..Hα-helixtrans-74.6-36.3-179.9-69.5169.8000112.3L2249 A2252 S2264 R2265 Q2266 L2271 L2272 I2292 L2299L2249-L2268 HydrophobicContact CD2-CD2 3.87Å; A2252-L2268 HydrophobicContact CB-CD1 4.39Å; A2252-L2268 HydrophobicContact CB-CD2 4.01Å; A2252-L2268 HydrophobicContact CB-CG 3.96Å; S2264-L2268 WeakPolarHBondContact O-CB 3.4Å; S2264-L2268 VanDerWaalsContact O-CD1 3.28Å; S2264-L2268 WeakPolarHBondContact O-CD1 3.41Å; S2264-L2268 VanDerWaalsContact O-CG 3.25Å; S2264-L2268 WeakPolarHBondContact O-CG 3.39Å; S2264-L2268 PolarHBondContact O-N 3.12Å; S2264-L2268 VanDerWaalsContact O-N 3.16Å; R2265-L2268 CarbonylContact O-C 3.56Å; R2265-L2268 WeakPolarHBondContact O-CA 3.31Å; R2265-L2268 PolarHBondContact O-N 3.28Å; R2265-L2268 VanDerWaalsContact O-N 3.09Å; Q2266-L2268 VanDerWaalsContact C-N 3.32Å; Q2266-L2268 PolarHBondContact O-N 3.21Å; L2268-L2271 HydrophobicContact CD2-CD1 4.42Å; L2268-L2271 PolarHBondContact O-N 3.12Å; L2268-L2272 WeakPolarHBondContact O-CB 3.37Å; L2268-L2272 VanDerWaalsContact O-CG 3.27Å; L2268-L2272 WeakPolarHBondContact O-CG 3.37Å; L2268-L2272 PolarHBondContact O-N 3.01Å; L2268-I2292 HydrophobicContact CD2-CG2 4.12Å; L2268-L2299 HydrophobicContact CD1-CB 4.19Å; L2268-L2299 HydrophobicContact CD1-CD2 4.02Å
2269E85.4Confident81.5Confident40.4 Ų40.448 Ų4819%0.18928%0.284CS..Hα-helixtrans-63.6-44.9172.9-73.5168.9162.900111R2265 Q2266 L2271 L2272 G2273R2265-E2269 VanDerWaalsContact C-OE2 3.27Å; R2265-E2269 HydrophobicContact CG-CG 4.29Å; R2265-E2269 VanDerWaalsContact CG-OE1 3.31Å; R2265-E2269 WeakPolarHBondContact CG-OE1 3.36Å; R2265-E2269 IonicContact CZ-OE1 3.36Å; R2265-E2269 IonicContact NE-OE1 3.29Å; R2265-E2269 PolarHBondContact NE-OE1 3.26Å; R2265-E2269 IonicContact NE-OE2 2.8Å; R2265-E2269 IonicContact NH2-OE1 3.01Å; R2265-E2269 PolarHBondContact NH2-OE1 3.18Å; R2265-E2269 WeakPolarHBondContact O-CB 3.44Å; R2265-E2269 WeakPolarHBondContact O-CG 3.43Å; R2265-E2269 PolarHBondContact O-N 3.25Å; Q2266-E2269 WeakPolarHBondContact CA-OE2 3.45Å; Q2266-E2269 PolarHBondContact N-OE2 2.66Å; Q2266-E2269 PolarHBondContact O-N 3.16Å; E2269-L2271 VanDerWaalsContact C-N 3.26Å; E2269-L2271 PolarHBondContact O-N 3.22Å; E2269-L2272 PolarHBondContact O-N 2.9Å; E2269-L2272 VanDerWaalsContact O-N 3.14Å; E2269-G2273 PolarHBondContact O-N 2.95Å
2270N84Confident81.2Confident123.6 Ų123.650.4 Ų50.466%0.66130%0.297SS*.Hα-helixtrans-60.7-34.5174.7-70.9-5.3000112.3Q2266 V2267Q2266-N2270 VanDerWaalsContact O-CB 3.3Å; Q2266-N2270 WeakPolarHBondContact O-CB 3.44Å; Q2266-N2270 PolarHBondContact O-N 3.34Å; Q2266-N2270 PolarHBondContact O-ND2 3.46Å; Q2266-N2270 PolarHBondContact O-OD1 3.25Å; V2267-N2270 PolarHBondContact O-N 3.22Å
2271L84.1Confident80.6Confident23.6 Ų23.651.4 Ų51.412%0.12431%0.307CS..Hα-helixtrans-76.7-28.2175.6-76176.6000113.6P2241 W2248 L2249 V2267 L2268 E2269 I2292P2241-L2271 HydrophobicContact CB-CD2 3.84Å; P2241-L2271 VanDerWaalsContact O-CD2 3.28Å; P2241-L2271 WeakPolarHBondContact O-CD2 3.45Å; W2248-L2271 HydrophobicContact CB-CD1 3.84Å; W2248-L2271 HydrophobicContact CB-CD2 4.13Å; W2248-L2271 HydrophobicContact CB-CG 4.36Å; W2248-L2271 HydrophobicContact CG-CD2 4.37Å; L2249-L2271 HydrophobicContact CD2-CD1 4.15Å; L2249-L2271 HydrophobicContact CG-CD1 4.32Å; V2267-L2271 HydrophobicContact CG1-CD1 4.39Å; V2267-L2271 WeakPolarHBondContact O-CB 3.19Å; V2267-L2271 VanDerWaalsContact O-CG 3.28Å; V2267-L2271 WeakPolarHBondContact O-CG 3.29Å; V2267-L2271 PolarHBondContact O-N 3.12Å; V2267-L2271 VanDerWaalsContact O-N 3.09Å; L2268-L2271 HydrophobicContact CD2-CD1 4.42Å; L2268-L2271 PolarHBondContact O-N 3.12Å; E2269-L2271 VanDerWaalsContact C-N 3.26Å; E2269-L2271 PolarHBondContact O-N 3.22Å; L2271-I2292 HydrophobicContact CB-CD1 4.1Å; L2271-I2292 HydrophobicContact CB-CG1 4.19Å; L2271-I2292 HydrophobicContact CB-CG2 4.01Å; L2271-I2292 HydrophobicContact CD1-CG1 4.42Å; L2271-I2292 HydrophobicContact CD1-CG2 4.47Å; L2271-I2292 WeakPolarHBondContact O-CD1 3.47Å
2272L82.4Confident79.8Confident17.8 Ų17.852.2 Ų52.29%0.09332%0.321CS..Hα-helixtrans-83.8-25.6177-72.4169.3000112.3L2268 E2269 L2274 P2276 S2288 I2292 V2293 Y2296L2268-L2272 WeakPolarHBondContact O-CB 3.37Å; L2268-L2272 VanDerWaalsContact O-CG 3.27Å; L2268-L2272 WeakPolarHBondContact O-CG 3.37Å; L2268-L2272 PolarHBondContact O-N 3.01Å; E2269-L2272 PolarHBondContact O-N 2.9Å; E2269-L2272 VanDerWaalsContact O-N 3.14Å; L2272-L2274 HydrophobicContact CB-CD1 4.44Å; L2272-L2274 HydrophobicContact CB-CG 4.34Å; L2272-L2274 PolarHBondContact O-N 3.04Å; L2272-L2274 VanDerWaalsContact O-N 3.17Å; L2272-P2276 HydrophobicContact CD1-CB 4.43Å; L2272-P2276 HydrophobicContact CD1-CG 4.2Å; L2272-S2288 WeakPolarHBondContact CD2-OG 3.44Å; L2272-I2292 HydrophobicContact CD1-CG2 4.39Å; L2272-I2292 HydrophobicContact CD2-CB 4.15Å; L2272-I2292 HydrophobicContact CD2-CG2 3.64Å; L2272-I2292 HydrophobicContact CG-CG2 3.69Å; L2272-V2293 HydrophobicContact CD2-CG2 4.3Å; L2272-Y2296 HydrophobicContact CD1-CG 4.48Å
2273G77.4Confident79.3Confident69.6 Ų69.651.6 Ų51.672%0.71832%0.319SS*.THydrogen-bonded Turntrans72.43.8-175.400000114.5E2269E2269-G2273 PolarHBondContact O-N 2.95Å
2274L77.9Confident78.8Confident72.2 Ų72.253.9 Ų53.938%0.37834%0.335SS..SBendtrans-146.6151.8-176.816.3123.2000110.1L2272 P2276 I2279 I2285 P2286L2272-L2274 HydrophobicContact CB-CD1 4.44Å; L2272-L2274 HydrophobicContact CB-CG 4.34Å; L2272-L2274 PolarHBondContact O-N 3.04Å; L2272-L2274 VanDerWaalsContact O-N 3.17Å; L2274-P2276 HydrophobicContact CD1-CB 4.23Å; L2274-P2276 VanDerWaalsContact O-CD 3.29Å; L2274-P2276 WeakPolarHBondContact O-CD 3.32Å; L2274-I2279 HydrophobicContact CD1-CD1 3.92Å; L2274-I2285 HydrophobicContact CD1-CG2 3.97Å; L2274-I2285 HydrophobicContact CD2-CG2 4.47Å; L2274-P2286 WeakPolarHBondContact CD2-O 3.48Å
2275D74.8Confident78.2Confident87.4 Ų87.454.6 Ų54.647%0.46734%0.338SS..  trans-81.6109.8170.5-175.3-0.7000109.6R2265 A2277 G2278R2265-D2275 IonicContact CZ-OD1 2.91Å; R2265-D2275 IonicContact NH2-OD1 3.04Å; R2265-D2275 PolarHBondContact NH2-OD1 2.98Å; R2265-D2275 IonicContact NH2-OD2 3.19Å; R2265-D2275 PolarHBondContact NH2-OD2 3.22Å; R2265-D2275 VanDerWaalsContact NH2-OD2 3.13Å; D2275-A2277 PolarHBondContact O-N 3.16Å; D2275-A2277 VanDerWaalsContact O-N 3.16Å; D2275-A2277 VanDerWaalsContact OD1-CB 3.28Å; D2275-A2277 WeakPolarHBondContact OD1-CB 3.42Å; D2275-A2277 PolarHBondContact OD1-N 3.19Å; D2275-G2278 PolarHBondContact O-N 3.17Å
2276P72.6Confident77.2Confident0.6 Ų0.653.9 Ų53.90%0.00435%0.345CS..G310 helixtrans-67.4-13.3-179.329.1-36.5000113.6L2272 L2274 G2278 I2279 I2285 Y2296 R2312L2272-P2276 HydrophobicContact CD1-CB 4.43Å; L2272-P2276 HydrophobicContact CD1-CG 4.2Å; L2274-P2276 HydrophobicContact CD1-CB 4.23Å; L2274-P2276 VanDerWaalsContact O-CD 3.29Å; L2274-P2276 WeakPolarHBondContact O-CD 3.32Å; P2276-G2278 PolarHBondContact O-N 3.14Å; P2276-I2279 PolarHBondContact O-N 3.11Å; P2276-I2285 HydrophobicContact CB-CD1 4.04Å; P2276-Y2296 HydrophobicContact CB-CD1 4.33Å; P2276-Y2296 HydrophobicContact CB-CE1 3.78Å; P2276-Y2296 HydrophobicContact CB-CE2 4.32Å; P2276-Y2296 HydrophobicContact CG-CD1 4.19Å; P2276-Y2296 HydrophobicContact CG-CD2 4.03Å; P2276-Y2296 HydrophobicContact CG-CE1 3.64Å; P2276-Y2296 HydrophobicContact CG-CE2 3.46Å; P2276-Y2296 VanDerWaalsContact CG-CE2 3.41Å; P2276-Y2296 HydrophobicContact CG-CG 4.33Å; P2276-Y2296 VanDerWaalsContact CG-OH 3.3Å; P2276-Y2296 WeakPolarHBondContact CG-OH 3.39Å; P2276-R2312 PolarHBondContact O-NH2 2.94Å
2277A72.6Confident76.1Confident57.8 Ų57.856 Ų5648%0.47837%0.368SS..G310 helixtrans-66.7-22.317800000113.3D2275 I2279D2275-A2277 PolarHBondContact O-N 3.16Å; D2275-A2277 VanDerWaalsContact O-N 3.16Å; D2275-A2277 VanDerWaalsContact OD1-CB 3.28Å; D2275-A2277 WeakPolarHBondContact OD1-CB 3.42Å; D2275-A2277 PolarHBondContact OD1-N 3.19Å; A2277-I2279 VanDerWaalsContact C-N 3.32Å; A2277-I2279 PolarHBondContact O-N 3.16Å
2278G71.3Confident75.1Confident71.6 Ų71.657.2 Ų57.274%0.73838%0.377SS*.G310 helixtrans-78.6-11.6176.900000114.8D2275 P2276D2275-G2278 PolarHBondContact O-N 3.17Å; P2276-G2278 PolarHBondContact O-N 3.14Å
2279I74.8Confident74.7Confident36.4 Ų36.459.3 Ų59.319%0.18739%0.388CS..SBendtrans-96.2135.6-176-55.9171.5000108.6L2274 P2276 A2277 D2283 I2285 R2312L2274-I2279 HydrophobicContact CD1-CD1 3.92Å; P2276-I2279 PolarHBondContact O-N 3.11Å; A2277-I2279 VanDerWaalsContact C-N 3.32Å; A2277-I2279 PolarHBondContact O-N 3.16Å; I2279-D2283 HydrophobicContact CG2-CB 4.02Å; I2279-I2285 HydrophobicContact CD1-CB 4.43Å; I2279-I2285 HydrophobicContact CD1-CG1 4.3Å; I2279-I2285 HydrophobicContact CD1-CG2 4.07Å; I2279-R2312 PolarHBondContact O-NH1 3.37Å; I2279-R2312 PolarHBondContact O-NH2 3.07Å
2280P74.4Confident74.6Confident68.8 Ų68.858.1 Ų58.145%0.44738%0.383SS..  trans-57.6146.7173.9-14.722.3000112.2C2282 D2283 R2312P2280-C2282 PolarHBondContact O-N 2.98Å; P2280-C2282 VanDerWaalsContact O-N 3.15Å; P2280-D2283 WeakPolarHBondContact CB-OD2 3.44Å; P2280-D2283 WeakPolarHBondContact CD-OD2 3.38Å; P2280-D2283 HydrophobicContact CG-CB 4.12Å; P2280-D2283 VanDerWaalsContact CG-OD2 3.24Å; P2280-D2283 WeakPolarHBondContact CG-OD2 3.37Å; P2280-D2283 PolarHBondContact O-N 3.33Å; P2280-D2283 VanDerWaalsContact O-N 3.13Å; P2280-R2312 VanDerWaalsContact O-CZ 3.3Å; P2280-R2312 PolarHBondContact O-NH1 3.21Å; P2280-R2312 PolarHBondContact O-NH2 3.28Å
2281P70.5Confident74.6Confident56.8 Ų56.853.4 Ų53.437%0.36936%0.362SS..THydrogen-bonded Turntrans-63.2-23.3-174.123.9-33.8000114.4E2308 R2312P2281-E2308 HydrophobicContact CB-CG 4.15Å; P2281-R2312 WeakPolarHBondContact O-CD 3.38Å; P2281-R2312 PolarHBondContact O-NE 2.94Å; P2281-R2312 VanDerWaalsContact O-NE 3.11Å
2282C70.1Confident74.7Confident86.2 Ų86.252.8 Ų52.858%0.58236%0.359SS*.THydrogen-bonded Turntrans-85.1-13.9-179.3-59.30000113.9P2280 V2315P2280-C2282 PolarHBondContact O-N 2.98Å; P2280-C2282 VanDerWaalsContact O-N 3.15Å; C2282-V2315 WeakPolarHBondContact O-CG2 3.42Å
2283D74.7Confident74.9Confident81.2 Ų81.252.4 Ų52.443%0.43436%0.358SS..SBendtrans-94142.1-176.1-67-26.1000111.4I2279 P2280 I2285 R2312I2279-D2283 HydrophobicContact CG2-CB 4.02Å; P2280-D2283 WeakPolarHBondContact CB-OD2 3.44Å; P2280-D2283 WeakPolarHBondContact CD-OD2 3.38Å; P2280-D2283 HydrophobicContact CG-CB 4.12Å; P2280-D2283 VanDerWaalsContact CG-OD2 3.24Å; P2280-D2283 WeakPolarHBondContact CG-OD2 3.37Å; P2280-D2283 PolarHBondContact O-N 3.33Å; P2280-D2283 VanDerWaalsContact O-N 3.13Å; D2283-I2285 PolarHBondContact O-N 3.21Å; D2283-R2312 PolarHBondContact O-NH1 3.26Å
2284P73.6Confident75.4Confident60 Ų6049.7 Ų49.739%0.3933%0.326SS..PPolyproline II helixtrans-67.6135175.528.5-33.2000110P2286 V2315 H2319 V2320P2284-P2286 VanDerWaalsContact O-CD 3.26Å; P2284-P2286 WeakPolarHBondContact O-CD 3.34Å; P2284-V2315 HydrophobicContact CB-CG1 4.07Å; P2284-H2319 HydrophobicContact CB-CB 4.45Å; P2284-V2320 HydrophobicContact CB-CG2 4.23Å
2285I74.9Confident75.8Confident16 Ų1646.8 Ų46.88%0.08231%0.314CS..PPolyproline II helixtrans-67118.2174.4-58.1176.3000107.8L2274 P2276 I2279 D2283 S2287 S2288 V2293 Y2296L2274-I2285 HydrophobicContact CD1-CG2 3.97Å; L2274-I2285 HydrophobicContact CD2-CG2 4.47Å; P2276-I2285 HydrophobicContact CB-CD1 4.04Å; I2279-I2285 HydrophobicContact CD1-CB 4.43Å; I2279-I2285 HydrophobicContact CD1-CG1 4.3Å; I2279-I2285 HydrophobicContact CD1-CG2 4.07Å; D2283-I2285 PolarHBondContact O-N 3.21Å; I2285-S2287 PolarHBondContact O-N 2.94Å; I2285-S2288 WeakPolarHBondContact CG2-OG 3.45Å; I2285-V2293 HydrophobicContact CB-CG2 4.38Å; I2285-V2293 HydrophobicContact CD1-CG1 4.07Å; I2285-V2293 HydrophobicContact CD1-CG2 4.29Å; I2285-V2293 HydrophobicContact CG2-CG2 4.5Å; I2285-Y2296 HydrophobicContact CD1-CD1 4.12Å; I2285-Y2296 HydrophobicContact CD1-CE1 4.39Å
2286P67.2Low76.5Confident79.6 Ų79.643 Ų4352%0.51729%0.292SS..THydrogen-bonded Turntrans-63.2136.1-176.2-13.121.6000111.8L2274 P2284 S2288L2274-P2286 WeakPolarHBondContact CD2-O 3.48Å; P2284-P2286 VanDerWaalsContact O-CD 3.26Å; P2284-P2286 WeakPolarHBondContact O-CD 3.34Å; P2286-S2288 PolarHBondContact O-N 3.13Å; P2286-S2288 PolarHBondContact O-OG 3.19Å; P2286-S2288 VanDerWaalsContact O-OG 3.07Å
2287S61.4Low77.2Confident115.6 Ų115.642.9 Ų42.981%0.80829%0.292SS*.THydrogen-bonded Turntrans54.435.9168.819.80000115.5I2285 D2289 V2293I2285-S2287 PolarHBondContact O-N 2.94Å; S2287-D2289 PolarHBondContact O-N 3.5Å; S2287-D2289 PolarHBondContact OG-O 3Å; S2287-V2293 WeakPolarHBondContact OG-CG2 3.44Å
2288S66.2Low78.1Confident34 Ų3442.7 Ų42.724%0.23828%0.28CS..  trans-98134-176.2-49.80000112.4L2272 I2285 P2286 P2290L2272-S2288 WeakPolarHBondContact CD2-OG 3.44Å; I2285-S2288 WeakPolarHBondContact CG2-OG 3.45Å; P2286-S2288 PolarHBondContact O-N 3.13Å; P2286-S2288 PolarHBondContact O-OG 3.19Å; P2286-S2288 VanDerWaalsContact O-OG 3.07Å; S2288-P2290 WeakPolarHBondContact O-CD 3.2Å
2289D77.4Confident78.9Confident46 Ų4639.5 Ų39.525%0.24625%0.246CC..  trans-72123.9176.3-179.3-15.3000110.8R2245 S2287 A2291 I2292 V2293R2245-D2289 WeakPolarHBondContact CD-OD2 3.29Å; R2245-D2289 IonicContact CZ-OD2 2.76Å; R2245-D2289 IonicContact NE-OD2 3.07Å; R2245-D2289 IonicContact NH1-OD1 3.3Å; R2245-D2289 IonicContact NH1-OD2 3.23Å; R2245-D2289 PolarHBondContact NH1-OD2 3.14Å; S2287-D2289 PolarHBondContact O-N 3.5Å; S2287-D2289 PolarHBondContact OG-O 3Å; D2289-A2291 PolarHBondContact O-N 3.18Å; D2289-A2291 VanDerWaalsContact O-N 3.07Å; D2289-A2291 VanDerWaalsContact OD1-CB 3.3Å; D2289-A2291 WeakPolarHBondContact OD1-CB 3.35Å; D2289-A2291 PolarHBondContact OD1-N 3.01Å; D2289-I2292 HydrophobicContact CB-CB 4.45Å; D2289-I2292 HydrophobicContact CB-CD1 3.75Å; D2289-I2292 HydrophobicContact CB-CG1 3.97Å; D2289-I2292 PolarHBondContact O-N 3Å; D2289-V2293 PolarHBondContact O-N 3.05Å; D2289-V2293 VanDerWaalsContact O-N 3.14Å
2290P83.3Confident79.6Confident14.4 Ų14.438.5 Ų38.59%0.09424%0.241CC..Hα-helixtrans-52.5-28.9177.9-27.634.9000114.6S2288 I2292 V2293 F2294 L2316 V2320 L2321 L2324 L2373 L2376S2288-P2290 WeakPolarHBondContact O-CD 3.2Å; P2290-I2292 VanDerWaalsContact C-N 3.35Å; P2290-I2292 PolarHBondContact O-N 3.26Å; P2290-V2293 PolarHBondContact O-N 2.86Å; P2290-F2294 VanDerWaalsContact O-CB 3.3Å; P2290-F2294 WeakPolarHBondContact O-CB 3.31Å; P2290-F2294 PolarHBondContact O-N 3.17Å; P2290-L2316 HydrophobicContact CB-CD1 4.1Å; P2290-V2320 HydrophobicContact CB-CG1 4.46Å; P2290-V2320 HydrophobicContact CG-CG1 3.87Å; P2290-L2321 HydrophobicContact CB-CD2 3.71Å; P2290-L2321 HydrophobicContact CB-CG 4.35Å; P2290-L2321 HydrophobicContact CG-CD2 4.18Å; P2290-L2324 HydrophobicContact CG-CD1 4.17Å; P2290-L2373 HydrophobicContact CG-CD2 4.41Å; P2290-L2376 HydrophobicContact CB-CD2 3.71Å
2291A85.2Confident80.3Confident26.6 Ų26.636.7 Ų36.722%0.2223%0.226CC..Hα-helixtrans-68.5-33.5179.500000112.9L2249 D2289 G2295 L2376L2249-A2291 HydrophobicContact CD1-CB 4.02Å; D2289-A2291 PolarHBondContact O-N 3.18Å; D2289-A2291 VanDerWaalsContact O-N 3.07Å; D2289-A2291 VanDerWaalsContact OD1-CB 3.3Å; D2289-A2291 WeakPolarHBondContact OD1-CB 3.35Å; D2289-A2291 PolarHBondContact OD1-N 3.01Å; A2291-G2295 PolarHBondContact O-N 3.25Å; A2291-L2376 HydrophobicContact CB-CD2 4.15Å
2292I85.6Confident81.2Confident10.6 Ų10.635.6 Ų35.65%0.05422%0.221CC..Hα-helixtrans-74.9-43.5178-54.8167.5000109.9L2249 L2268 L2271 L2272 D2289 P2290 F2294 G2295 Y2296L2249-I2292 HydrophobicContact CD1-CG1 4.24Å; L2249-I2292 HydrophobicContact CD2-CB 4.33Å; L2249-I2292 HydrophobicContact CD2-CG1 4.08Å; L2249-I2292 HydrophobicContact CD2-CG2 4.39Å; L2249-I2292 HydrophobicContact CG-CG1 4.44Å; L2268-I2292 HydrophobicContact CD2-CG2 4.12Å; L2271-I2292 HydrophobicContact CB-CD1 4.1Å; L2271-I2292 HydrophobicContact CB-CG1 4.19Å; L2271-I2292 HydrophobicContact CB-CG2 4.01Å; L2271-I2292 HydrophobicContact CD1-CG1 4.42Å; L2271-I2292 HydrophobicContact CD1-CG2 4.47Å; L2271-I2292 WeakPolarHBondContact O-CD1 3.47Å; L2272-I2292 HydrophobicContact CD1-CG2 4.39Å; L2272-I2292 HydrophobicContact CD2-CB 4.15Å; L2272-I2292 HydrophobicContact CD2-CG2 3.64Å; L2272-I2292 HydrophobicContact CG-CG2 3.69Å; D2289-I2292 HydrophobicContact CB-CB 4.45Å; D2289-I2292 HydrophobicContact CB-CD1 3.75Å; D2289-I2292 HydrophobicContact CB-CG1 3.97Å; D2289-I2292 PolarHBondContact O-N 3Å; P2290-I2292 VanDerWaalsContact C-N 3.35Å; P2290-I2292 PolarHBondContact O-N 3.26Å; I2292-F2294 VanDerWaalsContact C-N 3.28Å; I2292-F2294 PolarHBondContact O-N 3.16Å; I2292-G2295 CarbonylContact O-C 3.49Å; I2292-G2295 VanDerWaalsContact O-CA 3.25Å; I2292-G2295 WeakPolarHBondContact O-CA 3.42Å; I2292-G2295 PolarHBondContact O-N 3.29Å; I2292-Y2296 PolarHBondContact O-N 3.07Å
2293V86.2Confident82Confident9.6 Ų9.635.7 Ų35.76%0.05822%0.219CC..Hα-helixtrans-59.6-40.5173.8-177.80000110.8L2272 I2285 S2287 D2289 P2290 G2295 Y2296 T2297 L2316L2272-V2293 HydrophobicContact CD2-CG2 4.3Å; I2285-V2293 HydrophobicContact CB-CG2 4.38Å; I2285-V2293 HydrophobicContact CD1-CG1 4.07Å; I2285-V2293 HydrophobicContact CD1-CG2 4.29Å; I2285-V2293 HydrophobicContact CG2-CG2 4.5Å; S2287-V2293 WeakPolarHBondContact OG-CG2 3.44Å; D2289-V2293 PolarHBondContact O-N 3.05Å; D2289-V2293 VanDerWaalsContact O-N 3.14Å; P2290-V2293 PolarHBondContact O-N 2.86Å; V2293-G2295 VanDerWaalsContact C-N 3.31Å; V2293-G2295 PolarHBondContact O-N 3.13Å; V2293-Y2296 PolarHBondContact O-N 3.17Å; V2293-T2297 WeakPolarHBondContact O-CG2 3.38Å; V2293-T2297 PolarHBondContact O-N 2.96Å; V2293-T2297 PolarHBondContact O-OG1 2.95Å; V2293-T2297 VanDerWaalsContact O-OG1 3.09Å; V2293-L2316 HydrophobicContact CB-CD1 3.99Å; V2293-L2316 HydrophobicContact CB-CD2 4.34Å; V2293-L2316 HydrophobicContact CG1-CB 4.48Å; V2293-L2316 HydrophobicContact CG1-CD1 3.9Å; V2293-L2316 HydrophobicContact CG1-CD2 4.15Å; V2293-L2316 HydrophobicContact CG1-CG 4.42Å
2294F88.7Confident82.5Confident13.2 Ų13.233.8 Ų33.86%0.05822%0.219CC..Hα-helixtrans-64.2-33.1171.4-176.2-123000112.9P2290 I2292 T2297 K2298 L2313 L2316 L2376 K2379 C2380 K2383P2290-F2294 VanDerWaalsContact O-CB 3.3Å; P2290-F2294 WeakPolarHBondContact O-CB 3.31Å; P2290-F2294 PolarHBondContact O-N 3.17Å; I2292-F2294 VanDerWaalsContact C-N 3.28Å; I2292-F2294 PolarHBondContact O-N 3.16Å; F2294-T2297 WeakPolarHBondContact CA-OG1 3.35Å; F2294-T2297 PolarHBondContact O-OG1 2.95Å; F2294-T2297 VanDerWaalsContact O-OG1 3.06Å; F2294-K2298 VanDerWaalsContact C-NZ 3.33Å; F2294-K2298 HydrophobicContact CD1-CD 4.42Å; F2294-K2298 HydrophobicContact CE1-CD 4.12Å; F2294-K2298 HydrophobicContact CE2-CD 4.33Å; F2294-K2298 HydrophobicContact CE2-CG 4.4Å; F2294-K2298 HydrophobicContact CZ-CD 4.15Å; F2294-K2298 HydrophobicContact CZ-CG 4.44Å; F2294-K2298 WeakPolarHBondContact O-CD 3.39Å; F2294-K2298 WeakPolarHBondContact O-CE 3.39Å; F2294-K2298 VanDerWaalsContact O-CG 3.26Å; F2294-K2298 WeakPolarHBondContact O-CG 3.28Å; F2294-K2298 PolarHBondContact O-N 3.25Å; F2294-K2298 PolarHBondContact O-NZ 2.92Å; F2294-L2313 HydrophobicContact CD2-CD1 3.77Å; F2294-L2313 HydrophobicContact CE2-CD1 4.03Å; F2294-L2316 HydrophobicContact CB-CD2 3.95Å; F2294-L2376 HydrophobicContact CB-CD1 4.01Å; F2294-L2376 HydrophobicContact CD1-CD1 3.57Å; F2294-L2376 VanDerWaalsContact CD1-CD1 3.45Å; F2294-L2376 HydrophobicContact CE1-CD1 4.23Å; F2294-L2376 HydrophobicContact CG-CD1 3.92Å; F2294-K2379 HydrophobicContact CE1-CB 4.05Å; F2294-K2379 HydrophobicContact CZ-CB 4.01Å; F2294-C2380 HydrophobicContact CD2-CB 4.5Å; F2294-C2380 VanDerWaalsContact CD2-SG 3.52Å; F2294-C2380 WeakPolarHBondContact CD2-SG 3.37Å; F2294-C2380 HydrophobicContact CE2-CB 4.42Å; F2294-K2383 HydrophobicContact CE2-CB 4.22Å; F2294-K2383 HydrophobicContact CE2-CG 4.23Å; F2294-K2383 HydrophobicContact CZ-CB 4.41Å; F2294-K2383 HydrophobicContact CZ-CG 3.99Å
2295G86.8Confident83.2Confident11 Ų1132.6 Ų32.611%0.11321%0.213CC..Hα-helixtrans-60.4-48.8169.800000112.4A2291 I2292 V2293 K2298 L2299A2291-G2295 PolarHBondContact O-N 3.25Å; I2292-G2295 CarbonylContact O-C 3.49Å; I2292-G2295 VanDerWaalsContact O-CA 3.25Å; I2292-G2295 WeakPolarHBondContact O-CA 3.42Å; I2292-G2295 PolarHBondContact O-N 3.29Å; V2293-G2295 VanDerWaalsContact C-N 3.31Å; V2293-G2295 PolarHBondContact O-N 3.13Å; G2295-K2298 WeakPolarHBondContact O-CB 3.35Å; G2295-K2298 PolarHBondContact O-N 3.23Å; G2295-L2299 PolarHBondContact O-N 3.25Å; G2295-L2299 VanDerWaalsContact O-N 3.14Å
2296Y88.1Confident83.8Confident6 Ų634.9 Ų34.92%0.02422%0.224CC..Hα-helixtrans-65.5-44.7-179.1-178.3-106.6000113.2L2272 P2276 I2285 I2292 V2293 K2298 L2299 L2300L2272-Y2296 HydrophobicContact CD1-CG 4.48Å; P2276-Y2296 HydrophobicContact CB-CD1 4.33Å; P2276-Y2296 HydrophobicContact CB-CE1 3.78Å; P2276-Y2296 HydrophobicContact CB-CE2 4.32Å; P2276-Y2296 HydrophobicContact CG-CD1 4.19Å; P2276-Y2296 HydrophobicContact CG-CD2 4.03Å; P2276-Y2296 HydrophobicContact CG-CE1 3.64Å; P2276-Y2296 HydrophobicContact CG-CE2 3.46Å; P2276-Y2296 VanDerWaalsContact CG-CE2 3.41Å; P2276-Y2296 HydrophobicContact CG-CG 4.33Å; P2276-Y2296 VanDerWaalsContact CG-OH 3.3Å; P2276-Y2296 WeakPolarHBondContact CG-OH 3.39Å; I2285-Y2296 HydrophobicContact CD1-CD1 4.12Å; I2285-Y2296 HydrophobicContact CD1-CE1 4.39Å; I2292-Y2296 PolarHBondContact O-N 3.07Å; V2293-Y2296 PolarHBondContact O-N 3.17Å; Y2296-K2298 VanDerWaalsContact C-N 3.27Å; Y2296-K2298 PolarHBondContact O-N 3.09Å; Y2296-L2299 HydrophobicContact CD2-CD2 4.5Å; Y2296-L2299 WeakPolarHBondContact O-CA 3.44Å; Y2296-L2299 VanDerWaalsContact O-CB 3.31Å; Y2296-L2299 WeakPolarHBondContact O-CB 3.36Å; Y2296-L2299 PolarHBondContact O-N 3.15Å; Y2296-L2300 HydrophobicContact CD1-CD1 4.01Å; Y2296-L2300 HydrophobicContact CD1-CG 4.34Å; Y2296-L2300 HydrophobicContact CE1-CD1 3.5Å; Y2296-L2300 VanDerWaalsContact CE1-CD1 3.46Å; Y2296-L2300 HydrophobicContact CE1-CD2 4.25Å; Y2296-L2300 HydrophobicContact CE1-CG 3.85Å; Y2296-L2300 HydrophobicContact CE2-CG 4.47Å; Y2296-L2300 PolarHBondContact O-N 3.28Å
2297T88.5Confident84.6Confident0 Ų037.9 Ų37.90%023%0.231CC..Hα-helixtrans-59.6-36.9175.351.20000112.5V2293 F2294 L2299 L2300 W2301 A2309 R2312 L2313 W2387V2293-T2297 WeakPolarHBondContact O-CG2 3.38Å; V2293-T2297 PolarHBondContact O-N 2.96Å; V2293-T2297 PolarHBondContact O-OG1 2.95Å; V2293-T2297 VanDerWaalsContact O-OG1 3.09Å; F2294-T2297 WeakPolarHBondContact CA-OG1 3.35Å; F2294-T2297 PolarHBondContact O-OG1 2.95Å; F2294-T2297 VanDerWaalsContact O-OG1 3.06Å; T2297-L2299 VanDerWaalsContact C-N 3.29Å; T2297-L2299 PolarHBondContact O-N 3.17Å; T2297-L2300 PolarHBondContact O-N 3.16Å; T2297-W2301 PolarHBondContact O-N 3.33Å; T2297-W2301 VanDerWaalsContact O-N 3.1Å; T2297-A2309 WeakPolarHBondContact O-CB 3.33Å; T2297-R2312 HydrophobicContact CG2-CB 3.58Å; T2297-R2312 VanDerWaalsContact CG2-CB 3.42Å; T2297-R2312 HydrophobicContact CG2-CG 4.46Å; T2297-L2313 HydrophobicContact CG2-CB 4.43Å; T2297-W2387 WeakPolarHBondContact O-CH2 3.41Å
2298K90.4Very high85.8Confident52.2 Ų52.235.4 Ų35.423%0.22721%0.206CC..Hα-helixtrans-66-31.4172.9-72.4175.6-79.9-169.80113.1R2256 F2294 G2295 Y2296 A2302 W2387R2256-K2298 VanDerWaalsContact CD-O 3.27Å; R2256-K2298 WeakPolarHBondContact CD-O 3.33Å; R2256-K2298 PolarHBondContact NH1-O 3.01Å; R2256-K2298 VanDerWaalsContact NH1-O 3.11Å; F2294-K2298 VanDerWaalsContact C-NZ 3.33Å; F2294-K2298 HydrophobicContact CD1-CD 4.42Å; F2294-K2298 HydrophobicContact CE1-CD 4.12Å; F2294-K2298 HydrophobicContact CE2-CD 4.33Å; F2294-K2298 HydrophobicContact CE2-CG 4.4Å; F2294-K2298 HydrophobicContact CZ-CD 4.15Å; F2294-K2298 HydrophobicContact CZ-CG 4.44Å; F2294-K2298 WeakPolarHBondContact O-CD 3.39Å; F2294-K2298 WeakPolarHBondContact O-CE 3.39Å; F2294-K2298 VanDerWaalsContact O-CG 3.26Å; F2294-K2298 WeakPolarHBondContact O-CG 3.28Å; F2294-K2298 PolarHBondContact O-N 3.25Å; F2294-K2298 PolarHBondContact O-NZ 2.92Å; G2295-K2298 WeakPolarHBondContact O-CB 3.35Å; G2295-K2298 PolarHBondContact O-N 3.23Å; Y2296-K2298 VanDerWaalsContact C-N 3.27Å; Y2296-K2298 PolarHBondContact O-N 3.09Å; K2298-A2302 WeakPolarHBondContact O-CB 3.4Å; K2298-A2302 PolarHBondContact O-N 3.12Å; K2298-A2302 VanDerWaalsContact O-N 3.14Å; K2298-W2387 HydrophobicContact CB-CH2 4.39Å; K2298-W2387 HydrophobicContact CB-CZ2 4.42Å; K2298-W2387 HydrophobicContact CG-CH2 4.03Å; K2298-W2387 HydrophobicContact CG-CZ2 4.06Å
2299L89.3Confident86.8Confident4.4 Ų4.433.8 Ų33.82%0.02320%0.195CC..Hα-helixtrans-70.1-48.3175176.465.1000110.5R2256 F2261 R2265 L2268 G2295 Y2296 T2297 W2301 A2302 V2303R2256-L2299 HydrophobicContact CB-CD1 4.41Å; R2256-L2299 HydrophobicContact CG-CD1 4.13Å; F2261-L2299 HydrophobicContact CB-CD1 4.15Å; F2261-L2299 HydrophobicContact CD1-CD1 4.03Å; F2261-L2299 HydrophobicContact CG-CD1 4.47Å; R2265-L2299 VanDerWaalsContact CA-CD2 3.44Å; R2265-L2299 HydrophobicContact CB-CD2 3.74Å; R2265-L2299 HydrophobicContact CG-CD2 4.24Å; L2268-L2299 HydrophobicContact CD1-CB 4.19Å; L2268-L2299 HydrophobicContact CD1-CD2 4.02Å; G2295-L2299 PolarHBondContact O-N 3.25Å; G2295-L2299 VanDerWaalsContact O-N 3.14Å; Y2296-L2299 HydrophobicContact CD2-CD2 4.5Å; Y2296-L2299 WeakPolarHBondContact O-CA 3.44Å; Y2296-L2299 VanDerWaalsContact O-CB 3.31Å; Y2296-L2299 WeakPolarHBondContact O-CB 3.36Å; Y2296-L2299 PolarHBondContact O-N 3.15Å; T2297-L2299 VanDerWaalsContact C-N 3.29Å; T2297-L2299 PolarHBondContact O-N 3.17Å; L2299-W2301 VanDerWaalsContact C-N 3.27Å; L2299-W2301 PolarHBondContact O-N 3.04Å; L2299-A2302 CarbonylContact O-C 3.43Å; L2299-A2302 WeakPolarHBondContact O-CA 3.37Å; L2299-A2302 WeakPolarHBondContact O-CB 3.47Å; L2299-A2302 PolarHBondContact O-N 3.11Å; L2299-V2303 HydrophobicContact CD1-CG2 4.13Å; L2299-V2303 HydrophobicContact CG-CG2 4.35Å; L2299-V2303 WeakPolarHBondContact O-CG2 3.34Å; L2299-V2303 PolarHBondContact O-N 3.14Å
2300L88.6Confident87.3Confident15.4 Ų15.432.1 Ų32.18%0.08119%0.186CC..Hα-helixtrans-52.5-46.4175-72.6176.4000111.7Y2296 T2297 A2302 V2303 G2304 A2305 E2308 A2309 R2312Y2296-L2300 HydrophobicContact CD1-CD1 4.01Å; Y2296-L2300 HydrophobicContact CD1-CG 4.34Å; Y2296-L2300 HydrophobicContact CE1-CD1 3.5Å; Y2296-L2300 VanDerWaalsContact CE1-CD1 3.46Å; Y2296-L2300 HydrophobicContact CE1-CD2 4.25Å; Y2296-L2300 HydrophobicContact CE1-CG 3.85Å; Y2296-L2300 HydrophobicContact CE2-CG 4.47Å; Y2296-L2300 PolarHBondContact O-N 3.28Å; T2297-L2300 PolarHBondContact O-N 3.16Å; L2300-A2302 VanDerWaalsContact C-N 3.3Å; L2300-A2302 PolarHBondContact O-N 3.2Å; L2300-V2303 PolarHBondContact O-N 3.17Å; L2300-G2304 PolarHBondContact O-N 2.95Å; L2300-G2304 VanDerWaalsContact O-N 3.15Å; L2300-A2305 HydrophobicContact CB-CB 4.4Å; L2300-A2305 HydrophobicContact CD2-CB 4.26Å; L2300-A2305 PolarHBondContact O-N 3.17Å; L2300-A2305 VanDerWaalsContact O-N 3.1Å; L2300-E2308 HydrophobicContact CD1-CB 4.37Å; L2300-E2308 HydrophobicContact CD1-CG 4.17Å; L2300-E2308 WeakPolarHBondContact CD1-OE1 3.43Å; L2300-E2308 WeakPolarHBondContact CD2-OE2 3.4Å; L2300-A2309 HydrophobicContact CB-CB 3.83Å; L2300-R2312 HydrophobicContact CD1-CG 4.37Å
2301W89.9Confident87.4Confident32.8 Ų32.833.4 Ų33.412%0.12420%0.196CC..Hα-helixtrans-58.1-40.7174.8-176.4-87.1000113T2297 L2299 V2303 G2304 H2306 A2309 V2310 W2387 E2390 L2391T2297-W2301 PolarHBondContact O-N 3.33Å; T2297-W2301 VanDerWaalsContact O-N 3.1Å; L2299-W2301 VanDerWaalsContact C-N 3.27Å; L2299-W2301 PolarHBondContact O-N 3.04Å; W2301-V2303 VanDerWaalsContact C-N 3.34Å; W2301-G2304 PolarHBondContact O-N 3.05Å; W2301-H2306 AromaticContact CD2-ND1 3.35Å; W2301-H2306 VanDerWaalsContact CD2-ND1 3.3Å; W2301-H2306 AromaticContact CE2-CE1 3.85Å; W2301-H2306 AromaticContact CE2-ND1 3.45Å; W2301-H2306 HydrophobicContact CE3-CB 3.99Å; W2301-H2306 AromaticContact CE3-CG 3.99Å; W2301-H2306 AromaticContact CE3-ND1 3.34Å; W2301-H2306 VanDerWaalsContact CE3-ND1 3.3Å; W2301-H2306 AromaticContact CG-ND1 3.98Å; W2301-H2306 HydrophobicContact CH2-CB 4.29Å; W2301-H2306 AromaticContact CH2-ND1 3.58Å; W2301-H2306 WeakPolarHBondContact CH2-ND1 3.22Å; W2301-H2306 AromaticContact CZ2-CE1 3.95Å; W2301-H2306 AromaticContact CZ2-ND1 3.58Å; W2301-H2306 WeakPolarHBondContact CZ2-ND1 3.5Å; W2301-H2306 HydrophobicContact CZ3-CB 3.68Å; W2301-H2306 AromaticContact CZ3-CG 3.92Å; W2301-H2306 AromaticContact CZ3-ND1 3.45Å; W2301-H2306 WeakPolarHBondContact CZ3-ND1 3.37Å; W2301-H2306 PolarHBondContact O-CE1 3Å; W2301-H2306 VanDerWaalsContact O-CE1 3.27Å; W2301-A2309 HydrophobicContact CB-CB 4.05Å; W2301-A2309 HydrophobicContact CE3-CB 4.25Å; W2301-V2310 HydrophobicContact CE3-CG2 4.47Å; W2301-V2310 HydrophobicContact CZ3-CG2 3.99Å; W2301-W2387 HydrophobicContact CB-CD2 4.45Å; W2301-W2387 HydrophobicContact CB-CH2 3.94Å; W2301-W2387 HydrophobicContact CB-CZ2 3.67Å; W2301-W2387 HydrophobicContact CB-CZ3 4.42Å; W2301-W2387 AromaticContact CD1-CE2 3.93Å; W2301-W2387 AromaticContact CD1-NE1 3.67Å; W2301-W2387 HydrophobicContact CD2-CB 4.41Å; W2301-W2387 AromaticContact CD2-CD1 3.57Å; W2301-W2387 VanDerWaalsContact CD2-CD1 3.42Å; W2301-W2387 AromaticContact CD2-CD2 3.69Å; W2301-W2387 HydrophobicContact CD2-CD2 3.69Å; W2301-W2387 AromaticContact CD2-CE2 3.58Å; W2301-W2387 HydrophobicContact CD2-CE3 4.35Å; W2301-W2387 AromaticContact CD2-CG 3.73Å; W2301-W2387 HydrophobicContact CD2-CG 3.73Å; W2301-W2387 HydrophobicContact CD2-CZ2 4.21Å; W2301-W2387 AromaticContact CD2-NE1 3.45Å; W2301-W2387 VanDerWaalsContact CD2-NE1 3.34Å; W2301-W2387 AromaticContact CE2-CD1 3.37Å; W2301-W2387 VanDerWaalsContact CE2-CD1 3.45Å; W2301-W2387 AromaticContact CE2-CG 3.88Å; W2301-W2387 AromaticContact CE2-NE1 3.47Å; W2301-W2387 HydrophobicContact CE3-CB 3.93Å; W2301-W2387 AromaticContact CE3-CD1 3.9Å; W2301-W2387 AromaticContact CE3-CD2 3.56Å; W2301-W2387 HydrophobicContact CE3-CD2 3.56Å; W2301-W2387 VanDerWaalsContact CE3-CD2 3.5Å; W2301-W2387 AromaticContact CE3-CE2 3.94Å; W2301-W2387 AromaticContact CE3-CE3 3.92Å; W2301-W2387 HydrophobicContact CE3-CE3 3.92Å; W2301-W2387 AromaticContact CE3-CG 3.57Å; W2301-W2387 HydrophobicContact CE3-CG 3.57Å; W2301-W2387 VanDerWaalsContact CE3-CG 3.48Å; W2301-W2387 HydrophobicContact CG-CD2 4.14Å; W2301-W2387 AromaticContact CG-CE2 3.56Å; W2301-W2387 VanDerWaalsContact CG-CE2 3.45Å; W2301-W2387 HydrophobicContact CG-CG 4.42Å; W2301-W2387 HydrophobicContact CG-CH2 4.41Å; W2301-W2387 AromaticContact CG-CZ2 3.74Å; W2301-W2387 HydrophobicContact CG-CZ2 3.74Å; W2301-W2387 AromaticContact CG-NE1 3.59Å; W2301-W2387 HydrophobicContact CH2-CB 3.59Å; W2301-W2387 AromaticContact CH2-CD1 3.84Å; W2301-W2387 AromaticContact CH2-CG 3.79Å; W2301-W2387 HydrophobicContact CH2-CG 3.79Å; W2301-W2387 WeakPolarHBondContact CH2-O 3.44Å; W2301-W2387 HydrophobicContact CZ2-CB 4.19Å; W2301-W2387 AromaticContact CZ2-CD1 3.52Å; W2301-W2387 VanDerWaalsContact CZ2-CD1 3.49Å; W2301-W2387 AromaticContact CZ2-CG 3.92Å; W2301-W2387 HydrophobicContact CZ2-CG 3.95Å; W2301-W2387 HydrophobicContact CZ3-CB 3.45Å; W2301-W2387 VanDerWaalsContact CZ3-CB 3.42Å; W2301-W2387 AromaticContact CZ3-CD1 3.99Å; W2301-W2387 HydrophobicContact CZ3-CD2 4.07Å; W2301-W2387 HydrophobicContact CZ3-CE3 4.44Å; W2301-W2387 AromaticContact CZ3-CG 3.6Å; W2301-W2387 HydrophobicContact CZ3-CG 3.6Å; W2301-W2387 AromaticContact NE1-CD1 3.84Å; W2301-W2387 AromaticContact NE1-NE1 3.57Å; W2301-E2390 HydrophobicContact CH2-CB 4.36Å; W2301-E2390 HydrophobicContact CH2-CG 4.46Å; W2301-E2390 HydrophobicContact CZ2-CB 4.24Å; W2301-E2390 HydrophobicContact CZ2-CG 4.29Å; W2301-E2390 WeakPolarHBondContact CZ2-OE2 3.37Å; W2301-L2391 HydrophobicContact CH2-CD1 4.33Å; W2301-L2391 HydrophobicContact CH2-CD2 4.34Å; W2301-L2391 HydrophobicContact CH2-CG 3.97Å; W2301-L2391 HydrophobicContact CZ3-CD1 4.03Å; W2301-L2391 HydrophobicContact CZ3-CG 4.18Å
2302A88.1Confident87.4Confident32.4 Ų32.432.5 Ų32.527%0.26819%0.187SC..Hα-helixtrans-75.7-24.9-178.800000113.4R2256 F2261 K2298 L2299 L2300 G2304R2256-A2302 HydrophobicContact CG-CB 3.73Å; F2261-A2302 HydrophobicContact CD1-CB 4.36Å; F2261-A2302 HydrophobicContact CE1-CB 3.82Å; F2261-A2302 WeakPolarHBondContact CZ-O 3.28Å; K2298-A2302 WeakPolarHBondContact O-CB 3.4Å; K2298-A2302 PolarHBondContact O-N 3.12Å; K2298-A2302 VanDerWaalsContact O-N 3.14Å; L2299-A2302 CarbonylContact O-C 3.43Å; L2299-A2302 WeakPolarHBondContact O-CA 3.37Å; L2299-A2302 WeakPolarHBondContact O-CB 3.47Å; L2299-A2302 PolarHBondContact O-N 3.11Å; L2300-A2302 VanDerWaalsContact C-N 3.3Å; L2300-A2302 PolarHBondContact O-N 3.2Å; A2302-G2304 VanDerWaalsContact C-N 3.31Å
2303V88.2Confident87.5Confident89.4 Ų89.432 Ų3254%0.54218%0.184SC..Hα-helixtrans-77.7-21.3174.4172.90000111.6F2261 L2299 L2300 W2301F2261-V2303 HydrophobicContact CB-CG2 3.94Å; F2261-V2303 HydrophobicContact CD1-CG2 4.28Å; F2261-V2303 HydrophobicContact CD2-CG2 4.36Å; F2261-V2303 HydrophobicContact CG-CG2 3.99Å; L2299-V2303 HydrophobicContact CD1-CG2 4.13Å; L2299-V2303 HydrophobicContact CG-CG2 4.35Å; L2299-V2303 WeakPolarHBondContact O-CG2 3.34Å; L2299-V2303 PolarHBondContact O-N 3.14Å; L2300-V2303 PolarHBondContact O-N 3.17Å; W2301-V2303 VanDerWaalsContact C-N 3.34Å
2304G85.8Confident87.5Confident41 Ų4133.1 Ų33.142%0.42319%0.193SC..THydrogen-bonded Turntrans108.50.1-179.900000114.5L2300 W2301 A2302 H2306L2300-G2304 PolarHBondContact O-N 2.95Å; L2300-G2304 VanDerWaalsContact O-N 3.15Å; W2301-G2304 PolarHBondContact O-N 3.05Å; A2302-G2304 VanDerWaalsContact C-N 3.31Å; G2304-H2306 PolarHBondContact O-CD2 3.04Å; G2304-H2306 VanDerWaalsContact O-CD2 3.25Å; G2304-H2306 PolarHBondContact O-N 3.15Å
2305A87.2Confident87.4Confident34.2 Ų34.233.2 Ų33.228%0.28319%0.194SC..  trans-80.463.7175.400000110.8L2300 E2308 A2309L2300-A2305 HydrophobicContact CB-CB 4.4Å; L2300-A2305 HydrophobicContact CD2-CB 4.26Å; L2300-A2305 PolarHBondContact O-N 3.17Å; L2300-A2305 VanDerWaalsContact O-N 3.1Å; A2305-E2308 HydrophobicContact CB-CB 4.46Å; A2305-A2309 WeakPolarHBondContact O-CB 3.17Å; A2305-A2309 PolarHBondContact O-N 3.27Å; A2305-A2309 VanDerWaalsContact O-N 3.07Å
2306H87.9Confident87.3Confident65.2 Ų65.232.9 Ų32.930%0.30219%0.19SC..Hα-helixtrans-66.7-44-167.9-62.4-68.7000113.9W2301 G2304 A2309 V2310 L2391W2301-H2306 AromaticContact CD2-ND1 3.35Å; W2301-H2306 VanDerWaalsContact CD2-ND1 3.3Å; W2301-H2306 AromaticContact CE2-CE1 3.85Å; W2301-H2306 AromaticContact CE2-ND1 3.45Å; W2301-H2306 HydrophobicContact CE3-CB 3.99Å; W2301-H2306 AromaticContact CE3-CG 3.99Å; W2301-H2306 AromaticContact CE3-ND1 3.34Å; W2301-H2306 VanDerWaalsContact CE3-ND1 3.3Å; W2301-H2306 AromaticContact CG-ND1 3.98Å; W2301-H2306 HydrophobicContact CH2-CB 4.29Å; W2301-H2306 AromaticContact CH2-ND1 3.58Å; W2301-H2306 WeakPolarHBondContact CH2-ND1 3.22Å; W2301-H2306 AromaticContact CZ2-CE1 3.95Å; W2301-H2306 AromaticContact CZ2-ND1 3.58Å; W2301-H2306 WeakPolarHBondContact CZ2-ND1 3.5Å; W2301-H2306 HydrophobicContact CZ3-CB 3.68Å; W2301-H2306 AromaticContact CZ3-CG 3.92Å; W2301-H2306 AromaticContact CZ3-ND1 3.45Å; W2301-H2306 WeakPolarHBondContact CZ3-ND1 3.37Å; W2301-H2306 PolarHBondContact O-CE1 3Å; W2301-H2306 VanDerWaalsContact O-CE1 3.27Å; G2304-H2306 PolarHBondContact O-CD2 3.04Å; G2304-H2306 VanDerWaalsContact O-CD2 3.25Å; G2304-H2306 PolarHBondContact O-N 3.15Å; H2306-A2309 PolarHBondContact O-N 3.23Å; H2306-V2310 WeakPolarHBondContact O-CG2 3.3Å; H2306-V2310 PolarHBondContact O-N 3.19Å; H2306-L2391 HydrophobicContact CB-CD1 4.07Å; H2306-L2391 HydrophobicContact CB-CD2 3.79Å; H2306-L2391 HydrophobicContact CB-CG 4.37Å
2307E84.6Confident87.2Confident142.2 Ų142.233.3 Ų33.366%0.66419%0.192SC*.Hα-helixtrans-66.1-42.6-179.4-64-174.3161.800111.8A2309 V2310 S2311 L2391E2307-A2309 VanDerWaalsContact C-N 3.34Å; E2307-A2309 PolarHBondContact O-N 3.19Å; E2307-V2310 PolarHBondContact O-N 3.13Å; E2307-S2311 WeakPolarHBondContact O-CB 3.44Å; E2307-S2311 PolarHBondContact O-N 3.2Å; E2307-S2311 PolarHBondContact O-OG 3.23Å; E2307-L2391 HydrophobicContact CG-CD1 4.47Å
2308E85.2Confident87Confident62.6 Ų62.635.8 Ų35.829%0.29321%0.207SC..Hα-helixtrans-62.4-44.6174.9-167-169.2162.600110.9P2281 L2300 A2305 V2310 S2311 R2312P2281-E2308 HydrophobicContact CB-CG 4.15Å; L2300-E2308 HydrophobicContact CD1-CB 4.37Å; L2300-E2308 HydrophobicContact CD1-CG 4.17Å; L2300-E2308 WeakPolarHBondContact CD1-OE1 3.43Å; L2300-E2308 WeakPolarHBondContact CD2-OE2 3.4Å; A2305-E2308 HydrophobicContact CB-CB 4.46Å; E2308-V2310 VanDerWaalsContact C-N 3.32Å; E2308-V2310 PolarHBondContact O-N 3.19Å; E2308-S2311 PolarHBondContact O-N 3.13Å; E2308-R2312 HydrophobicContact CG-CG 4.27Å; E2308-R2312 WeakPolarHBondContact O-CB 3.39Å; E2308-R2312 VanDerWaalsContact O-CG 3.27Å; E2308-R2312 WeakPolarHBondContact O-CG 3.31Å; E2308-R2312 PolarHBondContact O-N 3.03Å; E2308-R2312 IonicContact OE1-CZ 2.97Å; E2308-R2312 IonicContact OE1-NE 3.19Å; E2308-R2312 PolarHBondContact OE1-NE 3.23Å; E2308-R2312 IonicContact OE1-NH1 3.51Å; E2308-R2312 PolarHBondContact OE1-NH1 3.36Å; E2308-R2312 IonicContact OE1-NH2 3.6Å; E2308-R2312 PolarHBondContact OE1-NH2 3.12Å; E2308-R2312 VanDerWaalsContact OE1-NH2 3.13Å
2309A87.4Confident86.6Confident0 Ų038.8 Ų38.80%022%0.222CC..Hα-helixtrans-59.7-41.2178.500000112.5T2297 L2300 W2301 A2305 H2306 E2307 L2313 W2387T2297-A2309 WeakPolarHBondContact O-CB 3.33Å; L2300-A2309 HydrophobicContact CB-CB 3.83Å; W2301-A2309 HydrophobicContact CB-CB 4.05Å; W2301-A2309 HydrophobicContact CE3-CB 4.25Å; A2305-A2309 WeakPolarHBondContact O-CB 3.17Å; A2305-A2309 PolarHBondContact O-N 3.27Å; A2305-A2309 VanDerWaalsContact O-N 3.07Å; H2306-A2309 PolarHBondContact O-N 3.23Å; E2307-A2309 VanDerWaalsContact C-N 3.34Å; E2307-A2309 PolarHBondContact O-N 3.19Å; A2309-L2313 VanDerWaalsContact O-CB 3.24Å; A2309-L2313 WeakPolarHBondContact O-CB 3.28Å; A2309-L2313 PolarHBondContact O-N 3.13Å; A2309-L2313 VanDerWaalsContact O-N 3.11Å; A2309-W2387 HydrophobicContact CB-CE3 4.45Å; A2309-W2387 HydrophobicContact CB-CZ3 4.17Å
2310V87.7Confident86.1Confident10 Ų1040.2 Ų40.26%0.06123%0.231CC..Hα-helixtrans-68.7-46.3177170.10000111.1W2301 H2306 E2307 E2308 R2312 L2313 C2314 L2384 W2387 Y2388 L2391W2301-V2310 HydrophobicContact CE3-CG2 4.47Å; W2301-V2310 HydrophobicContact CZ3-CG2 3.99Å; H2306-V2310 WeakPolarHBondContact O-CG2 3.3Å; H2306-V2310 PolarHBondContact O-N 3.19Å; E2307-V2310 PolarHBondContact O-N 3.13Å; E2308-V2310 VanDerWaalsContact C-N 3.32Å; E2308-V2310 PolarHBondContact O-N 3.19Å; V2310-R2312 PolarHBondContact O-N 3.36Å; V2310-L2313 PolarHBondContact O-N 3.03Å; V2310-L2313 VanDerWaalsContact O-N 3.15Å; V2310-C2314 WeakPolarHBondContact O-CB 3.36Å; V2310-C2314 PolarHBondContact O-N 3.08Å; V2310-L2384 HydrophobicContact CG1-CD1 3.97Å; V2310-W2387 HydrophobicContact CG2-CB 3.94Å; V2310-W2387 HydrophobicContact CG2-CE3 4.33Å; V2310-Y2388 HydrophobicContact CG1-CD2 4.23Å; V2310-L2391 HydrophobicContact CG2-CD1 3.88Å
2311S86.2Confident85.8Confident43.2 Ų43.239.5 Ų39.530%0.30223%0.227SC..Hα-helixtrans-58.6-49.5178.3-1010000111.5E2307 E2308 L2313 C2314 V2315E2307-S2311 WeakPolarHBondContact O-CB 3.44Å; E2307-S2311 PolarHBondContact O-N 3.2Å; E2307-S2311 PolarHBondContact O-OG 3.23Å; E2308-S2311 PolarHBondContact O-N 3.13Å; S2311-L2313 VanDerWaalsContact C-N 3.31Å; S2311-L2313 PolarHBondContact O-N 3.19Å; S2311-C2314 WeakPolarHBondContact O-CA 3.43Å; S2311-C2314 VanDerWaalsContact O-CB 3.31Å; S2311-C2314 WeakPolarHBondContact O-CB 3.31Å; S2311-C2314 PolarHBondContact O-N 3.26Å; S2311-C2314 VanDerWaalsContact O-N 3.09Å; S2311-V2315 WeakPolarHBondContact O-CG2 3.37Å; S2311-V2315 PolarHBondContact O-N 3.09Å
2312R85Confident85.5Confident6.2 Ų6.239.7 Ų39.72%0.02323%0.229CC..Hα-helixtrans-61.5-37.4176.5-70.2-75.1-168.8169.5-2112.8P2276 I2279 P2280 P2281 D2283 T2297 L2300 E2308 V2310 C2314 V2315 L2316P2276-R2312 PolarHBondContact O-NH2 2.94Å; I2279-R2312 PolarHBondContact O-NH1 3.37Å; I2279-R2312 PolarHBondContact O-NH2 3.07Å; P2280-R2312 VanDerWaalsContact O-CZ 3.3Å; P2280-R2312 PolarHBondContact O-NH1 3.21Å; P2280-R2312 PolarHBondContact O-NH2 3.28Å; P2281-R2312 WeakPolarHBondContact O-CD 3.38Å; P2281-R2312 PolarHBondContact O-NE 2.94Å; P2281-R2312 VanDerWaalsContact O-NE 3.11Å; D2283-R2312 PolarHBondContact O-NH1 3.26Å; T2297-R2312 HydrophobicContact CG2-CB 3.58Å; T2297-R2312 VanDerWaalsContact CG2-CB 3.42Å; T2297-R2312 HydrophobicContact CG2-CG 4.46Å; L2300-R2312 HydrophobicContact CD1-CG 4.37Å; E2308-R2312 HydrophobicContact CG-CG 4.27Å; E2308-R2312 WeakPolarHBondContact O-CB 3.39Å; E2308-R2312 VanDerWaalsContact O-CG 3.27Å; E2308-R2312 WeakPolarHBondContact O-CG 3.31Å; E2308-R2312 PolarHBondContact O-N 3.03Å; E2308-R2312 IonicContact OE1-CZ 2.97Å; E2308-R2312 IonicContact OE1-NE 3.19Å; E2308-R2312 PolarHBondContact OE1-NE 3.23Å; E2308-R2312 IonicContact OE1-NH1 3.51Å; E2308-R2312 PolarHBondContact OE1-NH1 3.36Å; E2308-R2312 IonicContact OE1-NH2 3.6Å; E2308-R2312 PolarHBondContact OE1-NH2 3.12Å; E2308-R2312 VanDerWaalsContact OE1-NH2 3.13Å; V2310-R2312 PolarHBondContact O-N 3.36Å; R2312-C2314 VanDerWaalsContact C-N 3.35Å; R2312-V2315 PolarHBondContact O-N 3.28Å; R2312-L2316 WeakPolarHBondContact O-CB 3.41Å; R2312-L2316 PolarHBondContact O-N 3.05Å
2313L87.1Confident85.1Confident0 Ų040.9 Ų40.90%023%0.234CC..Hα-helixtrans-71.3-35.9177.7-172.362.9000111.9F2294 T2297 A2309 V2310 S2311 L2316 K2317 C2380 K2383 L2384 W2387F2294-L2313 HydrophobicContact CD2-CD1 3.77Å; F2294-L2313 HydrophobicContact CE2-CD1 4.03Å; T2297-L2313 HydrophobicContact CG2-CB 4.43Å; A2309-L2313 VanDerWaalsContact O-CB 3.24Å; A2309-L2313 WeakPolarHBondContact O-CB 3.28Å; A2309-L2313 PolarHBondContact O-N 3.13Å; A2309-L2313 VanDerWaalsContact O-N 3.11Å; V2310-L2313 PolarHBondContact O-N 3.03Å; V2310-L2313 VanDerWaalsContact O-N 3.15Å; S2311-L2313 VanDerWaalsContact C-N 3.31Å; S2311-L2313 PolarHBondContact O-N 3.19Å; L2313-L2316 HydrophobicContact CD1-CD2 4.21Å; L2313-L2316 PolarHBondContact O-N 3.17Å; L2313-K2317 WeakPolarHBondContact O-CB 3.37Å; L2313-K2317 PolarHBondContact O-N 3.18Å; L2313-K2317 VanDerWaalsContact O-N 3.08Å; L2313-C2380 HydrophobicContact CD1-CB 3.94Å; L2313-C2380 WeakPolarHBondContact CD1-SG 3.31Å; L2313-K2383 HydrophobicContact CD2-CB 4.06Å; L2313-L2384 HydrophobicContact CB-CD1 4.33Å; L2313-L2384 HydrophobicContact CD2-CB 3.76Å; L2313-L2384 HydrophobicContact CD2-CD1 4.14Å; L2313-L2384 HydrophobicContact CD2-CG 4.42Å; L2313-L2384 HydrophobicContact CG-CB 4.29Å; L2313-L2384 HydrophobicContact CG-CD1 4.28Å; L2313-W2387 HydrophobicContact CB-CZ3 4.27Å; L2313-W2387 HydrophobicContact CD2-CD2 4.49Å; L2313-W2387 HydrophobicContact CD2-CE3 3.62Å; L2313-W2387 HydrophobicContact CD2-CH2 4.32Å; L2313-W2387 HydrophobicContact CD2-CZ3 3.5Å; L2313-W2387 VanDerWaalsContact CD2-CZ3 3.46Å; L2313-W2387 HydrophobicContact CG-CZ3 4.42Å
2314C86.4Confident84.6Confident34.6 Ų34.639.1 Ų39.123%0.23422%0.221CC..Hα-helixtrans-60.2-49.3169.6-940000110.7V2310 S2311 R2312 L2316 K2317 T2318 L2384V2310-C2314 WeakPolarHBondContact O-CB 3.36Å; V2310-C2314 PolarHBondContact O-N 3.08Å; S2311-C2314 WeakPolarHBondContact O-CA 3.43Å; S2311-C2314 VanDerWaalsContact O-CB 3.31Å; S2311-C2314 WeakPolarHBondContact O-CB 3.31Å; S2311-C2314 PolarHBondContact O-N 3.26Å; S2311-C2314 VanDerWaalsContact O-N 3.09Å; R2312-C2314 VanDerWaalsContact C-N 3.35Å; C2314-L2316 VanDerWaalsContact C-N 3.34Å; C2314-L2316 PolarHBondContact O-N 3.09Å; C2314-K2317 WeakPolarHBondContact O-CA 3.28Å; C2314-K2317 WeakPolarHBondContact O-CB 3.37Å; C2314-K2317 PolarHBondContact O-N 3.03Å; C2314-K2317 VanDerWaalsContact O-N 3.11Å; C2314-T2318 PolarHBondContact O-N 3.14Å; C2314-T2318 PolarHBondContact O-OG1 3.2Å; C2314-T2318 VanDerWaalsContact O-OG1 3.1Å; C2314-L2384 VanDerWaalsContact SG-CD1 3.59Å
2315V86.3Confident84.2Confident15 Ų1538 Ų389%0.09121%0.205CC..Hα-helixtrans-59.9-43.8178.1172.80000111.4C2282 P2284 S2311 R2312 K2317 T2318 H2319C2282-V2315 WeakPolarHBondContact O-CG2 3.42Å; P2284-V2315 HydrophobicContact CB-CG1 4.07Å; S2311-V2315 WeakPolarHBondContact O-CG2 3.37Å; S2311-V2315 PolarHBondContact O-N 3.09Å; R2312-V2315 PolarHBondContact O-N 3.28Å; V2315-K2317 VanDerWaalsContact C-N 3.3Å; V2315-K2317 PolarHBondContact O-N 3.19Å; V2315-T2318 PolarHBondContact O-N 3.23Å; V2315-H2319 HydrophobicContact CG1-CB 4.33Å; V2315-H2319 WeakPolarHBondContact O-CA 3.45Å; V2315-H2319 WeakPolarHBondContact O-CB 3.41Å; V2315-H2319 PolarHBondContact O-N 2.98Å
2316L85.8Confident83.4Confident4.8 Ų4.844 Ų443%0.02522%0.221CC..Iπ-helixtrans-59.7-39.8175.7-177.765.8000112.1P2290 V2293 F2294 R2312 L2313 C2314 V2320 L2321P2290-L2316 HydrophobicContact CB-CD1 4.1Å; V2293-L2316 HydrophobicContact CB-CD1 3.99Å; V2293-L2316 HydrophobicContact CB-CD2 4.34Å; V2293-L2316 HydrophobicContact CG1-CB 4.48Å; V2293-L2316 HydrophobicContact CG1-CD1 3.9Å; V2293-L2316 HydrophobicContact CG1-CD2 4.15Å; V2293-L2316 HydrophobicContact CG1-CG 4.42Å; F2294-L2316 HydrophobicContact CB-CD2 3.95Å; R2312-L2316 WeakPolarHBondContact O-CB 3.41Å; R2312-L2316 PolarHBondContact O-N 3.05Å; L2313-L2316 HydrophobicContact CD1-CD2 4.21Å; L2313-L2316 PolarHBondContact O-N 3.17Å; C2314-L2316 VanDerWaalsContact C-N 3.34Å; C2314-L2316 PolarHBondContact O-N 3.09Å; L2316-V2320 HydrophobicContact CD1-CB 4.14Å; L2316-V2320 HydrophobicContact CD1-CG1 4.33Å; L2316-V2320 HydrophobicContact CD1-CG2 4.35Å; L2316-V2320 WeakPolarHBondContact O-CB 3.31Å; L2316-V2320 PolarHBondContact O-N 3.09Å; L2316-L2321 HydrophobicContact CD1-CD1 4.48Å; L2316-L2321 HydrophobicContact CD1-CG 4.47Å; L2316-L2321 HydrophobicContact CD2-CD1 4.42Å; L2316-L2321 HydrophobicContact CG-CD1 4.01Å; L2316-L2321 HydrophobicContact CG-CG 4.38Å; L2316-L2321 WeakPolarHBondContact O-CB 3.34Å; L2316-L2321 WeakPolarHBondContact O-CG 3.36Å; L2316-L2321 PolarHBondContact O-N 3.3Å
2317K86.5Confident82.1Confident14 Ų1443.3 Ų43.36%0.06123%0.226CC..Iπ-helixtrans-65.6-57.3175.4176.7-167.2169.3-170.20111L2313 C2314 V2315 E2322 L2377 L2384L2313-K2317 WeakPolarHBondContact O-CB 3.37Å; L2313-K2317 PolarHBondContact O-N 3.18Å; L2313-K2317 VanDerWaalsContact O-N 3.08Å; C2314-K2317 WeakPolarHBondContact O-CA 3.28Å; C2314-K2317 WeakPolarHBondContact O-CB 3.37Å; C2314-K2317 PolarHBondContact O-N 3.03Å; C2314-K2317 VanDerWaalsContact O-N 3.11Å; V2315-K2317 VanDerWaalsContact C-N 3.3Å; V2315-K2317 PolarHBondContact O-N 3.19Å; K2317-E2322 VanDerWaalsContact CE-OE1 3.24Å; K2317-E2322 WeakPolarHBondContact CE-OE1 3.35Å; K2317-E2322 HydrophobicContact CG-CG 4.48Å; K2317-E2322 VanDerWaalsContact CG-OE1 3.32Å; K2317-E2322 WeakPolarHBondContact CG-OE1 3.42Å; K2317-E2322 IonicContact NZ-OE1 2.62Å; K2317-E2322 WeakPolarHBondContact O-CB 3.36Å; K2317-E2322 WeakPolarHBondContact O-CG 3.23Å; K2317-E2322 PolarHBondContact O-N 3.1Å; K2317-L2377 HydrophobicContact CB-CD1 4.43Å; K2317-L2377 HydrophobicContact CG-CD1 3.93Å; K2317-L2384 HydrophobicContact CD-CD2 4.07Å
2318T83.3Confident80.5Confident53 Ų5340 Ų4033%0.32521%0.211SC..Iπ-helixtrans-80.5-37.4-166.754.90000113.9C2314 V2315 P2323C2314-T2318 PolarHBondContact O-N 3.14Å; C2314-T2318 PolarHBondContact O-OG1 3.2Å; C2314-T2318 VanDerWaalsContact O-OG1 3.1Å; V2315-T2318 PolarHBondContact O-N 3.23Å; T2318-P2323 VanDerWaalsContact O-CD 3.27Å; T2318-P2323 WeakPolarHBondContact O-CD 3.34Å; T2318-P2323 WeakPolarHBondContact O-CG 3.36Å
2319H81.1Confident78.6Confident114.4 Ų114.443.2 Ų43.253%0.5324%0.235SC..Iπ-helixtrans-99.6-16.7-173.4-65.8-75.2000114P2284 V2315 P2323P2284-H2319 HydrophobicContact CB-CB 4.45Å; V2315-H2319 HydrophobicContact CG1-CB 4.33Å; V2315-H2319 WeakPolarHBondContact O-CA 3.45Å; V2315-H2319 WeakPolarHBondContact O-CB 3.41Å; V2315-H2319 PolarHBondContact O-N 2.98Å; H2319-P2323 WeakPolarHBondContact O-CG 3.33Å
2320V80.3Confident76.3Confident34.8 Ų34.845.9 Ų45.921%0.21126%0.263CS..Iπ-helixtrans-118.9-63.5-176.9-173.70000111.4P2284 P2290 L2316 P2323 L2324P2284-V2320 HydrophobicContact CB-CG2 4.23Å; P2290-V2320 HydrophobicContact CB-CG1 4.46Å; P2290-V2320 HydrophobicContact CG-CG1 3.87Å; L2316-V2320 HydrophobicContact CD1-CB 4.14Å; L2316-V2320 HydrophobicContact CD1-CG1 4.33Å; L2316-V2320 HydrophobicContact CD1-CG2 4.35Å; L2316-V2320 WeakPolarHBondContact O-CB 3.31Å; L2316-V2320 PolarHBondContact O-N 3.09Å; V2320-P2323 WeakPolarHBondContact O-CD 3.43Å; V2320-L2324 HydrophobicContact CG1-CD1 3.89Å; V2320-L2324 VanDerWaalsContact O-CB 3.31Å; V2320-L2324 WeakPolarHBondContact O-CB 3.31Å; V2320-L2324 VanDerWaalsContact O-CD1 3.27Å; V2320-L2324 WeakPolarHBondContact O-CD1 3.4Å; V2320-L2324 VanDerWaalsContact O-CG 3.25Å; V2320-L2324 WeakPolarHBondContact O-CG 3.32Å; V2320-L2324 PolarHBondContact O-N 3.07Å; V2320-L2324 VanDerWaalsContact O-N 3.16Å
2321L82.5Confident74.1Confident0.6 Ų0.648.4 Ų48.40%0.00328%0.275CS..Iπ-helixtrans-71.4-44-171-70.1170000113.7P2290 L2316 L2325 L2373 L2376 L2377 C2380P2290-L2321 HydrophobicContact CB-CD2 3.71Å; P2290-L2321 HydrophobicContact CB-CG 4.35Å; P2290-L2321 HydrophobicContact CG-CD2 4.18Å; L2316-L2321 HydrophobicContact CD1-CD1 4.48Å; L2316-L2321 HydrophobicContact CD1-CG 4.47Å; L2316-L2321 HydrophobicContact CD2-CD1 4.42Å; L2316-L2321 HydrophobicContact CG-CD1 4.01Å; L2316-L2321 HydrophobicContact CG-CG 4.38Å; L2316-L2321 WeakPolarHBondContact O-CB 3.34Å; L2316-L2321 WeakPolarHBondContact O-CG 3.36Å; L2316-L2321 PolarHBondContact O-N 3.3Å; L2321-L2325 WeakPolarHBondContact O-CG 3.3Å; L2321-L2325 PolarHBondContact O-N 3.01Å; L2321-L2325 VanDerWaalsContact O-N 3.13Å; L2321-L2373 HydrophobicContact CD2-CD2 4.1Å; L2321-L2376 HydrophobicContact CD1-CG 4.37Å; L2321-L2376 HydrophobicContact CD2-CD2 4.1Å; L2321-L2376 HydrophobicContact CD2-CG 4.43Å; L2321-L2377 HydrophobicContact CB-CB 4.44Å; L2321-L2377 HydrophobicContact CB-CD1 3.95Å; L2321-L2377 HydrophobicContact CD1-CB 4.35Å; L2321-L2377 HydrophobicContact CD1-CD1 4.12Å; L2321-C2380 HydrophobicContact CD1-CB 4.23Å
2322E82.6Confident71.7Confident35.6 Ų35.652.7 Ų52.717%0.16629%0.294CS..Hα-helixtrans-64.6-46.4177.4-78.4-178-158.200112.7K2317 L2324 L2325 R2326 L2377K2317-E2322 VanDerWaalsContact CE-OE1 3.24Å; K2317-E2322 WeakPolarHBondContact CE-OE1 3.35Å; K2317-E2322 HydrophobicContact CG-CG 4.48Å; K2317-E2322 VanDerWaalsContact CG-OE1 3.32Å; K2317-E2322 WeakPolarHBondContact CG-OE1 3.42Å; K2317-E2322 IonicContact NZ-OE1 2.62Å; K2317-E2322 WeakPolarHBondContact O-CB 3.36Å; K2317-E2322 WeakPolarHBondContact O-CG 3.23Å; K2317-E2322 PolarHBondContact O-N 3.1Å; E2322-L2324 PolarHBondContact O-N 2.86Å; E2322-L2325 PolarHBondContact O-N 3.15Å; E2322-L2325 VanDerWaalsContact O-N 3.14Å; E2322-R2326 WeakPolarHBondContact O-CB 3.32Å; E2322-R2326 VanDerWaalsContact O-CG 3.32Å; E2322-R2326 WeakPolarHBondContact O-CG 3.37Å; E2322-R2326 PolarHBondContact O-N 3.17Å; E2322-R2326 IonicContact OE2-CZ 3.43Å; E2322-R2326 VanDerWaalsContact OE2-CZ 3.28Å; E2322-R2326 IonicContact OE2-NE 2.71Å; E2322-R2326 IonicContact OE2-NH1 3.47Å; E2322-R2326 PolarHBondContact OE2-NH1 3.19Å; E2322-R2326 IonicContact OE2-NH2 3.33Å; E2322-R2326 PolarHBondContact OE2-NH2 3.29Å; E2322-L2377 HydrophobicContact CG-CD1 4.49Å; E2322-L2377 HydrophobicContact CG-CD2 4.13Å
2323P79.8Confident69.7Low58 Ų5857.2 Ų57.238%0.37733%0.327SS..Hα-helixtrans-60.3-42.7175.2-28.738.4000113.7T2318 H2319 V2320 L2325 R2326 A2327T2318-P2323 VanDerWaalsContact O-CD 3.27Å; T2318-P2323 WeakPolarHBondContact O-CD 3.34Å; T2318-P2323 WeakPolarHBondContact O-CG 3.36Å; H2319-P2323 WeakPolarHBondContact O-CG 3.33Å; V2320-P2323 WeakPolarHBondContact O-CD 3.43Å; P2323-L2325 VanDerWaalsContact C-N 3.29Å; P2323-L2325 PolarHBondContact O-N 3.14Å; P2323-R2326 PolarHBondContact O-N 3.12Å; P2323-R2326 VanDerWaalsContact O-N 3.16Å; P2323-A2327 WeakPolarHBondContact O-CB 3.44Å; P2323-A2327 PolarHBondContact O-N 3.1Å
2324L77.4Confident67.6Low51.2 Ų51.261.4 Ų61.427%0.26836%0.361SS..Hα-helixtrans-60-31.9177-75.2170000112.6P2290 V2320 E2322 L2343P2290-L2324 HydrophobicContact CG-CD1 4.17Å; V2320-L2324 HydrophobicContact CG1-CD1 3.89Å; V2320-L2324 VanDerWaalsContact O-CB 3.31Å; V2320-L2324 WeakPolarHBondContact O-CB 3.31Å; V2320-L2324 VanDerWaalsContact O-CD1 3.27Å; V2320-L2324 WeakPolarHBondContact O-CD1 3.4Å; V2320-L2324 VanDerWaalsContact O-CG 3.25Å; V2320-L2324 WeakPolarHBondContact O-CG 3.32Å; V2320-L2324 PolarHBondContact O-N 3.07Å; V2320-L2324 VanDerWaalsContact O-N 3.16Å; E2322-L2324 PolarHBondContact O-N 2.86Å; L2324-L2343 HydrophobicContact CD2-CD2 4.5Å
2325L77.4Confident65.5Low18 Ų1864.9 Ų64.99%0.09437%0.374CS..Hα-helixtrans-87-29.5177.3-69.3169000113.3L2321 E2322 P2323 A2327 E2328 R2370 L2373 R2374 L2377L2321-L2325 WeakPolarHBondContact O-CG 3.3Å; L2321-L2325 PolarHBondContact O-N 3.01Å; L2321-L2325 VanDerWaalsContact O-N 3.13Å; E2322-L2325 PolarHBondContact O-N 3.15Å; E2322-L2325 VanDerWaalsContact O-N 3.14Å; P2323-L2325 VanDerWaalsContact C-N 3.29Å; P2323-L2325 PolarHBondContact O-N 3.14Å; L2325-A2327 VanDerWaalsContact C-N 3.28Å; L2325-A2327 PolarHBondContact O-N 3.15Å; L2325-E2328 WeakPolarHBondContact O-CB 3.3Å; L2325-E2328 VanDerWaalsContact O-CG 3.26Å; L2325-E2328 WeakPolarHBondContact O-CG 3.5Å; L2325-E2328 PolarHBondContact O-N 3.16Å; L2325-R2370 HydrophobicContact CD2-CG 4.38Å; L2325-L2373 HydrophobicContact CD2-CB 4.22Å; L2325-R2374 HydrophobicContact CD1-CG 4.16Å; L2325-R2374 HydrophobicContact CD2-CG 3.76Å; L2325-L2377 HydrophobicContact CD1-CB 4.34Å; L2325-L2377 HydrophobicContact CD1-CD2 3.52Å; L2325-L2377 VanDerWaalsContact CD1-CD2 3.48Å
2326R70.7Confident63.3Low159.8 Ų159.870.1 Ų70.160%0.60340%0.398SS*.Hα-helixtrans-74.5-21.6179.4-79.1-173.5-168.6136.711.2114.3E2322 P2323 E2328 T2329E2322-R2326 WeakPolarHBondContact O-CB 3.32Å; E2322-R2326 VanDerWaalsContact O-CG 3.32Å; E2322-R2326 WeakPolarHBondContact O-CG 3.37Å; E2322-R2326 PolarHBondContact O-N 3.17Å; E2322-R2326 IonicContact OE2-CZ 3.43Å; E2322-R2326 VanDerWaalsContact OE2-CZ 3.28Å; E2322-R2326 IonicContact OE2-NE 2.71Å; E2322-R2326 IonicContact OE2-NH1 3.47Å; E2322-R2326 PolarHBondContact OE2-NH1 3.19Å; E2322-R2326 IonicContact OE2-NH2 3.33Å; E2322-R2326 PolarHBondContact OE2-NH2 3.29Å; P2323-R2326 PolarHBondContact O-N 3.12Å; P2323-R2326 VanDerWaalsContact O-N 3.16Å; R2326-E2328 PolarHBondContact O-N 3.18Å; R2326-E2328 VanDerWaalsContact O-N 3.14Å; R2326-T2329 PolarHBondContact O-N 3.19Å; R2326-T2329 PolarHBondContact O-OG1 3.12Å
2327A60.6Low61.2Low50.8 Ų50.873.9 Ų73.942%0.4243%0.425SS..G310 helixtrans-59.9-3.2176.400000114.2P2323 L2325 T2329 I2331P2323-A2327 WeakPolarHBondContact O-CB 3.44Å; P2323-A2327 PolarHBondContact O-N 3.1Å; L2325-A2327 VanDerWaalsContact C-N 3.28Å; L2325-A2327 PolarHBondContact O-N 3.15Å; A2327-T2329 VanDerWaalsContact C-N 3.33Å; A2327-T2329 PolarHBondContact O-N 3.09Å; A2327-I2331 WeakPolarHBondContact O-CD1 3.35Å; A2327-I2331 WeakPolarHBondContact O-CG1 3.29Å
2328E50.3Low59.1Low74.2 Ų74.275.7 Ų75.735%0.34744%0.439SS..G310 helixtrans-74.9-23.9178.5-84.4-176.7158.900116.1L2325 R2326 G2330 I2331 L2343 R2370 R2374L2325-E2328 WeakPolarHBondContact O-CB 3.3Å; L2325-E2328 VanDerWaalsContact O-CG 3.26Å; L2325-E2328 WeakPolarHBondContact O-CG 3.5Å; L2325-E2328 PolarHBondContact O-N 3.16Å; R2326-E2328 PolarHBondContact O-N 3.18Å; R2326-E2328 VanDerWaalsContact O-N 3.14Å; E2328-G2330 PolarHBondContact O-N 3.28Å; E2328-I2331 HydrophobicContact CB-CD1 4.37Å; E2328-I2331 HydrophobicContact CG-CD1 4.43Å; E2328-L2343 WeakPolarHBondContact OE1-CD1 3.36Å; E2328-R2370 VanDerWaalsContact CG-NH1 3.32Å; E2328-R2370 VanDerWaalsContact CG-NH2 3.34Å; E2328-R2370 IonicContact OE1-CZ 3.98Å; E2328-R2370 IonicContact OE1-NH1 3Å; E2328-R2370 PolarHBondContact OE1-NH1 3.4Å; E2328-R2370 IonicContact OE1-NH2 3.24Å; E2328-R2370 PolarHBondContact OE1-NH2 3.34Å; E2328-R2370 WeakPolarHBondContact OE2-CD 3.39Å; E2328-R2370 IonicContact OE2-CZ 3.49Å; E2328-R2370 IonicContact OE2-NE 3.24Å; E2328-R2370 PolarHBondContact OE2-NE 3.16Å; E2328-R2370 IonicContact OE2-NH1 3.53Å; E2328-R2370 PolarHBondContact OE2-NH1 2.88Å; E2328-R2370 IonicContact OE2-NH2 2.94Å; E2328-R2374 IonicContact OE1-CZ 2.94Å; E2328-R2374 IonicContact OE1-NE 3.79Å; E2328-R2374 IonicContact OE1-NH2 3.36Å; E2328-R2374 PolarHBondContact OE1-NH2 3.29Å; E2328-R2374 IonicContact OE2-NH2 2.82Å; E2328-R2374 PolarHBondContact OE2-NH2 3.22Å
2329T45.9Very low57.2Low129.6 Ų129.674.3 Ų74.380%0.79543%0.43SS*.G310 helixtrans-88.58.3-163.8550000116R2326 A2327R2326-T2329 PolarHBondContact O-N 3.19Å; R2326-T2329 PolarHBondContact O-OG1 3.12Å; A2327-T2329 VanDerWaalsContact C-N 3.33Å; A2327-T2329 PolarHBondContact O-N 3.09Å
2330G39.8Very low55.4Low56 Ų5670.9 Ų70.958%0.57741%0.414SS*.G310 helixtrans-153.445.7-18000000115.8E2328 N2332 Q2335E2328-G2330 PolarHBondContact O-N 3.28Å; G2330-N2332 PolarHBondContact O-N 3.36Å; G2330-N2332 VanDerWaalsContact O-N 3.15Å; G2330-Q2335 PolarHBondContact O-OE1 3.02Å
2331I41.1Very low53.7Low63.4 Ų63.474.8 Ų74.833%0.32543%0.43SS..  trans-104.3103.6-174.4-55.8176.8000111.3A2327 E2328 Q2335 Q2336 V2339A2327-I2331 WeakPolarHBondContact O-CD1 3.35Å; A2327-I2331 WeakPolarHBondContact O-CG1 3.29Å; E2328-I2331 HydrophobicContact CB-CD1 4.37Å; E2328-I2331 HydrophobicContact CG-CD1 4.43Å; I2331-Q2335 HydrophobicContact CG2-CB 4.07Å; I2331-Q2335 VanDerWaalsContact CG2-CB 3.46Å; I2331-Q2335 HydrophobicContact CG2-CG 4.33Å; I2331-Q2335 VanDerWaalsContact CG2-OE1 3.28Å; I2331-Q2336 HydrophobicContact CG2-CB 4.38Å; I2331-Q2336 HydrophobicContact CG2-CG 3.63Å; I2331-V2339 HydrophobicContact CD1-CB 4.22Å; I2331-V2339 HydrophobicContact CD1-CG1 4.12Å; I2331-V2339 HydrophobicContact CD1-CG2 4.17Å
2332N35.6Very low51.9Low132.2 Ų132.280.8 Ų80.871%0.70746%0.462SS*.  trans-69.4150.8158.2-73.8-32.2000109.8G2330 A2334 Q2335G2330-N2332 PolarHBondContact O-N 3.36Å; G2330-N2332 VanDerWaalsContact O-N 3.15Å; N2332-A2334 PolarHBondContact O-N 3.37Å; N2332-Q2335 PolarHBondContact O-N 3.1Å; N2332-Q2335 VanDerWaalsContact O-N 3.15Å
2333S43.5Very low50.2Low101.4 Ų101.480.8 Ų80.871%0.70946%0.462SS*.G310 helixtrans-49.9-25.1-174.248.30000115.9Q2335 Q2336S2333-Q2335 VanDerWaalsContact C-N 3.33Å; S2333-Q2335 PolarHBondContact O-N 3.09Å; S2333-Q2336 PolarHBondContact O-N 2.95Å
2334A43Very low48.6Very low87 Ų8778.9 Ų78.972%0.71945%0.451SS*.G310 helixtrans-75.6-15.1178.800000115.3N2332 S2337N2332-A2334 PolarHBondContact O-N 3.37Å; A2334-S2337 PolarHBondContact O-OG 2.93Å
2335Q41.2Very low46.9Very low109.4 Ų109.480.3 Ų80.351%0.51146%0.463SS..G310 helixtrans-102.31.3179.4-79.2179.1-27.500113.8G2330 I2331 N2332 S2333 S2337 S2338 V2339G2330-Q2335 PolarHBondContact O-OE1 3.02Å; I2331-Q2335 HydrophobicContact CG2-CB 4.07Å; I2331-Q2335 VanDerWaalsContact CG2-CB 3.46Å; I2331-Q2335 HydrophobicContact CG2-CG 4.33Å; I2331-Q2335 VanDerWaalsContact CG2-OE1 3.28Å; N2332-Q2335 PolarHBondContact O-N 3.1Å; N2332-Q2335 VanDerWaalsContact O-N 3.15Å; S2333-Q2335 VanDerWaalsContact C-N 3.33Å; S2333-Q2335 PolarHBondContact O-N 3.09Å; Q2335-S2337 VanDerWaalsContact C-N 3.25Å; Q2335-S2337 PolarHBondContact O-N 3.08Å; Q2335-S2337 VanDerWaalsContact O-N 3.15Å; Q2335-S2338 PolarHBondContact O-N 3.05Å; Q2335-S2338 PolarHBondContact O-OG 2.94Å; Q2335-V2339 WeakPolarHBondContact O-CG2 3.33Å; Q2335-V2339 PolarHBondContact O-N 3.22Å
2336Q41.5Very low45.2Very low124.8 Ų124.884.7 Ų84.758%0.58349%0.487SS*.Hα-helixtrans-60.3-33.6175-73.6-178-13.200112.1I2331 S2333 S2338 V2339 F2340I2331-Q2336 HydrophobicContact CG2-CB 4.38Å; I2331-Q2336 HydrophobicContact CG2-CG 3.63Å; S2333-Q2336 PolarHBondContact O-N 2.95Å; Q2336-S2338 PolarHBondContact O-N 3.34Å; Q2336-V2339 PolarHBondContact O-N 3.26Å; Q2336-F2340 WeakPolarHBondContact O-CB 3.3Å; Q2336-F2340 PolarHBondContact O-N 3.1Å; Q2336-F2340 VanDerWaalsContact O-N 3.1Å
2337S41.1Very low43.7Very low83.4 Ų83.480.3 Ų80.358%0.58347%0.474SS*.Hα-helixtrans-66.3-36179.2-28.90000113.7A2334 Q2335 F2340 Q2341A2334-S2337 PolarHBondContact O-OG 2.93Å; Q2335-S2337 VanDerWaalsContact C-N 3.25Å; Q2335-S2337 PolarHBondContact O-N 3.08Å; Q2335-S2337 VanDerWaalsContact O-N 3.15Å; S2337-F2340 WeakPolarHBondContact O-CB 3.47Å; S2337-Q2341 WeakPolarHBondContact O-CG 3.31Å; S2337-Q2341 PolarHBondContact O-N 3.22Å; S2337-Q2341 VanDerWaalsContact O-N 3.14Å
2338S42.2Very low42.5Very low51.4 Ų51.482 Ų8236%0.35948%0.476SS..Hα-helixtrans-78.4-32.7179.259.50000112.6Q2335 Q2336 F2340 Q2341 L2342Q2335-S2338 PolarHBondContact O-N 3.05Å; Q2335-S2338 PolarHBondContact O-OG 2.94Å; Q2336-S2338 PolarHBondContact O-N 3.34Å; S2338-F2340 VanDerWaalsContact C-N 3.31Å; S2338-Q2341 PolarHBondContact O-N 3.35Å; S2338-L2342 WeakPolarHBondContact O-CG 3.28Å; S2338-L2342 PolarHBondContact O-N 3.01Å
2339V44.1Very low41.8Very low24.4 Ų24.485.1 Ų85.115%0.14850%0.495CS..Hα-helixtrans-70.3-34.7173.4178.50000111I2331 Q2335 Q2336 Q2341 L2342 L2343I2331-V2339 HydrophobicContact CD1-CB 4.22Å; I2331-V2339 HydrophobicContact CD1-CG1 4.12Å; I2331-V2339 HydrophobicContact CD1-CG2 4.17Å; Q2335-V2339 WeakPolarHBondContact O-CG2 3.33Å; Q2335-V2339 PolarHBondContact O-N 3.22Å; Q2336-V2339 PolarHBondContact O-N 3.26Å; V2339-Q2341 VanDerWaalsContact C-N 3.32Å; V2339-Q2341 PolarHBondContact O-N 3.5Å; V2339-L2342 PolarHBondContact O-N 3Å; V2339-L2342 VanDerWaalsContact O-N 3.12Å; V2339-L2343 HydrophobicContact CG1-CD1 3.66Å; V2339-L2343 HydrophobicContact CG1-CG 4.24Å; V2339-L2343 WeakPolarHBondContact O-CB 3.4Å; V2339-L2343 VanDerWaalsContact O-CG 3.3Å; V2339-L2343 WeakPolarHBondContact O-CG 3.41Å; V2339-L2343 PolarHBondContact O-N 3.04Å; V2339-L2343 VanDerWaalsContact O-N 3.13Å
2340F42.8Very low41.2Very low42.8 Ų42.882.4 Ų82.419%0.18849%0.486CS..Hα-helixtrans-62.7-42.8172.3-168.4-99.6000112Q2336 S2337 S2338 L2342 L2343 S2344 L2347 I2362 I2366Q2336-F2340 WeakPolarHBondContact O-CB 3.3Å; Q2336-F2340 PolarHBondContact O-N 3.1Å; Q2336-F2340 VanDerWaalsContact O-N 3.1Å; S2337-F2340 WeakPolarHBondContact O-CB 3.47Å; S2338-F2340 VanDerWaalsContact C-N 3.31Å; F2340-L2342 VanDerWaalsContact C-N 3.28Å; F2340-L2342 PolarHBondContact O-N 3.13Å; F2340-L2343 PolarHBondContact O-N 3.02Å; F2340-S2344 CarbonylContact O-C 3.59Å; F2340-S2344 WeakPolarHBondContact O-CA 3.4Å; F2340-S2344 PolarHBondContact O-N 3.21Å; F2340-L2347 HydrophobicContact CE1-CB 4.02Å; F2340-L2347 HydrophobicContact CE1-CD1 4.38Å; F2340-L2347 HydrophobicContact CE2-CD1 4.44Å; F2340-L2347 HydrophobicContact CZ-CB 4.18Å; F2340-L2347 HydrophobicContact CZ-CD1 3.85Å; F2340-L2347 HydrophobicContact CZ-CD2 4.37Å; F2340-L2347 HydrophobicContact CZ-CG 4.39Å; F2340-I2362 HydrophobicContact CD2-CG2 4.18Å; F2340-I2362 HydrophobicContact CE2-CG2 3.96Å; F2340-I2362 HydrophobicContact CZ-CG2 4Å; F2340-I2366 HydrophobicContact CD2-CD1 3.95Å; F2340-I2366 HydrophobicContact CD2-CG1 4.04Å; F2340-I2366 HydrophobicContact CE2-CD1 4.04Å; F2340-I2366 HydrophobicContact CE2-CG1 3.87Å
2341Q43.7Very low41Very low116.6 Ų116.687.5 Ų87.555%0.54550%0.5SS..Hα-helixtrans-61.7-31.9173.6-78.5177.2-21.100113.4S2337 S2338 V2339 P2345 L2348S2337-Q2341 WeakPolarHBondContact O-CG 3.31Å; S2337-Q2341 PolarHBondContact O-N 3.22Å; S2337-Q2341 VanDerWaalsContact O-N 3.14Å; S2338-Q2341 PolarHBondContact O-N 3.35Å; V2339-Q2341 VanDerWaalsContact C-N 3.32Å; V2339-Q2341 PolarHBondContact O-N 3.5Å; Q2341-P2345 WeakPolarHBondContact O-CA 3.34Å; Q2341-L2348 HydrophobicContact CG-CD1 3.88Å
2342L46.1Very low40.8Very low127.6 Ų127.692.3 Ų92.367%0.66852%0.521SS*.Hα-helixtrans-81.5-33.4178.6-80.5161.6000113.7S2338 V2339 F2340S2338-L2342 WeakPolarHBondContact O-CG 3.28Å; S2338-L2342 PolarHBondContact O-N 3.01Å; V2339-L2342 PolarHBondContact O-N 3Å; V2339-L2342 VanDerWaalsContact O-N 3.12Å; F2340-L2342 VanDerWaalsContact C-N 3.28Å; F2340-L2342 PolarHBondContact O-N 3.13Å
2343L46.9Very low40.9Very low33.8 Ų33.891.4 Ų91.418%0.17752%0.521CS..Hα-helixtrans-84-32.2179.9-71.8167.5000112.5L2324 E2328 V2339 F2340 I2366 R2370 L2373L2324-L2343 HydrophobicContact CD2-CD2 4.5Å; E2328-L2343 WeakPolarHBondContact OE1-CD1 3.36Å; V2339-L2343 HydrophobicContact CG1-CD1 3.66Å; V2339-L2343 HydrophobicContact CG1-CG 4.24Å; V2339-L2343 WeakPolarHBondContact O-CB 3.4Å; V2339-L2343 VanDerWaalsContact O-CG 3.3Å; V2339-L2343 WeakPolarHBondContact O-CG 3.41Å; V2339-L2343 PolarHBondContact O-N 3.04Å; V2339-L2343 VanDerWaalsContact O-N 3.13Å; F2340-L2343 PolarHBondContact O-N 3.02Å; L2343-I2366 HydrophobicContact CD1-CG2 4.22Å; L2343-R2370 HydrophobicContact CD1-CG 4.48Å; L2343-L2373 HydrophobicContact CD2-CD1 3.96Å
2344S44.9Very low40.7Very low19.6 Ų19.692.6 Ų92.614%0.13752%0.518CS..  trans-142.178.5-177.1-91.70000111F2340 N2346 L2347 E2369F2340-S2344 CarbonylContact O-C 3.59Å; F2340-S2344 WeakPolarHBondContact O-CA 3.4Å; F2340-S2344 PolarHBondContact O-N 3.21Å; S2344-N2346 PolarHBondContact O-N 3.04Å; S2344-N2346 VanDerWaalsContact O-N 3.14Å; S2344-L2347 PolarHBondContact O-N 3.29Å; S2344-E2369 VanDerWaalsContact OG-CD 3.25Å; S2344-E2369 PolarHBondContact OG-OE1 3.16Å; S2344-E2369 VanDerWaalsContact OG-OE1 3.1Å; S2344-E2369 PolarHBondContact OG-OE2 3.11Å
2345P43Very low40.6Very low80.8 Ų80.896.3 Ų96.353%0.52553%0.526SS..G310 helixtrans-60.6-21.3177.74.5-6.5000113.5Q2341 L2347 L2348Q2341-P2345 WeakPolarHBondContact O-CA 3.34Å; P2345-L2347 PolarHBondContact O-N 2.72Å; P2345-L2348 PolarHBondContact O-N 3.24Å
2346N41.3Very low40.9Very low110.4 Ų110.494.5 Ų94.559%0.5954%0.536SS*.G310 helixtrans-93.4-4.1-169-68.3-1.2000115.1S2344 L2348 N2349S2344-N2346 PolarHBondContact O-N 3.04Å; S2344-N2346 VanDerWaalsContact O-N 3.14Å; N2346-L2348 VanDerWaalsContact C-N 3.29Å; N2346-L2348 PolarHBondContact O-N 2.93Å; N2346-N2349 PolarHBondContact O-N 3.49Å
2347L39.1Very low41.1Very low65.8 Ų65.892.4 Ų92.435%0.34553%0.529SS..G310 helixtrans-79-6177-110.8151.6000113.5F2340 S2344 P2345 L2357F2340-L2347 HydrophobicContact CE1-CB 4.02Å; F2340-L2347 HydrophobicContact CE1-CD1 4.38Å; F2340-L2347 HydrophobicContact CE2-CD1 4.44Å; F2340-L2347 HydrophobicContact CZ-CB 4.18Å; F2340-L2347 HydrophobicContact CZ-CD1 3.85Å; F2340-L2347 HydrophobicContact CZ-CD2 4.37Å; F2340-L2347 HydrophobicContact CZ-CG 4.39Å; S2344-L2347 PolarHBondContact O-N 3.29Å; P2345-L2347 PolarHBondContact O-N 2.72Å; L2347-L2357 HydrophobicContact CD2-CD1 4.46Å
2348L34.5Very low41.8Very low87.8 Ų87.893.7 Ų93.746%0.4653%0.529SS..G310 helixtrans-105.19.1177.1-72.1169000113.4Q2341 P2345 N2346 A2350 L2354Q2341-L2348 HydrophobicContact CG-CD1 3.88Å; P2345-L2348 PolarHBondContact O-N 3.24Å; N2346-L2348 VanDerWaalsContact C-N 3.29Å; N2346-L2348 PolarHBondContact O-N 2.93Å; L2348-A2350 PolarHBondContact O-N 3.24Å; L2348-L2354 HydrophobicContact CD2-CD1 3.96Å; L2348-L2354 HydrophobicContact CD2-CD2 3.8Å
2349N35.6Very low42.5Very low138.2 Ų138.295.9 Ų95.974%0.73955%0.545SS*.SBendtrans-83.334.4171-83.5-8.9000111.6N2346 N2351 E2352N2346-N2349 PolarHBondContact O-N 3.49Å; N2349-N2351 PolarHBondContact O-N 3.07Å; N2349-E2352 PolarHBondContact O-N 3.32Å; N2349-E2352 VanDerWaalsContact O-N 3.12Å
2350A34.5Very low43.4Very low73.4 Ų73.4104.1 Ų104.161%0.60757%0.573SS**SBendtrans-77.486.5170.500000112.1L2348 E2352L2348-A2350 PolarHBondContact O-N 3.24Å; A2350-E2352 PolarHBondContact O-N 3.28Å
2351N34.9Very low44.3Very low163.8 Ų163.8107.3 Ų107.388%0.87659%0.588SS**THydrogen-bonded Turntrans-69.415.5170.1-77.1-18.7000115.5N2349N2349-N2351 PolarHBondContact O-N 3.07Å
2352E36.4Very low45.1Very low164.2 Ų164.2104.2 Ų104.277%0.76758%0.575SS**SBendtrans-109.499174.1-70.7-173.9167.500110.4N2349 A2350 L2354N2349-E2352 PolarHBondContact O-N 3.32Å; N2349-E2352 VanDerWaalsContact O-N 3.12Å; A2350-E2352 PolarHBondContact O-N 3.28Å; E2352-L2354 PolarHBondContact O-N 3.19Å
2353T38.1Very low46.2Very low113.4 Ų113.4103.9 Ų103.970%0.69657%0.57SS**  trans-61.392.4178.251.10000114D2355T2353-D2355 PolarHBondContact O-N 3.26Å
2354L40Very low47.4Very low125.2 Ų125.2107.1 Ų107.166%0.65559%0.586SS**SBendtrans-69.3-2.8177.7-157.374.4000114.4L2348 E2352 G2356L2348-L2354 HydrophobicContact CD2-CD1 3.96Å; L2348-L2354 HydrophobicContact CD2-CD2 3.8Å; E2352-L2354 PolarHBondContact O-N 3.19Å; L2354-G2356 VanDerWaalsContact C-N 3.29Å; L2354-G2356 PolarHBondContact O-N 2.98Å
2355D41Very low48.6Very low165.6 Ų165.6110.6 Ų110.689%0.88660%0.601SS**THydrogen-bonded Turntrans-94.88-171.1-74.8-24.2000114.9T2353T2353-D2355 PolarHBondContact O-N 3.26Å
2356G46.1Very low49.9Very low70.6 Ų70.6108.7 Ų108.773%0.72859%0.586SS**THydrogen-bonded Turntrans-127.7-1.8-172.800000117.9L2354 D2358L2354-G2356 VanDerWaalsContact C-N 3.29Å; L2354-G2356 PolarHBondContact O-N 2.98Å; G2356-D2358 PolarHBondContact O-N 3Å
2357L47.4Very low51.7Low82.2 Ų82.2108.1 Ų108.143%0.4358%0.582SS.*  trans-92.9114.5-176.3-79.9147000111.7L2347 S2359 Q2361 I2362L2347-L2357 HydrophobicContact CD2-CD1 4.46Å; L2357-S2359 PolarHBondContact O-N 3.24Å; L2357-Q2361 VanDerWaalsContact CD2-OE1 3.26Å; L2357-I2362 HydrophobicContact CB-CD1 4.06Å; L2357-I2362 HydrophobicContact CB-CG1 4.31Å; L2357-I2362 HydrophobicContact CD2-CD1 4.07Å; L2357-I2362 HydrophobicContact CD2-CG1 3.94Å
2358D54.9Low53.5Low109.2 Ų109.2109.2 Ų109.258%0.58459%0.588SS**  trans-53.7123.9173.5-113.3-11.2000110.6G2356 R2360 Q2361 I2362G2356-D2358 PolarHBondContact O-N 3Å; D2358-R2360 PolarHBondContact O-N 3.22Å; D2358-Q2361 HydrophobicContact CB-CG 4.23Å; D2358-Q2361 WeakPolarHBondContact O-CB 3.24Å; D2358-Q2361 PolarHBondContact O-N 3.19Å; D2358-I2362 PolarHBondContact O-N 2.91Å
2359S56.5Low55.5Low98.4 Ų98.4107.3 Ų107.369%0.68858%0.576SS**Hα-helixtrans-53-27.7-174.6-55.20000113.9L2357 Q2361 I2362 E2363L2357-S2359 PolarHBondContact O-N 3.24Å; S2359-Q2361 VanDerWaalsContact C-N 3.32Å; S2359-Q2361 PolarHBondContact O-N 3.32Å; S2359-I2362 PolarHBondContact O-N 2.87Å; S2359-E2363 WeakPolarHBondContact O-CB 3.45Å; S2359-E2363 PolarHBondContact O-N 3.12Å; S2359-E2363 VanDerWaalsContact O-N 3.11Å
2360R62.7Low57.5Low197 Ų197103.3 Ų103.374%0.74355%0.551SS**Hα-helixtrans-65.1-36.4175.2-73.1-176.2174.7179.80.1113.5D2358 E2363 I2364D2358-R2360 PolarHBondContact O-N 3.22Å; R2360-E2363 PolarHBondContact O-N 3.03Å; R2360-I2364 WeakPolarHBondContact O-CD1 3.35Å; R2360-I2364 VanDerWaalsContact O-CG1 3.27Å; R2360-I2364 WeakPolarHBondContact O-CG1 3.38Å; R2360-I2364 PolarHBondContact O-N 3.16Å; R2360-I2364 VanDerWaalsContact O-N 3.1Å
2361Q62.1Low59.8Low109.2 Ų109.2104.5 Ų104.551%0.5154%0.543SS..Hα-helixtrans-69.7-40.5179.8-66.2-175.24.100111L2357 D2358 S2359 E2363 I2364 Q2365L2357-Q2361 VanDerWaalsContact CD2-OE1 3.26Å; D2358-Q2361 HydrophobicContact CB-CG 4.23Å; D2358-Q2361 WeakPolarHBondContact O-CB 3.24Å; D2358-Q2361 PolarHBondContact O-N 3.19Å; S2359-Q2361 VanDerWaalsContact C-N 3.32Å; S2359-Q2361 PolarHBondContact O-N 3.32Å; Q2361-E2363 VanDerWaalsContact C-N 3.33Å; Q2361-E2363 PolarHBondContact O-N 3.13Å; Q2361-I2364 PolarHBondContact O-N 3.19Å; Q2361-Q2365 WeakPolarHBondContact O-CB 3.4Å; Q2361-Q2365 WeakPolarHBondContact O-CG 3.34Å; Q2361-Q2365 PolarHBondContact O-N 3.04Å
2362I61.2Low62.1Low51.4 Ų51.4100.7 Ų100.726%0.26452%0.52SS..Hα-helixtrans-61-45174.9-62172.5000110.2F2340 L2357 D2358 S2359 I2364 Q2365 I2366F2340-I2362 HydrophobicContact CD2-CG2 4.18Å; F2340-I2362 HydrophobicContact CE2-CG2 3.96Å; F2340-I2362 HydrophobicContact CZ-CG2 4Å; L2357-I2362 HydrophobicContact CB-CD1 4.06Å; L2357-I2362 HydrophobicContact CB-CG1 4.31Å; L2357-I2362 HydrophobicContact CD2-CD1 4.07Å; L2357-I2362 HydrophobicContact CD2-CG1 3.94Å; D2358-I2362 PolarHBondContact O-N 2.91Å; S2359-I2362 PolarHBondContact O-N 2.87Å; I2362-I2364 PolarHBondContact O-N 3.12Å; I2362-Q2365 WeakPolarHBondContact O-CB 3.25Å; I2362-Q2365 PolarHBondContact O-N 3.37Å; I2362-I2366 HydrophobicContact CG2-CD1 3.84Å; I2362-I2366 HydrophobicContact CG2-CG1 4.45Å; I2362-I2366 VanDerWaalsContact O-CG1 3.29Å; I2362-I2366 WeakPolarHBondContact O-CG1 3.39Å; I2362-I2366 PolarHBondContact O-N 3.3Å
2363E68.3Low64.3Low122.8 Ų122.894.1 Ų94.157%0.57449%0.489SS*.Hα-helixtrans-61.8-44.2177.9-167174.5-162.100112.2S2359 R2360 Q2361 Q2365 I2366 I2367S2359-E2363 WeakPolarHBondContact O-CB 3.45Å; S2359-E2363 PolarHBondContact O-N 3.12Å; S2359-E2363 VanDerWaalsContact O-N 3.11Å; R2360-E2363 PolarHBondContact O-N 3.03Å; Q2361-E2363 VanDerWaalsContact C-N 3.33Å; Q2361-E2363 PolarHBondContact O-N 3.13Å; E2363-Q2365 VanDerWaalsContact C-N 3.32Å; E2363-Q2365 PolarHBondContact O-N 3.16Å; E2363-I2366 PolarHBondContact O-N 3.33Å; E2363-I2367 HydrophobicContact CG-CD1 4.21Å; E2363-I2367 WeakPolarHBondContact O-CD1 3.46Å; E2363-I2367 VanDerWaalsContact O-CG1 3.25Å; E2363-I2367 WeakPolarHBondContact O-CG1 3.42Å; E2363-I2367 PolarHBondContact O-N 3.1Å
2364I72.3Confident66.6Low99.2 Ų99.293.3 Ų93.351%0.50947%0.474SS..Hα-helixtrans-61.9-40.9175.4-69.2165.4000111.4R2360 Q2361 I2362 I2367 N2368R2360-I2364 WeakPolarHBondContact O-CD1 3.35Å; R2360-I2364 VanDerWaalsContact O-CG1 3.27Å; R2360-I2364 WeakPolarHBondContact O-CG1 3.38Å; R2360-I2364 PolarHBondContact O-N 3.16Å; R2360-I2364 VanDerWaalsContact O-N 3.1Å; Q2361-I2364 PolarHBondContact O-N 3.19Å; I2362-I2364 PolarHBondContact O-N 3.12Å; I2364-I2367 PolarHBondContact O-N 3.26Å; I2364-N2368 WeakPolarHBondContact O-CB 3.28Å; I2364-N2368 PolarHBondContact O-N 3Å; I2364-N2368 VanDerWaalsContact O-N 3.07Å; I2364-N2368 PolarHBondContact O-ND2 3.31Å
2365Q69.5Low68.9Low93.4 Ų93.492.1 Ų92.144%0.43646%0.46SS..Hα-helixtrans-63.8-46.4178.3-154.6143-14.400111.4Q2361 I2362 E2363 I2367 N2368 E2369Q2361-Q2365 WeakPolarHBondContact O-CB 3.4Å; Q2361-Q2365 WeakPolarHBondContact O-CG 3.34Å; Q2361-Q2365 PolarHBondContact O-N 3.04Å; I2362-Q2365 WeakPolarHBondContact O-CB 3.25Å; I2362-Q2365 PolarHBondContact O-N 3.37Å; E2363-Q2365 VanDerWaalsContact C-N 3.32Å; E2363-Q2365 PolarHBondContact O-N 3.16Å; Q2365-I2367 VanDerWaalsContact C-N 3.33Å; Q2365-I2367 PolarHBondContact O-N 3.21Å; Q2365-N2368 WeakPolarHBondContact O-CB 3.48Å; Q2365-N2368 PolarHBondContact O-N 3.33Å; Q2365-N2368 VanDerWaalsContact O-N 3.13Å; Q2365-E2369 PolarHBondContact NE2-OE1 2.83Å; Q2365-E2369 WeakPolarHBondContact O-CG 3.4Å; Q2365-E2369 PolarHBondContact O-N 3.27Å
2366I72.3Confident71.1Confident41.6 Ų41.685.2 Ų85.221%0.21342%0.423CS..Hα-helixtrans-60.3-42.6176.7-67.4166.3000111F2340 L2343 I2362 E2363 N2368 E2369 R2370F2340-I2366 HydrophobicContact CD2-CD1 3.95Å; F2340-I2366 HydrophobicContact CD2-CG1 4.04Å; F2340-I2366 HydrophobicContact CE2-CD1 4.04Å; F2340-I2366 HydrophobicContact CE2-CG1 3.87Å; L2343-I2366 HydrophobicContact CD1-CG2 4.22Å; I2362-I2366 HydrophobicContact CG2-CD1 3.84Å; I2362-I2366 HydrophobicContact CG2-CG1 4.45Å; I2362-I2366 VanDerWaalsContact O-CG1 3.29Å; I2362-I2366 WeakPolarHBondContact O-CG1 3.39Å; I2362-I2366 PolarHBondContact O-N 3.3Å; E2363-I2366 PolarHBondContact O-N 3.33Å; I2366-N2368 VanDerWaalsContact C-N 3.32Å; I2366-N2368 PolarHBondContact O-N 3.27Å; I2366-E2369 PolarHBondContact O-N 3.01Å; I2366-R2370 HydrophobicContact CG2-CG 4.44Å; I2366-R2370 WeakPolarHBondContact O-CB 3.35Å; I2366-R2370 VanDerWaalsContact O-CG 3.26Å; I2366-R2370 WeakPolarHBondContact O-CG 3.43Å; I2366-R2370 PolarHBondContact O-N 3.19Å
2367I78.2Confident73.1Confident98.2 Ų98.281.9 Ų81.950%0.50439%0.389SS..Hα-helixtrans-61.3-42.6176.9-69.9165000110.8E2363 I2364 Q2365 K2371E2363-I2367 HydrophobicContact CG-CD1 4.21Å; E2363-I2367 WeakPolarHBondContact O-CD1 3.46Å; E2363-I2367 VanDerWaalsContact O-CG1 3.25Å; E2363-I2367 WeakPolarHBondContact O-CG1 3.42Å; E2363-I2367 PolarHBondContact O-N 3.1Å; I2364-I2367 PolarHBondContact O-N 3.26Å; Q2365-I2367 VanDerWaalsContact C-N 3.33Å; Q2365-I2367 PolarHBondContact O-N 3.21Å; I2367-K2371 VanDerWaalsContact O-CB 3.29Å; I2367-K2371 WeakPolarHBondContact O-CB 3.36Å; I2367-K2371 PolarHBondContact O-N 3.26Å
2368N77.7Confident75.1Confident88 Ų8878.1 Ų78.147%0.47137%0.369SS..Hα-helixtrans-67.2-44.7179-77.2-31.5000112.4I2364 Q2365 I2366 R2370 K2371 E2372I2364-N2368 WeakPolarHBondContact O-CB 3.28Å; I2364-N2368 PolarHBondContact O-N 3Å; I2364-N2368 VanDerWaalsContact O-N 3.07Å; I2364-N2368 PolarHBondContact O-ND2 3.31Å; Q2365-N2368 WeakPolarHBondContact O-CB 3.48Å; Q2365-N2368 PolarHBondContact O-N 3.33Å; Q2365-N2368 VanDerWaalsContact O-N 3.13Å; I2366-N2368 VanDerWaalsContact C-N 3.32Å; I2366-N2368 PolarHBondContact O-N 3.27Å; N2368-R2370 VanDerWaalsContact C-N 3.32Å; N2368-R2370 PolarHBondContact O-N 3.12Å; N2368-K2371 WeakPolarHBondContact O-CB 3.43Å; N2368-K2371 PolarHBondContact O-N 3.27Å; N2368-K2371 VanDerWaalsContact O-N 3.15Å; N2368-E2372 WeakPolarHBondContact O-CG 3.46Å; N2368-E2372 PolarHBondContact O-N 3.07Å
2369E74.8Confident76.7Confident48.2 Ų48.278.3 Ų78.323%0.22537%0.365CS..Hα-helixtrans-62-43.5176.6-73-177.2171.100111.6S2344 Q2365 I2366 K2371 E2372 L2373S2344-E2369 VanDerWaalsContact OG-CD 3.25Å; S2344-E2369 PolarHBondContact OG-OE1 3.16Å; S2344-E2369 VanDerWaalsContact OG-OE1 3.1Å; S2344-E2369 PolarHBondContact OG-OE2 3.11Å; Q2365-E2369 PolarHBondContact NE2-OE1 2.83Å; Q2365-E2369 WeakPolarHBondContact O-CG 3.4Å; Q2365-E2369 PolarHBondContact O-N 3.27Å; I2366-E2369 PolarHBondContact O-N 3.01Å; E2369-K2371 VanDerWaalsContact C-N 3.31Å; E2369-K2371 PolarHBondContact O-N 3.13Å; E2369-E2372 CarbonylContact O-C 3.59Å; E2369-E2372 WeakPolarHBondContact O-CA 3.31Å; E2369-E2372 PolarHBondContact O-N 3.08Å; E2369-E2372 VanDerWaalsContact O-N 3.13Å; E2369-L2373 WeakPolarHBondContact O-CG 3.42Å; E2369-L2373 PolarHBondContact O-N 3.23Å
2370R78.4Confident78.3Confident54 Ų5473.6 Ų73.620%0.20433%0.332CS..Hα-helixtrans-62.2-37.9174.4-88178.8-177.9-1700112.5L2325 E2328 L2343 I2366 N2368 E2372 L2373 R2374L2325-R2370 HydrophobicContact CD2-CG 4.38Å; E2328-R2370 VanDerWaalsContact CG-NH1 3.32Å; E2328-R2370 VanDerWaalsContact CG-NH2 3.34Å; E2328-R2370 IonicContact OE1-CZ 3.98Å; E2328-R2370 IonicContact OE1-NH1 3Å; E2328-R2370 PolarHBondContact OE1-NH1 3.4Å; E2328-R2370 IonicContact OE1-NH2 3.24Å; E2328-R2370 PolarHBondContact OE1-NH2 3.34Å; E2328-R2370 WeakPolarHBondContact OE2-CD 3.39Å; E2328-R2370 IonicContact OE2-CZ 3.49Å; E2328-R2370 IonicContact OE2-NE 3.24Å; E2328-R2370 PolarHBondContact OE2-NE 3.16Å; E2328-R2370 IonicContact OE2-NH1 3.53Å; E2328-R2370 PolarHBondContact OE2-NH1 2.88Å; E2328-R2370 IonicContact OE2-NH2 2.94Å; L2343-R2370 HydrophobicContact CD1-CG 4.48Å; I2366-R2370 HydrophobicContact CG2-CG 4.44Å; I2366-R2370 WeakPolarHBondContact O-CB 3.35Å; I2366-R2370 VanDerWaalsContact O-CG 3.26Å; I2366-R2370 WeakPolarHBondContact O-CG 3.43Å; I2366-R2370 PolarHBondContact O-N 3.19Å; N2368-R2370 VanDerWaalsContact C-N 3.32Å; N2368-R2370 PolarHBondContact O-N 3.12Å; R2370-E2372 VanDerWaalsContact C-N 3.33Å; R2370-E2372 PolarHBondContact O-N 2.97Å; R2370-L2373 PolarHBondContact O-N 3.06Å; R2370-R2374 VanDerWaalsContact CZ-NH2 3.3Å; R2370-R2374 VanDerWaalsContact NE-NH2 3.18Å; R2370-R2374 WeakPolarHBondContact O-CB 3.31Å; R2370-R2374 VanDerWaalsContact O-CG 3.31Å; R2370-R2374 WeakPolarHBondContact O-CG 3.41Å; R2370-R2374 PolarHBondContact O-N 3.13Å
2371K82.5Confident79.6Confident98.8 Ų98.864.2 Ų64.243%0.4330%0.297SS..Hα-helixtrans-64.7-39.6174.9-169.8176.3-174.7176.30111.5I2367 N2368 E2369 R2375I2367-K2371 VanDerWaalsContact O-CB 3.29Å; I2367-K2371 WeakPolarHBondContact O-CB 3.36Å; I2367-K2371 PolarHBondContact O-N 3.26Å; N2368-K2371 WeakPolarHBondContact O-CB 3.43Å; N2368-K2371 PolarHBondContact O-N 3.27Å; N2368-K2371 VanDerWaalsContact O-N 3.15Å; E2369-K2371 VanDerWaalsContact C-N 3.31Å; E2369-K2371 PolarHBondContact O-N 3.13Å; K2371-R2375 VanDerWaalsContact CE-NH2 3.33Å; K2371-R2375 WeakPolarHBondContact O-CB 3.38Å; K2371-R2375 WeakPolarHBondContact O-CD 3.4Å; K2371-R2375 VanDerWaalsContact O-CG 3.26Å; K2371-R2375 WeakPolarHBondContact O-CG 3.33Å; K2371-R2375 PolarHBondContact O-N 3.11Å; K2371-R2375 VanDerWaalsContact O-N 3.1Å
2372E82.5Confident80.9Confident84.6 Ų84.660.4 Ų60.440%0.39528%0.28SS..Hα-helixtrans-67-41.4174.1-70.8-123140.500112.3R2246 N2368 E2369 R2370 R2375 L2376R2246-E2372 IonicContact CZ-OE1 3.25Å; R2246-E2372 VanDerWaalsContact NH2-CD 3.27Å; R2246-E2372 IonicContact NH2-OE1 2.78Å; R2246-E2372 PolarHBondContact NH2-OE1 3.18Å; R2246-E2372 IonicContact NH2-OE2 3.28Å; R2246-E2372 PolarHBondContact NH2-OE2 2.79Å; N2368-E2372 WeakPolarHBondContact O-CG 3.46Å; N2368-E2372 PolarHBondContact O-N 3.07Å; E2369-E2372 CarbonylContact O-C 3.59Å; E2369-E2372 WeakPolarHBondContact O-CA 3.31Å; E2369-E2372 PolarHBondContact O-N 3.08Å; E2369-E2372 VanDerWaalsContact O-N 3.13Å; R2370-E2372 VanDerWaalsContact C-N 3.33Å; R2370-E2372 PolarHBondContact O-N 2.97Å; E2372-R2375 CarbonylContact O-C 3.6Å; E2372-R2375 WeakPolarHBondContact O-CB 3.4Å; E2372-R2375 PolarHBondContact O-N 3.22Å; E2372-R2375 WeakPolarHBondContact OE1-CD 3.46Å; E2372-R2375 IonicContact OE1-CZ 3.56Å; E2372-R2375 IonicContact OE1-NE 3.62Å; E2372-R2375 IonicContact OE1-NH1 3.18Å; E2372-R2375 PolarHBondContact OE1-NH1 3.32Å; E2372-L2376 WeakPolarHBondContact O-CB 3.37Å; E2372-L2376 PolarHBondContact O-N 3.24Å
2373L84.3Confident82.2Confident25 Ų2561.9 Ų61.913%0.13129%0.285CS..Hα-helixtrans-62.1-44.7174.5-75.1169.5000112.3P2290 L2321 L2325 L2343 E2369 R2370 R2375 L2376 L2377P2290-L2373 HydrophobicContact CG-CD2 4.41Å; L2321-L2373 HydrophobicContact CD2-CD2 4.1Å; L2325-L2373 HydrophobicContact CD2-CB 4.22Å; L2343-L2373 HydrophobicContact CD2-CD1 3.96Å; E2369-L2373 WeakPolarHBondContact O-CG 3.42Å; E2369-L2373 PolarHBondContact O-N 3.23Å; R2370-L2373 PolarHBondContact O-N 3.06Å; L2373-R2375 VanDerWaalsContact C-N 3.33Å; L2373-R2375 PolarHBondContact O-N 3.12Å; L2373-L2376 WeakPolarHBondContact O-CB 3.45Å; L2373-L2376 PolarHBondContact O-N 3.02Å; L2373-L2376 VanDerWaalsContact O-N 3.14Å; L2373-L2377 WeakPolarHBondContact O-CB 3.46Å; L2373-L2377 PolarHBondContact O-N 3.13Å
2374R86.1Confident83.2Confident97.2 Ų97.256.1 Ų56.137%0.36726%0.257SS..Hα-helixtrans-60.6-42.3174.6-73.3179-173.31742.8111.8L2325 E2328 R2370 L2376 L2377 A2378 H2525L2325-R2374 HydrophobicContact CD1-CG 4.16Å; L2325-R2374 HydrophobicContact CD2-CG 3.76Å; E2328-R2374 IonicContact OE1-CZ 2.94Å; E2328-R2374 IonicContact OE1-NE 3.79Å; E2328-R2374 IonicContact OE1-NH2 3.36Å; E2328-R2374 PolarHBondContact OE1-NH2 3.29Å; E2328-R2374 IonicContact OE2-NH2 2.82Å; E2328-R2374 PolarHBondContact OE2-NH2 3.22Å; R2370-R2374 VanDerWaalsContact CZ-NH2 3.3Å; R2370-R2374 VanDerWaalsContact NE-NH2 3.18Å; R2370-R2374 WeakPolarHBondContact O-CB 3.31Å; R2370-R2374 VanDerWaalsContact O-CG 3.31Å; R2370-R2374 WeakPolarHBondContact O-CG 3.41Å; R2370-R2374 PolarHBondContact O-N 3.13Å; R2374-L2376 VanDerWaalsContact C-N 3.33Å; R2374-L2376 PolarHBondContact O-N 2.98Å; R2374-L2377 PolarHBondContact O-N 3.28Å; R2374-A2378 WeakPolarHBondContact O-CB 3.29Å; R2374-A2378 PolarHBondContact O-N 3.15Å; R2374-H2525 HydrophobicContact CB-CB 4.34Å
2375R87Confident83.9Confident100.4 Ų100.451.4 Ų51.438%0.37923%0.233SC..Hα-helixtrans-65-36.8174.7-75.4170.1170.4178-5.9112.2K2371 E2372 L2373 A2378 K2379 D2528K2371-R2375 VanDerWaalsContact CE-NH2 3.33Å; K2371-R2375 WeakPolarHBondContact O-CB 3.38Å; K2371-R2375 WeakPolarHBondContact O-CD 3.4Å; K2371-R2375 VanDerWaalsContact O-CG 3.26Å; K2371-R2375 WeakPolarHBondContact O-CG 3.33Å; K2371-R2375 PolarHBondContact O-N 3.11Å; K2371-R2375 VanDerWaalsContact O-N 3.1Å; E2372-R2375 CarbonylContact O-C 3.6Å; E2372-R2375 WeakPolarHBondContact O-CB 3.4Å; E2372-R2375 PolarHBondContact O-N 3.22Å; E2372-R2375 WeakPolarHBondContact OE1-CD 3.46Å; E2372-R2375 IonicContact OE1-CZ 3.56Å; E2372-R2375 IonicContact OE1-NE 3.62Å; E2372-R2375 IonicContact OE1-NH1 3.18Å; E2372-R2375 PolarHBondContact OE1-NH1 3.32Å; L2373-R2375 VanDerWaalsContact C-N 3.33Å; L2373-R2375 PolarHBondContact O-N 3.12Å; R2375-A2378 PolarHBondContact O-N 3.28Å; R2375-K2379 VanDerWaalsContact O-CD 3.26Å; R2375-K2379 WeakPolarHBondContact O-CD 3.27Å; R2375-K2379 WeakPolarHBondContact O-CE 3.27Å; R2375-K2379 VanDerWaalsContact O-CG 3.29Å; R2375-K2379 WeakPolarHBondContact O-CG 3.36Å; R2375-K2379 PolarHBondContact O-N 3.05Å; R2375-K2379 VanDerWaalsContact O-N 3.09Å; R2375-D2528 IonicContact CZ-OD2 3.37Å; R2375-D2528 IonicContact NE-OD2 2.74Å; R2375-D2528 IonicContact NH2-OD2 3.09Å; R2375-D2528 PolarHBondContact NH2-OD2 3.43Å
2376L87.4Confident84.8Confident19.2 Ų19.248.8 Ų48.810%0.10123%0.225CC..Hα-helixtrans-67.5-45.6175.7-178.561.3000111P2290 A2291 F2294 L2321 E2372 L2373 R2374 A2378 K2379 C2380P2290-L2376 HydrophobicContact CB-CD2 3.71Å; A2291-L2376 HydrophobicContact CB-CD2 4.15Å; F2294-L2376 HydrophobicContact CB-CD1 4.01Å; F2294-L2376 HydrophobicContact CD1-CD1 3.57Å; F2294-L2376 VanDerWaalsContact CD1-CD1 3.45Å; F2294-L2376 HydrophobicContact CE1-CD1 4.23Å; F2294-L2376 HydrophobicContact CG-CD1 3.92Å; L2321-L2376 HydrophobicContact CD1-CG 4.37Å; L2321-L2376 HydrophobicContact CD2-CD2 4.1Å; L2321-L2376 HydrophobicContact CD2-CG 4.43Å; E2372-L2376 WeakPolarHBondContact O-CB 3.37Å; E2372-L2376 PolarHBondContact O-N 3.24Å; L2373-L2376 WeakPolarHBondContact O-CB 3.45Å; L2373-L2376 PolarHBondContact O-N 3.02Å; L2373-L2376 VanDerWaalsContact O-N 3.14Å; R2374-L2376 VanDerWaalsContact C-N 3.33Å; R2374-L2376 PolarHBondContact O-N 2.98Å; L2376-A2378 VanDerWaalsContact C-N 3.34Å; L2376-A2378 PolarHBondContact O-N 3.25Å; L2376-K2379 CarbonylContact O-C 3.55Å; L2376-K2379 WeakPolarHBondContact O-CA 3.28Å; L2376-K2379 WeakPolarHBondContact O-CB 3.34Å; L2376-K2379 PolarHBondContact O-N 3.11Å; L2376-K2379 VanDerWaalsContact O-N 3.13Å; L2376-C2380 WeakPolarHBondContact O-CB 3.45Å; L2376-C2380 PolarHBondContact O-N 3.16Å; L2376-C2380 PolarHBondContact O-SG 3.08Å
2377L88.7Confident85.6Confident1 Ų147.2 Ų47.21%0.00522%0.217CC..Hα-helixtrans-58.2-45174.1178.859000111.6K2317 L2321 E2322 L2325 L2373 R2374 K2379 C2380 C2381 H2525K2317-L2377 HydrophobicContact CB-CD1 4.43Å; K2317-L2377 HydrophobicContact CG-CD1 3.93Å; L2321-L2377 HydrophobicContact CB-CB 4.44Å; L2321-L2377 HydrophobicContact CB-CD1 3.95Å; L2321-L2377 HydrophobicContact CD1-CB 4.35Å; L2321-L2377 HydrophobicContact CD1-CD1 4.12Å; E2322-L2377 HydrophobicContact CG-CD1 4.49Å; E2322-L2377 HydrophobicContact CG-CD2 4.13Å; L2325-L2377 HydrophobicContact CD1-CB 4.34Å; L2325-L2377 HydrophobicContact CD1-CD2 3.52Å; L2325-L2377 VanDerWaalsContact CD1-CD2 3.48Å; L2373-L2377 WeakPolarHBondContact O-CB 3.46Å; L2373-L2377 PolarHBondContact O-N 3.13Å; R2374-L2377 PolarHBondContact O-N 3.28Å; L2377-K2379 VanDerWaalsContact C-N 3.32Å; L2377-K2379 PolarHBondContact O-N 3.03Å; L2377-C2380 WeakPolarHBondContact O-CB 3.29Å; L2377-C2380 PolarHBondContact O-N 3.22Å; L2377-C2380 VanDerWaalsContact O-N 3.16Å; L2377-C2381 WeakPolarHBondContact O-CB 3.44Å; L2377-C2381 PolarHBondContact O-N 3.1Å; L2377-C2381 PolarHBondContact O-SG 3.04Å; L2377-C2381 VanDerWaalsContact O-SG 3.41Å; L2377-H2525 VanDerWaalsContact CD2-CD2 3.47Å; L2377-H2525 WeakPolarHBondContact CD2-CD2 3.37Å; L2377-H2525 VanDerWaalsContact CD2-NE2 3.31Å; L2377-H2525 WeakPolarHBondContact CD2-NE2 3.39Å
2378A88.6Confident85.9Confident2.8 Ų2.843.7 Ų43.72%0.02320%0.197CC..Hα-helixtrans-59.9-41174.800000112.4R2374 R2375 L2376 C2381 L2382 A2522 H2525 A2526 T2532R2374-A2378 WeakPolarHBondContact O-CB 3.29Å; R2374-A2378 PolarHBondContact O-N 3.15Å; R2375-A2378 PolarHBondContact O-N 3.28Å; L2376-A2378 VanDerWaalsContact C-N 3.34Å; L2376-A2378 PolarHBondContact O-N 3.25Å; A2378-C2381 PolarHBondContact O-N 2.95Å; A2378-L2382 VanDerWaalsContact O-CB 3.31Å; A2378-L2382 WeakPolarHBondContact O-CB 3.43Å; A2378-L2382 WeakPolarHBondContact O-CG 3.38Å; A2378-L2382 PolarHBondContact O-N 3.13Å; A2378-A2522 HydrophobicContact CB-CB 4.34Å; A2378-H2525 HydrophobicContact CB-CB 4.4Å; A2378-A2526 HydrophobicContact CB-CB 3.53Å; A2378-A2526 VanDerWaalsContact CB-CB 3.48Å; A2378-T2532 HydrophobicContact CB-CG2 4.35Å
2379K89.5Confident86.1Confident113 Ų11341.3 Ų41.349%0.49119%0.187SC..Hα-helixtrans-65.8-39.3174.4-72.1167.4-174.7171.40112.4F2294 R2375 L2376 L2377 L2382 K2383F2294-K2379 HydrophobicContact CE1-CB 4.05Å; F2294-K2379 HydrophobicContact CZ-CB 4.01Å; R2375-K2379 VanDerWaalsContact O-CD 3.26Å; R2375-K2379 WeakPolarHBondContact O-CD 3.27Å; R2375-K2379 WeakPolarHBondContact O-CE 3.27Å; R2375-K2379 VanDerWaalsContact O-CG 3.29Å; R2375-K2379 WeakPolarHBondContact O-CG 3.36Å; R2375-K2379 PolarHBondContact O-N 3.05Å; R2375-K2379 VanDerWaalsContact O-N 3.09Å; L2376-K2379 CarbonylContact O-C 3.55Å; L2376-K2379 WeakPolarHBondContact O-CA 3.28Å; L2376-K2379 WeakPolarHBondContact O-CB 3.34Å; L2376-K2379 PolarHBondContact O-N 3.11Å; L2376-K2379 VanDerWaalsContact O-N 3.13Å; L2377-K2379 VanDerWaalsContact C-N 3.32Å; L2377-K2379 PolarHBondContact O-N 3.03Å; K2379-L2382 PolarHBondContact O-N 3.42Å; K2379-K2383 WeakPolarHBondContact O-CB 3.35Å; K2379-K2383 WeakPolarHBondContact O-CG 3.3Å; K2379-K2383 PolarHBondContact O-N 3.07Å
2380C89.5Confident86.4Confident0.6 Ų0.643.3 Ų43.30%0.00420%0.197CC..Hα-helixtrans-62.2-51.3175.3-830000110.2F2294 L2313 L2321 L2376 L2377 L2382 K2383 L2384F2294-C2380 HydrophobicContact CD2-CB 4.5Å; F2294-C2380 VanDerWaalsContact CD2-SG 3.52Å; F2294-C2380 WeakPolarHBondContact CD2-SG 3.37Å; F2294-C2380 HydrophobicContact CE2-CB 4.42Å; L2313-C2380 HydrophobicContact CD1-CB 3.94Å; L2313-C2380 WeakPolarHBondContact CD1-SG 3.31Å; L2321-C2380 HydrophobicContact CD1-CB 4.23Å; L2376-C2380 WeakPolarHBondContact O-CB 3.45Å; L2376-C2380 PolarHBondContact O-N 3.16Å; L2376-C2380 PolarHBondContact O-SG 3.08Å; L2377-C2380 WeakPolarHBondContact O-CB 3.29Å; L2377-C2380 PolarHBondContact O-N 3.22Å; L2377-C2380 VanDerWaalsContact O-N 3.16Å; C2380-L2382 VanDerWaalsContact C-N 3.33Å; C2380-L2382 PolarHBondContact O-N 3.12Å; C2380-K2383 PolarHBondContact O-N 3.19Å; C2380-K2383 VanDerWaalsContact O-N 3.09Å; C2380-L2384 VanDerWaalsContact O-CB 3.25Å; C2380-L2384 WeakPolarHBondContact O-CB 3.35Å; C2380-L2384 PolarHBondContact O-N 3.16Å
2381C89.9Confident86.5Confident0 Ų043.2 Ų43.20%020%0.2CC..Hα-helixtrans-61.7-39.2177.6-69.30000112.8L2377 A2378 L2384 G2385 C2518 T2521 A2522L2377-C2381 WeakPolarHBondContact O-CB 3.44Å; L2377-C2381 PolarHBondContact O-N 3.1Å; L2377-C2381 PolarHBondContact O-SG 3.04Å; L2377-C2381 VanDerWaalsContact O-SG 3.41Å; A2378-C2381 PolarHBondContact O-N 2.95Å; C2381-L2384 PolarHBondContact O-N 3.05Å; C2381-G2385 PolarHBondContact O-N 3.09Å; C2381-C2518 VanDerWaalsContact CB-O 3.3Å; C2381-C2518 WeakPolarHBondContact CB-O 3.36Å; C2381-T2521 PolarHBondContact SG-OG1 2.97Å; C2381-T2521 VanDerWaalsContact SG-OG1 3.4Å; C2381-A2522 HydrophobicContact CB-CB 3.94Å
2382L89.4Confident86.1Confident29.8 Ų29.842.3 Ų42.316%0.15619%0.194CC..Hα-helixtrans-62.4-43.1173.8-96.2169.3000112.3A2378 K2379 C2380 G2385 S2386 Y2519 A2522 N2531 T2532 S2535A2378-L2382 VanDerWaalsContact O-CB 3.31Å; A2378-L2382 WeakPolarHBondContact O-CB 3.43Å; A2378-L2382 WeakPolarHBondContact O-CG 3.38Å; A2378-L2382 PolarHBondContact O-N 3.13Å; K2379-L2382 PolarHBondContact O-N 3.42Å; C2380-L2382 VanDerWaalsContact C-N 3.33Å; C2380-L2382 PolarHBondContact O-N 3.12Å; L2382-G2385 PolarHBondContact O-N 2.98Å; L2382-S2386 WeakPolarHBondContact O-CB 3.26Å; L2382-S2386 PolarHBondContact O-N 3.17Å; L2382-S2386 VanDerWaalsContact O-N 3.13Å; L2382-S2386 PolarHBondContact O-OG 3.22Å; L2382-Y2519 HydrophobicContact CD2-CD1 3.76Å; L2382-Y2519 HydrophobicContact CD2-CE1 3.97Å; L2382-Y2519 WeakPolarHBondContact O-CE1 3.44Å; L2382-A2522 HydrophobicContact CD2-CB 4.3Å; L2382-A2522 HydrophobicContact CG-CB 4.12Å; L2382-N2531 HydrophobicContact CD1-CB 4.43Å; L2382-T2532 HydrophobicContact CD1-CG2 3.7Å; L2382-T2532 VanDerWaalsContact CD1-CG2 3.49Å; L2382-T2532 HydrophobicContact CD2-CG2 4.34Å; L2382-T2532 HydrophobicContact CG-CG2 4.13Å; L2382-S2535 VanDerWaalsContact CD2-CB 3.46Å; L2382-S2535 WeakPolarHBondContact CD2-OG 3.24Å
2383K89.9Confident85.2Confident83 Ų8339.9 Ų39.936%0.36119%0.186SC..Hα-helixtrans-70.9-40.3177.4-79.4-66.9167.4-163.60112.1F2294 L2313 K2379 C2380 G2385 S2386 W2387F2294-K2383 HydrophobicContact CE2-CB 4.22Å; F2294-K2383 HydrophobicContact CE2-CG 4.23Å; F2294-K2383 HydrophobicContact CZ-CB 4.41Å; F2294-K2383 HydrophobicContact CZ-CG 3.99Å; L2313-K2383 HydrophobicContact CD2-CB 4.06Å; K2379-K2383 WeakPolarHBondContact O-CB 3.35Å; K2379-K2383 WeakPolarHBondContact O-CG 3.3Å; K2379-K2383 PolarHBondContact O-N 3.07Å; C2380-K2383 PolarHBondContact O-N 3.19Å; C2380-K2383 VanDerWaalsContact O-N 3.09Å; K2383-G2385 PolarHBondContact O-N 3.34Å; K2383-S2386 WeakPolarHBondContact CA-OG 3.44Å; K2383-S2386 PolarHBondContact NZ-OG 3.4Å; K2383-S2386 PolarHBondContact O-N 3.1Å; K2383-S2386 PolarHBondContact O-OG 3.12Å; K2383-W2387 HydrophobicContact CB-CD2 4.45Å; K2383-W2387 HydrophobicContact CB-CZ2 4.37Å; K2383-W2387 HydrophobicContact CD-CZ2 4.19Å; K2383-W2387 HydrophobicContact CG-CZ2 4.41Å; K2383-W2387 VanDerWaalsContact O-CB 3.29Å; K2383-W2387 WeakPolarHBondContact O-CB 3.36Å; K2383-W2387 PolarHBondContact O-N 3.08Å
2384L89.2Confident83.9Confident0.4 Ų0.448.1 Ų48.10%0.00222%0.215CC..Hα-helixtrans-60-50.1176.9-172.661.8000110.9V2310 L2313 C2314 K2317 C2380 C2381 S2386 W2387 Y2388 F2514V2310-L2384 HydrophobicContact CG1-CD1 3.97Å; L2313-L2384 HydrophobicContact CB-CD1 4.33Å; L2313-L2384 HydrophobicContact CD2-CB 3.76Å; L2313-L2384 HydrophobicContact CD2-CD1 4.14Å; L2313-L2384 HydrophobicContact CD2-CG 4.42Å; L2313-L2384 HydrophobicContact CG-CB 4.29Å; L2313-L2384 HydrophobicContact CG-CD1 4.28Å; C2314-L2384 VanDerWaalsContact SG-CD1 3.59Å; K2317-L2384 HydrophobicContact CD-CD2 4.07Å; C2380-L2384 VanDerWaalsContact O-CB 3.25Å; C2380-L2384 WeakPolarHBondContact O-CB 3.35Å; C2380-L2384 PolarHBondContact O-N 3.16Å; C2381-L2384 PolarHBondContact O-N 3.05Å; L2384-S2386 VanDerWaalsContact C-N 3.32Å; L2384-S2386 PolarHBondContact O-N 3.13Å; L2384-W2387 PolarHBondContact O-N 3.28Å; L2384-Y2388 WeakPolarHBondContact O-CB 3.4Å; L2384-Y2388 PolarHBondContact O-N 3.23Å; L2384-F2514 HydrophobicContact CD1-CE1 4.4Å; L2384-F2514 HydrophobicContact CD2-CE1 4.19Å; L2384-F2514 HydrophobicContact CD2-CZ 3.89Å; L2384-F2514 HydrophobicContact CG-CE1 4.11Å; L2384-F2514 HydrophobicContact CG-CZ 4.32Å
2385G86.4Confident81.8Confident0 Ų047.3 Ų47.30%022%0.224CC..Hα-helixtrans-60.5-39.8175.700000112.9C2381 L2382 K2383 S2389 V2515 Y2519C2381-G2385 PolarHBondContact O-N 3.09Å; L2382-G2385 PolarHBondContact O-N 2.98Å; K2383-G2385 PolarHBondContact O-N 3.34Å; G2385-S2389 WeakPolarHBondContact O-CB 3.31Å; G2385-S2389 PolarHBondContact O-N 3.26Å; G2385-V2515 WeakPolarHBondContact O-CG2 3.44Å; G2385-Y2519 VanDerWaalsContact C-OH 3.24Å; G2385-Y2519 PolarHBondContact O-OH 2.96Å
2386S87.9Confident79.6Confident39 Ų3946.9 Ų46.927%0.27323%0.234SC..Hα-helixtrans-66.8-45.2178.1162.80000112.3L2382 K2383 L2384 Y2388 S2389 E2390 Y2519L2382-S2386 WeakPolarHBondContact O-CB 3.26Å; L2382-S2386 PolarHBondContact O-N 3.17Å; L2382-S2386 VanDerWaalsContact O-N 3.13Å; L2382-S2386 PolarHBondContact O-OG 3.22Å; K2383-S2386 WeakPolarHBondContact CA-OG 3.44Å; K2383-S2386 PolarHBondContact NZ-OG 3.4Å; K2383-S2386 PolarHBondContact O-N 3.1Å; K2383-S2386 PolarHBondContact O-OG 3.12Å; L2384-S2386 VanDerWaalsContact C-N 3.32Å; L2384-S2386 PolarHBondContact O-N 3.13Å; S2386-Y2388 VanDerWaalsContact C-N 3.34Å; S2386-S2389 PolarHBondContact O-N 2.97Å; S2386-E2390 WeakPolarHBondContact O-CB 3.31Å; S2386-E2390 WeakPolarHBondContact O-CG 3.31Å; S2386-E2390 PolarHBondContact O-N 3.04Å; S2386-E2390 VanDerWaalsContact O-N 3.13Å; S2386-Y2519 VanDerWaalsContact CA-OH 3.3Å; S2386-Y2519 WeakPolarHBondContact CA-OH 3.3Å; S2386-Y2519 PolarHBondContact N-OH 3.09Å; S2386-Y2519 VanDerWaalsContact N-OH 3.09Å
2387W88.7Confident77.1Confident7.4 Ų7.451.8 Ų51.83%0.02827%0.267CS..Hα-helixtrans-70.4-41.1-178.8-69.3-12.8000111.8T2297 K2298 W2301 A2309 V2310 L2313 K2383 L2384 S2389 E2390 L2391T2297-W2387 WeakPolarHBondContact O-CH2 3.41Å; K2298-W2387 HydrophobicContact CB-CH2 4.39Å; K2298-W2387 HydrophobicContact CB-CZ2 4.42Å; K2298-W2387 HydrophobicContact CG-CH2 4.03Å; K2298-W2387 HydrophobicContact CG-CZ2 4.06Å; W2301-W2387 HydrophobicContact CB-CD2 4.45Å; W2301-W2387 HydrophobicContact CB-CH2 3.94Å; W2301-W2387 HydrophobicContact CB-CZ2 3.67Å; W2301-W2387 HydrophobicContact CB-CZ3 4.42Å; W2301-W2387 AromaticContact CD1-CE2 3.93Å; W2301-W2387 AromaticContact CD1-NE1 3.67Å; W2301-W2387 HydrophobicContact CD2-CB 4.41Å; W2301-W2387 AromaticContact CD2-CD1 3.57Å; W2301-W2387 VanDerWaalsContact CD2-CD1 3.42Å; W2301-W2387 AromaticContact CD2-CD2 3.69Å; W2301-W2387 HydrophobicContact CD2-CD2 3.69Å; W2301-W2387 AromaticContact CD2-CE2 3.58Å; W2301-W2387 HydrophobicContact CD2-CE3 4.35Å; W2301-W2387 AromaticContact CD2-CG 3.73Å; W2301-W2387 HydrophobicContact CD2-CG 3.73Å; W2301-W2387 HydrophobicContact CD2-CZ2 4.21Å; W2301-W2387 AromaticContact CD2-NE1 3.45Å; W2301-W2387 VanDerWaalsContact CD2-NE1 3.34Å; W2301-W2387 AromaticContact CE2-CD1 3.37Å; W2301-W2387 VanDerWaalsContact CE2-CD1 3.45Å; W2301-W2387 AromaticContact CE2-CG 3.88Å; W2301-W2387 AromaticContact CE2-NE1 3.47Å; W2301-W2387 HydrophobicContact CE3-CB 3.93Å; W2301-W2387 AromaticContact CE3-CD1 3.9Å; W2301-W2387 AromaticContact CE3-CD2 3.56Å; W2301-W2387 HydrophobicContact CE3-CD2 3.56Å; W2301-W2387 VanDerWaalsContact CE3-CD2 3.5Å; W2301-W2387 AromaticContact CE3-CE2 3.94Å; W2301-W2387 AromaticContact CE3-CE3 3.92Å; W2301-W2387 HydrophobicContact CE3-CE3 3.92Å; W2301-W2387 AromaticContact CE3-CG 3.57Å; W2301-W2387 HydrophobicContact CE3-CG 3.57Å; W2301-W2387 VanDerWaalsContact CE3-CG 3.48Å; W2301-W2387 HydrophobicContact CG-CD2 4.14Å; W2301-W2387 AromaticContact CG-CE2 3.56Å; W2301-W2387 VanDerWaalsContact CG-CE2 3.45Å; W2301-W2387 HydrophobicContact CG-CG 4.42Å; W2301-W2387 HydrophobicContact CG-CH2 4.41Å; W2301-W2387 AromaticContact CG-CZ2 3.74Å; W2301-W2387 HydrophobicContact CG-CZ2 3.74Å; W2301-W2387 AromaticContact CG-NE1 3.59Å; W2301-W2387 HydrophobicContact CH2-CB 3.59Å; W2301-W2387 AromaticContact CH2-CD1 3.84Å; W2301-W2387 AromaticContact CH2-CG 3.79Å; W2301-W2387 HydrophobicContact CH2-CG 3.79Å; W2301-W2387 WeakPolarHBondContact CH2-O 3.44Å; W2301-W2387 HydrophobicContact CZ2-CB 4.19Å; W2301-W2387 AromaticContact CZ2-CD1 3.52Å; W2301-W2387 VanDerWaalsContact CZ2-CD1 3.49Å; W2301-W2387 AromaticContact CZ2-CG 3.92Å; W2301-W2387 HydrophobicContact CZ2-CG 3.95Å; W2301-W2387 HydrophobicContact CZ3-CB 3.45Å; W2301-W2387 VanDerWaalsContact CZ3-CB 3.42Å; W2301-W2387 AromaticContact CZ3-CD1 3.99Å; W2301-W2387 HydrophobicContact CZ3-CD2 4.07Å; W2301-W2387 HydrophobicContact CZ3-CE3 4.44Å; W2301-W2387 AromaticContact CZ3-CG 3.6Å; W2301-W2387 HydrophobicContact CZ3-CG 3.6Å; W2301-W2387 AromaticContact NE1-CD1 3.84Å; W2301-W2387 AromaticContact NE1-NE1 3.57Å; A2309-W2387 HydrophobicContact CB-CE3 4.45Å; A2309-W2387 HydrophobicContact CB-CZ3 4.17Å; V2310-W2387 HydrophobicContact CG2-CB 3.94Å; V2310-W2387 HydrophobicContact CG2-CE3 4.33Å; L2313-W2387 HydrophobicContact CB-CZ3 4.27Å; L2313-W2387 HydrophobicContact CD2-CD2 4.49Å; L2313-W2387 HydrophobicContact CD2-CE3 3.62Å; L2313-W2387 HydrophobicContact CD2-CH2 4.32Å; L2313-W2387 HydrophobicContact CD2-CZ3 3.5Å; L2313-W2387 VanDerWaalsContact CD2-CZ3 3.46Å; L2313-W2387 HydrophobicContact CG-CZ3 4.42Å; K2383-W2387 HydrophobicContact CB-CD2 4.45Å; K2383-W2387 HydrophobicContact CB-CZ2 4.37Å; K2383-W2387 HydrophobicContact CD-CZ2 4.19Å; K2383-W2387 HydrophobicContact CG-CZ2 4.41Å; K2383-W2387 VanDerWaalsContact O-CB 3.29Å; K2383-W2387 WeakPolarHBondContact O-CB 3.36Å; K2383-W2387 PolarHBondContact O-N 3.08Å; L2384-W2387 PolarHBondContact O-N 3.28Å; W2387-S2389 VanDerWaalsContact C-N 3.32Å; W2387-S2389 PolarHBondContact O-N 3.21Å; W2387-E2390 PolarHBondContact O-N 3.1Å; W2387-L2391 VanDerWaalsContact O-CG 3.31Å; W2387-L2391 WeakPolarHBondContact O-CG 3.23Å; W2387-L2391 PolarHBondContact O-N 3.1Å
2388Y84.9Confident74.5Confident26 Ų2655.4 Ų55.410%0.10231%0.305CS..Hα-helixtrans-63.8-42175.3-155.7-83.2000111.1V2310 L2384 S2386 E2390 L2391 Y2392 Q2506 F2514 V2515V2310-Y2388 HydrophobicContact CG1-CD2 4.23Å; L2384-Y2388 WeakPolarHBondContact O-CB 3.4Å; L2384-Y2388 PolarHBondContact O-N 3.23Å; S2386-Y2388 VanDerWaalsContact C-N 3.34Å; Y2388-E2390 VanDerWaalsContact C-N 3.34Å; Y2388-E2390 PolarHBondContact O-N 3.24Å; Y2388-L2391 PolarHBondContact O-N 3.03Å; Y2388-Y2392 AromaticContact CD1-CD2 3.61Å; Y2388-Y2392 HydrophobicContact CD1-CD2 3.61Å; Y2388-Y2392 AromaticContact CD1-CE2 3.83Å; Y2388-Y2392 HydrophobicContact CD1-CE2 4.25Å; Y2388-Y2392 HydrophobicContact CD1-CG 4.39Å; Y2388-Y2392 AromaticContact CD2-CD2 3.79Å; Y2388-Y2392 HydrophobicContact CD2-CD2 3.87Å; Y2388-Y2392 AromaticContact CD2-CE2 3.76Å; Y2388-Y2392 HydrophobicContact CD2-CE2 3.76Å; Y2388-Y2392 AromaticContact CE1-CD2 3.51Å; Y2388-Y2392 HydrophobicContact CE1-CD2 3.51Å; Y2388-Y2392 VanDerWaalsContact CE1-CD2 3.47Å; Y2388-Y2392 AromaticContact CE1-CE2 3.52Å; Y2388-Y2392 HydrophobicContact CE1-CE2 4.13Å; Y2388-Y2392 HydrophobicContact CE1-CG 4.13Å; Y2388-Y2392 AromaticContact CE2-CD2 3.73Å; Y2388-Y2392 HydrophobicContact CE2-CD2 3.81Å; Y2388-Y2392 AromaticContact CE2-CE2 3.58Å; Y2388-Y2392 HydrophobicContact CE2-CE2 3.58Å; Y2388-Y2392 VanDerWaalsContact CE2-CE2 3.48Å; Y2388-Y2392 AromaticContact CG-CD2 3.78Å; Y2388-Y2392 HydrophobicContact CG-CD2 3.78Å; Y2388-Y2392 AromaticContact CG-CE2 3.9Å; Y2388-Y2392 HydrophobicContact CG-CE2 4.13Å; Y2388-Y2392 AromaticContact CZ-CD2 3.63Å; Y2388-Y2392 AromaticContact CZ-CE2 3.69Å; Y2388-Y2392 AromaticContact CZ-CZ 3.89Å; Y2388-Y2392 WeakPolarHBondContact O-CB 3.32Å; Y2388-Y2392 WeakPolarHBondContact O-CD2 3.39Å; Y2388-Y2392 PolarHBondContact O-N 3.08Å; Y2388-Y2392 VanDerWaalsContact O-N 3.15Å; Y2388-Q2506 VanDerWaalsContact OH-CD 3.31Å; Y2388-Q2506 PolarHBondContact OH-NE2 3.21Å; Y2388-Q2506 PolarHBondContact OH-OE1 3.08Å; Y2388-F2514 AromaticContact CD1-CD1 3.95Å; Y2388-F2514 HydrophobicContact CD1-CD1 4.01Å; Y2388-F2514 AromaticContact CD2-CD1 3.71Å; Y2388-F2514 HydrophobicContact CD2-CD1 3.81Å; Y2388-F2514 AromaticContact CD2-CE1 3.63Å; Y2388-F2514 HydrophobicContact CD2-CE1 3.74Å; Y2388-F2514 HydrophobicContact CE1-CD1 4.18Å; Y2388-F2514 AromaticContact CE2-CD1 3.9Å; Y2388-F2514 HydrophobicContact CE2-CD1 3.97Å; Y2388-F2514 AromaticContact CE2-CE1 3.87Å; Y2388-F2514 HydrophobicContact CE2-CE1 4.06Å; Y2388-F2514 AromaticContact CG-CD1 3.74Å; Y2388-F2514 HydrophobicContact CG-CD1 3.82Å; Y2388-F2514 AromaticContact CG-CE1 3.97Å; Y2388-F2514 HydrophobicContact CG-CE1 4.08Å; Y2388-V2515 HydrophobicContact CD1-CG2 3.96Å; Y2388-V2515 HydrophobicContact CG-CG2 4.41Å
2389S82.3Confident71.7Confident36.2 Ų36.258 Ų5825%0.25333%0.332SS..Hα-helixtrans-61.3-43.9172.9-176.10000111.9G2385 S2386 W2387 L2391 T2393 R2394G2385-S2389 WeakPolarHBondContact O-CB 3.31Å; G2385-S2389 PolarHBondContact O-N 3.26Å; S2386-S2389 PolarHBondContact O-N 2.97Å; W2387-S2389 VanDerWaalsContact C-N 3.32Å; W2387-S2389 PolarHBondContact O-N 3.21Å; S2389-L2391 VanDerWaalsContact C-N 3.33Å; S2389-L2391 PolarHBondContact O-N 3.36Å; S2389-T2393 VanDerWaalsContact C-OG1 3.24Å; S2389-T2393 VanDerWaalsContact CA-OG1 3.3Å; S2389-T2393 WeakPolarHBondContact CA-OG1 3.28Å; S2389-T2393 WeakPolarHBondContact CB-OG1 3.26Å; S2389-T2393 WeakPolarHBondContact O-CA 3.37Å; S2389-T2393 VanDerWaalsContact O-CB 3.26Å; S2389-T2393 WeakPolarHBondContact O-CB 3.37Å; S2389-T2393 WeakPolarHBondContact O-CG2 3.4Å; S2389-T2393 PolarHBondContact O-N 2.96Å; S2389-T2393 VanDerWaalsContact O-N 3.07Å; S2389-T2393 PolarHBondContact O-OG1 3.28Å; S2389-T2393 PolarHBondContact OG-OG1 3.28Å; S2389-R2394 PolarHBondContact O-N 2.98Å
2390E82Confident68.8Low91 Ų9161.2 Ų61.243%0.42535%0.348SS..Hα-helixtrans-65.4-35.7-179.7-159.1165.1-163.200113.4W2301 S2386 W2387 Y2388 R2394W2301-E2390 HydrophobicContact CH2-CB 4.36Å; W2301-E2390 HydrophobicContact CH2-CG 4.46Å; W2301-E2390 HydrophobicContact CZ2-CB 4.24Å; W2301-E2390 HydrophobicContact CZ2-CG 4.29Å; W2301-E2390 WeakPolarHBondContact CZ2-OE2 3.37Å; S2386-E2390 WeakPolarHBondContact O-CB 3.31Å; S2386-E2390 WeakPolarHBondContact O-CG 3.31Å; S2386-E2390 PolarHBondContact O-N 3.04Å; S2386-E2390 VanDerWaalsContact O-N 3.13Å; W2387-E2390 PolarHBondContact O-N 3.1Å; Y2388-E2390 VanDerWaalsContact C-N 3.34Å; Y2388-E2390 PolarHBondContact O-N 3.24Å; E2390-R2394 WeakPolarHBondContact O-CD 3.31Å; E2390-R2394 VanDerWaalsContact O-CG 3.27Å; E2390-R2394 WeakPolarHBondContact O-CG 3.35Å; E2390-R2394 PolarHBondContact O-NE 3.12Å; E2390-R2394 IonicContact OE1-CZ 2.92Å; E2390-R2394 VanDerWaalsContact OE1-CZ 3.27Å; E2390-R2394 IonicContact OE1-NH1 3.15Å; E2390-R2394 PolarHBondContact OE1-NH1 3.31Å; E2390-R2394 IonicContact OE1-NH2 3.59Å; E2390-R2394 PolarHBondContact OE1-NH2 3.23Å
2391L79.9Confident65.8Low51.6 Ų51.670.1 Ų70.127%0.2739%0.39SS..Hα-helixtrans-77-50.1177.5-72174.6000113W2301 H2306 E2307 V2310 W2387 Y2388 S2389W2301-L2391 HydrophobicContact CH2-CD1 4.33Å; W2301-L2391 HydrophobicContact CH2-CD2 4.34Å; W2301-L2391 HydrophobicContact CH2-CG 3.97Å; W2301-L2391 HydrophobicContact CZ3-CD1 4.03Å; W2301-L2391 HydrophobicContact CZ3-CG 4.18Å; H2306-L2391 HydrophobicContact CB-CD1 4.07Å; H2306-L2391 HydrophobicContact CB-CD2 3.79Å; H2306-L2391 HydrophobicContact CB-CG 4.37Å; E2307-L2391 HydrophobicContact CG-CD1 4.47Å; V2310-L2391 HydrophobicContact CG2-CD1 3.88Å; W2387-L2391 VanDerWaalsContact O-CG 3.31Å; W2387-L2391 WeakPolarHBondContact O-CG 3.23Å; W2387-L2391 PolarHBondContact O-N 3.1Å; Y2388-L2391 PolarHBondContact O-N 3.03Å; S2389-L2391 VanDerWaalsContact C-N 3.33Å; S2389-L2391 PolarHBondContact O-N 3.36Å
2392Y73.6Confident62.9Low80.8 Ų80.876.5 Ų76.532%0.31742%0.422SS..Hα-helixtrans-102.8-16.5-164.7-58.1-72.1000114.1Y2388 R2394 I2402Y2388-Y2392 AromaticContact CD1-CD2 3.61Å; Y2388-Y2392 HydrophobicContact CD1-CD2 3.61Å; Y2388-Y2392 AromaticContact CD1-CE2 3.83Å; Y2388-Y2392 HydrophobicContact CD1-CE2 4.25Å; Y2388-Y2392 HydrophobicContact CD1-CG 4.39Å; Y2388-Y2392 AromaticContact CD2-CD2 3.79Å; Y2388-Y2392 HydrophobicContact CD2-CD2 3.87Å; Y2388-Y2392 AromaticContact CD2-CE2 3.76Å; Y2388-Y2392 HydrophobicContact CD2-CE2 3.76Å; Y2388-Y2392 AromaticContact CE1-CD2 3.51Å; Y2388-Y2392 HydrophobicContact CE1-CD2 3.51Å; Y2388-Y2392 VanDerWaalsContact CE1-CD2 3.47Å; Y2388-Y2392 AromaticContact CE1-CE2 3.52Å; Y2388-Y2392 HydrophobicContact CE1-CE2 4.13Å; Y2388-Y2392 HydrophobicContact CE1-CG 4.13Å; Y2388-Y2392 AromaticContact CE2-CD2 3.73Å; Y2388-Y2392 HydrophobicContact CE2-CD2 3.81Å; Y2388-Y2392 AromaticContact CE2-CE2 3.58Å; Y2388-Y2392 HydrophobicContact CE2-CE2 3.58Å; Y2388-Y2392 VanDerWaalsContact CE2-CE2 3.48Å; Y2388-Y2392 AromaticContact CG-CD2 3.78Å; Y2388-Y2392 HydrophobicContact CG-CD2 3.78Å; Y2388-Y2392 AromaticContact CG-CE2 3.9Å; Y2388-Y2392 HydrophobicContact CG-CE2 4.13Å; Y2388-Y2392 AromaticContact CZ-CD2 3.63Å; Y2388-Y2392 AromaticContact CZ-CE2 3.69Å; Y2388-Y2392 AromaticContact CZ-CZ 3.89Å; Y2388-Y2392 WeakPolarHBondContact O-CB 3.32Å; Y2388-Y2392 WeakPolarHBondContact O-CD2 3.39Å; Y2388-Y2392 PolarHBondContact O-N 3.08Å; Y2388-Y2392 VanDerWaalsContact O-N 3.15Å; Y2392-R2394 PolarHBondContact O-N 3.41Å; Y2392-I2402 HydrophobicContact CE1-CD1 4.42Å
2393T63.7Low60Low34.2 Ų34.282.3 Ų82.321%0.2145%0.454CS..THydrogen-bonded Turntrans-101.9-10.5-176.969.20000114.1S2389 S2395 W2508 Q2512 V2515S2389-T2393 VanDerWaalsContact C-OG1 3.24Å; S2389-T2393 VanDerWaalsContact CA-OG1 3.3Å; S2389-T2393 WeakPolarHBondContact CA-OG1 3.28Å; S2389-T2393 WeakPolarHBondContact CB-OG1 3.26Å; S2389-T2393 WeakPolarHBondContact O-CA 3.37Å; S2389-T2393 VanDerWaalsContact O-CB 3.26Å; S2389-T2393 WeakPolarHBondContact O-CB 3.37Å; S2389-T2393 WeakPolarHBondContact O-CG2 3.4Å; S2389-T2393 PolarHBondContact O-N 2.96Å; S2389-T2393 VanDerWaalsContact O-N 3.07Å; S2389-T2393 PolarHBondContact O-OG1 3.28Å; S2389-T2393 PolarHBondContact OG-OG1 3.28Å; T2393-S2395 VanDerWaalsContact C-N 3.28Å; T2393-S2395 PolarHBondContact O-N 3.22Å; T2393-W2508 PolarHBondContact O-NE1 3.01Å; T2393-Q2512 VanDerWaalsContact CB-NE2 3.27Å; T2393-Q2512 HydrophobicContact CG2-CG 4.34Å; T2393-V2515 HydrophobicContact CG2-CG2 4.46Å
2394R56.8Low56.9Low197 Ų19785.4 Ų85.474%0.74347%0.474SS*.SBendtrans-77.50.3179-101.5-177.7-177.6-172.22.5113.6S2389 E2390 Y2392 P2396S2389-R2394 PolarHBondContact O-N 2.98Å; E2390-R2394 WeakPolarHBondContact O-CD 3.31Å; E2390-R2394 VanDerWaalsContact O-CG 3.27Å; E2390-R2394 WeakPolarHBondContact O-CG 3.35Å; E2390-R2394 PolarHBondContact O-NE 3.12Å; E2390-R2394 IonicContact OE1-CZ 2.92Å; E2390-R2394 VanDerWaalsContact OE1-CZ 3.27Å; E2390-R2394 IonicContact OE1-NH1 3.15Å; E2390-R2394 PolarHBondContact OE1-NH1 3.31Å; E2390-R2394 IonicContact OE1-NH2 3.59Å; E2390-R2394 PolarHBondContact OE1-NH2 3.23Å; Y2392-R2394 PolarHBondContact O-N 3.41Å; R2394-P2396 WeakPolarHBondContact O-CD 3.45Å
2395S42.4Very low54Low80.2 Ų80.294.3 Ų94.356%0.56152%0.515SS*.SBendtrans-89.5119.5179.1-63.80000111.5T2393T2393-S2395 VanDerWaalsContact C-N 3.28Å; T2393-S2395 PolarHBondContact O-N 3.22Å
2396P39.7Very low51.1Low92.2 Ų92.299.7 Ų99.760%0.59955%0.553SS**  trans-68.7146.4172.827.7-31.2000110.5R2394 G2398 G2399 H2546R2394-P2396 WeakPolarHBondContact O-CD 3.45Å; P2396-G2398 PolarHBondContact O-N 3.19Å; P2396-G2398 VanDerWaalsContact O-N 3.11Å; P2396-G2399 PolarHBondContact O-N 3.11Å; P2396-H2546 WeakPolarHBondContact CB-CE1 3.32Å
2397P35.4Very low48.2Very low121 Ų121105.5 Ų105.579%0.78658%0.58SS**THydrogen-bonded Turntrans-67.7103176.226.9-31000109.6
2398G34.9Very low45.1Very low78 Ų78109.3 Ų109.380%0.80461%0.614SS**THydrogen-bonded Turntrans161.5-3.3-17900000116.1P2396 H2400P2396-G2398 PolarHBondContact O-N 3.19Å; P2396-G2398 VanDerWaalsContact O-N 3.11Å; G2398-H2400 PolarHBondContact O-N 3Å
2399G28.5Very low42.4Very low56.2 Ų56.2118 Ų11858%0.57965%0.648SS**  trans-107.836.7-176.200000115.6P2396 Q2401P2396-G2399 PolarHBondContact O-N 3.11Å; G2399-Q2401 PolarHBondContact O-N 3.38Å
2400H29.5Very low39.7Very low181.2 Ų181.2121.8 Ų121.884%0.83967%0.669SS**  trans-103.4102.3170-76-59.3000112.5G2398 I2402G2398-H2400 PolarHBondContact O-N 3Å; H2400-I2402 VanDerWaalsContact C-N 3.26Å; H2400-I2402 HydrophobicContact CB-CD1 4.16Å; H2400-I2402 HydrophobicContact CB-CG1 3.83Å; H2400-I2402 PolarHBondContact O-N 3.12Å
2401Q27.2Very low37.1Very low186.6 Ų186.6122.1 Ų122.187%0.87268%0.679SS**  trans-65.1124.1156-70.1175-3500108G2399 D2403G2399-Q2401 PolarHBondContact O-N 3.38Å; Q2401-D2403 PolarHBondContact O-N 3.07Å
2402I29.3Very low34.6Very low134.6 Ų134.6126.4 Ų126.469%0.6970%0.702SS**  trans-84.3120.8159.2-58.2176.5000108Y2392 H2400 N2404Y2392-I2402 HydrophobicContact CE1-CD1 4.42Å; H2400-I2402 VanDerWaalsContact C-N 3.26Å; H2400-I2402 HydrophobicContact CB-CD1 4.16Å; H2400-I2402 HydrophobicContact CB-CG1 3.83Å; H2400-I2402 PolarHBondContact O-N 3.12Å; I2402-N2404 VanDerWaalsContact C-N 3.26Å; I2402-N2404 WeakPolarHBondContact CG2-OD1 3.43Å; I2402-N2404 PolarHBondContact O-N 2.97Å
2403D26.8Very low32.4Very low151.8 Ų151.8126.9 Ų126.981%0.81272%0.718SS**  trans-78.9122.8167.4-75.3-43.9000110.7Q2401 H2405Q2401-D2403 PolarHBondContact O-N 3.07Å; D2403-H2405 PolarHBondContact O-N 3.17Å; D2403-H2405 VanDerWaalsContact O-N 3.17Å
2404N26.3Very low30.9Very low147.8 Ų147.8130.6 Ų130.679%0.7974%0.741SS**  trans-69103.9-177.6-78-36.6000111.7I2402I2402-N2404 VanDerWaalsContact C-N 3.26Å; I2402-N2404 WeakPolarHBondContact CG2-OD1 3.43Å; I2402-N2404 PolarHBondContact O-N 2.97Å
2405H26.8Very low29.6Very low186.6 Ų186.6127.3 Ų127.386%0.86473%0.732SS**  trans-132.697.8152.9-93.2-65.7000111.2D2403 L2407D2403-H2405 PolarHBondContact O-N 3.17Å; D2403-H2405 VanDerWaalsContact O-N 3.17Å; H2405-L2407 PolarHBondContact O-N 3.41Å
2406S25.3Very low28.9Very low113.6 Ų113.6129.3 Ų129.379%0.79474%0.741SS**  trans-112.5124.8171.558.30000112.3A2408S2406-A2408 VanDerWaalsContact C-N 3.34Å; S2406-A2408 PolarHBondContact O-N 2.77Å
2407L27.1Very low28.4Very low160.6 Ų160.6128.4 Ų128.484%0.84174%0.741SS**  trans-110.5117.5160.4-77.9165.3000111H2405 Y2409H2405-L2407 PolarHBondContact O-N 3.41Å; L2407-Y2409 PolarHBondContact O-N 3.5Å
2408A25.4Very low28.2Very low89 Ų89127.7 Ų127.774%0.73675%0.745SS**  trans-93.6131.7174.100000111.2S2406S2406-A2408 VanDerWaalsContact C-N 3.34Å; S2406-A2408 PolarHBondContact O-N 2.77Å
2409Y26.8Very low28.1Very low207.2 Ų207.2128.5 Ų128.581%0.81374%0.739SS**  trans-136.7113.3158.9-109.1-94.7000110.6L2407 P2411L2407-Y2409 PolarHBondContact O-N 3.5Å; Y2409-P2411 WeakPolarHBondContact O-CD 3.29Å
2410T26.5Very low28.5Very low115.8 Ų115.8128.3 Ų128.371%0.7174%0.737SS**  trans-98.5117.1159.751.10000112.1N2412T2410-N2412 PolarHBondContact O-N 3.01Å
2411P27.5Very low29.2Very low98.4 Ų98.4124.9 Ų124.964%0.63973%0.725SS**  trans-76.8102.2169.725.3-20.7000109.3Y2409 S2413Y2409-P2411 WeakPolarHBondContact O-CD 3.29Å; P2411-S2413 VanDerWaalsContact C-N 3.25Å; P2411-S2413 PolarHBondContact O-N 3.26Å
2412N26Very low30.3Very low140.6 Ų140.6118 Ų11875%0.75270%0.703SS**  trans-99.395.3167.4-92.1-17.4000111.1T2410 V2414T2410-N2412 PolarHBondContact O-N 3.01Å; N2412-V2414 WeakPolarHBondContact O-CG2 3.41Å; N2412-V2414 PolarHBondContact O-N 3.06Å
2413S28.9Very low31.6Very low92.8 Ų92.8112.8 Ų112.865%0.64968%0.677SS**  trans-120.979.516777.10000111.8P2411 F2415 T2416P2411-S2413 VanDerWaalsContact C-N 3.25Å; P2411-S2413 PolarHBondContact O-N 3.26Å; S2413-F2415 PolarHBondContact O-N 3.24Å; S2413-T2416 PolarHBondContact O-N 2.88Å; S2413-T2416 VanDerWaalsContact O-N 3.12Å; S2413-T2416 PolarHBondContact O-OG1 2.58Å
2414V31.5Very low33Very low112.4 Ų112.4110.1 Ų110.168%0.68166%0.659SS**SBendtrans-96.44.3174.8-177.70000112.2N2412 T2416 L2630N2412-V2414 WeakPolarHBondContact O-CG2 3.41Å; N2412-V2414 PolarHBondContact O-N 3.06Å; V2414-T2416 PolarHBondContact O-N 2.85Å; V2414-L2630 HydrophobicContact CG1-CD1 3.37Å; V2414-L2630 HydrophobicContact CG1-CD2 3.68Å; V2414-L2630 HydrophobicContact CG1-CG 4.17Å
2415F30.1Very low34.5Very low127.6 Ų127.6109.4 Ų109.456%0.5665%0.65SS**  trans-103.961.2-179.9-75.6-80.1000113.3S2413 A2417 G2422 E2509 A2513 F2514 H2631S2413-F2415 PolarHBondContact O-N 3.24Å; F2415-A2417 HydrophobicContact CD1-CB 4.46Å; F2415-A2417 PolarHBondContact O-N 3.45Å; F2415-A2417 VanDerWaalsContact O-N 3.15Å; F2415-G2422 WeakPolarHBondContact O-CA 3.44Å; F2415-E2509 HydrophobicContact CB-CB 4.22Å; F2415-E2509 WeakPolarHBondContact CB-OE2 2.85Å; F2415-E2509 HydrophobicContact CD1-CB 4.36Å; F2415-E2509 HydrophobicContact CD1-CG 4.28Å; F2415-E2509 HydrophobicContact CD2-CB 3.77Å; F2415-E2509 HydrophobicContact CE2-CB 4.2Å; F2415-E2509 WeakPolarHBondContact CE2-O 3.47Å; F2415-E2509 HydrophobicContact CG-CB 3.86Å; F2415-E2509 HydrophobicContact CG-CG 4.23Å; F2415-A2513 HydrophobicContact CD2-CB 4.44Å; F2415-A2513 HydrophobicContact CE2-CB 4.06Å; F2415-F2514 HydrophobicContact CD1-CD2 4.27Å; F2415-F2514 AromaticContact CD1-CE2 3.88Å; F2415-F2514 HydrophobicContact CD1-CE2 3.88Å; F2415-F2514 AromaticContact CE1-CE2 3.77Å; F2415-F2514 HydrophobicContact CE1-CE2 3.77Å; F2415-F2514 HydrophobicContact CE1-CZ 4.48Å; F2415-H2631 AromaticContact CE1-NE2 3.76Å; F2415-H2631 AromaticContact CZ-NE2 3.48Å; F2415-H2631 WeakPolarHBondContact CZ-NE2 3.32Å
2416T28.1Very low36Very low120.8 Ų120.8101.5 Ų101.574%0.74162%0.616SS**  trans-121.473.6165.746.70000110S2413 V2414 A2418S2413-T2416 PolarHBondContact O-N 2.88Å; S2413-T2416 VanDerWaalsContact O-N 3.12Å; S2413-T2416 PolarHBondContact O-OG1 2.58Å; V2414-T2416 PolarHBondContact O-N 2.85Å; T2416-A2418 PolarHBondContact O-N 3.02Å
2417A29.3Very low37.7Very low72.8 Ų72.896.6 Ų96.660%0.60258%0.581SS**  trans-96.893.9171.200000111.1F2415 S2419 G2420F2415-A2417 HydrophobicContact CD1-CB 4.46Å; F2415-A2417 PolarHBondContact O-N 3.45Å; F2415-A2417 VanDerWaalsContact O-N 3.15Å; A2417-S2419 VanDerWaalsContact C-N 3.29Å; A2417-S2419 CarbonylContact O-C 3.58Å; A2417-S2419 PolarHBondContact O-N 3.21Å; A2417-G2420 PolarHBondContact O-N 2.87Å
2418A29.4Very low39.5Very low106.6 Ų106.690.8 Ų90.888%0.88156%0.556SS**SBendtrans-40.441167.600000115T2416T2416-A2418 PolarHBondContact O-N 3.02Å
2419S33.2Very low41.2Very low95.8 Ų95.887.8 Ų87.867%0.6753%0.531SS*.SBendtrans-158.689168.3179.60000112.9A2417 N2421 R2619A2417-S2419 VanDerWaalsContact C-N 3.29Å; A2417-S2419 CarbonylContact O-C 3.58Å; A2417-S2419 PolarHBondContact O-N 3.21Å; S2419-N2421 PolarHBondContact O-N 3.2Å; S2419-R2619 PolarHBondContact OG-NH2 3.07Å
2420G37.5Very low42.7Very low52.6 Ų52.678.1 Ų78.154%0.54249%0.494SS..  trans-81.1-1.8178.100000119A2417 G2422 L2423A2417-G2420 PolarHBondContact O-N 2.87Å; G2420-G2422 VanDerWaalsContact C-N 3.35Å; G2420-G2422 PolarHBondContact O-N 3.12Å; G2420-G2422 VanDerWaalsContact O-N 3.11Å; G2420-L2423 PolarHBondContact O-N 3.15Å
2421N43.3Very low44.5Very low109.6 Ų109.675 Ų7559%0.58648%0.48SS*.Hα-helixtrans-80.4-11.4-169.2-66.41.1000113.7S2419 L2423 Q2424 F2425S2419-N2421 PolarHBondContact O-N 3.2Å; N2421-L2423 PolarHBondContact O-N 3.47Å; N2421-Q2424 PolarHBondContact O-N 3.05Å; N2421-F2425 HydrophobicContact CB-CB 4.02Å; N2421-F2425 HydrophobicContact CB-CD1 3.47Å; N2421-F2425 VanDerWaalsContact CB-CD1 3.47Å; N2421-F2425 HydrophobicContact CB-CD2 4.37Å; N2421-F2425 HydrophobicContact CB-CE1 4.04Å; N2421-F2425 HydrophobicContact CB-CE2 4.09Å; N2421-F2425 HydrophobicContact CB-CG 3.76Å; N2421-F2425 WeakPolarHBondContact ND2-CE1 3.45Å; N2421-F2425 WeakPolarHBondContact ND2-CZ 3.36Å; N2421-F2425 WeakPolarHBondContact O-CB 3.44Å; N2421-F2425 WeakPolarHBondContact O-CD2 3.34Å; N2421-F2425 PolarHBondContact O-N 2.86Å
2422G51.6Low46.2Very low40.8 Ų40.877 Ų7742%0.42148%0.475SS..Hα-helixtrans-67.7-46.7-176.600000114.6F2415 G2420 Q2424 F2425 S2426F2415-G2422 WeakPolarHBondContact O-CA 3.44Å; G2420-G2422 VanDerWaalsContact C-N 3.35Å; G2420-G2422 PolarHBondContact O-N 3.12Å; G2420-G2422 VanDerWaalsContact O-N 3.11Å; G2422-Q2424 VanDerWaalsContact C-N 3.27Å; G2422-Q2424 PolarHBondContact O-N 3.14Å; G2422-F2425 WeakPolarHBondContact O-CA 3.42Å; G2422-F2425 WeakPolarHBondContact O-CB 3.44Å; G2422-F2425 PolarHBondContact O-N 2.97Å; G2422-S2426 WeakPolarHBondContact O-CB 3.29Å; G2422-S2426 PolarHBondContact O-N 3.07Å; G2422-S2426 VanDerWaalsContact O-N 3.15Å; G2422-S2426 PolarHBondContact O-OG 3Å
2423L55.3Low47.8Very low25.8 Ų25.871.1 Ų71.114%0.13544%0.444CS..Hα-helixtrans-67.7-43.8-177.3-16397.7000111.7G2420 N2421 F2425 S2426 V2427 E2509 V2543 L2547 L2550 A2557 L2561 P2613 L2617 D2623 L2624 C2627G2420-L2423 PolarHBondContact O-N 3.15Å; N2421-L2423 PolarHBondContact O-N 3.47Å; L2423-F2425 VanDerWaalsContact C-N 3.28Å; L2423-F2425 PolarHBondContact O-N 3.21Å; L2423-S2426 WeakPolarHBondContact O-CB 3.3Å; L2423-S2426 PolarHBondContact O-N 3.1Å; L2423-S2426 VanDerWaalsContact O-N 3.1Å; L2423-S2426 PolarHBondContact O-OG 3.17Å; L2423-V2427 HydrophobicContact CD1-CG2 4.16Å; L2423-V2427 HydrophobicContact CD2-CG2 4.41Å; L2423-V2427 HydrophobicContact CG-CG2 4.26Å; L2423-V2427 WeakPolarHBondContact O-CB 3.34Å; L2423-V2427 WeakPolarHBondContact O-CG2 3.37Å; L2423-V2427 PolarHBondContact O-N 3.08Å; L2423-E2509 HydrophobicContact CD2-CB 4.17Å; L2423-E2509 HydrophobicContact CD2-CG 4.5Å; L2423-E2509 HydrophobicContact CG-CB 4.17Å; L2423-E2509 HydrophobicContact CG-CG 4.14Å; L2423-E2509 PolarHBondContact N-OE1 3.21Å; L2423-V2543 HydrophobicContact CD1-CG1 3.74Å; L2423-V2543 HydrophobicContact CD2-CG1 4.04Å; L2423-L2547 HydrophobicContact CD1-CD1 4.07Å; L2423-L2547 HydrophobicContact CD1-CD2 3.93Å; L2423-L2547 HydrophobicContact CD1-CG 4.4Å; L2423-L2547 HydrophobicContact CD2-CD1 4.36Å; L2423-L2547 HydrophobicContact CD2-CD2 3.5Å; L2423-L2547 VanDerWaalsContact CD2-CD2 3.5Å; L2423-L2550 HydrophobicContact CD2-CD1 4Å; L2423-L2550 HydrophobicContact CG-CD1 4.32Å; L2423-A2557 HydrophobicContact CD1-CB 3.87Å; L2423-A2557 HydrophobicContact CG-CB 4.4Å; L2423-L2561 HydrophobicContact CD1-CD1 3.74Å; L2423-L2561 HydrophobicContact CD2-CD1 3.58Å; L2423-L2561 HydrophobicContact CD2-CD2 4.35Å; L2423-L2561 HydrophobicContact CG-CD1 4.07Å; L2423-P2613 HydrophobicContact CD2-CB 3.63Å; L2423-L2617 HydrophobicContact CD1-CD1 4.1Å; L2423-L2617 HydrophobicContact CD1-CD2 4.09Å; L2423-D2623 HydrophobicContact CD1-CB 3.54Å; L2423-L2624 HydrophobicContact CD1-CB 4.14Å; L2423-L2624 HydrophobicContact CD2-CD1 4.15Å; L2423-C2627 HydrophobicContact CD2-CB 3.94Å
2424Q56.9Low49.3Very low94.2 Ų94.267.6 Ų67.644%0.4442%0.417SS..Hα-helixtrans-60.2-39.4177.7-106.6-178.511.900112N2421 G2422 A2428 T2507 E2509 E2510N2421-Q2424 PolarHBondContact O-N 3.05Å; G2422-Q2424 VanDerWaalsContact C-N 3.27Å; G2422-Q2424 PolarHBondContact O-N 3.14Å; Q2424-A2428 VanDerWaalsContact O-CB 3.25Å; Q2424-A2428 WeakPolarHBondContact O-CB 3.3Å; Q2424-A2428 PolarHBondContact O-N 3.22Å; Q2424-T2507 PolarHBondContact NE2-OG1 3.26Å; Q2424-T2507 VanDerWaalsContact NE2-OG1 3.14Å; Q2424-E2509 WeakPolarHBondContact CA-OE2 3.26Å; Q2424-E2509 HydrophobicContact CB-CB 4.13Å; Q2424-E2509 HydrophobicContact CB-CG 4.36Å; Q2424-E2509 WeakPolarHBondContact CB-OE1 3.46Å; Q2424-E2509 HydrophobicContact CG-CB 4.39Å; Q2424-E2509 PolarHBondContact N-OE1 3.22Å; Q2424-E2510 PolarHBondContact NE2-OE1 3.38Å
2425F57.6Low50.6Low133 Ų13365.7 Ų65.758%0.58341%0.409SS*.Hα-helixtrans-67.9-40.6177.2-131.5-80.2000112.3N2421 G2422 L2423 A2428 A2429N2421-F2425 HydrophobicContact CB-CB 4.02Å; N2421-F2425 HydrophobicContact CB-CD1 3.47Å; N2421-F2425 VanDerWaalsContact CB-CD1 3.47Å; N2421-F2425 HydrophobicContact CB-CD2 4.37Å; N2421-F2425 HydrophobicContact CB-CE1 4.04Å; N2421-F2425 HydrophobicContact CB-CE2 4.09Å; N2421-F2425 HydrophobicContact CB-CG 3.76Å; N2421-F2425 WeakPolarHBondContact ND2-CE1 3.45Å; N2421-F2425 WeakPolarHBondContact ND2-CZ 3.36Å; N2421-F2425 WeakPolarHBondContact O-CB 3.44Å; N2421-F2425 WeakPolarHBondContact O-CD2 3.34Å; N2421-F2425 PolarHBondContact O-N 2.86Å; G2422-F2425 WeakPolarHBondContact O-CA 3.42Å; G2422-F2425 WeakPolarHBondContact O-CB 3.44Å; G2422-F2425 PolarHBondContact O-N 2.97Å; L2423-F2425 VanDerWaalsContact C-N 3.28Å; L2423-F2425 PolarHBondContact O-N 3.21Å; F2425-A2428 PolarHBondContact O-N 2.88Å; F2425-A2429 HydrophobicContact CD1-CB 4.41Å; F2425-A2429 HydrophobicContact CE1-CB 4.28Å; F2425-A2429 VanDerWaalsContact O-CB 3.26Å; F2425-A2429 WeakPolarHBondContact O-CB 3.4Å; F2425-A2429 PolarHBondContact O-N 2.92Å
2426S59.5Low51.9Low21.6 Ų21.664.4 Ų64.415%0.15140%0.403CS..Hα-helixtrans-67.9-43.8-179.9-140000112.8G2422 L2423 A2429 A2430 A2620 D2623 C2627G2422-S2426 WeakPolarHBondContact O-CB 3.29Å; G2422-S2426 PolarHBondContact O-N 3.07Å; G2422-S2426 VanDerWaalsContact O-N 3.15Å; G2422-S2426 PolarHBondContact O-OG 3Å; L2423-S2426 WeakPolarHBondContact O-CB 3.3Å; L2423-S2426 PolarHBondContact O-N 3.1Å; L2423-S2426 VanDerWaalsContact O-N 3.1Å; L2423-S2426 PolarHBondContact O-OG 3.17Å; S2426-A2429 PolarHBondContact O-N 3.09Å; S2426-A2430 VanDerWaalsContact O-CB 3.29Å; S2426-A2430 WeakPolarHBondContact O-CB 3.3Å; S2426-A2430 PolarHBondContact O-N 3.09Å; S2426-A2620 WeakPolarHBondContact OG-CA 3.39Å; S2426-D2623 PolarHBondContact OG-O 3.43Å; S2426-D2623 PolarHBondContact OG-OD2 3.15Å; S2426-C2627 PolarHBondContact OG-SG 3.47Å
2427V61.1Low53.1Low11.6 Ų11.660.1 Ų60.17%0.0738%0.377CS..Hα-helixtrans-69.6-43.7178.2175.70000110.8L2423 A2429 A2430 A2431 E2509 L2547 L2550 L2554 E2616 L2617 A2620L2423-V2427 HydrophobicContact CD1-CG2 4.16Å; L2423-V2427 HydrophobicContact CD2-CG2 4.41Å; L2423-V2427 HydrophobicContact CG-CG2 4.26Å; L2423-V2427 WeakPolarHBondContact O-CB 3.34Å; L2423-V2427 WeakPolarHBondContact O-CG2 3.37Å; L2423-V2427 PolarHBondContact O-N 3.08Å; V2427-A2429 VanDerWaalsContact C-N 3.33Å; V2427-A2429 PolarHBondContact O-N 3.12Å; V2427-A2430 PolarHBondContact O-N 3.17Å; V2427-A2431 VanDerWaalsContact O-CB 3.3Å; V2427-A2431 WeakPolarHBondContact O-CB 3.33Å; V2427-A2431 PolarHBondContact O-N 3.05Å; V2427-E2509 HydrophobicContact CB-CG 4.19Å; V2427-E2509 WeakPolarHBondContact CB-OE1 3.26Å; V2427-E2509 HydrophobicContact CG1-CG 4.48Å; V2427-E2509 VanDerWaalsContact CG1-OE1 3.27Å; V2427-E2509 WeakPolarHBondContact CG1-OE1 3.25Å; V2427-E2509 HydrophobicContact CG2-CG 4.31Å; V2427-L2547 HydrophobicContact CG2-CD2 3.52Å; V2427-L2550 HydrophobicContact CG1-CD1 3.95Å; V2427-L2550 HydrophobicContact CG1-CD2 4.36Å; V2427-L2550 HydrophobicContact CG2-CD1 4.35Å; V2427-L2554 HydrophobicContact CB-CD2 4.44Å; V2427-L2554 HydrophobicContact CG1-CD2 3.99Å; V2427-L2554 HydrophobicContact CG1-CG 4.35Å; V2427-L2554 HydrophobicContact CG2-CD1 4.22Å; V2427-L2554 HydrophobicContact CG2-CD2 4.19Å; V2427-L2554 HydrophobicContact CG2-CG 4.29Å; V2427-E2616 HydrophobicContact CG1-CB 4.06Å; V2427-L2617 HydrophobicContact CG2-CB 4.28Å; V2427-L2617 HydrophobicContact CG2-CD1 3.92Å; V2427-A2620 HydrophobicContact CG1-CB 4.41Å; V2427-A2620 HydrophobicContact CG2-CB 4.36Å
2428A63.1Low54.2Low38.6 Ų38.660.8 Ų60.832%0.31937%0.371SS..Hα-helixtrans-68.2-30.4175.900000113Q2424 F2425 R2432Q2424-A2428 VanDerWaalsContact O-CB 3.25Å; Q2424-A2428 WeakPolarHBondContact O-CB 3.3Å; Q2424-A2428 PolarHBondContact O-N 3.22Å; F2425-A2428 PolarHBondContact O-N 2.88Å; A2428-R2432 VanDerWaalsContact O-CB 3.3Å; A2428-R2432 WeakPolarHBondContact O-CB 3.42Å; A2428-R2432 VanDerWaalsContact O-CG 3.27Å; A2428-R2432 WeakPolarHBondContact O-CG 3.34Å; A2428-R2432 PolarHBondContact O-N 3.06Å; A2428-R2432 VanDerWaalsContact O-N 3.13Å; A2428-R2432 PolarHBondContact O-NE 3.17Å; A2428-R2432 VanDerWaalsContact O-NE 3.17Å
2429A61.6Low55Low26 Ų2659.1 Ų59.122%0.21535%0.352CS..Hα-helixtrans-65.9-50.8170.700000110.5F2425 S2426 V2427 A2431 R2432 T2433F2425-A2429 HydrophobicContact CD1-CB 4.41Å; F2425-A2429 HydrophobicContact CE1-CB 4.28Å; F2425-A2429 VanDerWaalsContact O-CB 3.26Å; F2425-A2429 WeakPolarHBondContact O-CB 3.4Å; F2425-A2429 PolarHBondContact O-N 2.92Å; S2426-A2429 PolarHBondContact O-N 3.09Å; V2427-A2429 VanDerWaalsContact C-N 3.33Å; V2427-A2429 PolarHBondContact O-N 3.12Å; A2429-A2431 VanDerWaalsContact C-N 3.29Å; A2429-A2431 PolarHBondContact O-N 2.92Å; A2429-R2432 CarbonylContact O-C 3.57Å; A2429-R2432 PolarHBondContact O-N 3.31Å; A2429-T2433 WeakPolarHBondContact O-CB 3.37Å; A2429-T2433 PolarHBondContact O-N 3.16Å; A2429-T2433 PolarHBondContact O-OG1 3.08Å; A2429-T2433 VanDerWaalsContact O-OG1 3.06Å
2430A59.5Low55.4Low2.4 Ų2.459.3 Ų59.32%0.0235%0.346CS..Hα-helixtrans-58.3-45.4176.800000112.5S2426 V2427 R2432 T2433 L2434 L2554 E2616 A2620 L2624S2426-A2430 VanDerWaalsContact O-CB 3.29Å; S2426-A2430 WeakPolarHBondContact O-CB 3.3Å; S2426-A2430 PolarHBondContact O-N 3.09Å; V2427-A2430 PolarHBondContact O-N 3.17Å; A2430-R2432 VanDerWaalsContact C-N 3.3Å; A2430-R2432 PolarHBondContact O-N 3.25Å; A2430-T2433 VanDerWaalsContact C-OG1 3.31Å; A2430-T2433 VanDerWaalsContact CA-OG1 3.23Å; A2430-T2433 WeakPolarHBondContact CA-OG1 3.44Å; A2430-T2433 WeakPolarHBondContact O-CA 3.42Å; A2430-T2433 WeakPolarHBondContact O-CB 3.37Å; A2430-T2433 PolarHBondContact O-N 3.18Å; A2430-T2433 PolarHBondContact O-OG1 3.1Å; A2430-T2433 VanDerWaalsContact O-OG1 3.11Å; A2430-L2434 HydrophobicContact CB-CD1 4.25Å; A2430-L2434 WeakPolarHBondContact O-CB 3.42Å; A2430-L2434 WeakPolarHBondContact O-CD1 3.27Å; A2430-L2434 WeakPolarHBondContact O-CG 3.38Å; A2430-L2434 PolarHBondContact O-N 3.09Å; A2430-L2554 HydrophobicContact CB-CD1 4.06Å; A2430-L2554 HydrophobicContact CB-CD2 4.26Å; A2430-E2616 HydrophobicContact CB-CB 4.27Å; A2430-A2620 HydrophobicContact CB-CB 4.24Å; A2430-L2624 HydrophobicContact CB-CD1 3.82Å; A2430-L2624 HydrophobicContact CB-CD2 4.04Å; A2430-L2624 HydrophobicContact CB-CG 4.03Å
2431A62.8Low55.5Low50.2 Ų50.260.1 Ų60.142%0.41534%0.343SS..Hα-helixtrans-63.3-38.9177.200000112.6V2427 A2429 T2433 L2434 S2435V2427-A2431 VanDerWaalsContact O-CB 3.3Å; V2427-A2431 WeakPolarHBondContact O-CB 3.33Å; V2427-A2431 PolarHBondContact O-N 3.05Å; A2429-A2431 VanDerWaalsContact C-N 3.29Å; A2429-A2431 PolarHBondContact O-N 2.92Å; A2431-T2433 VanDerWaalsContact C-N 3.33Å; A2431-L2434 PolarHBondContact O-N 3.14Å; A2431-S2435 WeakPolarHBondContact O-CB 3.37Å; A2431-S2435 PolarHBondContact O-N 3.03Å; A2431-S2435 PolarHBondContact O-OG 2.97Å
2432R63Low55Low141.2 Ų141.261.3 Ų61.353%0.53335%0.35SS..Hα-helixtrans-67.3-39.2174.2-78.8179.2-72175.4-2.9112.5A2428 A2429 A2430 L2434 S2435 K2436A2428-R2432 VanDerWaalsContact O-CB 3.3Å; A2428-R2432 WeakPolarHBondContact O-CB 3.42Å; A2428-R2432 VanDerWaalsContact O-CG 3.27Å; A2428-R2432 WeakPolarHBondContact O-CG 3.34Å; A2428-R2432 PolarHBondContact O-N 3.06Å; A2428-R2432 VanDerWaalsContact O-N 3.13Å; A2428-R2432 PolarHBondContact O-NE 3.17Å; A2428-R2432 VanDerWaalsContact O-NE 3.17Å; A2429-R2432 CarbonylContact O-C 3.57Å; A2429-R2432 PolarHBondContact O-N 3.31Å; A2430-R2432 VanDerWaalsContact C-N 3.3Å; A2430-R2432 PolarHBondContact O-N 3.25Å; R2432-L2434 VanDerWaalsContact C-N 3.31Å; R2432-L2434 PolarHBondContact O-N 2.7Å; R2432-S2435 PolarHBondContact O-N 3.15Å; R2432-S2435 PolarHBondContact O-OG 3.11Å; R2432-K2436 WeakPolarHBondContact O-CB 3.26Å; R2432-K2436 VanDerWaalsContact O-CG 3.31Å; R2432-K2436 WeakPolarHBondContact O-CG 3.43Å; R2432-K2436 PolarHBondContact O-N 3.1Å
2433T60.5Low54.2Low16.4 Ų16.464.5 Ų64.510%0.10136%0.361CS..Hα-helixtrans-64.1-41.4174.1-23.10000111.1A2429 A2430 A2431 S2435 K2436 V2437 E2509 L2547 L2550 L2554 E2616 L2617A2429-T2433 WeakPolarHBondContact O-CB 3.37Å; A2429-T2433 PolarHBondContact O-N 3.16Å; A2429-T2433 PolarHBondContact O-OG1 3.08Å; A2429-T2433 VanDerWaalsContact O-OG1 3.06Å; A2430-T2433 VanDerWaalsContact C-OG1 3.31Å; A2430-T2433 VanDerWaalsContact CA-OG1 3.23Å; A2430-T2433 WeakPolarHBondContact CA-OG1 3.44Å; A2430-T2433 WeakPolarHBondContact O-CA 3.42Å; A2430-T2433 WeakPolarHBondContact O-CB 3.37Å; A2430-T2433 PolarHBondContact O-N 3.18Å; A2430-T2433 PolarHBondContact O-OG1 3.1Å; A2430-T2433 VanDerWaalsContact O-OG1 3.11Å; A2431-T2433 VanDerWaalsContact C-N 3.33Å; T2433-S2435 VanDerWaalsContact C-N 3.34Å; T2433-S2435 PolarHBondContact O-N 3.19Å; T2433-K2436 PolarHBondContact O-N 3.24Å; T2433-V2437 VanDerWaalsContact O-CG2 3.25Å; T2433-V2437 WeakPolarHBondContact O-CG2 3.4Å; T2433-V2437 PolarHBondContact O-N 3.21Å; T2433-E2509 WeakPolarHBondContact CA-OE1 3.34Å; T2433-E2509 WeakPolarHBondContact CA-OE2 2.91Å; T2433-E2509 VanDerWaalsContact CB-OE1 3.27Å; T2433-E2509 WeakPolarHBondContact CB-OE1 3.43Å; T2433-E2509 HydrophobicContact CG2-CG 4.27Å; T2433-E2509 WeakPolarHBondContact CG2-OE1 3.35Å; T2433-E2509 VanDerWaalsContact O-OE2 3.12Å; T2433-E2509 PolarHBondContact OG1-OE1 3.47Å; T2433-L2547 HydrophobicContact CG2-CD2 3.85Å; T2433-L2550 HydrophobicContact CG2-CD1 4.28Å; T2433-L2554 HydrophobicContact CG2-CD2 4.26Å; T2433-E2616 WeakPolarHBondContact CB-OE2 3.45Å; T2433-E2616 HydrophobicContact CG2-CB 4.25Å; T2433-E2616 WeakPolarHBondContact CG2-OE2 3.24Å; T2433-E2616 PolarHBondContact OG1-OE2 3Å; T2433-L2617 HydrophobicContact CG2-CB 4.5Å; T2433-L2617 HydrophobicContact CG2-CD2 3.72Å; T2433-L2617 HydrophobicContact CG2-CG 3.85Å
2434L59.8Low53Low18.6 Ų18.669.5 Ų69.510%0.09739%0.386CS..Hα-helixtrans-69.1-39.8179.2-71.6166000112.9A2430 A2431 R2432 K2436 V2437 N2438 L2550 C2553 L2554 A2557 L2561 P2613 A2620 D2623 L2624 C2627A2430-L2434 HydrophobicContact CB-CD1 4.25Å; A2430-L2434 WeakPolarHBondContact O-CB 3.42Å; A2430-L2434 WeakPolarHBondContact O-CD1 3.27Å; A2430-L2434 WeakPolarHBondContact O-CG 3.38Å; A2430-L2434 PolarHBondContact O-N 3.09Å; A2431-L2434 PolarHBondContact O-N 3.14Å; R2432-L2434 VanDerWaalsContact C-N 3.31Å; R2432-L2434 PolarHBondContact O-N 2.7Å; L2434-K2436 VanDerWaalsContact C-N 3.34Å; L2434-K2436 PolarHBondContact O-N 3.06Å; L2434-V2437 PolarHBondContact O-N 3.31Å; L2434-N2438 WeakPolarHBondContact O-CB 3.39Å; L2434-N2438 PolarHBondContact O-N 3.08Å; L2434-N2438 PolarHBondContact O-OD1 2.79Å; L2434-L2550 HydrophobicContact CD1-CD2 4.46Å; L2434-C2553 HydrophobicContact CD1-CB 3.99Å; L2434-C2553 HydrophobicContact CD2-CB 4.06Å; L2434-L2554 HydrophobicContact CD1-CD2 4.3Å; L2434-L2554 HydrophobicContact CD1-CG 4.2Å; L2434-L2554 HydrophobicContact CD2-CD2 3.97Å; L2434-L2554 HydrophobicContact CD2-CG 4.38Å; L2434-L2554 HydrophobicContact CG-CD2 3.67Å; L2434-L2554 HydrophobicContact CG-CG 4.29Å; L2434-A2557 HydrophobicContact CD1-CB 3.55Å; L2434-A2557 HydrophobicContact CD2-CB 4.22Å; L2434-L2561 HydrophobicContact CD2-CB 3.84Å; L2434-L2561 HydrophobicContact CD2-CD1 3.39Å; L2434-L2561 HydrophobicContact CD2-CG 4.19Å; L2434-P2613 HydrophobicContact CD2-CB 4.39Å; L2434-A2620 HydrophobicContact CD1-CB 4.31Å; L2434-A2620 WeakPolarHBondContact CD1-O 3.33Å; L2434-D2623 HydrophobicContact CB-CB 4.22Å; L2434-D2623 HydrophobicContact CD1-CB 3.78Å; L2434-D2623 VanDerWaalsContact CD2-C 3.42Å; L2434-D2623 HydrophobicContact CD2-CB 4.08Å; L2434-D2623 WeakPolarHBondContact CD2-O 3.33Å; L2434-D2623 HydrophobicContact CG-CB 4.22Å; L2434-L2624 HydrophobicContact CD1-CB 4.27Å; L2434-L2624 VanDerWaalsContact CD2-CA 3.41Å; L2434-L2624 HydrophobicContact CD2-CB 4.15Å; L2434-L2624 HydrophobicContact CD2-CD1 3.9Å; L2434-C2627 HydrophobicContact CD2-CB 4.23Å; L2434-C2627 WeakPolarHBondContact CD2-SG 3.46Å
2435S60.3Low51.6Low74 Ų7471.8 Ų71.852%0.51740%0.402SS..Hα-helixtrans-63.6-35.9176.387.80000112.3A2431 R2432 T2433 V2437 N2438 S2439A2431-S2435 WeakPolarHBondContact O-CB 3.37Å; A2431-S2435 PolarHBondContact O-N 3.03Å; A2431-S2435 PolarHBondContact O-OG 2.97Å; R2432-S2435 PolarHBondContact O-N 3.15Å; R2432-S2435 PolarHBondContact O-OG 3.11Å; T2433-S2435 VanDerWaalsContact C-N 3.34Å; T2433-S2435 PolarHBondContact O-N 3.19Å; S2435-V2437 VanDerWaalsContact C-N 3.33Å; S2435-V2437 PolarHBondContact O-N 3Å; S2435-N2438 PolarHBondContact O-N 2.93Å; S2435-S2439 WeakPolarHBondContact O-CB 3.33Å; S2435-S2439 PolarHBondContact O-N 3.23Å; S2435-S2439 PolarHBondContact O-OG 3.09Å
2436K56.8Low50.1Low98.8 Ų98.872.4 Ų72.443%0.4341%0.411SS..Hα-helixtrans-72.3-34176.9-73.7-176.3178.8-172.20113.5R2432 T2433 L2434 N2438 S2439 N2440 T2507 E2509 E2510 E2616R2432-K2436 WeakPolarHBondContact O-CB 3.26Å; R2432-K2436 VanDerWaalsContact O-CG 3.31Å; R2432-K2436 WeakPolarHBondContact O-CG 3.43Å; R2432-K2436 PolarHBondContact O-N 3.1Å; T2433-K2436 PolarHBondContact O-N 3.24Å; L2434-K2436 VanDerWaalsContact C-N 3.34Å; L2434-K2436 PolarHBondContact O-N 3.06Å; K2436-N2438 VanDerWaalsContact C-N 3.33Å; K2436-N2438 PolarHBondContact O-N 3.29Å; K2436-S2439 WeakPolarHBondContact CA-OG 3.17Å; K2436-S2439 PolarHBondContact O-N 3.23Å; K2436-S2439 PolarHBondContact O-OG 3.36Å; K2436-N2440 WeakPolarHBondContact O-CB 3.37Å; K2436-N2440 PolarHBondContact O-N 3.18Å; K2436-N2440 PolarHBondContact O-ND2 3.02Å; K2436-T2507 HydrophobicContact CD-CG2 4.37Å; K2436-T2507 WeakPolarHBondContact CD-OG1 3.22Å; K2436-T2507 PolarHBondContact NZ-OG1 3.43Å; K2436-E2509 WeakPolarHBondContact CB-OE2 3.25Å; K2436-E2510 IonicContact NZ-OE1 3.59Å; K2436-E2510 PolarHBondContact NZ-OE1 2.78Å; K2436-E2510 IonicContact NZ-OE2 2.68Å; K2436-E2510 PolarHBondContact NZ-OE2 2.87Å; K2436-E2616 VanDerWaalsContact CD-OE2 3.31Å; K2436-E2616 WeakPolarHBondContact CD-OE2 3.08Å; K2436-E2616 IonicContact NZ-OE1 2.74Å; K2436-E2616 PolarHBondContact NZ-OE1 3Å; K2436-E2616 IonicContact NZ-OE2 2.75Å; K2436-E2616 PolarHBondContact NZ-OE2 3.05Å
2437V52.8Low48.5Very low32.4 Ų32.478.4 Ų78.420%0.19644%0.44CS..Hα-helixtrans-67.6-41.9176.7175.30000110.7T2433 L2434 S2435 S2439 N2440 S2441 E2509 A2557 L2561 V2564 P2613 L2617 C2627 L2630T2433-V2437 VanDerWaalsContact O-CG2 3.25Å; T2433-V2437 WeakPolarHBondContact O-CG2 3.4Å; T2433-V2437 PolarHBondContact O-N 3.21Å; L2434-V2437 PolarHBondContact O-N 3.31Å; S2435-V2437 VanDerWaalsContact C-N 3.33Å; S2435-V2437 PolarHBondContact O-N 3Å; V2437-S2439 VanDerWaalsContact C-N 3.31Å; V2437-S2439 PolarHBondContact O-N 3.02Å; V2437-N2440 PolarHBondContact O-N 3.18Å; V2437-N2440 VanDerWaalsContact O-N 3.12Å; V2437-S2441 PolarHBondContact O-N 2.65Å; V2437-E2509 HydrophobicContact CG2-CG 4.42Å; V2437-A2557 HydrophobicContact CG1-CB 4.05Å; V2437-L2561 HydrophobicContact CG1-CD1 3.89Å; V2437-L2561 HydrophobicContact CG1-CG 4.14Å; V2437-L2561 HydrophobicContact CG2-CD1 4.03Å; V2437-V2564 HydrophobicContact CG1-CG1 3.96Å; V2437-P2613 HydrophobicContact CG2-CB 4.49Å; V2437-P2613 HydrophobicContact CG2-CG 3.6Å; V2437-L2617 HydrophobicContact CG2-CD1 4.13Å; V2437-L2617 HydrophobicContact CG2-CD2 4.3Å; V2437-L2617 HydrophobicContact CG2-CG 4.3Å; V2437-C2627 HydrophobicContact CG1-CB 4.27Å; V2437-C2627 VanDerWaalsContact CG1-SG 3.57Å; V2437-C2627 WeakPolarHBondContact CG1-SG 3.48Å; V2437-L2630 HydrophobicContact CG1-CD1 4.22Å
2438N52Low46.8Very low87.4 Ų87.485.5 Ų85.547%0.46747%0.472SS..Hα-helixtrans-66.4-32.5177.9-76.8-11.2000113.1L2434 S2435 K2436 N2440 S2441L2434-N2438 WeakPolarHBondContact O-CB 3.39Å; L2434-N2438 PolarHBondContact O-N 3.08Å; L2434-N2438 PolarHBondContact O-OD1 2.79Å; S2435-N2438 PolarHBondContact O-N 2.93Å; K2436-N2438 VanDerWaalsContact C-N 3.33Å; K2436-N2438 PolarHBondContact O-N 3.29Å; N2438-N2440 VanDerWaalsContact C-N 3.27Å; N2438-N2440 PolarHBondContact O-N 2.98Å; N2438-N2440 VanDerWaalsContact O-N 3.16Å; N2438-S2441 PolarHBondContact O-N 2.97Å; N2438-S2441 PolarHBondContact O-OG 3.17Å
2439S47.6Very low45.2Very low69.8 Ų69.888.6 Ų88.649%0.48849%0.489SS..Hα-helixtrans-71.5-17.7176.4370000114.2S2435 K2436 V2437 V2443S2435-S2439 WeakPolarHBondContact O-CB 3.33Å; S2435-S2439 PolarHBondContact O-N 3.23Å; S2435-S2439 PolarHBondContact O-OG 3.09Å; K2436-S2439 WeakPolarHBondContact CA-OG 3.17Å; K2436-S2439 PolarHBondContact O-N 3.23Å; K2436-S2439 PolarHBondContact O-OG 3.36Å; V2437-S2439 VanDerWaalsContact C-N 3.31Å; V2437-S2439 PolarHBondContact O-N 3.02Å; S2439-V2443 WeakPolarHBondContact O-CG2 3.4Å
2440N41.5Very low43.5Very low100 Ų10091.6 Ų91.654%0.53551%0.508SS..THydrogen-bonded Turntrans-93.1-3.7-179.1-74.4-12.6000113.7K2436 V2437 N2438 D2442K2436-N2440 WeakPolarHBondContact O-CB 3.37Å; K2436-N2440 PolarHBondContact O-N 3.18Å; K2436-N2440 PolarHBondContact O-ND2 3.02Å; V2437-N2440 PolarHBondContact O-N 3.18Å; V2437-N2440 VanDerWaalsContact O-N 3.12Å; N2438-N2440 VanDerWaalsContact C-N 3.27Å; N2438-N2440 PolarHBondContact O-N 2.98Å; N2438-N2440 VanDerWaalsContact O-N 3.16Å; N2440-D2442 VanDerWaalsContact C-N 3.33Å
2441S38.4Very low41.9Very low70.4 Ų70.4100.1 Ų100.149%0.49255%0.547SS..THydrogen-bonded Turntrans-75.3-21175.793.70000113.2V2437 N2438 V2443 I2444V2437-S2441 PolarHBondContact O-N 2.65Å; N2438-S2441 PolarHBondContact O-N 2.97Å; N2438-S2441 PolarHBondContact O-OG 3.17Å; S2441-V2443 PolarHBondContact O-N 3.08Å; S2441-V2443 VanDerWaalsContact O-N 3.09Å; S2441-I2444 VanDerWaalsContact O-CD1 3.3Å; S2441-I2444 WeakPolarHBondContact O-CD1 3.29Å; S2441-I2444 WeakPolarHBondContact O-CG1 3.45Å; S2441-I2444 PolarHBondContact O-N 2.89Å; S2441-I2444 VanDerWaalsContact O-N 3.11Å
2442D33.4Very low40.2Very low134.8 Ų134.8106.2 Ų106.272%0.72157%0.569SS**THydrogen-bonded Turntrans-82.45.4-173.5-65-12.8000113.9N2440 N2446N2440-D2442 VanDerWaalsContact C-N 3.33Å; D2442-N2446 PolarHBondContact O-ND2 3.14Å
2443V34.3Very low38.5Very low107.2 Ų107.2104.5 Ų104.565%0.6558%0.579SS**THydrogen-bonded Turntrans-103.8-3.6179.6-1780000113.1S2439 S2441 D2445 N2446 I2447S2439-V2443 WeakPolarHBondContact O-CG2 3.4Å; S2441-V2443 PolarHBondContact O-N 3.08Å; S2441-V2443 VanDerWaalsContact O-N 3.09Å; V2443-D2445 PolarHBondContact O-N 3.11Å; V2443-N2446 PolarHBondContact O-N 2.96Å; V2443-N2446 VanDerWaalsContact O-N 3.14Å; V2443-I2447 HydrophobicContact CG1-CG1 4.38Å
2444I30.3Very low36.8Very low130.4 Ų130.4115.4 Ų115.467%0.66962%0.619SS**THydrogen-bonded Turntrans-96.610.5-177.3-59.5-179.8000112.3S2441 N2446 V2564S2441-I2444 VanDerWaalsContact O-CD1 3.3Å; S2441-I2444 WeakPolarHBondContact O-CD1 3.29Å; S2441-I2444 WeakPolarHBondContact O-CG1 3.45Å; S2441-I2444 PolarHBondContact O-N 2.89Å; S2441-I2444 VanDerWaalsContact O-N 3.11Å; I2444-N2446 PolarHBondContact O-N 3.04Å; I2444-N2446 VanDerWaalsContact O-N 3.08Å; I2444-V2564 HydrophobicContact CD1-CG1 4.02Å
2445D27.8Very low35.2Very low143.8 Ų143.8118.3 Ų118.377%0.76965%0.653SS**  trans-85.539.4170.6-76.1-25.1000115.4V2443 I2447V2443-D2445 PolarHBondContact O-N 3.11Å; D2445-I2447 PolarHBondContact O-N 3.19Å
2446N25.5Very low33.5Very low145.4 Ų145.4119.7 Ų119.778%0.77867%0.669SS**  trans-116.560.1171.9-74.1-58.4000114.7D2442 V2443 I2444D2442-N2446 PolarHBondContact O-ND2 3.14Å; V2443-N2446 PolarHBondContact O-N 2.96Å; V2443-N2446 VanDerWaalsContact O-N 3.14Å; I2444-N2446 PolarHBondContact O-N 3.04Å; I2444-N2446 VanDerWaalsContact O-N 3.08Å
2447I26.9Very low32Very low147 Ų147118.7 Ų118.775%0.75469%0.686SS**  trans-129.685.3159.4-58.2174.7000110V2443 D2445V2443-I2447 HydrophobicContact CG1-CG1 4.38Å; D2445-I2447 PolarHBondContact O-N 3.19Å
2448H25.1Very low30.7Very low159.8 Ų159.8126 Ų12674%0.7472%0.721SS**  trans-86.4142.7159.6-119.6-94.3000109.4S2450 Q2451H2448-S2450 PolarHBondContact CE1-OG 3.43Å; H2448-S2450 VanDerWaalsContact CE1-OG 3.28Å; H2448-S2450 PolarHBondContact ND1-OG 3.03Å; H2448-S2450 PolarHBondContact O-N 3.08Å; H2448-Q2451 PolarHBondContact O-N 3.24Å
2449P29Very low29.3Very low105.6 Ų105.6133.4 Ų133.469%0.68674%0.742SS**  -117.5113.1107.724.2-9.6000114.1Q2451P2449-Q2451 VanDerWaalsContact C-N 3.27Å; P2449-Q2451 PolarHBondContact O-N 3.41Å
2450S25.3Very low28.2Very low88.4 Ų88.4138.1 Ų138.162%0.61876%0.761SS**  trans-75.3113.9158.153.70000114.3H2448 S2453H2448-S2450 PolarHBondContact CE1-OG 3.43Å; H2448-S2450 VanDerWaalsContact CE1-OG 3.28Å; H2448-S2450 PolarHBondContact ND1-OG 3.03Å; H2448-S2450 PolarHBondContact O-N 3.08Å; S2450-S2453 PolarHBondContact O-N 3.02Å
2451Q27.2Very low27.5Very low180.2 Ų180.2138.2 Ų138.284%0.84277%0.77SS**  trans90.984.8162.6-68.1-176.19.200115.6H2448 P2449 S2453H2448-Q2451 PolarHBondContact O-N 3.24Å; P2449-Q2451 VanDerWaalsContact C-N 3.27Å; P2449-Q2451 PolarHBondContact O-N 3.41Å; Q2451-S2453 PolarHBondContact O-N 3.08Å; Q2451-S2453 VanDerWaalsContact O-N 3.16Å
2452M26.9Very low26.8Very low178 Ų178142.3 Ų142.388%0.87779%0.786SS**  trans-14290.9135.2-75.4-171.596.800112.2
2453S26.2Very low26.4Very low106 Ų106142.9 Ų142.974%0.74179%0.789SS**  trans-105.697147.6-163.50000114.2S2450 Q2451S2450-S2453 PolarHBondContact O-N 3.02Å; Q2451-S2453 PolarHBondContact O-N 3.08Å; Q2451-S2453 VanDerWaalsContact O-N 3.16Å
2454R25.6Very low25.9Very low246.2 Ų246.2148.7 Ų148.793%0.92980%0.801SS**  trans148.2101.4153.4-79.6178.8175.2-174-1.2114.5
2455G25.2Very low25.7Very low78.8 Ų78.8148.1 Ų148.181%0.81281%0.808SS**  trans161.199.5154.500000114G2457G2455-G2457 PolarHBondContact O-N 2.95Å
2456A25.8Very low25.6Very low103 Ų103144.4 Ų144.485%0.85180%0.804SS**  trans-116.1102.1166.900000111.7M2458A2456-M2458 PolarHBondContact O-N 3.22Å
2457G24.4Very low25.5Very low77.2 Ų77.2145.4 Ų145.480%0.79681%0.807SS**  trans-70.8106.816600000112.8G2455 R2459G2455-G2457 PolarHBondContact O-N 2.95Å; G2457-R2459 PolarHBondContact O-N 2.8Å; G2457-R2459 VanDerWaalsContact O-N 3.09Å
2458M25.8Very low25.5Very low187 Ų187144.7 Ų144.792%0.92181%0.81SS**  trans-97.8112.7154.6-122.2-178.9173.500109.4A2456 L2460A2456-M2458 PolarHBondContact O-N 3.22Å; M2458-L2460 PolarHBondContact O-N 3.25Å
2459R22.6Very low25.5Very low243.2 Ų243.2143.8 Ų143.892%0.91882%0.815SS**  trans-73.9116.8171.3-72.7178.5172.8-175.2-2.8108.8G2457 S2461G2457-R2459 PolarHBondContact O-N 2.8Å; G2457-R2459 VanDerWaalsContact O-N 3.09Å; R2459-S2461 VanDerWaalsContact C-N 3.31Å; R2459-S2461 PolarHBondContact O-N 3.49Å
2460L25.7Very low25.3Very low168.6 Ų168.6142.2 Ų142.288%0.88382%0.818SS**  trans-90.8107.7157-76.8167.6000107.8M2458 N2462M2458-L2460 PolarHBondContact O-N 3.25Å; L2460-N2462 PolarHBondContact O-N 2.89Å
2461S25.4Very low25.2Very low102.2 Ų102.2141.5 Ų141.572%0.71583%0.825SS**  trans-75.3114.7174.266.80000109.8R2459 N2463R2459-S2461 VanDerWaalsContact C-N 3.31Å; R2459-S2461 PolarHBondContact O-N 3.49Å; S2461-N2463 VanDerWaalsContact C-N 3.28Å; S2461-N2463 PolarHBondContact O-N 3.03Å
2462N24.8Very low25Very low155 Ų155143.8 Ų143.883%0.82983%0.826SS**  trans-62.8106.4160.3-86-14.9000109.4L2460L2460-N2462 PolarHBondContact O-N 2.89Å
2463N24.5Very low24.9Very low147.2 Ų147.2143 Ų14379%0.78782%0.82SS**  trans-129.985.3156.7-89.7-12.5000108.9S2461 S2465S2461-N2463 VanDerWaalsContact C-N 3.28Å; S2461-N2463 PolarHBondContact O-N 3.03Å; N2463-S2465 VanDerWaalsContact C-N 3.27Å; N2463-S2465 PolarHBondContact O-N 3.34Å
2464Y24.7Very low24.9Very low229.6 Ų229.6143 Ų14390%0.982%0.82SS**  trans-125.489157.8-106.1-83.8000107.6G2466Y2464-G2466 VanDerWaalsContact C-N 3.29Å; Y2464-G2466 PolarHBondContact O-N 3.17Å
2465S25.1Very low24.9Very low118.6 Ų118.6136.4 Ų136.483%0.82981%0.811SS**  trans-126.3110.9150.535.50000109.1N2463 I2467N2463-S2465 VanDerWaalsContact C-N 3.27Å; N2463-S2465 PolarHBondContact O-N 3.34Å; S2465-I2467 PolarHBondContact O-N 2.88Å; S2465-I2467 VanDerWaalsContact O-N 3.14Å
2466G25.1Very low25Very low64.8 Ų64.8139.7 Ų139.767%0.66881%0.81SS**  trans-47.9109.3172.500000113.8Y2464 V2468Y2464-G2466 VanDerWaalsContact C-N 3.29Å; Y2464-G2466 PolarHBondContact O-N 3.17Å; G2466-V2468 VanDerWaalsContact C-N 3.32Å; G2466-V2468 PolarHBondContact O-N 3.07Å
2467I25.2Very low25Very low167.8 Ų167.8145 Ų14586%0.86181%0.808SS**  trans-108.3104.3142.6-69.3172.6000106.1S2465 V2469S2465-I2467 PolarHBondContact O-N 2.88Å; S2465-I2467 VanDerWaalsContact O-N 3.14Å; I2467-V2469 HydrophobicContact CG2-CG2 3.92Å; I2467-V2469 PolarHBondContact O-N 3.32Å
2468V25.6Very low25.1Very low132 Ų132148.8 Ų148.880%0.881%0.81SS**  trans-98.6122.2171.5174.60000107.5G2466 G2470G2466-V2468 VanDerWaalsContact C-N 3.32Å; G2466-V2468 PolarHBondContact O-N 3.07Å; V2468-G2470 PolarHBondContact O-N 3.01Å; V2468-G2470 VanDerWaalsContact O-N 3.12Å
2469V25.2Very low25.1Very low140.2 Ų140.2143.6 Ų143.685%0.8581%0.805SS**  trans-100115.6166.6178.90000107.5I2467I2467-V2469 HydrophobicContact CG2-CG2 3.92Å; I2467-V2469 PolarHBondContact O-N 3.32Å
2470G24.1Very low25.3Very low72.8 Ų72.8137.1 Ų137.175%0.75180%0.797SS**  trans-134.8115.5177.400000111V2468V2468-G2470 PolarHBondContact O-N 3.01Å; V2468-G2470 VanDerWaalsContact O-N 3.12Å
2471G24.1Very low25.2Very low74 Ų74139.8 Ų139.876%0.76380%0.795SS**  trans-109.1141.7175.400000111.2
2472R23.7Very low25.3Very low227.6 Ų227.6141.5 Ų141.586%0.85980%0.795SS**  trans-168.9135.4137.2-87.6175152.4164-2.5111.2
2473E24.5Very low25.3Very low161.8 Ų161.8144.1 Ų144.176%0.75679%0.793SS**  69.2134.5109.9-82165.3-175.100115.9
2474S25Very low25.3Very low105.6 Ų105.6147.5 Ų147.574%0.73880%0.795SS**  130.113611717.20000115.1N2476S2474-N2476 PolarHBondContact O-N 2.86Å
2475S26.8Very low25.3Very low106.6 Ų106.6142.4 Ų142.475%0.74579%0.788SS**  78.3118.5126.148.60000119
2476N26.3Very low25.3Very low148.4 Ų148.4141.2 Ų141.279%0.79479%0.785SS**  79.3121.5127.2-106.1-10.4000120.2S2474S2474-N2476 PolarHBondContact O-N 2.86Å
2477R26.5Very low25.3Very low215.8 Ų215.8143.5 Ų143.581%0.81479%0.791SS**  trans35.8142.8142.6-75.8176.4171.7177.8-2.7116.8
2478N25.5Very low25.3Very low155.8 Ų155.8140.1 Ų140.183%0.83379%0.787SS**  trans84.9118.6137.5-74.6-3.8000117.5
2479G26.3Very low25.3Very low78.8 Ų78.8139 Ų13981%0.81279%0.792SS**  trans153.480.1145.800000116.6
2480S26.3Very low25.2Very low105.8 Ų105.8136.2 Ų136.274%0.7479%0.792SS**  trans-59.5134.6155.91740000115.9
2481R24.9Very low25.3Very low224.8 Ų224.8136.5 Ų136.585%0.84880%0.795SS**  trans114.1124145.5-104.6178-176.6-176.83.1115.3R2483R2481-R2483 PolarHBondContact O-N 2.75Å
2482I27.4Very low25.2Very low138.4 Ų138.4139.8 Ų139.871%0.7180%0.801SS**  155.5118.899.7-77.3166.7000109.7
2483R24.1Very low25.3Very low210.2 Ų210.2134.3 Ų134.379%0.79380%0.797SS**  -40.9133.9122.7-103.3170-175.9-178.6-0.1112R2481R2481-R2483 PolarHBondContact O-N 2.75Å
2484R24.9Very low25.2Very low217.6 Ų217.6133 Ų13382%0.82180%0.8SS**  -169.2134.9111.5-86-172.9-179.1166.3-0.9110.7
2485T24.3Very low25.3Very low122.6 Ų122.6133.9 Ų133.975%0.75280%0.801SS**  -98.2144.912847.40000114.7
2486A24.8Very low25.2Very low93.6 Ų93.6135.7 Ų135.777%0.77480%0.802SS**  101.1142.2129.200000117.4
2487S24.9Very low25.1Very low114 Ų114137.1 Ų137.180%0.79780%0.804SS**  trans162.5141.5140.161.50000114.6
2488A25.4Very low25Very low95.2 Ų95.2134 Ų13479%0.78780%0.803SS**  trans135130.9132.400000118
2489A26.2Very low25Very low108.6 Ų108.6134.6 Ų134.690%0.89881%0.806SS**  trans81.4122.3143.500000118.1
2490G23.9Very low25Very low82.2 Ų82.2135.3 Ų135.385%0.84780%0.804SS**  trans147.681.9144.800000114.8T2492G2490-T2492 PolarHBondContact O-N 2.91Å
2491G24.8Very low24.9Very low79.4 Ų79.4136.4 Ų136.482%0.81981%0.806SS**  trans132106163.300000115.5
2492T23.5Very low24.9Very low142.6 Ų142.6130 Ų13088%0.87580%0.796SS**  trans-108.1124.5164.641.20000112.8G2490 V2494G2490-T2492 PolarHBondContact O-N 2.91Å; T2492-V2494 PolarHBondContact O-N 3.41Å; T2492-V2494 VanDerWaalsContact O-N 3.12Å
2493S24.1Very low24.9Very low112.8 Ų112.8130.4 Ų130.479%0.78980%0.799SS**  trans-101.7122.7154168.70000111.4
2494V24.3Very low25.2Very low134.4 Ų134.4126.1 Ų126.182%0.81579%0.791SS**  trans-114.3118.3158.2174.30000109T2492T2492-V2494 PolarHBondContact O-N 3.41Å; T2492-V2494 VanDerWaalsContact O-N 3.12Å
2495V26.1Very low25.6Very low124.2 Ų124.2121.8 Ų121.875%0.75379%0.789SS**  trans-100.3119.7159.3-175.70000111.5E2497V2495-E2497 HydrophobicContact CG1-CG 4.05Å; V2495-E2497 PolarHBondContact O-N 2.83Å
2496N25.3Very low26.7Very low145.2 Ų145.2120.3 Ų120.378%0.77677%0.773SS**  trans-44.2111.5165.3-106.7-6.8000114.5N2498N2496-N2498 HydrophobicContact CB-CB 4.26Å; N2496-N2498 PolarHBondContact O-N 2.74Å
2497E23.3Very low28.4Very low177.2 Ų177.2118 Ų11883%0.82875%0.75SS**  trans-73.7119.5152-70.3-179.8142.600109.5V2495V2495-E2497 HydrophobicContact CG1-CG 4.05Å; V2495-E2497 PolarHBondContact O-N 2.83Å
2498N24.9Very low30.6Very low150 Ų150114.9 Ų114.980%0.80272%0.721SS**  trans157.254.1171.9-77.2-41.2000113.8N2496N2496-N2498 HydrophobicContact CB-CB 4.26Å; N2496-N2498 PolarHBondContact O-N 2.74Å
2499L24.6Very low32.6Very low169.8 Ų169.8111.7 Ų111.789%0.88969%0.69SS**  trans-132.393.3157.3-146.276.6000110.2T2501L2499-T2501 PolarHBondContact O-N 3.15Å
2500A26.3Very low34.6Very low93 Ų93110.4 Ų110.477%0.76967%0.665SS**  trans-98.363.1176.100000113.2S2502A2500-S2502 PolarHBondContact O-N 3.04Å
2501T25.3Very low37.1Very low127.8 Ų127.8106.6 Ų106.678%0.78463%0.626SS**  trans-7480.7164.143.10000112.8L2499 N2503L2499-T2501 PolarHBondContact O-N 3.15Å; T2501-N2503 PolarHBondContact O-N 3.1Å; T2501-N2503 VanDerWaalsContact O-N 3.07Å
2502S25.4Very low39.8Very low92.2 Ų92.2103.4 Ų103.465%0.64559%0.589SS**  trans-94.290.7168.554.60000112A2500 I2504A2500-S2502 PolarHBondContact O-N 3.04Å; S2502-I2504 PolarHBondContact O-N 2.83Å; S2502-I2504 VanDerWaalsContact O-N 3.12Å
2503N27.1Very low42.6Very low145 Ų14598.6 Ų98.678%0.77556%0.564SS**  trans-69.684.9171.9-67.2-14000111.3T2501 T2505T2501-N2503 PolarHBondContact O-N 3.1Å; T2501-N2503 VanDerWaalsContact O-N 3.07Å; N2503-T2505 PolarHBondContact O-N 3.27Å; N2503-T2505 VanDerWaalsContact O-N 3.17Å
2504I30.9Very low45.6Very low120.8 Ų120.895.2 Ų95.262%0.61954%0.535SS*.  trans-112.586.2160.2-70.4169.4000108.5S2502 Q2506S2502-I2504 PolarHBondContact O-N 2.83Å; S2502-I2504 VanDerWaalsContact O-N 3.12Å; I2504-Q2506 VanDerWaalsContact C-N 3.28Å; I2504-Q2506 HydrophobicContact CB-CG 4.43Å; I2504-Q2506 HydrophobicContact CG1-CG 4.35Å; I2504-Q2506 HydrophobicContact CG2-CB 3.37Å; I2504-Q2506 VanDerWaalsContact CG2-CB 3.5Å; I2504-Q2506 VanDerWaalsContact CG2-CD 3.49Å; I2504-Q2506 HydrophobicContact CG2-CG 3.45Å; I2504-Q2506 VanDerWaalsContact CG2-CG 3.45Å; I2504-Q2506 PolarHBondContact O-N 3.17Å
2505T33.1Very low48.6Very low126.4 Ų126.488.9 Ų88.978%0.77550%0.497SS*.  trans-76.183.3160.549.70000108.9N2503 T2507N2503-T2505 PolarHBondContact O-N 3.27Å; N2503-T2505 VanDerWaalsContact O-N 3.17Å; T2505-T2507 PolarHBondContact O-N 3.17Å; T2505-T2507 VanDerWaalsContact O-N 3.08Å
2506Q47.1Very low51.6Low91.6 Ų91.683.8 Ų83.843%0.42847%0.465SS..  trans-60.5127.1167.5-86.4174.7-11.800108.3Y2388 I2504 E2510Y2388-Q2506 VanDerWaalsContact OH-CD 3.31Å; Y2388-Q2506 PolarHBondContact OH-NE2 3.21Å; Y2388-Q2506 PolarHBondContact OH-OE1 3.08Å; I2504-Q2506 VanDerWaalsContact C-N 3.28Å; I2504-Q2506 HydrophobicContact CB-CG 4.43Å; I2504-Q2506 HydrophobicContact CG1-CG 4.35Å; I2504-Q2506 HydrophobicContact CG2-CB 3.37Å; I2504-Q2506 VanDerWaalsContact CG2-CB 3.5Å; I2504-Q2506 VanDerWaalsContact CG2-CD 3.49Å; I2504-Q2506 HydrophobicContact CG2-CG 3.45Å; I2504-Q2506 VanDerWaalsContact CG2-CG 3.45Å; I2504-Q2506 PolarHBondContact O-N 3.17Å; Q2506-E2510 VanDerWaalsContact CA-OE2 3.29Å; Q2506-E2510 WeakPolarHBondContact CA-OE2 3.36Å; Q2506-E2510 HydrophobicContact CB-CB 4.25Å; Q2506-E2510 HydrophobicContact CG-CB 4.22Å; Q2506-E2510 WeakPolarHBondContact CG-OE2 3.44Å
2507T60.9Low54.7Low45.2 Ų45.280.4 Ų80.428%0.27745%0.445SS..  trans-74151.3-179.661.50000110.3Q2424 K2436 T2505 E2509 E2510 S2511Q2424-T2507 PolarHBondContact NE2-OG1 3.26Å; Q2424-T2507 VanDerWaalsContact NE2-OG1 3.14Å; K2436-T2507 HydrophobicContact CD-CG2 4.37Å; K2436-T2507 WeakPolarHBondContact CD-OG1 3.22Å; K2436-T2507 PolarHBondContact NZ-OG1 3.43Å; T2505-T2507 PolarHBondContact O-N 3.17Å; T2505-T2507 VanDerWaalsContact O-N 3.08Å; T2507-E2509 VanDerWaalsContact C-N 3.26Å; T2507-E2509 WeakPolarHBondContact CB-OE2 3.3Å; T2507-E2509 PolarHBondContact O-N 3.07Å; T2507-E2509 VanDerWaalsContact O-N 3.1Å; T2507-E2509 PolarHBondContact OG1-OE2 3.07Å; T2507-E2510 PolarHBondContact N-OE2 3Å; T2507-E2510 PolarHBondContact O-N 3.02Å; T2507-E2510 VanDerWaalsContact O-N 3.09Å; T2507-E2510 VanDerWaalsContact OG1-CD 3.25Å; T2507-E2510 WeakPolarHBondContact OG1-CG 3.32Å; T2507-E2510 PolarHBondContact OG1-N 3.21Å; T2507-E2510 PolarHBondContact OG1-OE1 3.19Å; T2507-E2510 PolarHBondContact OG1-OE2 3.1Å; T2507-S2511 PolarHBondContact O-N 3.19Å; T2507-S2511 VanDerWaalsContact O-N 3.1Å; T2507-S2511 PolarHBondContact O-OG 3.1Å; T2507-S2511 VanDerWaalsContact O-OG 3.05Å
2508W70.1Confident57.9Low48.8 Ų48.872 Ų7219%0.18541%0.406CS..Hα-helixtrans-53.5-34.3176.317592.1000111.4T2393 S2511 Q2512 V2543 H2546T2393-W2508 PolarHBondContact O-NE1 3.01Å; W2508-S2511 WeakPolarHBondContact O-CB 3.39Å; W2508-S2511 PolarHBondContact O-N 3.3Å; W2508-S2511 PolarHBondContact O-OG 3.29Å; W2508-Q2512 HydrophobicContact CD2-CG 3.97Å; W2508-Q2512 HydrophobicContact CE3-CG 4.14Å; W2508-Q2512 HydrophobicContact CH2-CB 4.49Å; W2508-Q2512 HydrophobicContact CH2-CG 3.97Å; W2508-Q2512 HydrophobicContact CZ2-CB 4.44Å; W2508-Q2512 HydrophobicContact CZ2-CG 3.83Å; W2508-Q2512 VanDerWaalsContact CZ2-NE2 3.33Å; W2508-Q2512 HydrophobicContact CZ3-CG 4.1Å; W2508-Q2512 WeakPolarHBondContact O-CB 3.42Å; W2508-Q2512 WeakPolarHBondContact O-CG 3.31Å; W2508-Q2512 PolarHBondContact O-N 3.12Å; W2508-V2543 HydrophobicContact CH2-CB 4.42Å; W2508-V2543 HydrophobicContact CH2-CG1 4.37Å; W2508-V2543 HydrophobicContact CH2-CG2 4.33Å; W2508-V2543 HydrophobicContact CZ3-CG2 4.33Å; W2508-H2546 AromaticContact CE3-CD2 3.85Å; W2508-H2546 HydrophobicContact CH2-CB 3.64Å; W2508-H2546 AromaticContact CH2-CD2 3.43Å; W2508-H2546 VanDerWaalsContact CH2-CD2 3.44Å; W2508-H2546 WeakPolarHBondContact CH2-CD2 3.33Å; W2508-H2546 AromaticContact CH2-CG 3.64Å; W2508-H2546 VanDerWaalsContact CH2-CG 3.47Å; W2508-H2546 HydrophobicContact CZ2-CB 3.97Å; W2508-H2546 AromaticContact CZ2-CD2 3.83Å; W2508-H2546 AromaticContact CZ2-CG 3.71Å; W2508-H2546 HydrophobicContact CZ3-CB 4.26Å; W2508-H2546 AromaticContact CZ3-CD2 3.4Å; W2508-H2546 VanDerWaalsContact CZ3-CD2 3.41Å; W2508-H2546 WeakPolarHBondContact CZ3-CD2 3.38Å; W2508-H2546 AromaticContact CZ3-CG 3.87Å; W2508-H2546 AromaticContact CZ3-NE2 3.96Å
2509E66.8Low61.1Low29.4 Ų29.465.8 Ų65.814%0.13737%0.371CS..Hα-helixtrans-63.9-46.7176.8-61.2144.9-167.300113.1F2415 L2423 Q2424 V2427 T2433 K2436 V2437 T2507 S2511 Q2512 A2513F2415-E2509 HydrophobicContact CB-CB 4.22Å; F2415-E2509 WeakPolarHBondContact CB-OE2 2.85Å; F2415-E2509 HydrophobicContact CD1-CB 4.36Å; F2415-E2509 HydrophobicContact CD1-CG 4.28Å; F2415-E2509 HydrophobicContact CD2-CB 3.77Å; F2415-E2509 HydrophobicContact CE2-CB 4.2Å; F2415-E2509 WeakPolarHBondContact CE2-O 3.47Å; F2415-E2509 HydrophobicContact CG-CB 3.86Å; F2415-E2509 HydrophobicContact CG-CG 4.23Å; L2423-E2509 HydrophobicContact CD2-CB 4.17Å; L2423-E2509 HydrophobicContact CD2-CG 4.5Å; L2423-E2509 HydrophobicContact CG-CB 4.17Å; L2423-E2509 HydrophobicContact CG-CG 4.14Å; L2423-E2509 PolarHBondContact N-OE1 3.21Å; Q2424-E2509 WeakPolarHBondContact CA-OE2 3.26Å; Q2424-E2509 HydrophobicContact CB-CB 4.13Å; Q2424-E2509 HydrophobicContact CB-CG 4.36Å; Q2424-E2509 WeakPolarHBondContact CB-OE1 3.46Å; Q2424-E2509 HydrophobicContact CG-CB 4.39Å; Q2424-E2509 PolarHBondContact N-OE1 3.22Å; V2427-E2509 HydrophobicContact CB-CG 4.19Å; V2427-E2509 WeakPolarHBondContact CB-OE1 3.26Å; V2427-E2509 HydrophobicContact CG1-CG 4.48Å; V2427-E2509 VanDerWaalsContact CG1-OE1 3.27Å; V2427-E2509 WeakPolarHBondContact CG1-OE1 3.25Å; V2427-E2509 HydrophobicContact CG2-CG 4.31Å; T2433-E2509 WeakPolarHBondContact CA-OE1 3.34Å; T2433-E2509 WeakPolarHBondContact CA-OE2 2.91Å; T2433-E2509 VanDerWaalsContact CB-OE1 3.27Å; T2433-E2509 WeakPolarHBondContact CB-OE1 3.43Å; T2433-E2509 HydrophobicContact CG2-CG 4.27Å; T2433-E2509 WeakPolarHBondContact CG2-OE1 3.35Å; T2433-E2509 VanDerWaalsContact O-OE2 3.12Å; T2433-E2509 PolarHBondContact OG1-OE1 3.47Å; K2436-E2509 WeakPolarHBondContact CB-OE2 3.25Å; V2437-E2509 HydrophobicContact CG2-CG 4.42Å; T2507-E2509 VanDerWaalsContact C-N 3.26Å; T2507-E2509 WeakPolarHBondContact CB-OE2 3.3Å; T2507-E2509 PolarHBondContact O-N 3.07Å; T2507-E2509 VanDerWaalsContact O-N 3.1Å; T2507-E2509 PolarHBondContact OG1-OE2 3.07Å; E2509-S2511 VanDerWaalsContact C-N 3.31Å; E2509-S2511 PolarHBondContact O-N 3.14Å; E2509-Q2512 PolarHBondContact O-N 3.27Å; E2509-Q2512 VanDerWaalsContact O-N 3.15Å; E2509-A2513 WeakPolarHBondContact O-CB 3.37Å; E2509-A2513 PolarHBondContact O-N 3.2Å
2510E70Confident64.4Low79.6 Ų79.662 Ų6237%0.37235%0.349SS..Hα-helixtrans-60.6-40.6175.6-72.3163.9-175.300110.9Q2424 K2436 Q2506 T2507 Q2512 A2513 F2514Q2424-E2510 PolarHBondContact NE2-OE1 3.38Å; K2436-E2510 IonicContact NZ-OE1 3.59Å; K2436-E2510 PolarHBondContact NZ-OE1 2.78Å; K2436-E2510 IonicContact NZ-OE2 2.68Å; K2436-E2510 PolarHBondContact NZ-OE2 2.87Å; Q2506-E2510 VanDerWaalsContact CA-OE2 3.29Å; Q2506-E2510 WeakPolarHBondContact CA-OE2 3.36Å; Q2506-E2510 HydrophobicContact CB-CB 4.25Å; Q2506-E2510 HydrophobicContact CG-CB 4.22Å; Q2506-E2510 WeakPolarHBondContact CG-OE2 3.44Å; T2507-E2510 PolarHBondContact N-OE2 3Å; T2507-E2510 PolarHBondContact O-N 3.02Å; T2507-E2510 VanDerWaalsContact O-N 3.09Å; T2507-E2510 VanDerWaalsContact OG1-CD 3.25Å; T2507-E2510 WeakPolarHBondContact OG1-CG 3.32Å; T2507-E2510 PolarHBondContact OG1-N 3.21Å; T2507-E2510 PolarHBondContact OG1-OE1 3.19Å; T2507-E2510 PolarHBondContact OG1-OE2 3.1Å; E2510-Q2512 PolarHBondContact O-N 3.49Å; E2510-A2513 PolarHBondContact O-N 3.16Å; E2510-F2514 PolarHBondContact O-N 2.83Å; E2510-F2514 VanDerWaalsContact O-N 3.12Å
2511S75.5Confident67.4Low3.8 Ų3.858.8 Ų58.83%0.02732%0.32CS..Hα-helixtrans-64.2-42.8177.3-54.80000112.2T2507 W2508 E2509 F2514 V2515T2507-S2511 PolarHBondContact O-N 3.19Å; T2507-S2511 VanDerWaalsContact O-N 3.1Å; T2507-S2511 PolarHBondContact O-OG 3.1Å; T2507-S2511 VanDerWaalsContact O-OG 3.05Å; W2508-S2511 WeakPolarHBondContact O-CB 3.39Å; W2508-S2511 PolarHBondContact O-N 3.3Å; W2508-S2511 PolarHBondContact O-OG 3.29Å; E2509-S2511 VanDerWaalsContact C-N 3.31Å; E2509-S2511 PolarHBondContact O-N 3.14Å; S2511-F2514 PolarHBondContact O-N 2.9Å; S2511-V2515 VanDerWaalsContact O-CG2 3.27Å; S2511-V2515 WeakPolarHBondContact O-CG2 3.33Å; S2511-V2515 PolarHBondContact O-N 3.02Å; S2511-V2515 VanDerWaalsContact O-N 3.13Å
2512Q81.1Confident70.5Confident11.2 Ų11.252.7 Ų52.75%0.05228%0.282CS..Hα-helixtrans-70.2-37.5177-82.9-48.8-14.300112.4T2393 W2508 E2509 E2510 F2514 V2515 I2516 A2539 V2543T2393-Q2512 VanDerWaalsContact CB-NE2 3.27Å; T2393-Q2512 HydrophobicContact CG2-CG 4.34Å; W2508-Q2512 HydrophobicContact CD2-CG 3.97Å; W2508-Q2512 HydrophobicContact CE3-CG 4.14Å; W2508-Q2512 HydrophobicContact CH2-CB 4.49Å; W2508-Q2512 HydrophobicContact CH2-CG 3.97Å; W2508-Q2512 HydrophobicContact CZ2-CB 4.44Å; W2508-Q2512 HydrophobicContact CZ2-CG 3.83Å; W2508-Q2512 VanDerWaalsContact CZ2-NE2 3.33Å; W2508-Q2512 HydrophobicContact CZ3-CG 4.1Å; W2508-Q2512 WeakPolarHBondContact O-CB 3.42Å; W2508-Q2512 WeakPolarHBondContact O-CG 3.31Å; W2508-Q2512 PolarHBondContact O-N 3.12Å; E2509-Q2512 PolarHBondContact O-N 3.27Å; E2509-Q2512 VanDerWaalsContact O-N 3.15Å; E2510-Q2512 PolarHBondContact O-N 3.49Å; Q2512-F2514 VanDerWaalsContact C-N 3.32Å; Q2512-F2514 PolarHBondContact O-N 3.11Å; Q2512-V2515 PolarHBondContact O-N 3.32Å; Q2512-I2516 HydrophobicContact CG-CD1 4.17Å; Q2512-I2516 WeakPolarHBondContact O-CB 3.43Å; Q2512-I2516 VanDerWaalsContact O-CG1 3.3Å; Q2512-I2516 WeakPolarHBondContact O-CG1 3.32Å; Q2512-I2516 PolarHBondContact O-N 3.04Å; Q2512-A2539 PolarHBondContact NE2-O 3.24Å; Q2512-V2543 HydrophobicContact CB-CG2 3.86Å; Q2512-V2543 HydrophobicContact CG-CG2 3.96Å
2513A83.4Confident73.7Confident43 Ų4348.6 Ų48.636%0.35525%0.254SS..Hα-helixtrans-59.6-44.417600000111.3F2415 E2509 E2510 V2515 I2516 Q2517F2415-A2513 HydrophobicContact CD2-CB 4.44Å; F2415-A2513 HydrophobicContact CE2-CB 4.06Å; E2509-A2513 WeakPolarHBondContact O-CB 3.37Å; E2509-A2513 PolarHBondContact O-N 3.2Å; E2510-A2513 PolarHBondContact O-N 3.16Å; A2513-V2515 PolarHBondContact O-N 2.99Å; A2513-I2516 PolarHBondContact O-N 3.02Å; A2513-Q2517 WeakPolarHBondContact O-CB 3.41Å; A2513-Q2517 PolarHBondContact O-N 3.09Å
2514F86.3Confident76.7Confident41.2 Ų41.247.8 Ų47.818%0.18125%0.248CC..Hα-helixtrans-63.2-41.4175.3-178.8-104.5000112.8L2384 Y2388 F2415 E2510 S2511 Q2512 I2516 Q2517 C2518L2384-F2514 HydrophobicContact CD1-CE1 4.4Å; L2384-F2514 HydrophobicContact CD2-CE1 4.19Å; L2384-F2514 HydrophobicContact CD2-CZ 3.89Å; L2384-F2514 HydrophobicContact CG-CE1 4.11Å; L2384-F2514 HydrophobicContact CG-CZ 4.32Å; Y2388-F2514 AromaticContact CD1-CD1 3.95Å; Y2388-F2514 HydrophobicContact CD1-CD1 4.01Å; Y2388-F2514 AromaticContact CD2-CD1 3.71Å; Y2388-F2514 HydrophobicContact CD2-CD1 3.81Å; Y2388-F2514 AromaticContact CD2-CE1 3.63Å; Y2388-F2514 HydrophobicContact CD2-CE1 3.74Å; Y2388-F2514 HydrophobicContact CE1-CD1 4.18Å; Y2388-F2514 AromaticContact CE2-CD1 3.9Å; Y2388-F2514 HydrophobicContact CE2-CD1 3.97Å; Y2388-F2514 AromaticContact CE2-CE1 3.87Å; Y2388-F2514 HydrophobicContact CE2-CE1 4.06Å; Y2388-F2514 AromaticContact CG-CD1 3.74Å; Y2388-F2514 HydrophobicContact CG-CD1 3.82Å; Y2388-F2514 AromaticContact CG-CE1 3.97Å; Y2388-F2514 HydrophobicContact CG-CE1 4.08Å; F2415-F2514 HydrophobicContact CD1-CD2 4.27Å; F2415-F2514 AromaticContact CD1-CE2 3.88Å; F2415-F2514 HydrophobicContact CD1-CE2 3.88Å; F2415-F2514 AromaticContact CE1-CE2 3.77Å; F2415-F2514 HydrophobicContact CE1-CE2 3.77Å; F2415-F2514 HydrophobicContact CE1-CZ 4.48Å; E2510-F2514 PolarHBondContact O-N 2.83Å; E2510-F2514 VanDerWaalsContact O-N 3.12Å; S2511-F2514 PolarHBondContact O-N 2.9Å; Q2512-F2514 VanDerWaalsContact C-N 3.32Å; Q2512-F2514 PolarHBondContact O-N 3.11Å; F2514-I2516 PolarHBondContact O-N 3.01Å; F2514-Q2517 PolarHBondContact O-N 3.1Å; F2514-C2518 VanDerWaalsContact CE1-SG 3.59Å; F2514-C2518 VanDerWaalsContact CZ-SG 3.59Å; F2514-C2518 WeakPolarHBondContact O-CB 3.37Å; F2514-C2518 PolarHBondContact O-N 3.18Å; F2514-C2518 PolarHBondContact O-SG 3.08Å
2515V87.8Confident79.5Confident1.8 Ų1.844.7 Ų44.71%0.01123%0.231CC..Hα-helixtrans-62.2-46176170.40000111.1G2385 Y2388 T2393 S2511 Q2512 A2513 Q2517 C2518 Y2519 A2539G2385-V2515 WeakPolarHBondContact O-CG2 3.44Å; Y2388-V2515 HydrophobicContact CD1-CG2 3.96Å; Y2388-V2515 HydrophobicContact CG-CG2 4.41Å; T2393-V2515 HydrophobicContact CG2-CG2 4.46Å; S2511-V2515 VanDerWaalsContact O-CG2 3.27Å; S2511-V2515 WeakPolarHBondContact O-CG2 3.33Å; S2511-V2515 PolarHBondContact O-N 3.02Å; S2511-V2515 VanDerWaalsContact O-N 3.13Å; Q2512-V2515 PolarHBondContact O-N 3.32Å; A2513-V2515 PolarHBondContact O-N 2.99Å; V2515-Q2517 VanDerWaalsContact C-N 3.34Å; V2515-Q2517 PolarHBondContact O-N 3.18Å; V2515-C2518 PolarHBondContact O-N 3.2Å; V2515-Y2519 HydrophobicContact CG1-CD2 3.85Å; V2515-Y2519 HydrophobicContact CG1-CE2 3.34Å; V2515-Y2519 VanDerWaalsContact CG1-CE2 3.44Å; V2515-Y2519 VanDerWaalsContact O-CD2 3.28Å; V2515-Y2519 WeakPolarHBondContact O-CD2 3.34Å; V2515-Y2519 PolarHBondContact O-N 3.01Å; V2515-Y2519 VanDerWaalsContact O-N 3.1Å; V2515-A2539 HydrophobicContact CG1-CB 4.26Å
2516I89.4Confident82.1Confident16.8 Ų16.838.9 Ų38.99%0.08620%0.196CC..Hα-helixtrans-61.5-45176.4-69.5168000110.4Q2512 A2513 F2514 C2518 Y2519 Q2520 A2539 V2543Q2512-I2516 HydrophobicContact CG-CD1 4.17Å; Q2512-I2516 WeakPolarHBondContact O-CB 3.43Å; Q2512-I2516 VanDerWaalsContact O-CG1 3.3Å; Q2512-I2516 WeakPolarHBondContact O-CG1 3.32Å; Q2512-I2516 PolarHBondContact O-N 3.04Å; A2513-I2516 PolarHBondContact O-N 3.02Å; F2514-I2516 PolarHBondContact O-N 3.01Å; I2516-C2518 VanDerWaalsContact C-N 3.35Å; I2516-C2518 PolarHBondContact O-N 3.15Å; I2516-Y2519 PolarHBondContact O-N 3.23Å; I2516-Q2520 VanDerWaalsContact O-CB 3.29Å; I2516-Q2520 WeakPolarHBondContact O-CB 3.18Å; I2516-Q2520 PolarHBondContact O-N 3.29Å; I2516-A2539 HydrophobicContact CG1-CB 3.78Å; I2516-V2543 HydrophobicContact CD1-CG2 3.98Å
2517Q90.1Very high84Confident74 Ų7438 Ų3835%0.34620%0.198SC..Hα-helixtrans-60.4-44177.3-170.4-172.32300111.4A2513 F2514 V2515 Y2519 Q2520 T2521A2513-Q2517 WeakPolarHBondContact O-CB 3.41Å; A2513-Q2517 PolarHBondContact O-N 3.09Å; F2514-Q2517 PolarHBondContact O-N 3.1Å; V2515-Q2517 VanDerWaalsContact C-N 3.34Å; V2515-Q2517 PolarHBondContact O-N 3.18Å; Q2517-Y2519 PolarHBondContact O-N 2.95Å; Q2517-Q2520 WeakPolarHBondContact O-CB 3.42Å; Q2517-Q2520 PolarHBondContact O-N 3.12Å; Q2517-T2521 WeakPolarHBondContact O-CB 3.17Å; Q2517-T2521 WeakPolarHBondContact O-CG2 3.43Å; Q2517-T2521 PolarHBondContact O-N 3.24Å; Q2517-T2521 PolarHBondContact O-OG1 3.08Å; Q2517-T2521 VanDerWaalsContact O-OG1 3.11Å
2518C90.1Very high85.4Confident0 Ų040.3 Ų40.30%021%0.209CC..Hα-helixtrans-60.1-46176.5-73.10000111.8C2381 F2514 V2515 I2516 Q2520 T2521 A2522C2381-C2518 VanDerWaalsContact CB-O 3.3Å; C2381-C2518 WeakPolarHBondContact CB-O 3.36Å; F2514-C2518 VanDerWaalsContact CE1-SG 3.59Å; F2514-C2518 VanDerWaalsContact CZ-SG 3.59Å; F2514-C2518 WeakPolarHBondContact O-CB 3.37Å; F2514-C2518 PolarHBondContact O-N 3.18Å; F2514-C2518 PolarHBondContact O-SG 3.08Å; V2515-C2518 PolarHBondContact O-N 3.2Å; I2516-C2518 VanDerWaalsContact C-N 3.35Å; I2516-C2518 PolarHBondContact O-N 3.15Å; C2518-Q2520 VanDerWaalsContact C-N 3.33Å; C2518-Q2520 PolarHBondContact O-N 3.13Å; C2518-T2521 PolarHBondContact O-N 3.16Å; C2518-T2521 PolarHBondContact O-OG1 2.99Å; C2518-A2522 WeakPolarHBondContact O-CB 3.38Å; C2518-A2522 PolarHBondContact O-N 3.06Å
2519Y92.7Very high86.2Confident21.2 Ų21.240 Ų408%0.08321%0.214CC..Hα-helixtrans-68.8-34.1177.1-62-37.6000112.8L2382 G2385 S2386 V2515 I2516 Q2517 A2522 T2523 S2535 A2539L2382-Y2519 HydrophobicContact CD2-CD1 3.76Å; L2382-Y2519 HydrophobicContact CD2-CE1 3.97Å; L2382-Y2519 WeakPolarHBondContact O-CE1 3.44Å; G2385-Y2519 VanDerWaalsContact C-OH 3.24Å; G2385-Y2519 PolarHBondContact O-OH 2.96Å; S2386-Y2519 VanDerWaalsContact CA-OH 3.3Å; S2386-Y2519 WeakPolarHBondContact CA-OH 3.3Å; S2386-Y2519 PolarHBondContact N-OH 3.09Å; S2386-Y2519 VanDerWaalsContact N-OH 3.09Å; V2515-Y2519 HydrophobicContact CG1-CD2 3.85Å; V2515-Y2519 HydrophobicContact CG1-CE2 3.34Å; V2515-Y2519 VanDerWaalsContact CG1-CE2 3.44Å; V2515-Y2519 VanDerWaalsContact O-CD2 3.28Å; V2515-Y2519 WeakPolarHBondContact O-CD2 3.34Å; V2515-Y2519 PolarHBondContact O-N 3.01Å; V2515-Y2519 VanDerWaalsContact O-N 3.1Å; I2516-Y2519 PolarHBondContact O-N 3.23Å; Q2517-Y2519 PolarHBondContact O-N 2.95Å; Y2519-A2522 WeakPolarHBondContact O-CB 3.4Å; Y2519-A2522 PolarHBondContact O-N 3.1Å; Y2519-A2522 VanDerWaalsContact O-N 3.16Å; Y2519-T2523 WeakPolarHBondContact O-CG2 3.26Å; Y2519-T2523 PolarHBondContact O-N 3.22Å; Y2519-S2535 WeakPolarHBondContact CD2-O 3.38Å; Y2519-A2539 HydrophobicContact CD2-CB 3.63Å; Y2519-A2539 VanDerWaalsContact CD2-CB 3.5Å; Y2519-A2539 HydrophobicContact CE2-CB 3.85Å
2520Q92.4Very high87.3Confident90 Ų9041.6 Ų41.642%0.42122%0.219SC..Hα-helixtrans-62.1-48.5173.3-171.5178.6-0.500111I2516 Q2517 C2518 A2522 T2523 L2524 W2536I2516-Q2520 VanDerWaalsContact O-CB 3.29Å; I2516-Q2520 WeakPolarHBondContact O-CB 3.18Å; I2516-Q2520 PolarHBondContact O-N 3.29Å; Q2517-Q2520 WeakPolarHBondContact O-CB 3.42Å; Q2517-Q2520 PolarHBondContact O-N 3.12Å; C2518-Q2520 VanDerWaalsContact C-N 3.33Å; C2518-Q2520 PolarHBondContact O-N 3.13Å; Q2520-A2522 PolarHBondContact O-N 3.02Å; Q2520-T2523 PolarHBondContact O-N 3.06Å; Q2520-T2523 VanDerWaalsContact O-N 3.08Å; Q2520-T2523 PolarHBondContact O-OG1 3.13Å; Q2520-L2524 WeakPolarHBondContact O-CG 3.3Å; Q2520-L2524 PolarHBondContact O-N 3.13Å; Q2520-L2524 VanDerWaalsContact O-N 3.13Å; Q2520-W2536 HydrophobicContact CG-CZ2 4.49Å
2521T89.9Confident88.1Confident24.6 Ų24.642.2 Ų42.215%0.15122%0.224CC..Hα-helixtrans-56.9-39.1173.3-40.50000111.2C2381 Q2517 C2518 T2523 L2524 H2525C2381-T2521 PolarHBondContact SG-OG1 2.97Å; C2381-T2521 VanDerWaalsContact SG-OG1 3.4Å; Q2517-T2521 WeakPolarHBondContact O-CB 3.17Å; Q2517-T2521 WeakPolarHBondContact O-CG2 3.43Å; Q2517-T2521 PolarHBondContact O-N 3.24Å; Q2517-T2521 PolarHBondContact O-OG1 3.08Å; Q2517-T2521 VanDerWaalsContact O-OG1 3.11Å; C2518-T2521 PolarHBondContact O-N 3.16Å; C2518-T2521 PolarHBondContact O-OG1 2.99Å; T2521-T2523 VanDerWaalsContact C-N 3.35Å; T2521-T2523 PolarHBondContact O-N 3.05Å; T2521-L2524 PolarHBondContact O-N 3.25Å; T2521-H2525 PolarHBondContact O-CD2 2.83Å; T2521-H2525 PolarHBondContact O-N 3.12Å
2522A91.5Very high88.8Confident0 Ų042 Ų420%022%0.223CC..Hα-helixtrans-63.2-39.1175.600000113A2378 C2381 L2382 C2518 Y2519 Q2520 L2524 H2525 A2526 T2532A2378-A2522 HydrophobicContact CB-CB 4.34Å; C2381-A2522 HydrophobicContact CB-CB 3.94Å; L2382-A2522 HydrophobicContact CD2-CB 4.3Å; L2382-A2522 HydrophobicContact CG-CB 4.12Å; C2518-A2522 WeakPolarHBondContact O-CB 3.38Å; C2518-A2522 PolarHBondContact O-N 3.06Å; Y2519-A2522 WeakPolarHBondContact O-CB 3.4Å; Y2519-A2522 PolarHBondContact O-N 3.1Å; Y2519-A2522 VanDerWaalsContact O-N 3.16Å; Q2520-A2522 PolarHBondContact O-N 3.02Å; A2522-L2524 VanDerWaalsContact C-N 3.33Å; A2522-L2524 PolarHBondContact O-N 2.92Å; A2522-H2525 PolarHBondContact O-N 3.39Å; A2522-A2526 PolarHBondContact O-N 3.21Å; A2522-A2526 VanDerWaalsContact O-N 3.08Å; A2522-T2532 HydrophobicContact CB-CG2 3.88Å; A2522-T2532 WeakPolarHBondContact O-CG2 3.33Å
2523T91.2Very high89.4Confident7.2 Ų7.243 Ų434%0.04423%0.226CC..Hα-helixtrans-66.3-32.8175.560.90000113.1Y2519 Q2520 T2521 A2526 P2527 T2532 W2533 W2536Y2519-T2523 WeakPolarHBondContact O-CG2 3.26Å; Y2519-T2523 PolarHBondContact O-N 3.22Å; Q2520-T2523 PolarHBondContact O-N 3.06Å; Q2520-T2523 VanDerWaalsContact O-N 3.08Å; Q2520-T2523 PolarHBondContact O-OG1 3.13Å; T2521-T2523 VanDerWaalsContact C-N 3.35Å; T2521-T2523 PolarHBondContact O-N 3.05Å; T2523-A2526 CarbonylContact O-C 3.56Å; T2523-P2527 WeakPolarHBondContact O-CA 3.37Å; T2523-T2532 VanDerWaalsContact CG2-C 3.5Å; T2523-W2533 HydrophobicContact CG2-CD2 3.8Å; T2523-W2533 HydrophobicContact CG2-CE3 3.69Å; T2523-W2533 HydrophobicContact CG2-CG 4.25Å; T2523-W2533 HydrophobicContact CG2-CH2 4.45Å; T2523-W2533 HydrophobicContact CG2-CZ2 4.5Å; T2523-W2533 HydrophobicContact CG2-CZ3 4.06Å; T2523-W2536 HydrophobicContact CG2-CB 4.02Å; T2523-W2536 HydrophobicContact CG2-CD2 4.48Å; T2523-W2536 HydrophobicContact CG2-CE3 4.43Å; T2523-W2536 HydrophobicContact CG2-CG 4.36Å
2524L91.1Very high89.7Confident126.4 Ų126.442.6 Ų42.666%0.66222%0.217SC*.Hα-helixtrans-69.7-39.4177.9-66.2172.3000112.3Q2520 T2521 A2522Q2520-L2524 WeakPolarHBondContact O-CG 3.3Å; Q2520-L2524 PolarHBondContact O-N 3.13Å; Q2520-L2524 VanDerWaalsContact O-N 3.13Å; T2521-L2524 PolarHBondContact O-N 3.25Å; A2522-L2524 VanDerWaalsContact C-N 3.33Å; A2522-L2524 PolarHBondContact O-N 2.92Å
2525H88.5Confident89.9Confident56 Ų5642.2 Ų42.226%0.25922%0.22SC..Hα-helixtrans-86.4-23.1-178.3-66.3-64.1000114.4R2374 L2377 A2378 T2521 A2522R2374-H2525 HydrophobicContact CB-CB 4.34Å; L2377-H2525 VanDerWaalsContact CD2-CD2 3.47Å; L2377-H2525 WeakPolarHBondContact CD2-CD2 3.37Å; L2377-H2525 VanDerWaalsContact CD2-NE2 3.31Å; L2377-H2525 WeakPolarHBondContact CD2-NE2 3.39Å; A2378-H2525 HydrophobicContact CB-CB 4.4Å; T2521-H2525 PolarHBondContact O-CD2 2.83Å; T2521-H2525 PolarHBondContact O-N 3.12Å; A2522-H2525 PolarHBondContact O-N 3.39Å
2526A87.9Confident90.2Very high5.6 Ų5.643.2 Ų43.25%0.04622%0.223CC..  trans-136.772.717600000111.3A2378 A2522 T2523 D2528 C2529 T2532A2378-A2526 HydrophobicContact CB-CB 3.53Å; A2378-A2526 VanDerWaalsContact CB-CB 3.48Å; A2522-A2526 PolarHBondContact O-N 3.21Å; A2522-A2526 VanDerWaalsContact O-N 3.08Å; T2523-A2526 CarbonylContact O-C 3.56Å; A2526-D2528 PolarHBondContact O-N 3.02Å; A2526-C2529 HydrophobicContact CB-CB 3.98Å; A2526-C2529 WeakPolarHBondContact O-CB 3.34Å; A2526-C2529 PolarHBondContact O-N 3.01Å; A2526-T2532 HydrophobicContact CB-CG2 4.26Å; A2526-T2532 PolarHBondContact O-OG1 3.21Å; A2526-T2532 VanDerWaalsContact O-OG1 3.06Å
2527P88.1Confident90.2Very high71.2 Ų71.242.4 Ų42.446%0.46222%0.219SC..THydrogen-bonded Turntrans-69.9-19.4179.229.3-35.7000112.9T2523 C2529 W2533 L2645T2523-P2527 WeakPolarHBondContact O-CA 3.37Å; P2527-C2529 VanDerWaalsContact C-N 3.28Å; P2527-C2529 PolarHBondContact O-N 3.22Å; P2527-W2533 HydrophobicContact CB-CZ2 4.37Å; P2527-W2533 PolarHBondContact O-NE1 3.3Å; P2527-L2645 WeakPolarHBondContact O-CD1 3.39Å
2528D88.9Confident90.2Very high94.6 Ų94.641.4 Ų41.451%0.50622%0.215SC..THydrogen-bonded Turntrans-76.7-11.1174.947.3-29.2000113.1R2375 A2526R2375-D2528 IonicContact CZ-OD2 3.37Å; R2375-D2528 IonicContact NE-OD2 2.74Å; R2375-D2528 IonicContact NH2-OD2 3.09Å; R2375-D2528 PolarHBondContact NH2-OD2 3.43Å; A2526-D2528 PolarHBondContact O-N 3.02Å
2529C87.9Confident90.1Very high43 Ų4341.8 Ų41.829%0.29122%0.218SC..  trans-94.3112.3-173.7-171.80000111.7A2526 P2527 N2531 T2532A2526-C2529 HydrophobicContact CB-CB 3.98Å; A2526-C2529 WeakPolarHBondContact O-CB 3.34Å; A2526-C2529 PolarHBondContact O-N 3.01Å; P2527-C2529 VanDerWaalsContact C-N 3.28Å; P2527-C2529 PolarHBondContact O-N 3.22Å; C2529-N2531 VanDerWaalsContact C-N 3.27Å; C2529-N2531 PolarHBondContact O-N 3.19Å; C2529-N2531 VanDerWaalsContact O-N 3.12Å; C2529-T2532 HydrophobicContact CB-CG2 3.95Å; C2529-T2532 PolarHBondContact O-N 3.09Å; C2529-T2532 VanDerWaalsContact O-N 3.08Å; C2529-T2532 PolarHBondContact O-OG1 3Å
2530R88.8Confident89.9Confident62.2 Ų62.240.9 Ų40.924%0.23522%0.215CC..Hα-helixtrans-50.8-42.5173.6176-175.5160.7-151.2-18.7113T2532 W2533 Q2534 S2642 L2645 S2646 N2650 D2653R2530-T2532 VanDerWaalsContact C-N 3.3Å; R2530-T2532 PolarHBondContact O-N 3.03Å; R2530-W2533 PolarHBondContact O-N 3.08Å; R2530-Q2534 WeakPolarHBondContact O-CB 3.31Å; R2530-Q2534 PolarHBondContact O-N 3.07Å; R2530-S2642 VanDerWaalsContact CD-O 3.3Å; R2530-S2642 WeakPolarHBondContact CD-O 3.37Å; R2530-S2642 WeakPolarHBondContact CG-O 3.45Å; R2530-S2642 VanDerWaalsContact CG-OG 3.27Å; R2530-S2642 WeakPolarHBondContact CG-OG 3.42Å; R2530-S2642 PolarHBondContact NE-OG 3.44Å; R2530-S2642 PolarHBondContact O-OG 2.96Å; R2530-L2645 HydrophobicContact CB-CB 4.19Å; R2530-S2646 PolarHBondContact NH1-OG 3.25Å; R2530-S2646 VanDerWaalsContact NH1-OG 3.1Å; R2530-N2650 PolarHBondContact NH2-ND2 3.31Å; R2530-N2650 VanDerWaalsContact NH2-ND2 3.17Å; R2530-D2653 IonicContact NE-OD2 3.22Å
2531N87.3Confident89.7Confident92.2 Ų92.237.3 Ų37.349%0.49320%0.198SC..Hα-helixtrans-66.4-28.1-173.2-65.2-5000112.9L2382 C2529 S2535L2382-N2531 HydrophobicContact CD1-CB 4.43Å; C2529-N2531 VanDerWaalsContact C-N 3.27Å; C2529-N2531 PolarHBondContact O-N 3.19Å; C2529-N2531 VanDerWaalsContact O-N 3.12Å; N2531-S2535 VanDerWaalsContact O-CB 3.31Å; N2531-S2535 WeakPolarHBondContact O-CB 3.24Å; N2531-S2535 PolarHBondContact O-N 3.1Å; N2531-S2535 VanDerWaalsContact O-N 3.13Å; N2531-S2535 PolarHBondContact O-OG 3.1Å
2532T91.4Very high89.4Confident0.4 Ų0.438.2 Ų38.20%0.00221%0.207CC..Hα-helixtrans-69-49.5175.958.20000110.4A2378 L2382 A2522 T2523 A2526 C2529 R2530 Q2534 S2535 W2536A2378-T2532 HydrophobicContact CB-CG2 4.35Å; L2382-T2532 HydrophobicContact CD1-CG2 3.7Å; L2382-T2532 VanDerWaalsContact CD1-CG2 3.49Å; L2382-T2532 HydrophobicContact CD2-CG2 4.34Å; L2382-T2532 HydrophobicContact CG-CG2 4.13Å; A2522-T2532 HydrophobicContact CB-CG2 3.88Å; A2522-T2532 WeakPolarHBondContact O-CG2 3.33Å; T2523-T2532 VanDerWaalsContact CG2-C 3.5Å; A2526-T2532 HydrophobicContact CB-CG2 4.26Å; A2526-T2532 PolarHBondContact O-OG1 3.21Å; A2526-T2532 VanDerWaalsContact O-OG1 3.06Å; C2529-T2532 HydrophobicContact CB-CG2 3.95Å; C2529-T2532 PolarHBondContact O-N 3.09Å; C2529-T2532 VanDerWaalsContact O-N 3.08Å; C2529-T2532 PolarHBondContact O-OG1 3Å; R2530-T2532 VanDerWaalsContact C-N 3.3Å; R2530-T2532 PolarHBondContact O-N 3.03Å; T2532-Q2534 PolarHBondContact O-N 3.22Å; T2532-S2535 PolarHBondContact O-N 3.2Å; T2532-W2536 WeakPolarHBondContact O-CB 3.31Å; T2532-W2536 PolarHBondContact O-N 3.12Å
2533W92.6Very high89Confident32.2 Ų32.238.4 Ų38.412%0.12221%0.208CC..Hα-helixtrans-61.2-43.4176-68.2108.3000112.5T2523 P2527 R2530 S2535 W2536 A2537 N2641 L2645T2523-W2533 HydrophobicContact CG2-CD2 3.8Å; T2523-W2533 HydrophobicContact CG2-CE3 3.69Å; T2523-W2533 HydrophobicContact CG2-CG 4.25Å; T2523-W2533 HydrophobicContact CG2-CH2 4.45Å; T2523-W2533 HydrophobicContact CG2-CZ2 4.5Å; T2523-W2533 HydrophobicContact CG2-CZ3 4.06Å; P2527-W2533 HydrophobicContact CB-CZ2 4.37Å; P2527-W2533 PolarHBondContact O-NE1 3.3Å; R2530-W2533 PolarHBondContact O-N 3.08Å; W2533-S2535 PolarHBondContact O-N 2.87Å; W2533-W2536 AromaticContact CE3-CE3 3.91Å; W2533-W2536 HydrophobicContact CE3-CE3 3.99Å; W2533-W2536 HydrophobicContact CE3-CZ3 4.26Å; W2533-W2536 AromaticContact CZ3-CE3 3.95Å; W2533-W2536 HydrophobicContact CZ3-CE3 4.04Å; W2533-W2536 AromaticContact CZ3-CZ3 3.81Å; W2533-W2536 HydrophobicContact CZ3-CZ3 3.93Å; W2533-W2536 PolarHBondContact O-N 3.11Å; W2533-A2537 VanDerWaalsContact O-CB 3.3Å; W2533-A2537 WeakPolarHBondContact O-CB 3.34Å; W2533-A2537 PolarHBondContact O-N 3.12Å; W2533-N2641 HydrophobicContact CB-CB 4.16Å; W2533-N2641 HydrophobicContact CD2-CB 3.52Å; W2533-N2641 VanDerWaalsContact CD2-CB 3.48Å; W2533-N2641 HydrophobicContact CE3-CB 3.87Å; W2533-N2641 HydrophobicContact CG-CB 3.66Å; W2533-N2641 VanDerWaalsContact CH2-ND2 3.26Å; W2533-N2641 WeakPolarHBondContact CH2-ND2 3.43Å; W2533-N2641 HydrophobicContact CZ2-CB 4.45Å; W2533-N2641 WeakPolarHBondContact CZ2-ND2 3.35Å; W2533-N2641 HydrophobicContact CZ3-CB 4.48Å; W2533-N2641 VanDerWaalsContact CZ3-ND2 3.28Å; W2533-N2641 WeakPolarHBondContact CZ3-ND2 3.34Å; W2533-L2645 VanDerWaalsContact CD1-CD1 3.45Å; W2533-L2645 HydrophobicContact CG-CD1 4.48Å
2534Q91Very high88.5Confident33 Ų3338.1 Ų38.115%0.15421%0.207CC..Hα-helixtrans-63-45.2178.9-162179.613.300111.7R2530 T2532 W2536 A2537 M2538 S2642 N2650 D2653R2530-Q2534 WeakPolarHBondContact O-CB 3.31Å; R2530-Q2534 PolarHBondContact O-N 3.07Å; T2532-Q2534 PolarHBondContact O-N 3.22Å; Q2534-W2536 VanDerWaalsContact C-N 3.31Å; Q2534-W2536 PolarHBondContact O-N 3.32Å; Q2534-A2537 PolarHBondContact O-N 3.24Å; Q2534-M2538 HydrophobicContact CG-CG 4.28Å; Q2534-M2538 VanDerWaalsContact O-CB 3.29Å; Q2534-M2538 WeakPolarHBondContact O-CB 3.3Å; Q2534-M2538 VanDerWaalsContact O-CG 3.25Å; Q2534-M2538 WeakPolarHBondContact O-CG 3.35Å; Q2534-M2538 PolarHBondContact O-N 3.12Å; Q2534-S2642 VanDerWaalsContact CB-OG 3.32Å; Q2534-S2642 WeakPolarHBondContact CB-OG 3.42Å; Q2534-N2650 PolarHBondContact NE2-ND2 3.23Å; Q2534-D2653 WeakPolarHBondContact CG-OD2 3.38Å; Q2534-D2653 VanDerWaalsContact NE2-CG 3.34Å; Q2534-D2653 PolarHBondContact NE2-OD1 2.89Å; Q2534-D2653 PolarHBondContact NE2-OD2 3.26Å; Q2534-D2653 VanDerWaalsContact NE2-OD2 3.14Å
2535S89.3Confident87.9Confident34.8 Ų34.834.6 Ų34.624%0.24319%0.189CC..Hα-helixtrans-65.3-40.3178.6-63.60000112.1L2382 Y2519 N2531 T2532 W2533 M2538 A2539L2382-S2535 VanDerWaalsContact CD2-CB 3.46Å; L2382-S2535 WeakPolarHBondContact CD2-OG 3.24Å; Y2519-S2535 WeakPolarHBondContact CD2-O 3.38Å; N2531-S2535 VanDerWaalsContact O-CB 3.31Å; N2531-S2535 WeakPolarHBondContact O-CB 3.24Å; N2531-S2535 PolarHBondContact O-N 3.1Å; N2531-S2535 VanDerWaalsContact O-N 3.13Å; N2531-S2535 PolarHBondContact O-OG 3.1Å; T2532-S2535 PolarHBondContact O-N 3.2Å; W2533-S2535 PolarHBondContact O-N 2.87Å; S2535-M2538 PolarHBondContact O-N 3.18Å; S2535-A2539 WeakPolarHBondContact O-CB 3.37Å; S2535-A2539 PolarHBondContact O-N 3.15Å
2536W93.2Very high87.5Confident22 Ų2234.1 Ų34.18%0.08319%0.186CC..Hα-helixtrans-65.7-42.5175.6-174.661.8000112.3Q2520 T2523 T2532 W2533 Q2534 M2538 A2539 N2540 P2634 K2637Q2520-W2536 HydrophobicContact CG-CZ2 4.49Å; T2523-W2536 HydrophobicContact CG2-CB 4.02Å; T2523-W2536 HydrophobicContact CG2-CD2 4.48Å; T2523-W2536 HydrophobicContact CG2-CE3 4.43Å; T2523-W2536 HydrophobicContact CG2-CG 4.36Å; T2532-W2536 WeakPolarHBondContact O-CB 3.31Å; T2532-W2536 PolarHBondContact O-N 3.12Å; W2533-W2536 AromaticContact CE3-CE3 3.91Å; W2533-W2536 HydrophobicContact CE3-CE3 3.99Å; W2533-W2536 HydrophobicContact CE3-CZ3 4.26Å; W2533-W2536 AromaticContact CZ3-CE3 3.95Å; W2533-W2536 HydrophobicContact CZ3-CE3 4.04Å; W2533-W2536 AromaticContact CZ3-CZ3 3.81Å; W2533-W2536 HydrophobicContact CZ3-CZ3 3.93Å; W2533-W2536 PolarHBondContact O-N 3.11Å; Q2534-W2536 VanDerWaalsContact C-N 3.31Å; Q2534-W2536 PolarHBondContact O-N 3.32Å; W2536-M2538 VanDerWaalsContact C-N 3.31Å; W2536-M2538 PolarHBondContact O-N 3.02Å; W2536-A2539 PolarHBondContact O-N 3.06Å; W2536-N2540 PolarHBondContact NE1-ND2 2.84Å; W2536-N2540 PolarHBondContact O-N 3.23Å; W2536-N2540 VanDerWaalsContact O-N 3.16Å; W2536-N2540 PolarHBondContact O-ND2 2.92Å; W2536-P2634 HydrophobicContact CH2-CB 3.82Å; W2536-P2634 HydrophobicContact CZ2-CB 3.74Å; W2536-P2634 HydrophobicContact CZ2-CG 4.49Å; W2536-P2634 VanDerWaalsContact CZ3-O 3.29Å; W2536-P2634 WeakPolarHBondContact CZ3-O 3.42Å; W2536-K2637 HydrophobicContact CH2-CB 4.47Å; W2536-K2637 HydrophobicContact CH2-CD 4.21Å; W2536-K2637 HydrophobicContact CZ3-CB 4.27Å; W2536-K2637 HydrophobicContact CZ3-CD 4.24Å; W2536-K2637 HydrophobicContact CZ3-CG 4.36Å
2537A91.4Very high87.2Confident0 Ų034 Ų340%019%0.185CC..Hα-helixtrans-59.8-44.3174.300000111.5W2533 Q2534 Y2541 S2635 F2639W2533-A2537 VanDerWaalsContact O-CB 3.3Å; W2533-A2537 WeakPolarHBondContact O-CB 3.34Å; W2533-A2537 PolarHBondContact O-N 3.12Å; Q2534-A2537 PolarHBondContact O-N 3.24Å; A2537-Y2541 VanDerWaalsContact O-CB 3.27Å; A2537-Y2541 WeakPolarHBondContact O-CB 3.36Å; A2537-Y2541 PolarHBondContact O-N 3.16Å; A2537-S2635 PolarHBondContact O-OG 3.09Å; A2537-F2639 HydrophobicContact CB-CD1 3.66Å; A2537-F2639 HydrophobicContact CB-CD2 3.96Å; A2537-F2639 HydrophobicContact CB-CE1 3.65Å; A2537-F2639 HydrophobicContact CB-CE2 3.96Å; A2537-F2639 HydrophobicContact CB-CG 3.8Å; A2537-F2639 HydrophobicContact CB-CZ 3.79Å
2538M88.8Confident86.8Confident53.6 Ų53.632.9 Ų32.926%0.26418%0.175SC..Hα-helixtrans-68.2-38.3-179-80.3-60-61.100113.7Q2534 S2535 W2536 Y2541 A2542 F2639 R2656Q2534-M2538 HydrophobicContact CG-CG 4.28Å; Q2534-M2538 VanDerWaalsContact O-CB 3.29Å; Q2534-M2538 WeakPolarHBondContact O-CB 3.3Å; Q2534-M2538 VanDerWaalsContact O-CG 3.25Å; Q2534-M2538 WeakPolarHBondContact O-CG 3.35Å; Q2534-M2538 PolarHBondContact O-N 3.12Å; S2535-M2538 PolarHBondContact O-N 3.18Å; W2536-M2538 VanDerWaalsContact C-N 3.31Å; W2536-M2538 PolarHBondContact O-N 3.02Å; M2538-Y2541 HydrophobicContact CE-CD1 4.47Å; M2538-Y2541 PolarHBondContact O-N 3.12Å; M2538-Y2541 HydrophobicContact SD-CD1 4.43Å; M2538-A2542 VanDerWaalsContact O-CB 3.28Å; M2538-A2542 WeakPolarHBondContact O-CB 3.41Å; M2538-A2542 PolarHBondContact O-N 3.04Å; M2538-F2639 HydrophobicContact CG-CE1 4.38Å; M2538-F2639 HydrophobicContact CG-CZ 4.42Å; M2538-F2639 HydrophobicContact SD-CE1 4.23Å; M2538-F2639 HydrophobicContact SD-CZ 3.95Å; M2538-R2656 PolarHBondContact SD-NE 2.82Å; M2538-R2656 VanDerWaalsContact SD-NE 3.44Å; M2538-R2656 PolarHBondContact SD-NH1 3.04Å; M2538-R2656 PolarHBondContact SD-NH2 2.96Å
2539A88.2Confident86.3Confident7.2 Ų7.232.3 Ų32.36%0.0618%0.175CC..Hα-helixtrans-64.4-46.2176.200000111.4Q2512 V2515 I2516 Y2519 S2535 W2536 Y2541 A2542 V2543Q2512-A2539 PolarHBondContact NE2-O 3.24Å; V2515-A2539 HydrophobicContact CG1-CB 4.26Å; I2516-A2539 HydrophobicContact CG1-CB 3.78Å; Y2519-A2539 HydrophobicContact CD2-CB 3.63Å; Y2519-A2539 VanDerWaalsContact CD2-CB 3.5Å; Y2519-A2539 HydrophobicContact CE2-CB 3.85Å; S2535-A2539 WeakPolarHBondContact O-CB 3.37Å; S2535-A2539 PolarHBondContact O-N 3.15Å; W2536-A2539 PolarHBondContact O-N 3.06Å; A2539-Y2541 VanDerWaalsContact C-N 3.31Å; A2539-Y2541 PolarHBondContact O-N 3.19Å; A2539-A2542 PolarHBondContact O-N 3.1Å; A2539-V2543 WeakPolarHBondContact O-CG2 3.33Å; A2539-V2543 PolarHBondContact O-N 3.18Å; A2539-V2543 VanDerWaalsContact O-N 3.13Å
2540N89.3Confident85.9Confident3.2 Ų3.231.7 Ų31.72%0.01717%0.169CC..Hα-helixtrans-63.3-38.1173.6-73.3-77.8000111.9W2536 A2542 V2543 F2544 H2631W2536-N2540 PolarHBondContact NE1-ND2 2.84Å; W2536-N2540 PolarHBondContact O-N 3.23Å; W2536-N2540 VanDerWaalsContact O-N 3.16Å; W2536-N2540 PolarHBondContact O-ND2 2.92Å; N2540-A2542 VanDerWaalsContact C-N 3.35Å; N2540-A2542 PolarHBondContact O-N 2.91Å; N2540-V2543 WeakPolarHBondContact O-CB 3.44Å; N2540-V2543 PolarHBondContact O-N 3.23Å; N2540-F2544 WeakPolarHBondContact O-CB 3.36Å; N2540-F2544 WeakPolarHBondContact O-CE2 3.27Å; N2540-F2544 PolarHBondContact O-N 3.08Å; N2540-H2631 HydrophobicContact CB-CB 4.41Å; N2540-H2631 PolarHBondContact OD1-ND1 3.31Å; N2540-H2631 VanDerWaalsContact OD1-ND1 3.08Å
2541Y87.1Confident85.5Confident14.2 Ų14.231 Ų316%0.05617%0.168CC..Hα-helixtrans-66.4-36.4176.3-168.6-102.9000112.9A2537 M2538 A2539 V2543 F2544 N2545 F2639 R2656 N2659 L2660A2537-Y2541 VanDerWaalsContact O-CB 3.27Å; A2537-Y2541 WeakPolarHBondContact O-CB 3.36Å; A2537-Y2541 PolarHBondContact O-N 3.16Å; M2538-Y2541 HydrophobicContact CE-CD1 4.47Å; M2538-Y2541 PolarHBondContact O-N 3.12Å; M2538-Y2541 HydrophobicContact SD-CD1 4.43Å; A2539-Y2541 VanDerWaalsContact C-N 3.31Å; A2539-Y2541 PolarHBondContact O-N 3.19Å; Y2541-V2543 PolarHBondContact O-N 2.82Å; Y2541-F2544 VanDerWaalsContact CA-CD2 3.47Å; Y2541-F2544 AromaticContact CD2-CD1 3.83Å; Y2541-F2544 HydrophobicContact CD2-CD1 3.83Å; Y2541-F2544 AromaticContact CD2-CD2 3.81Å; Y2541-F2544 HydrophobicContact CD2-CD2 3.81Å; Y2541-F2544 HydrophobicContact CD2-CE1 4.38Å; Y2541-F2544 HydrophobicContact CD2-CE2 4.29Å; Y2541-F2544 AromaticContact CE2-CD1 3.77Å; Y2541-F2544 HydrophobicContact CE2-CD1 3.77Å; Y2541-F2544 HydrophobicContact CE2-CD2 4.42Å; Y2541-F2544 AromaticContact CE2-CE1 3.86Å; Y2541-F2544 HydrophobicContact CE2-CE1 3.86Å; Y2541-F2544 HydrophobicContact CG-CD1 4.46Å; Y2541-F2544 HydrophobicContact CG-CD2 4.21Å; Y2541-F2544 WeakPolarHBondContact O-CB 3.34Å; Y2541-F2544 PolarHBondContact O-N 3.32Å; Y2541-N2545 VanDerWaalsContact CD1-ND2 3.27Å; Y2541-N2545 WeakPolarHBondContact CD1-ND2 3.36Å; Y2541-N2545 VanDerWaalsContact CE1-ND2 3.33Å; Y2541-N2545 WeakPolarHBondContact CE1-ND2 3.36Å; Y2541-N2545 VanDerWaalsContact O-CG 3.25Å; Y2541-N2545 PolarHBondContact O-N 3.14Å; Y2541-N2545 PolarHBondContact O-ND2 3.28Å; Y2541-N2545 VanDerWaalsContact O-ND2 3.15Å; Y2541-F2639 AromaticContact CD2-CE2 3.96Å; Y2541-F2639 HydrophobicContact CD2-CE2 4.09Å; Y2541-F2639 HydrophobicContact CD2-CZ 4.38Å; Y2541-F2639 HydrophobicContact CG-CE2 4.24Å; Y2541-F2639 HydrophobicContact CG-CZ 4.34Å; Y2541-R2656 HydrophobicContact CD1-CG 4.49Å; Y2541-R2656 HydrophobicContact CE1-CG 4.12Å; Y2541-R2656 HydrophobicContact CE2-CB 4.42Å; Y2541-R2656 HydrophobicContact CE2-CG 4.49Å; Y2541-N2659 PolarHBondContact OH-ND2 2.9Å; Y2541-N2659 VanDerWaalsContact OH-ND2 3.09Å; Y2541-L2660 HydrophobicContact CD2-CD1 4.14Å; Y2541-L2660 HydrophobicContact CD2-CD2 4.08Å; Y2541-L2660 HydrophobicContact CD2-CG 4.22Å; Y2541-L2660 HydrophobicContact CE2-CD1 4.41Å; Y2541-L2660 HydrophobicContact CE2-CD2 4.07Å; Y2541-L2660 HydrophobicContact CE2-CG 4.1Å
2542A83.1Confident85.2Confident42.2 Ų42.228.3 Ų28.335%0.34916%0.157SC..Hα-helixtrans-66.7-40.5176.500000111.7M2538 A2539 N2540 F2544 N2545 H2546M2538-A2542 VanDerWaalsContact O-CB 3.28Å; M2538-A2542 WeakPolarHBondContact O-CB 3.41Å; M2538-A2542 PolarHBondContact O-N 3.04Å; A2539-A2542 PolarHBondContact O-N 3.1Å; N2540-A2542 VanDerWaalsContact C-N 3.35Å; N2540-A2542 PolarHBondContact O-N 2.91Å; A2542-F2544 VanDerWaalsContact C-N 3.32Å; A2542-F2544 PolarHBondContact O-N 3.26Å; A2542-N2545 PolarHBondContact O-N 3.03Å; A2542-H2546 PolarHBondContact O-N 3.06Å; A2542-H2546 VanDerWaalsContact O-N 3.11Å
2543V83.7Confident84.5Confident4.6 Ų4.630.6 Ų30.63%0.02817%0.173CC..Hα-helixtrans-60-46.9171.5176.70000110.2L2423 W2508 Q2512 I2516 A2539 N2540 Y2541 N2545 H2546 L2547L2423-V2543 HydrophobicContact CD1-CG1 3.74Å; L2423-V2543 HydrophobicContact CD2-CG1 4.04Å; W2508-V2543 HydrophobicContact CH2-CB 4.42Å; W2508-V2543 HydrophobicContact CH2-CG1 4.37Å; W2508-V2543 HydrophobicContact CH2-CG2 4.33Å; W2508-V2543 HydrophobicContact CZ3-CG2 4.33Å; Q2512-V2543 HydrophobicContact CB-CG2 3.86Å; Q2512-V2543 HydrophobicContact CG-CG2 3.96Å; I2516-V2543 HydrophobicContact CD1-CG2 3.98Å; A2539-V2543 WeakPolarHBondContact O-CG2 3.33Å; A2539-V2543 PolarHBondContact O-N 3.18Å; A2539-V2543 VanDerWaalsContact O-N 3.13Å; N2540-V2543 WeakPolarHBondContact O-CB 3.44Å; N2540-V2543 PolarHBondContact O-N 3.23Å; Y2541-V2543 PolarHBondContact O-N 2.82Å; V2543-N2545 VanDerWaalsContact C-N 3.34Å; V2543-N2545 PolarHBondContact O-N 3.28Å; V2543-H2546 WeakPolarHBondContact O-CB 3.39Å; V2543-H2546 PolarHBondContact O-N 3.1Å; V2543-H2546 VanDerWaalsContact O-N 3.12Å; V2543-L2547 HydrophobicContact CG1-CD1 3.92Å; V2543-L2547 HydrophobicContact CG1-CD2 4.42Å; V2543-L2547 HydrophobicContact CG1-CG 4.18Å; V2543-L2547 VanDerWaalsContact O-CG 3.28Å; V2543-L2547 WeakPolarHBondContact O-CG 3.31Å; V2543-L2547 PolarHBondContact O-N 3.16Å
2544F80.5Confident83.8Confident1.2 Ų1.229.2 Ų29.21%0.00517%0.168CC..Hα-helixtrans-54.5-47.2175166.2-94.2000112.9N2540 Y2541 A2542 H2546 L2547 D2548 M2628 H2631 A2632 L2660 K2663 F2664N2540-F2544 WeakPolarHBondContact O-CB 3.36Å; N2540-F2544 WeakPolarHBondContact O-CE2 3.27Å; N2540-F2544 PolarHBondContact O-N 3.08Å; Y2541-F2544 VanDerWaalsContact CA-CD2 3.47Å; Y2541-F2544 AromaticContact CD2-CD1 3.83Å; Y2541-F2544 HydrophobicContact CD2-CD1 3.83Å; Y2541-F2544 AromaticContact CD2-CD2 3.81Å; Y2541-F2544 HydrophobicContact CD2-CD2 3.81Å; Y2541-F2544 HydrophobicContact CD2-CE1 4.38Å; Y2541-F2544 HydrophobicContact CD2-CE2 4.29Å; Y2541-F2544 AromaticContact CE2-CD1 3.77Å; Y2541-F2544 HydrophobicContact CE2-CD1 3.77Å; Y2541-F2544 HydrophobicContact CE2-CD2 4.42Å; Y2541-F2544 AromaticContact CE2-CE1 3.86Å; Y2541-F2544 HydrophobicContact CE2-CE1 3.86Å; Y2541-F2544 HydrophobicContact CG-CD1 4.46Å; Y2541-F2544 HydrophobicContact CG-CD2 4.21Å; Y2541-F2544 WeakPolarHBondContact O-CB 3.34Å; Y2541-F2544 PolarHBondContact O-N 3.32Å; A2542-F2544 VanDerWaalsContact C-N 3.32Å; A2542-F2544 PolarHBondContact O-N 3.26Å; F2544-H2546 VanDerWaalsContact C-N 3.29Å; F2544-H2546 PolarHBondContact O-N 3.16Å; F2544-L2547 CarbonylContact O-C 3.59Å; F2544-L2547 PolarHBondContact O-N 3.14Å; F2544-L2547 VanDerWaalsContact O-N 3.17Å; F2544-D2548 HydrophobicContact CE2-CB 4.15Å; F2544-D2548 HydrophobicContact CZ-CB 4.28Å; F2544-D2548 WeakPolarHBondContact O-CB 3.38Å; F2544-D2548 PolarHBondContact O-N 3.13Å; F2544-M2628 HydrophobicContact CD2-CB 4.3Å; F2544-M2628 HydrophobicContact CD2-CE 4.01Å; F2544-M2628 HydrophobicContact CD2-CG 4.36Å; F2544-M2628 WeakPolarHBondContact CE1-O 3.25Å; F2544-M2628 HydrophobicContact CE2-CE 3.65Å; F2544-M2628 VanDerWaalsContact CE2-CE 3.44Å; F2544-H2631 HydrophobicContact CE1-CB 3.82Å; F2544-H2631 HydrophobicContact CZ-CB 3.79Å; F2544-H2631 WeakPolarHBondContact CZ-O 3.48Å; F2544-A2632 HydrophobicContact CE1-CB 3.98Å; F2544-A2632 HydrophobicContact CZ-CB 3.92Å; F2544-A2632 VanDerWaalsContact CZ-N 3.34Å; F2544-L2660 HydrophobicContact CD1-CD2 4.31Å; F2544-L2660 HydrophobicContact CD2-CD2 3.75Å; F2544-L2660 HydrophobicContact CE1-CD2 4.4Å; F2544-L2660 HydrophobicContact CE2-CD2 3.64Å; F2544-L2660 HydrophobicContact CZ-CD2 4.38Å; F2544-K2663 HydrophobicContact CE1-CD 4.42Å; F2544-K2663 HydrophobicContact CE2-CD 4.32Å; F2544-K2663 HydrophobicContact CZ-CD 3.6Å; F2544-F2664 HydrophobicContact CD1-CE2 4.08Å; F2544-F2664 HydrophobicContact CD1-CZ 4.03Å; F2544-F2664 AromaticContact CD2-CE2 3.7Å; F2544-F2664 HydrophobicContact CD2-CE2 3.7Å; F2544-F2664 AromaticContact CD2-CZ 3.66Å; F2544-F2664 HydrophobicContact CD2-CZ 3.66Å; F2544-F2664 HydrophobicContact CE1-CE2 4.21Å; F2544-F2664 HydrophobicContact CE1-CZ 4.28Å; F2544-F2664 AromaticContact CE2-CE2 3.4Å; F2544-F2664 HydrophobicContact CE2-CE2 3.4Å; F2544-F2664 VanDerWaalsContact CE2-CE2 3.47Å; F2544-F2664 AromaticContact CE2-CZ 3.42Å; F2544-F2664 HydrophobicContact CE2-CZ 3.42Å; F2544-F2664 VanDerWaalsContact CE2-CZ 3.42Å; F2544-F2664 HydrophobicContact CG-CE2 4.29Å; F2544-F2664 AromaticContact CZ-CE2 3.96Å; F2544-F2664 HydrophobicContact CZ-CE2 3.99Å; F2544-F2664 HydrophobicContact CZ-CZ 4.39Å
2545N79.1Confident83.3Confident53.4 Ų53.431.2 Ų31.229%0.28618%0.178SC..Hα-helixtrans-62.2-36.2179.2-73-20.6000112.2Y2541 A2542 V2543 D2548 T2549Y2541-N2545 VanDerWaalsContact CD1-ND2 3.27Å; Y2541-N2545 WeakPolarHBondContact CD1-ND2 3.36Å; Y2541-N2545 VanDerWaalsContact CE1-ND2 3.33Å; Y2541-N2545 WeakPolarHBondContact CE1-ND2 3.36Å; Y2541-N2545 VanDerWaalsContact O-CG 3.25Å; Y2541-N2545 PolarHBondContact O-N 3.14Å; Y2541-N2545 PolarHBondContact O-ND2 3.28Å; Y2541-N2545 VanDerWaalsContact O-ND2 3.15Å; A2542-N2545 PolarHBondContact O-N 3.03Å; V2543-N2545 VanDerWaalsContact C-N 3.34Å; V2543-N2545 PolarHBondContact O-N 3.28Å; N2545-D2548 PolarHBondContact O-N 2.9Å; N2545-T2549 WeakPolarHBondContact O-CB 3.48Å; N2545-T2549 WeakPolarHBondContact O-CG2 3.26Å; N2545-T2549 PolarHBondContact O-N 3.18Å; N2545-T2549 VanDerWaalsContact O-N 3.11Å; N2545-T2549 PolarHBondContact O-OG1 3.06Å
2546H79.5Confident82.7Confident45.4 Ų45.436.9 Ų36.921%0.2119%0.194CC..Hα-helixtrans-66.5-46.2174.6-175.961.5000111.5P2396 W2508 A2542 V2543 F2544 D2548 T2549 L2550P2396-H2546 WeakPolarHBondContact CB-CE1 3.32Å; W2508-H2546 AromaticContact CE3-CD2 3.85Å; W2508-H2546 HydrophobicContact CH2-CB 3.64Å; W2508-H2546 AromaticContact CH2-CD2 3.43Å; W2508-H2546 VanDerWaalsContact CH2-CD2 3.44Å; W2508-H2546 WeakPolarHBondContact CH2-CD2 3.33Å; W2508-H2546 AromaticContact CH2-CG 3.64Å; W2508-H2546 VanDerWaalsContact CH2-CG 3.47Å; W2508-H2546 HydrophobicContact CZ2-CB 3.97Å; W2508-H2546 AromaticContact CZ2-CD2 3.83Å; W2508-H2546 AromaticContact CZ2-CG 3.71Å; W2508-H2546 HydrophobicContact CZ3-CB 4.26Å; W2508-H2546 AromaticContact CZ3-CD2 3.4Å; W2508-H2546 VanDerWaalsContact CZ3-CD2 3.41Å; W2508-H2546 WeakPolarHBondContact CZ3-CD2 3.38Å; W2508-H2546 AromaticContact CZ3-CG 3.87Å; W2508-H2546 AromaticContact CZ3-NE2 3.96Å; A2542-H2546 PolarHBondContact O-N 3.06Å; A2542-H2546 VanDerWaalsContact O-N 3.11Å; V2543-H2546 WeakPolarHBondContact O-CB 3.39Å; V2543-H2546 PolarHBondContact O-N 3.1Å; V2543-H2546 VanDerWaalsContact O-N 3.12Å; F2544-H2546 VanDerWaalsContact C-N 3.29Å; F2544-H2546 PolarHBondContact O-N 3.16Å; H2546-D2548 VanDerWaalsContact C-N 3.32Å; H2546-D2548 PolarHBondContact O-N 3.09Å; H2546-T2549 WeakPolarHBondContact CA-OG1 3.28Å; H2546-T2549 WeakPolarHBondContact O-CA 3.37Å; H2546-T2549 VanDerWaalsContact O-CB 3.26Å; H2546-T2549 WeakPolarHBondContact O-CB 3.4Å; H2546-T2549 PolarHBondContact O-N 3Å; H2546-T2549 VanDerWaalsContact O-N 3.11Å; H2546-T2549 PolarHBondContact O-OG1 3.2Å; H2546-L2550 WeakPolarHBondContact O-CG 3.45Å; H2546-L2550 PolarHBondContact O-N 3.14Å
2547L81.8Confident81.8Confident2.8 Ų2.836.5 Ų36.52%0.01520%0.195CC..Hα-helixtrans-62.9-38.5177.1-62.2176.2000112.1L2423 V2427 T2433 V2543 F2544 T2549 L2550 K2551 L2624 C2627 M2628L2423-L2547 HydrophobicContact CD1-CD1 4.07Å; L2423-L2547 HydrophobicContact CD1-CD2 3.93Å; L2423-L2547 HydrophobicContact CD1-CG 4.4Å; L2423-L2547 HydrophobicContact CD2-CD1 4.36Å; L2423-L2547 HydrophobicContact CD2-CD2 3.5Å; L2423-L2547 VanDerWaalsContact CD2-CD2 3.5Å; V2427-L2547 HydrophobicContact CG2-CD2 3.52Å; T2433-L2547 HydrophobicContact CG2-CD2 3.85Å; V2543-L2547 HydrophobicContact CG1-CD1 3.92Å; V2543-L2547 HydrophobicContact CG1-CD2 4.42Å; V2543-L2547 HydrophobicContact CG1-CG 4.18Å; V2543-L2547 VanDerWaalsContact O-CG 3.28Å; V2543-L2547 WeakPolarHBondContact O-CG 3.31Å; V2543-L2547 PolarHBondContact O-N 3.16Å; F2544-L2547 CarbonylContact O-C 3.59Å; F2544-L2547 PolarHBondContact O-N 3.14Å; F2544-L2547 VanDerWaalsContact O-N 3.17Å; L2547-T2549 VanDerWaalsContact C-N 3.29Å; L2547-T2549 PolarHBondContact O-N 3.21Å; L2547-L2550 HydrophobicContact CD2-CD1 4.38Å; L2547-L2550 PolarHBondContact O-N 3.07Å; L2547-K2551 WeakPolarHBondContact O-CB 3.43Å; L2547-K2551 PolarHBondContact O-N 3.07Å; L2547-L2624 HydrophobicContact CB-CD1 3.97Å; L2547-L2624 HydrophobicContact CD2-CD1 3.72Å; L2547-L2624 HydrophobicContact CD2-CD2 3.57Å; L2547-L2624 HydrophobicContact CG-CD1 4.34Å; L2547-C2627 HydrophobicContact CD1-CB 4.09Å; L2547-C2627 HydrophobicContact CD2-CB 4.28Å; L2547-M2628 HydrophobicContact CB-CG 3.61Å; L2547-M2628 VanDerWaalsContact CB-CG 3.44Å; L2547-M2628 HydrophobicContact CB-SD 4.24Å; L2547-M2628 HydrophobicContact CD1-CB 4.16Å; L2547-M2628 HydrophobicContact CD1-CG 3.83Å; L2547-M2628 HydrophobicContact CG-CG 4.36Å
2548D79.4Confident81Confident48.2 Ų48.238.8 Ų38.826%0.25821%0.206SC..Hα-helixtrans-62.8-36.9174.3-144.931.3000111.2F2544 N2545 H2546 K2551 A2552 M2628 K2663F2544-D2548 HydrophobicContact CE2-CB 4.15Å; F2544-D2548 HydrophobicContact CZ-CB 4.28Å; F2544-D2548 WeakPolarHBondContact O-CB 3.38Å; F2544-D2548 PolarHBondContact O-N 3.13Å; N2545-D2548 PolarHBondContact O-N 2.9Å; H2546-D2548 VanDerWaalsContact C-N 3.32Å; H2546-D2548 PolarHBondContact O-N 3.09Å; D2548-K2551 WeakPolarHBondContact O-CB 3.35Å; D2548-K2551 PolarHBondContact O-N 3.28Å; D2548-A2552 WeakPolarHBondContact O-CB 3.39Å; D2548-A2552 PolarHBondContact O-N 3.28Å; D2548-M2628 HydrophobicContact CB-CE 3.92Å; D2548-M2628 VanDerWaalsContact OD1-CE 3.24Å; D2548-M2628 WeakPolarHBondContact OD1-CE 3.46Å; D2548-K2663 IonicContact OD1-NZ 2.92Å; D2548-K2663 IonicContact OD2-NZ 3.59Å; D2548-K2663 PolarHBondContact OD2-NZ 3.06Å
2549T80Confident80.4Confident82.6 Ų82.641.2 Ų41.251%0.50722%0.219SC..Hα-helixtrans-67.6-43.9174.4-40.10000111.7N2545 H2546 L2547 K2551 A2552 C2553N2545-T2549 WeakPolarHBondContact O-CB 3.48Å; N2545-T2549 WeakPolarHBondContact O-CG2 3.26Å; N2545-T2549 PolarHBondContact O-N 3.18Å; N2545-T2549 VanDerWaalsContact O-N 3.11Å; N2545-T2549 PolarHBondContact O-OG1 3.06Å; H2546-T2549 WeakPolarHBondContact CA-OG1 3.28Å; H2546-T2549 WeakPolarHBondContact O-CA 3.37Å; H2546-T2549 VanDerWaalsContact O-CB 3.26Å; H2546-T2549 WeakPolarHBondContact O-CB 3.4Å; H2546-T2549 PolarHBondContact O-N 3Å; H2546-T2549 VanDerWaalsContact O-N 3.11Å; H2546-T2549 PolarHBondContact O-OG1 3.2Å; L2547-T2549 VanDerWaalsContact C-N 3.29Å; L2547-T2549 PolarHBondContact O-N 3.21Å; T2549-K2551 VanDerWaalsContact C-N 3.32Å; T2549-K2551 PolarHBondContact O-N 2.81Å; T2549-A2552 PolarHBondContact O-N 3.19Å; T2549-C2553 PolarHBondContact O-N 3.12Å; T2549-C2553 VanDerWaalsContact O-N 3.11Å; T2549-C2553 PolarHBondContact O-SG 3.04Å; T2549-C2553 VanDerWaalsContact O-SG 3.4Å
2550L78.9Confident79.6Confident29.4 Ų29.445.5 Ų45.515%0.15424%0.238CC..Hα-helixtrans-63.1-40.7175.2-69.4178.2000111.6L2423 V2427 T2433 L2434 H2546 L2547 A2552 C2553 L2554 L2624L2423-L2550 HydrophobicContact CD2-CD1 4Å; L2423-L2550 HydrophobicContact CG-CD1 4.32Å; V2427-L2550 HydrophobicContact CG1-CD1 3.95Å; V2427-L2550 HydrophobicContact CG1-CD2 4.36Å; V2427-L2550 HydrophobicContact CG2-CD1 4.35Å; T2433-L2550 HydrophobicContact CG2-CD1 4.28Å; L2434-L2550 HydrophobicContact CD1-CD2 4.46Å; H2546-L2550 WeakPolarHBondContact O-CG 3.45Å; H2546-L2550 PolarHBondContact O-N 3.14Å; L2547-L2550 HydrophobicContact CD2-CD1 4.38Å; L2547-L2550 PolarHBondContact O-N 3.07Å; L2550-A2552 VanDerWaalsContact C-N 3.35Å; L2550-A2552 PolarHBondContact O-N 2.93Å; L2550-C2553 WeakPolarHBondContact O-CA 3.32Å; L2550-C2553 WeakPolarHBondContact O-CB 3.33Å; L2550-C2553 PolarHBondContact O-N 3.23Å; L2550-C2553 VanDerWaalsContact O-N 3.12Å; L2550-L2554 PolarHBondContact O-N 3.03Å; L2550-L2624 HydrophobicContact CB-CD1 4.05Å; L2550-L2624 HydrophobicContact CB-CD2 4.32Å; L2550-L2624 HydrophobicContact CD1-CD2 4.46Å
2551K81Confident78.6Confident49 Ų4947.5 Ų47.521%0.21325%0.249CC..Hα-helixtrans-59.2-47.7175.3-173.8179.1175.5-178.70111.2L2547 D2548 T2549 C2553 L2554 E2555 K2621 L2624 M2628L2547-K2551 WeakPolarHBondContact O-CB 3.43Å; L2547-K2551 PolarHBondContact O-N 3.07Å; D2548-K2551 WeakPolarHBondContact O-CB 3.35Å; D2548-K2551 PolarHBondContact O-N 3.28Å; T2549-K2551 VanDerWaalsContact C-N 3.32Å; T2549-K2551 PolarHBondContact O-N 2.81Å; K2551-C2553 VanDerWaalsContact C-N 3.26Å; K2551-C2553 PolarHBondContact O-N 3.06Å; K2551-L2554 PolarHBondContact O-N 3.01Å; K2551-L2554 VanDerWaalsContact O-N 3.12Å; K2551-E2555 WeakPolarHBondContact CE-OE1 3.37Å; K2551-E2555 HydrophobicContact CG-CG 4.46Å; K2551-E2555 WeakPolarHBondContact O-CB 3.47Å; K2551-E2555 WeakPolarHBondContact O-CG 3.44Å; K2551-E2555 PolarHBondContact O-N 3.36Å; K2551-K2621 HydrophobicContact CG-CG 4.39Å; K2551-L2624 VanDerWaalsContact CA-CD2 3.44Å; K2551-L2624 HydrophobicContact CB-CD1 4.05Å; K2551-L2624 HydrophobicContact CB-CD2 3.65Å; K2551-L2624 HydrophobicContact CG-CD2 4.21Å; K2551-M2628 HydrophobicContact CB-SD 4.43Å; K2551-M2628 HydrophobicContact CD-CE 4.34Å; K2551-M2628 HydrophobicContact CD-SD 3.99Å
2552A79Confident77.7Confident34 Ų3451.4 Ų51.428%0.28127%0.271SS..Hα-helixtrans-62.1-30.7176.300000112.8D2548 T2549 L2550 E2555 R2556D2548-A2552 WeakPolarHBondContact O-CB 3.39Å; D2548-A2552 PolarHBondContact O-N 3.28Å; T2549-A2552 PolarHBondContact O-N 3.19Å; L2550-A2552 VanDerWaalsContact C-N 3.35Å; L2550-A2552 PolarHBondContact O-N 2.93Å; A2552-E2555 PolarHBondContact O-N 2.7Å; A2552-R2556 VanDerWaalsContact C-NH2 3.35Å; A2552-R2556 WeakPolarHBondContact O-CB 3.41Å; A2552-R2556 WeakPolarHBondContact O-CG 3.27Å; A2552-R2556 PolarHBondContact O-N 3.25Å; A2552-R2556 VanDerWaalsContact O-N 3.11Å; A2552-R2556 PolarHBondContact O-NE 3.19Å; A2552-R2556 PolarHBondContact O-NH1 3.17Å; A2552-R2556 PolarHBondContact O-NH2 3.05Å; A2552-R2556 VanDerWaalsContact O-NH2 3.15Å
2553C78.4Confident76.9Confident49.4 Ų49.455.9 Ų55.933%0.33428%0.282SS..Hα-helixtrans-70.2-43.5172.8-68.90000112.2L2434 T2549 L2550 K2551 E2555 R2556 A2557L2434-C2553 HydrophobicContact CD1-CB 3.99Å; L2434-C2553 HydrophobicContact CD2-CB 4.06Å; T2549-C2553 PolarHBondContact O-N 3.12Å; T2549-C2553 VanDerWaalsContact O-N 3.11Å; T2549-C2553 PolarHBondContact O-SG 3.04Å; T2549-C2553 VanDerWaalsContact O-SG 3.4Å; L2550-C2553 WeakPolarHBondContact O-CA 3.32Å; L2550-C2553 WeakPolarHBondContact O-CB 3.33Å; L2550-C2553 PolarHBondContact O-N 3.23Å; L2550-C2553 VanDerWaalsContact O-N 3.12Å; K2551-C2553 VanDerWaalsContact C-N 3.26Å; K2551-C2553 PolarHBondContact O-N 3.06Å; C2553-E2555 VanDerWaalsContact C-N 3.3Å; C2553-E2555 PolarHBondContact O-N 2.67Å; C2553-R2556 PolarHBondContact O-N 3.19Å; C2553-R2556 PolarHBondContact SG-NH1 3.36Å; C2553-R2556 VanDerWaalsContact SG-NH1 3.44Å; C2553-R2556 PolarHBondContact SG-NH2 3.11Å; C2553-A2557 WeakPolarHBondContact O-CB 3.47Å; C2553-A2557 PolarHBondContact O-N 3.1Å
2554L78Confident75.7Confident2.8 Ų2.860.7 Ų60.72%0.01531%0.311CS..Hα-helixtrans-62.6-40.5174.8-69.4174.6000111.9V2427 A2430 T2433 L2434 L2550 K2551 R2556 A2557 E2558 L2617 A2620 K2621 L2624V2427-L2554 HydrophobicContact CB-CD2 4.44Å; V2427-L2554 HydrophobicContact CG1-CD2 3.99Å; V2427-L2554 HydrophobicContact CG1-CG 4.35Å; V2427-L2554 HydrophobicContact CG2-CD1 4.22Å; V2427-L2554 HydrophobicContact CG2-CD2 4.19Å; V2427-L2554 HydrophobicContact CG2-CG 4.29Å; A2430-L2554 HydrophobicContact CB-CD1 4.06Å; A2430-L2554 HydrophobicContact CB-CD2 4.26Å; T2433-L2554 HydrophobicContact CG2-CD2 4.26Å; L2434-L2554 HydrophobicContact CD1-CD2 4.3Å; L2434-L2554 HydrophobicContact CD1-CG 4.2Å; L2434-L2554 HydrophobicContact CD2-CD2 3.97Å; L2434-L2554 HydrophobicContact CD2-CG 4.38Å; L2434-L2554 HydrophobicContact CG-CD2 3.67Å; L2434-L2554 HydrophobicContact CG-CG 4.29Å; L2550-L2554 PolarHBondContact O-N 3.03Å; K2551-L2554 PolarHBondContact O-N 3.01Å; K2551-L2554 VanDerWaalsContact O-N 3.12Å; L2554-R2556 VanDerWaalsContact C-N 3.34Å; L2554-R2556 PolarHBondContact O-N 3.1Å; L2554-A2557 WeakPolarHBondContact O-CB 3.36Å; L2554-A2557 PolarHBondContact O-N 3.1Å; L2554-A2557 VanDerWaalsContact O-N 3.16Å; L2554-E2558 WeakPolarHBondContact O-CB 3.39Å; L2554-E2558 PolarHBondContact O-N 3.17Å; L2554-L2617 HydrophobicContact CB-CD1 4.17Å; L2554-L2617 HydrophobicContact CB-CD2 4.26Å; L2554-L2617 HydrophobicContact CD2-CD1 3.96Å; L2554-L2617 HydrophobicContact CD2-CD2 3.75Å; L2554-A2620 HydrophobicContact CD1-CB 4.25Å; L2554-A2620 HydrophobicContact CD2-CB 4.15Å; L2554-K2621 HydrophobicContact CD1-CB 4.3Å; L2554-K2621 HydrophobicContact CD1-CG 4.1Å; L2554-L2624 HydrophobicContact CD1-CB 4.25Å; L2554-L2624 HydrophobicContact CD1-CD1 3.58Å; L2554-L2624 HydrophobicContact CD1-CD2 3.86Å; L2554-L2624 HydrophobicContact CD1-CG 4.46Å
2555E79.2Confident74.2Confident76.2 Ų76.262.9 Ų62.936%0.35633%0.334SS..Hα-helixtrans-66-34.5177.4-72.1177.2167.500112.3K2551 A2552 C2553 E2558 L2559 K2621K2551-E2555 WeakPolarHBondContact CE-OE1 3.37Å; K2551-E2555 HydrophobicContact CG-CG 4.46Å; K2551-E2555 WeakPolarHBondContact O-CB 3.47Å; K2551-E2555 WeakPolarHBondContact O-CG 3.44Å; K2551-E2555 PolarHBondContact O-N 3.36Å; A2552-E2555 PolarHBondContact O-N 2.7Å; C2553-E2555 VanDerWaalsContact C-N 3.3Å; C2553-E2555 PolarHBondContact O-N 2.67Å; E2555-E2558 PolarHBondContact O-N 3.11Å; E2555-L2559 WeakPolarHBondContact O-CD1 3.2Å; E2555-L2559 WeakPolarHBondContact O-CG 3.33Å; E2555-L2559 PolarHBondContact O-N 3.16Å; E2555-L2559 VanDerWaalsContact O-N 3.1Å; E2555-K2621 HydrophobicContact CG-CD 3.86Å; E2555-K2621 WeakPolarHBondContact OE1-CE 3.31Å; E2555-K2621 IonicContact OE1-NZ 2.76Å; E2555-K2621 PolarHBondContact OE1-NZ 3.21Å
2556R77.2Confident72.4Confident153.6 Ų153.663.6 Ų63.658%0.5835%0.354SS*.Hα-helixtrans-66.8-44.4170.1-76.8178.3-132.11360.7111.8A2552 C2553 L2554 E2558 L2559 E2560A2552-R2556 VanDerWaalsContact C-NH2 3.35Å; A2552-R2556 WeakPolarHBondContact O-CB 3.41Å; A2552-R2556 WeakPolarHBondContact O-CG 3.27Å; A2552-R2556 PolarHBondContact O-N 3.25Å; A2552-R2556 VanDerWaalsContact O-N 3.11Å; A2552-R2556 PolarHBondContact O-NE 3.19Å; A2552-R2556 PolarHBondContact O-NH1 3.17Å; A2552-R2556 PolarHBondContact O-NH2 3.05Å; A2552-R2556 VanDerWaalsContact O-NH2 3.15Å; C2553-R2556 PolarHBondContact O-N 3.19Å; C2553-R2556 PolarHBondContact SG-NH1 3.36Å; C2553-R2556 VanDerWaalsContact SG-NH1 3.44Å; C2553-R2556 PolarHBondContact SG-NH2 3.11Å; L2554-R2556 VanDerWaalsContact C-N 3.34Å; L2554-R2556 PolarHBondContact O-N 3.1Å; R2556-E2558 VanDerWaalsContact C-N 3.31Å; R2556-E2558 PolarHBondContact O-N 3.1Å; R2556-L2559 WeakPolarHBondContact O-CA 3.3Å; R2556-L2559 WeakPolarHBondContact O-CB 3.39Å; R2556-L2559 PolarHBondContact O-N 3.01Å; R2556-L2559 VanDerWaalsContact O-N 3.13Å; R2556-E2560 WeakPolarHBondContact O-CG 3.34Å; R2556-E2560 PolarHBondContact O-N 3.15Å
2557A73.2Confident70.4Confident13.8 Ų13.868.2 Ų68.211%0.11438%0.379CS..Hα-helixtrans-62.1-38.3177.500000112.2L2423 L2434 V2437 C2553 L2554 E2560 L2561 L2617L2423-A2557 HydrophobicContact CD1-CB 3.87Å; L2423-A2557 HydrophobicContact CG-CB 4.4Å; L2434-A2557 HydrophobicContact CD1-CB 3.55Å; L2434-A2557 HydrophobicContact CD2-CB 4.22Å; V2437-A2557 HydrophobicContact CG1-CB 4.05Å; C2553-A2557 WeakPolarHBondContact O-CB 3.47Å; C2553-A2557 PolarHBondContact O-N 3.1Å; L2554-A2557 WeakPolarHBondContact O-CB 3.36Å; L2554-A2557 PolarHBondContact O-N 3.1Å; L2554-A2557 VanDerWaalsContact O-N 3.16Å; A2557-E2560 PolarHBondContact O-N 3.06Å; A2557-L2561 WeakPolarHBondContact O-CB 3.35Å; A2557-L2561 PolarHBondContact O-N 3.3Å; A2557-L2561 VanDerWaalsContact O-N 3.09Å; A2557-L2617 HydrophobicContact CB-CD1 4.32Å; A2557-L2617 HydrophobicContact CB-CD2 4.25Å
2558E75.3Confident68.2Low47 Ų4775 Ų7522%0.2242%0.415CS..Hα-helixtrans-61.3-44.5172.2-174175.6-160.800111.8L2554 E2555 R2556 E2560 L2561 N2562 L2617 K2621L2554-E2558 WeakPolarHBondContact O-CB 3.39Å; L2554-E2558 PolarHBondContact O-N 3.17Å; E2555-E2558 PolarHBondContact O-N 3.11Å; R2556-E2558 VanDerWaalsContact C-N 3.31Å; R2556-E2558 PolarHBondContact O-N 3.1Å; E2558-E2560 VanDerWaalsContact C-N 3.29Å; E2558-E2560 PolarHBondContact O-N 3.18Å; E2558-L2561 PolarHBondContact O-N 3.24Å; E2558-N2562 WeakPolarHBondContact O-CB 3.29Å; E2558-N2562 VanDerWaalsContact O-CG 3.28Å; E2558-N2562 PolarHBondContact O-N 3.22Å; E2558-N2562 PolarHBondContact O-ND2 2.95Å; E2558-L2617 HydrophobicContact CB-CD1 4.39Å; E2558-L2617 HydrophobicContact CB-CD2 3.86Å; E2558-L2617 HydrophobicContact CG-CD2 4Å; E2558-K2621 IonicContact OE1-NZ 3.07Å; E2558-K2621 PolarHBondContact OE1-NZ 3.23Å; E2558-K2621 IonicContact OE2-NZ 3.22Å; E2558-K2621 PolarHBondContact OE2-NZ 3.13Å
2559L75.9Confident66.3Low105.4 Ų105.477.2 Ų77.255%0.55243%0.427SS*.Hα-helixtrans-64.2-41.6177.2-93.6164.3000112.5E2555 R2556 N2562 K2563E2555-L2559 WeakPolarHBondContact O-CD1 3.2Å; E2555-L2559 WeakPolarHBondContact O-CG 3.33Å; E2555-L2559 PolarHBondContact O-N 3.16Å; E2555-L2559 VanDerWaalsContact O-N 3.1Å; R2556-L2559 WeakPolarHBondContact O-CA 3.3Å; R2556-L2559 WeakPolarHBondContact O-CB 3.39Å; R2556-L2559 PolarHBondContact O-N 3.01Å; R2556-L2559 VanDerWaalsContact O-N 3.13Å; L2559-N2562 PolarHBondContact O-N 2.93Å; L2559-K2563 WeakPolarHBondContact O-CG 3.31Å; L2559-K2563 PolarHBondContact O-N 3.16Å; L2559-K2563 VanDerWaalsContact O-N 3.1Å
2560E72.8Confident64.2Low96.4 Ų96.482 Ų8245%0.4544%0.443SS..Hα-helixtrans-66.4-41.7176.2-65.9-55.5129.300111.9R2556 A2557 E2558 N2562 K2563 V2564R2556-E2560 WeakPolarHBondContact O-CG 3.34Å; R2556-E2560 PolarHBondContact O-N 3.15Å; A2557-E2560 PolarHBondContact O-N 3.06Å; E2558-E2560 VanDerWaalsContact C-N 3.29Å; E2558-E2560 PolarHBondContact O-N 3.18Å; E2560-N2562 VanDerWaalsContact C-N 3.3Å; E2560-N2562 PolarHBondContact O-N 3.13Å; E2560-K2563 WeakPolarHBondContact O-CB 3.43Å; E2560-K2563 PolarHBondContact O-N 3.13Å; E2560-K2563 VanDerWaalsContact O-N 3.16Å; E2560-K2563 WeakPolarHBondContact OE1-CE 3.47Å; E2560-K2563 IonicContact OE1-NZ 3.25Å; E2560-K2563 PolarHBondContact OE1-NZ 3.08Å; E2560-K2563 WeakPolarHBondContact OE2-CD 3.32Å; E2560-K2563 WeakPolarHBondContact OE2-CE 3.34Å; E2560-K2563 IonicContact OE2-NZ 3.03Å; E2560-K2563 PolarHBondContact OE2-NZ 3.02Å; E2560-V2564 WeakPolarHBondContact O-CG2 3.24Å; E2560-V2564 PolarHBondContact O-N 2.96Å; E2560-V2564 VanDerWaalsContact O-N 3.1Å
2561L67.6Low62.3Low45.8 Ų45.884.7 Ų84.724%0.2446%0.464CS..Hα-helixtrans-61.5-39175.3-127.5130.6000112.2L2423 L2434 V2437 A2557 E2558 K2563 V2564 G2565 W2573 P2613 I2614 L2617L2423-L2561 HydrophobicContact CD1-CD1 3.74Å; L2423-L2561 HydrophobicContact CD2-CD1 3.58Å; L2423-L2561 HydrophobicContact CD2-CD2 4.35Å; L2423-L2561 HydrophobicContact CG-CD1 4.07Å; L2434-L2561 HydrophobicContact CD2-CB 3.84Å; L2434-L2561 HydrophobicContact CD2-CD1 3.39Å; L2434-L2561 HydrophobicContact CD2-CG 4.19Å; V2437-L2561 HydrophobicContact CG1-CD1 3.89Å; V2437-L2561 HydrophobicContact CG1-CG 4.14Å; V2437-L2561 HydrophobicContact CG2-CD1 4.03Å; A2557-L2561 WeakPolarHBondContact O-CB 3.35Å; A2557-L2561 PolarHBondContact O-N 3.3Å; A2557-L2561 VanDerWaalsContact O-N 3.09Å; E2558-L2561 PolarHBondContact O-N 3.24Å; L2561-K2563 VanDerWaalsContact C-N 3.29Å; L2561-K2563 PolarHBondContact O-N 3.06Å; L2561-V2564 PolarHBondContact O-N 2.9Å; L2561-G2565 PolarHBondContact O-N 3.14Å; L2561-G2565 VanDerWaalsContact O-N 3.14Å; L2561-W2573 HydrophobicContact CD2-CH2 4.49Å; L2561-W2573 HydrophobicContact CD2-CZ2 3.67Å; L2561-P2613 HydrophobicContact CD1-CB 3.84Å; L2561-I2614 HydrophobicContact CD1-CG1 4.17Å; L2561-I2614 HydrophobicContact CD2-CD1 4.13Å; L2561-I2614 HydrophobicContact CD2-CG1 3.72Å; L2561-L2617 HydrophobicContact CD1-CD1 3.5Å; L2561-L2617 VanDerWaalsContact CD1-CD1 3.5Å
2562N67.7Low60.2Low97 Ų9787.8 Ų87.852%0.51948%0.483SS..Hα-helixtrans-69.2-25.5176.5-73.8-30.6000113.2E2558 L2559 E2560 V2564 G2565E2558-N2562 WeakPolarHBondContact O-CB 3.29Å; E2558-N2562 VanDerWaalsContact O-CG 3.28Å; E2558-N2562 PolarHBondContact O-N 3.22Å; E2558-N2562 PolarHBondContact O-ND2 2.95Å; L2559-N2562 PolarHBondContact O-N 2.93Å; E2560-N2562 VanDerWaalsContact C-N 3.3Å; E2560-N2562 PolarHBondContact O-N 3.13Å; N2562-V2564 VanDerWaalsContact C-N 3.33Å; N2562-G2565 PolarHBondContact O-N 3.04Å
2563K67Low58.1Low136.2 Ų136.295.6 Ų95.659%0.59251%0.505SS*.Hα-helixtrans-73.7-38.8171.9-69.5174.4-166.5167.70112.2L2559 E2560 L2561 G2565 G2566L2559-K2563 WeakPolarHBondContact O-CG 3.31Å; L2559-K2563 PolarHBondContact O-N 3.16Å; L2559-K2563 VanDerWaalsContact O-N 3.1Å; E2560-K2563 WeakPolarHBondContact O-CB 3.43Å; E2560-K2563 PolarHBondContact O-N 3.13Å; E2560-K2563 VanDerWaalsContact O-N 3.16Å; E2560-K2563 WeakPolarHBondContact OE1-CE 3.47Å; E2560-K2563 IonicContact OE1-NZ 3.25Å; E2560-K2563 PolarHBondContact OE1-NZ 3.08Å; E2560-K2563 WeakPolarHBondContact OE2-CD 3.32Å; E2560-K2563 WeakPolarHBondContact OE2-CE 3.34Å; E2560-K2563 IonicContact OE2-NZ 3.03Å; E2560-K2563 PolarHBondContact OE2-NZ 3.02Å; L2561-K2563 VanDerWaalsContact C-N 3.29Å; L2561-K2563 PolarHBondContact O-N 3.06Å; K2563-G2565 VanDerWaalsContact C-N 3.29Å; K2563-G2565 PolarHBondContact O-N 3.04Å; K2563-G2566 PolarHBondContact O-N 3.01Å
2564V58.1Low56Low105.6 Ų105.698.2 Ų98.264%0.6452%0.52SS*.Hα-helixtrans-71.6-29.8-179.3178.80000111.6V2437 I2444 E2560 L2561 N2562 G2566V2437-V2564 HydrophobicContact CG1-CG1 3.96Å; I2444-V2564 HydrophobicContact CD1-CG1 4.02Å; E2560-V2564 WeakPolarHBondContact O-CG2 3.24Å; E2560-V2564 PolarHBondContact O-N 2.96Å; E2560-V2564 VanDerWaalsContact O-N 3.1Å; L2561-V2564 PolarHBondContact O-N 2.9Å; N2562-V2564 VanDerWaalsContact C-N 3.33Å; V2564-G2566 VanDerWaalsContact C-N 3.28Å; V2564-G2566 PolarHBondContact O-N 3.26Å
2565G49.6Very low53.9Low46.6 Ų46.6103 Ų10348%0.4855%0.553SS.*THydrogen-bonded Turntrans-76.426.817600000115.6L2561 N2562 K2563 I2567L2561-G2565 PolarHBondContact O-N 3.14Å; L2561-G2565 VanDerWaalsContact O-N 3.14Å; N2562-G2565 PolarHBondContact O-N 3.04Å; K2563-G2565 VanDerWaalsContact C-N 3.29Å; K2563-G2565 PolarHBondContact O-N 3.04Å; G2565-I2567 VanDerWaalsContact C-N 3.27Å; G2565-I2567 PolarHBondContact O-N 3.12Å
2566G40.3Very low51.7Low68.4 Ų68.4109.4 Ų109.471%0.70557%0.574SS**  trans-79.116.6-177.400000116.3K2563 V2564K2563-G2566 PolarHBondContact O-N 3.01Å; V2564-G2566 VanDerWaalsContact C-N 3.28Å; V2564-G2566 PolarHBondContact O-N 3.26Å
2567I38.3Very low49.5Very low141.4 Ų141.4111.7 Ų111.773%0.72558%0.583SS**SBendtrans-113.8120173.9-56.2175.8000108G2565 N2569G2565-I2567 VanDerWaalsContact C-N 3.27Å; G2565-I2567 PolarHBondContact O-N 3.12Å; I2567-N2569 VanDerWaalsContact C-N 3.31Å; I2567-N2569 PolarHBondContact O-N 3.4Å; I2567-N2569 PolarHBondContact O-ND2 3.4Å; I2567-N2569 VanDerWaalsContact O-ND2 3.15Å
2568D35.9Very low47.4Very low145.8 Ų145.8118 Ų11878%0.7862%0.615SS**SBendtrans43.466.2174-57.4-28.3000118.1H2570D2568-H2570 VanDerWaalsContact C-N 3.29Å; D2568-H2570 PolarHBondContact O-N 3.23Å
2569N38.8Very low45.1Very low95 Ų95125.6 Ų125.651%0.50865%0.647SS.*  trans-116.233.1167.6-90.5-47.6000114.1I2567 S2571 L2572 W2573I2567-N2569 VanDerWaalsContact C-N 3.31Å; I2567-N2569 PolarHBondContact O-N 3.4Å; I2567-N2569 PolarHBondContact O-ND2 3.4Å; I2567-N2569 VanDerWaalsContact O-ND2 3.15Å; N2569-S2571 VanDerWaalsContact C-N 3.29Å; N2569-S2571 PolarHBondContact O-N 3.04Å; N2569-S2571 VanDerWaalsContact O-N 3.14Å; N2569-L2572 PolarHBondContact O-N 2.98Å; N2569-L2572 WeakPolarHBondContact OD1-CD1 3.36Å; N2569-W2573 VanDerWaalsContact O-CD1 3.23Å; N2569-W2573 PolarHBondContact O-N 3.25Å; N2569-W2573 VanDerWaalsContact O-N 3.16Å
2570H36.6Very low42.8Very low182.4 Ų182.4125.4 Ų125.484%0.84466%0.655SS**THydrogen-bonded Turntrans-75.33.4-179.9-148.5-67000113.8D2568 T2574D2568-H2570 VanDerWaalsContact C-N 3.29Å; D2568-H2570 PolarHBondContact O-N 3.23Å; H2570-T2574 WeakPolarHBondContact O-CB 3.21Å; H2570-T2574 WeakPolarHBondContact O-CG2 3.47Å; H2570-T2574 PolarHBondContact O-N 3.16Å; H2570-T2574 PolarHBondContact O-OG1 3.45Å
2571S37.8Very low40.7Very low86 Ų86126 Ų12660%0.60167%0.669SS**THydrogen-bonded Turntrans-109.2-10.6-178.963.80000115.4N2569 T2574 S2575N2569-S2571 VanDerWaalsContact C-N 3.29Å; N2569-S2571 PolarHBondContact O-N 3.04Å; N2569-S2571 VanDerWaalsContact O-N 3.14Å; S2571-T2574 PolarHBondContact O-OG1 3.14Å; S2571-S2575 WeakPolarHBondContact O-CB 3.17Å; S2571-S2575 PolarHBondContact O-N 3.5Å; S2571-S2575 PolarHBondContact O-OG 3.25Å
2572L36.6Very low38.8Very low115.2 Ų115.2129.2 Ų129.260%0.60370%0.696SS**SBendtrans-101.4-13.5-174.4-87.3164.4000115.1N2569N2569-L2572 PolarHBondContact O-N 2.98Å; N2569-L2572 WeakPolarHBondContact OD1-CD1 3.36Å
2573W35Very low36.9Very low197.6 Ų197.6131.6 Ų131.675%0.74871%0.714SS**SBendtrans-92-8.1-178.8-89.863000114.5L2561 N2569 I2614 V2618L2561-W2573 HydrophobicContact CD2-CH2 4.49Å; L2561-W2573 HydrophobicContact CD2-CZ2 3.67Å; N2569-W2573 VanDerWaalsContact O-CD1 3.23Å; N2569-W2573 PolarHBondContact O-N 3.25Å; N2569-W2573 VanDerWaalsContact O-N 3.16Å; W2573-I2614 HydrophobicContact CH2-CG2 3.66Å; W2573-I2614 HydrophobicContact CZ2-CB 4.38Å; W2573-I2614 HydrophobicContact CZ2-CD1 4.06Å; W2573-I2614 HydrophobicContact CZ2-CG1 3.99Å; W2573-I2614 HydrophobicContact CZ2-CG2 3.58Å; W2573-I2614 HydrophobicContact CZ3-CG2 4.23Å; W2573-V2618 HydrophobicContact CZ3-CG2 4.36Å
2574T34.8Very low35.1Very low104.4 Ų104.4128.4 Ų128.464%0.6472%0.72SS**SBendtrans-93.71.6179.849.20000113H2570 S2571 R2576 R2577H2570-T2574 WeakPolarHBondContact O-CB 3.21Å; H2570-T2574 WeakPolarHBondContact O-CG2 3.47Å; H2570-T2574 PolarHBondContact O-N 3.16Å; H2570-T2574 PolarHBondContact O-OG1 3.45Å; S2571-T2574 PolarHBondContact O-OG1 3.14Å; T2574-R2576 VanDerWaalsContact C-N 3.26Å; T2574-R2576 PolarHBondContact O-N 3Å; T2574-R2576 VanDerWaalsContact O-N 3.09Å; T2574-R2577 PolarHBondContact O-N 3.23Å
2575S33.4Very low33.8Very low103.2 Ų103.2130.7 Ų130.772%0.72273%0.727SS**G310 helixtrans-109.213175.9-71.40000114.9S2571S2571-S2575 WeakPolarHBondContact O-CB 3.17Å; S2571-S2575 PolarHBondContact O-N 3.5Å; S2571-S2575 PolarHBondContact O-OG 3.25Å
2576R33.4Very low32.7Very low210.2 Ų210.2137.5 Ų137.579%0.79375%0.746SS**G310 helixtrans-119.922.3173.3-103.9-177.4-174.2-151.72115T2574 N2578 F2579T2574-R2576 VanDerWaalsContact C-N 3.26Å; T2574-R2576 PolarHBondContact O-N 3Å; T2574-R2576 VanDerWaalsContact O-N 3.09Å; R2576-N2578 PolarHBondContact O-N 3.2Å; R2576-N2578 VanDerWaalsContact O-N 3.12Å; R2576-F2579 PolarHBondContact O-N 3.33Å; R2576-F2579 VanDerWaalsContact O-N 3.15Å
2577R30.6Very low32.2Very low202.2 Ų202.2137.9 Ų137.976%0.76375%0.749SS**SBendtrans-107.621.1169.9-81.5-172.2-178.5168.61.2112.1T2574 F2579T2574-R2577 PolarHBondContact O-N 3.23Å; R2577-F2579 PolarHBondContact O-N 2.98Å
2578N29.3Very low31.6Very low146.2 Ų146.2137.3 Ų137.378%0.78276%0.758SS**  trans-134.463.7179.4-69-4.7000112.3R2576R2576-N2578 PolarHBondContact O-N 3.2Å; R2576-N2578 VanDerWaalsContact O-N 3.12Å
2579F28.6Very low31.2Very low206.6 Ų206.6133.7 Ų133.791%0.90676%0.756SS**  trans-144.384146-111.9-83.9000111.5R2576 R2577R2576-F2579 PolarHBondContact O-N 3.33Å; R2576-F2579 VanDerWaalsContact O-N 3.15Å; R2577-F2579 PolarHBondContact O-N 2.98Å
2580S26.9Very low30.7Very low101.6 Ų101.6135.1 Ų135.171%0.7177%0.768SS**  trans-123.394.6171.953.30000111.5
2581S27.5Very low30.4Very low108 Ų108133.1 Ų133.176%0.75576%0.763SS**  trans154.697.9158.360.90000115.3
2582S29.3Very low29.9Very low112.8 Ų112.8136.6 Ų136.679%0.78977%0.769SS**  trans176.9110.4139.679.80000113.4G2584S2582-G2584 PolarHBondContact O-N 3.01Å; S2582-G2584 VanDerWaalsContact O-N 3.1Å
2583T27.7Very low29.4Very low149 Ų149137.8 Ų137.891%0.91477%0.773SS**  trans-109.8112.8160.538.90000111.4
2584G29.3Very low29.1Very low69 Ų69136.2 Ų136.271%0.71178%0.775SS**  trans-162.7117.8163.700000112.4S2582S2582-G2584 PolarHBondContact O-N 3.01Å; S2582-G2584 VanDerWaalsContact O-N 3.1Å
2585I29.5Very low28.6Very low152.8 Ų152.8136.3 Ų136.378%0.78478%0.78SS**  trans47.1124.2147.4-55174.8000115.2
2586H27.5Very low28.4Very low190 Ų190136.2 Ų136.288%0.8878%0.779SS**  trans62.8134.9150.3-69.6-71000121.8
2587G29.5Very low28.1Very low75.6 Ų75.6133.4 Ų133.478%0.77978%0.78SS**  trans148.4119.6142.400000116.3
2588S25.7Very low28Very low129.2 Ų129.2131.7 Ų131.790%0.90379%0.785SS**  trans-68.7141.3168.990.40000114.9
2589G28.3Very low28.1Very low71.2 Ų71.2130.2 Ų130.273%0.73478%0.783SS**  trans137106161.900000117.4
2590V28Very low28.2Very low124.8 Ų124.8127.1 Ų127.176%0.75678%0.781SS**  89.6121.265.5174.60000114.4
2591N28.7Very low28.3Very low138.8 Ų138.8125.5 Ų125.574%0.74278%0.78SS**  trans81.3140.9145.5-68.8-11.2000121.8
2592H28.1Very low28.3Very low159.2 Ų159.2127.7 Ų127.774%0.73778%0.784SS**  107153.9108.8-107-57.9000115.6
2593M27.1Very low28.4Very low140.4 Ų140.4130.2 Ų130.269%0.69279%0.786SS**  -153.3151.9120.8-97.9-179.5152.100115.4
2594Q27.4Very low28.5Very low165.6 Ų165.6127.9 Ų127.977%0.77478%0.776SS**  112.1142.8109-96.4171.52.300117.1
2595S25.7Very low28.7Very low106.4 Ų106.4129.2 Ų129.274%0.74477%0.774SS**  trans92.8131139.8175.80000118.6
2596S27.5Very low28.7Very low100.2 Ų100.2129.4 Ų129.470%0.70178%0.777SS**  trans114.2123136.748.80000117.3
2597N28.1Very low29.2Very low152.6 Ų152.6129.1 Ų129.182%0.81677%0.774SS**  trans40.7117.3148.9-64.5-14.3000121
2598L28.4Very low29.6Very low165.4 Ų165.4130.7 Ų130.787%0.86677%0.773SS**  trans155.3149.8139.7-85153.1000112.9
2599P32.1Very low30.5Very low116 Ų116130.3 Ų130.375%0.75377%0.767SS**  -106.3147.8-119.334.5-27.5000114.3G2601P2599-G2601 PolarHBondContact O-N 2.92Å
2600V28.9Very low31.2Very low141.2 Ų141.2131.3 Ų131.386%0.85676%0.755SS**  trans-71.2115.8169.4179.90000111.4
2601G30.3Very low32.4Very low67.25 Ų67.25128.5 Ų128.569%0.69374%0.739SS**  trans-112.4121.7165.300000111.1P2599 I2603P2599-G2601 PolarHBondContact O-N 2.92Å; G2601-I2603 PolarHBondContact O-N 3.23Å
2602N27.7Very low33.8Very low155.25 Ų155.25126.4 Ų126.483%0.8373%0.733SS**  trans-51.4118.9178.4-86.5-26000113.5S2604N2602-S2604 PolarHBondContact O-N 3.11Å
2603I31.6Very low35.6Very low164.75 Ų164.75120.6 Ų120.685%0.84571%0.71SS**  trans-109.696.1153.4-59.4178.1000107.5G2601 S2605G2601-I2603 PolarHBondContact O-N 3.23Å; I2603-S2605 PolarHBondContact O-N 3.37Å
2604S29.3Very low37.6Very low99.75 Ų99.75115.5 Ų115.570%0.69869%0.685SS**  trans-83.7113.9169.2-13.50000110N2602 N2606N2602-S2604 PolarHBondContact O-N 3.11Å; S2604-N2606 PolarHBondContact O-N 3.45Å
2605S33.3Very low39.7Very low96.25 Ų96.25109.2 Ų109.267%0.67366%0.661SS**  trans-53.3110.6166.550.40000113.6I2603 F2607I2603-S2605 PolarHBondContact O-N 3.37Å; S2605-F2607 VanDerWaalsContact C-N 3.33Å; S2605-F2607 PolarHBondContact O-N 3.17Å
2606N30.1Very low41.9Very low157.5 Ų157.5108.2 Ų108.284%0.84265%0.645SS**  trans-103.583.3158.2-81.4-16000111.1S2604 S2608S2604-N2606 PolarHBondContact O-N 3.45Å; N2606-S2608 VanDerWaalsContact C-N 3.35Å; N2606-S2608 PolarHBondContact O-N 3.15Å
2607F37.1Very low44.1Very low184.5 Ų184.5103.6 Ų103.681%0.80961%0.612SS**  trans-91.4106.8154.3-86.2-86.4000107.7S2605S2605-F2607 VanDerWaalsContact C-N 3.33Å; S2605-F2607 PolarHBondContact O-N 3.17Å
2608S38.9Very low46.3Very low109.25 Ų109.2599.6 Ų99.676%0.76459%0.593SS**PPolyproline II helixtrans-62.1127.4168.6-79.90000108.9N2606 L2610N2606-S2608 VanDerWaalsContact C-N 3.35Å; N2606-S2608 PolarHBondContact O-N 3.15Å; S2608-L2610 PolarHBondContact O-N 2.87Å
2609P44.6Very low48.7Very low119.5 Ų119.598.8 Ų98.878%0.77658%0.579SS**PPolyproline II helixtrans-64.5139.4176.125.5-31.5000110
2610L43.2Very low50.8Low92.5 Ų92.593.4 Ų93.448%0.48454%0.544SS..PPolyproline II helixtrans-53.4145.7170.1-80.7128.6000109.8S2608 I2614 A2615S2608-L2610 PolarHBondContact O-N 2.87Å; L2610-I2614 HydrophobicContact CD2-CB 4.31Å; L2610-I2614 HydrophobicContact CD2-CG2 3.94Å; L2610-A2615 HydrophobicContact CB-CB 4.31Å
2611P53Low53.1Low66.75 Ų66.7589.6 Ų89.643%0.43352%0.516SS..PPolyproline II helixtrans-50.7133.9173.1-25.533.1000110.5P2613 I2614 A2615P2611-P2613 VanDerWaalsContact C-CD 3.45Å; P2611-P2613 VanDerWaalsContact C-N 3.28Å; P2611-P2613 WeakPolarHBondContact O-CD 3.48Å; P2611-P2613 VanDerWaalsContact O-N 3.12Å; P2611-I2614 HydrophobicContact CB-CD1 4.31Å; P2611-I2614 HydrophobicContact CB-CG1 4.43Å; P2611-I2614 HydrophobicContact CG-CD1 4.16Å; P2611-I2614 PolarHBondContact O-N 3Å; P2611-A2615 PolarHBondContact O-N 3.19Å; P2611-A2615 VanDerWaalsContact O-N 3.13Å
2612P58.5Low55.4Low94.25 Ų94.2590.4 Ų90.461%0.61251%0.507SS*.Hα-helixtrans-48.1-41.1-173.18.1-20.4000115.5I2614 A2615 E2616P2612-I2614 VanDerWaalsContact C-N 3.26Å; P2612-I2614 PolarHBondContact O-N 3.12Å; P2612-A2615 PolarHBondContact O-N 3.3Å; P2612-A2615 VanDerWaalsContact O-N 3.17Å; P2612-E2616 WeakPolarHBondContact O-CG 3.38Å; P2612-E2616 PolarHBondContact O-N 3.06Å; P2612-E2616 VanDerWaalsContact O-N 3.1Å
2613P65.2Low57.8Low37.25 Ų37.2585.6 Ų85.624%0.24248%0.482CS..Hα-helixtrans-64.2-33.3178.42.2-1.9000114.1L2423 L2434 V2437 L2561 P2611 E2616 L2617L2423-P2613 HydrophobicContact CD2-CB 3.63Å; L2434-P2613 HydrophobicContact CD2-CB 4.39Å; V2437-P2613 HydrophobicContact CG2-CB 4.49Å; V2437-P2613 HydrophobicContact CG2-CG 3.6Å; L2561-P2613 HydrophobicContact CD1-CB 3.84Å; P2611-P2613 VanDerWaalsContact C-CD 3.45Å; P2611-P2613 VanDerWaalsContact C-N 3.28Å; P2611-P2613 WeakPolarHBondContact O-CD 3.48Å; P2611-P2613 VanDerWaalsContact O-N 3.12Å; P2613-E2616 PolarHBondContact O-N 3.26Å; P2613-L2617 WeakPolarHBondContact O-CB 3.38Å; P2613-L2617 WeakPolarHBondContact O-CG 3.25Å; P2613-L2617 PolarHBondContact O-N 3.25Å; P2613-L2617 VanDerWaalsContact O-N 3.1Å
2614I68.3Low60.1Low33.75 Ų33.7577.9 Ų77.917%0.17344%0.442CS..Hα-helixtrans-74.4-41.1-179.7-59178.7000110L2561 W2573 L2610 P2611 P2612 E2616 L2617 V2618L2561-I2614 HydrophobicContact CD1-CG1 4.17Å; L2561-I2614 HydrophobicContact CD2-CD1 4.13Å; L2561-I2614 HydrophobicContact CD2-CG1 3.72Å; W2573-I2614 HydrophobicContact CH2-CG2 3.66Å; W2573-I2614 HydrophobicContact CZ2-CB 4.38Å; W2573-I2614 HydrophobicContact CZ2-CD1 4.06Å; W2573-I2614 HydrophobicContact CZ2-CG1 3.99Å; W2573-I2614 HydrophobicContact CZ2-CG2 3.58Å; W2573-I2614 HydrophobicContact CZ3-CG2 4.23Å; L2610-I2614 HydrophobicContact CD2-CB 4.31Å; L2610-I2614 HydrophobicContact CD2-CG2 3.94Å; P2611-I2614 HydrophobicContact CB-CD1 4.31Å; P2611-I2614 HydrophobicContact CB-CG1 4.43Å; P2611-I2614 HydrophobicContact CG-CD1 4.16Å; P2611-I2614 PolarHBondContact O-N 3Å; P2612-I2614 VanDerWaalsContact C-N 3.26Å; P2612-I2614 PolarHBondContact O-N 3.12Å; I2614-E2616 VanDerWaalsContact C-N 3.3Å; I2614-E2616 PolarHBondContact O-N 3.25Å; I2614-L2617 PolarHBondContact O-N 3.18Å; I2614-V2618 HydrophobicContact CG2-CG2 4.46Å; I2614-V2618 WeakPolarHBondContact O-CG2 3.43Å; I2614-V2618 PolarHBondContact O-N 2.99Å
2615A71.3Confident62.5Low33.25 Ų33.2575.6 Ų75.628%0.27542%0.42SS..Hα-helixtrans-64.7-33.5176.100000112.5L2610 P2611 P2612 R2619L2610-A2615 HydrophobicContact CB-CB 4.31Å; P2611-A2615 PolarHBondContact O-N 3.19Å; P2611-A2615 VanDerWaalsContact O-N 3.13Å; P2612-A2615 PolarHBondContact O-N 3.3Å; P2612-A2615 VanDerWaalsContact O-N 3.17Å; A2615-R2619 WeakPolarHBondContact O-CB 3.31Å; A2615-R2619 WeakPolarHBondContact O-CG 3.43Å; A2615-R2619 PolarHBondContact O-N 3.46Å; A2615-R2619 VanDerWaalsContact O-N 3.11Å; A2615-R2619 PolarHBondContact O-NE 3.04Å; A2615-R2619 PolarHBondContact O-NH2 3.26Å
2616E72.1Confident64.7Low84.75 Ų84.7578.8 Ų78.840%0.39642%0.418SS..Hα-helixtrans-72-43172.6-73-178-177.100112.3V2427 A2430 T2433 K2436 P2612 P2613 I2614 V2618 R2619 A2620V2427-E2616 HydrophobicContact CG1-CB 4.06Å; A2430-E2616 HydrophobicContact CB-CB 4.27Å; T2433-E2616 WeakPolarHBondContact CB-OE2 3.45Å; T2433-E2616 HydrophobicContact CG2-CB 4.25Å; T2433-E2616 WeakPolarHBondContact CG2-OE2 3.24Å; T2433-E2616 PolarHBondContact OG1-OE2 3Å; K2436-E2616 VanDerWaalsContact CD-OE2 3.31Å; K2436-E2616 WeakPolarHBondContact CD-OE2 3.08Å; K2436-E2616 IonicContact NZ-OE1 2.74Å; K2436-E2616 PolarHBondContact NZ-OE1 3Å; K2436-E2616 IonicContact NZ-OE2 2.75Å; K2436-E2616 PolarHBondContact NZ-OE2 3.05Å; P2612-E2616 WeakPolarHBondContact O-CG 3.38Å; P2612-E2616 PolarHBondContact O-N 3.06Å; P2612-E2616 VanDerWaalsContact O-N 3.1Å; P2613-E2616 PolarHBondContact O-N 3.26Å; I2614-E2616 VanDerWaalsContact C-N 3.3Å; I2614-E2616 PolarHBondContact O-N 3.25Å; E2616-V2618 PolarHBondContact O-N 3.09Å; E2616-R2619 PolarHBondContact O-N 3.3Å; E2616-A2620 WeakPolarHBondContact O-CB 3.44Å; E2616-A2620 PolarHBondContact O-N 3.19Å
2617L73.5Confident67.1Low3.5 Ų3.571.6 Ų71.62%0.01838%0.38CS..Hα-helixtrans-60.2-45.1177.2-157.7107000112.4L2423 V2427 T2433 V2437 L2554 A2557 E2558 L2561 P2613 I2614 R2619 A2620 K2621L2423-L2617 HydrophobicContact CD1-CD1 4.1Å; L2423-L2617 HydrophobicContact CD1-CD2 4.09Å; V2427-L2617 HydrophobicContact CG2-CB 4.28Å; V2427-L2617 HydrophobicContact CG2-CD1 3.92Å; T2433-L2617 HydrophobicContact CG2-CB 4.5Å; T2433-L2617 HydrophobicContact CG2-CD2 3.72Å; T2433-L2617 HydrophobicContact CG2-CG 3.85Å; V2437-L2617 HydrophobicContact CG2-CD1 4.13Å; V2437-L2617 HydrophobicContact CG2-CD2 4.3Å; V2437-L2617 HydrophobicContact CG2-CG 4.3Å; L2554-L2617 HydrophobicContact CB-CD1 4.17Å; L2554-L2617 HydrophobicContact CB-CD2 4.26Å; L2554-L2617 HydrophobicContact CD2-CD1 3.96Å; L2554-L2617 HydrophobicContact CD2-CD2 3.75Å; A2557-L2617 HydrophobicContact CB-CD1 4.32Å; A2557-L2617 HydrophobicContact CB-CD2 4.25Å; E2558-L2617 HydrophobicContact CB-CD1 4.39Å; E2558-L2617 HydrophobicContact CB-CD2 3.86Å; E2558-L2617 HydrophobicContact CG-CD2 4Å; L2561-L2617 HydrophobicContact CD1-CD1 3.5Å; L2561-L2617 VanDerWaalsContact CD1-CD1 3.5Å; P2613-L2617 WeakPolarHBondContact O-CB 3.38Å; P2613-L2617 WeakPolarHBondContact O-CG 3.25Å; P2613-L2617 PolarHBondContact O-N 3.25Å; P2613-L2617 VanDerWaalsContact O-N 3.1Å; I2614-L2617 PolarHBondContact O-N 3.18Å; L2617-R2619 VanDerWaalsContact C-N 3.33Å; L2617-R2619 PolarHBondContact O-N 3.14Å; L2617-A2620 PolarHBondContact O-N 2.97Å; L2617-K2621 VanDerWaalsContact O-CB 3.29Å; L2617-K2621 WeakPolarHBondContact O-CB 3.42Å; L2617-K2621 WeakPolarHBondContact O-CG 3.39Å; L2617-K2621 PolarHBondContact O-N 2.94Å
2618V75.7Confident69.3Low68.5 Ų68.563 Ų6342%0.41534%0.342SS..Hα-helixtrans-63.2-41.5177.3172.30000111.2W2573 I2614 E2616 K2621 T2622W2573-V2618 HydrophobicContact CZ3-CG2 4.36Å; I2614-V2618 HydrophobicContact CG2-CG2 4.46Å; I2614-V2618 WeakPolarHBondContact O-CG2 3.43Å; I2614-V2618 PolarHBondContact O-N 2.99Å; E2616-V2618 PolarHBondContact O-N 3.09Å; V2618-K2621 PolarHBondContact O-N 2.92Å; V2618-T2622 WeakPolarHBondContact O-CB 3.42Å; V2618-T2622 PolarHBondContact O-N 3.1Å; V2618-T2622 PolarHBondContact O-OG1 3.02Å
2619R78.2Confident71.3Confident148.75 Ų148.7560.7 Ų60.756%0.56132%0.319SS*.Hα-helixtrans-63.8-49.2175.6-98.3179.3-127.8-166.61.1111.7S2419 A2615 E2616 L2617 K2621 T2622 D2623S2419-R2619 PolarHBondContact OG-NH2 3.07Å; A2615-R2619 WeakPolarHBondContact O-CB 3.31Å; A2615-R2619 WeakPolarHBondContact O-CG 3.43Å; A2615-R2619 PolarHBondContact O-N 3.46Å; A2615-R2619 VanDerWaalsContact O-N 3.11Å; A2615-R2619 PolarHBondContact O-NE 3.04Å; A2615-R2619 PolarHBondContact O-NH2 3.26Å; E2616-R2619 PolarHBondContact O-N 3.3Å; L2617-R2619 VanDerWaalsContact C-N 3.33Å; L2617-R2619 PolarHBondContact O-N 3.14Å; R2619-K2621 VanDerWaalsContact C-N 3.28Å; R2619-K2621 PolarHBondContact O-N 3.19Å; R2619-T2622 WeakPolarHBondContact CA-OG1 3.41Å; R2619-T2622 WeakPolarHBondContact O-CA 3.31Å; R2619-T2622 WeakPolarHBondContact O-CB 3.38Å; R2619-T2622 PolarHBondContact O-N 3.23Å; R2619-T2622 PolarHBondContact O-OG1 3.09Å; R2619-D2623 WeakPolarHBondContact O-CB 3.48Å; R2619-D2623 PolarHBondContact O-N 3.13Å
2620A75.9Confident73.2Confident2.75 Ų2.7559.4 Ų59.42%0.02331%0.305CS..Hα-helixtrans-58.4-38.9177.200000112.4S2426 V2427 A2430 L2434 L2554 E2616 L2617 D2623 L2624S2426-A2620 WeakPolarHBondContact OG-CA 3.39Å; V2427-A2620 HydrophobicContact CG1-CB 4.41Å; V2427-A2620 HydrophobicContact CG2-CB 4.36Å; A2430-A2620 HydrophobicContact CB-CB 4.24Å; L2434-A2620 HydrophobicContact CD1-CB 4.31Å; L2434-A2620 WeakPolarHBondContact CD1-O 3.33Å; L2554-A2620 HydrophobicContact CD1-CB 4.25Å; L2554-A2620 HydrophobicContact CD2-CB 4.15Å; E2616-A2620 WeakPolarHBondContact O-CB 3.44Å; E2616-A2620 PolarHBondContact O-N 3.19Å; L2617-A2620 PolarHBondContact O-N 2.97Å; A2620-D2623 PolarHBondContact O-N 2.95Å; A2620-L2624 VanDerWaalsContact O-CB 3.28Å; A2620-L2624 WeakPolarHBondContact O-CB 3.35Å; A2620-L2624 WeakPolarHBondContact O-CG 3.48Å; A2620-L2624 PolarHBondContact O-N 2.99Å
2621K77.3Confident75.3Confident61.75 Ų61.7556.3 Ų56.327%0.26829%0.288SS..Hα-helixtrans-66.1-39.7175-156.6175.6175.71770112.8K2551 L2554 E2555 E2558 L2617 V2618 R2619 D2623 L2624 Q2625K2551-K2621 HydrophobicContact CG-CG 4.39Å; L2554-K2621 HydrophobicContact CD1-CB 4.3Å; L2554-K2621 HydrophobicContact CD1-CG 4.1Å; E2555-K2621 HydrophobicContact CG-CD 3.86Å; E2555-K2621 WeakPolarHBondContact OE1-CE 3.31Å; E2555-K2621 IonicContact OE1-NZ 2.76Å; E2555-K2621 PolarHBondContact OE1-NZ 3.21Å; E2558-K2621 IonicContact OE1-NZ 3.07Å; E2558-K2621 PolarHBondContact OE1-NZ 3.23Å; E2558-K2621 IonicContact OE2-NZ 3.22Å; E2558-K2621 PolarHBondContact OE2-NZ 3.13Å; L2617-K2621 VanDerWaalsContact O-CB 3.29Å; L2617-K2621 WeakPolarHBondContact O-CB 3.42Å; L2617-K2621 WeakPolarHBondContact O-CG 3.39Å; L2617-K2621 PolarHBondContact O-N 2.94Å; V2618-K2621 PolarHBondContact O-N 2.92Å; R2619-K2621 VanDerWaalsContact C-N 3.28Å; R2619-K2621 PolarHBondContact O-N 3.19Å; K2621-D2623 VanDerWaalsContact C-N 3.35Å; K2621-L2624 PolarHBondContact O-N 3.19Å; K2621-Q2625 WeakPolarHBondContact O-CB 3.29Å; K2621-Q2625 PolarHBondContact O-N 3.02Å; K2621-Q2625 VanDerWaalsContact O-N 3.12Å
2622T78.8Confident76.9Confident83.5 Ų83.553.2 Ų53.251%0.51227%0.268SS..Hα-helixtrans-69.2-42.6177.4-2.60000111.8V2618 R2619 Q2625 R2626V2618-T2622 WeakPolarHBondContact O-CB 3.42Å; V2618-T2622 PolarHBondContact O-N 3.1Å; V2618-T2622 PolarHBondContact O-OG1 3.02Å; R2619-T2622 WeakPolarHBondContact CA-OG1 3.41Å; R2619-T2622 WeakPolarHBondContact O-CA 3.31Å; R2619-T2622 WeakPolarHBondContact O-CB 3.38Å; R2619-T2622 PolarHBondContact O-N 3.23Å; R2619-T2622 PolarHBondContact O-OG1 3.09Å; T2622-Q2625 WeakPolarHBondContact O-CB 3.39Å; T2622-Q2625 PolarHBondContact O-N 3.07Å; T2622-R2626 WeakPolarHBondContact O-CB 3.26Å; T2622-R2626 PolarHBondContact O-N 2.97Å; T2622-R2626 VanDerWaalsContact O-N 3.09Å
2623D78.3Confident78.3Confident54.75 Ų54.7548.9 Ų48.929%0.29324%0.241SC..Hα-helixtrans-66-41.1177.3-67.6-28.8000111L2423 S2426 L2434 R2619 A2620 K2621 Q2625 R2626 C2627L2423-D2623 HydrophobicContact CD1-CB 3.54Å; S2426-D2623 PolarHBondContact OG-O 3.43Å; S2426-D2623 PolarHBondContact OG-OD2 3.15Å; L2434-D2623 HydrophobicContact CB-CB 4.22Å; L2434-D2623 HydrophobicContact CD1-CB 3.78Å; L2434-D2623 VanDerWaalsContact CD2-C 3.42Å; L2434-D2623 HydrophobicContact CD2-CB 4.08Å; L2434-D2623 WeakPolarHBondContact CD2-O 3.33Å; L2434-D2623 HydrophobicContact CG-CB 4.22Å; R2619-D2623 WeakPolarHBondContact O-CB 3.48Å; R2619-D2623 PolarHBondContact O-N 3.13Å; A2620-D2623 PolarHBondContact O-N 2.95Å; K2621-D2623 VanDerWaalsContact C-N 3.35Å; D2623-Q2625 PolarHBondContact O-N 2.95Å; D2623-R2626 WeakPolarHBondContact O-CB 3.5Å; D2623-R2626 PolarHBondContact O-N 3.15Å; D2623-C2627 PolarHBondContact O-N 3.13Å; D2623-C2627 PolarHBondContact O-SG 3.31Å; D2623-C2627 VanDerWaalsContact O-SG 3.38Å
2624L79.6Confident79.5Confident3.25 Ų3.2548.7 Ų48.72%0.01724%0.24CC..Hα-helixtrans-61-45.3174.5-158.585.9000112.1L2423 A2430 L2434 L2547 L2550 K2551 L2554 A2620 K2621 R2626 C2627 M2628L2423-L2624 HydrophobicContact CD1-CB 4.14Å; L2423-L2624 HydrophobicContact CD2-CD1 4.15Å; A2430-L2624 HydrophobicContact CB-CD1 3.82Å; A2430-L2624 HydrophobicContact CB-CD2 4.04Å; A2430-L2624 HydrophobicContact CB-CG 4.03Å; L2434-L2624 HydrophobicContact CD1-CB 4.27Å; L2434-L2624 VanDerWaalsContact CD2-CA 3.41Å; L2434-L2624 HydrophobicContact CD2-CB 4.15Å; L2434-L2624 HydrophobicContact CD2-CD1 3.9Å; L2547-L2624 HydrophobicContact CB-CD1 3.97Å; L2547-L2624 HydrophobicContact CD2-CD1 3.72Å; L2547-L2624 HydrophobicContact CD2-CD2 3.57Å; L2547-L2624 HydrophobicContact CG-CD1 4.34Å; L2550-L2624 HydrophobicContact CB-CD1 4.05Å; L2550-L2624 HydrophobicContact CB-CD2 4.32Å; L2550-L2624 HydrophobicContact CD1-CD2 4.46Å; K2551-L2624 VanDerWaalsContact CA-CD2 3.44Å; K2551-L2624 HydrophobicContact CB-CD1 4.05Å; K2551-L2624 HydrophobicContact CB-CD2 3.65Å; K2551-L2624 HydrophobicContact CG-CD2 4.21Å; L2554-L2624 HydrophobicContact CD1-CB 4.25Å; L2554-L2624 HydrophobicContact CD1-CD1 3.58Å; L2554-L2624 HydrophobicContact CD1-CD2 3.86Å; L2554-L2624 HydrophobicContact CD1-CG 4.46Å; A2620-L2624 VanDerWaalsContact O-CB 3.28Å; A2620-L2624 WeakPolarHBondContact O-CB 3.35Å; A2620-L2624 WeakPolarHBondContact O-CG 3.48Å; A2620-L2624 PolarHBondContact O-N 2.99Å; K2621-L2624 PolarHBondContact O-N 3.19Å; L2624-R2626 VanDerWaalsContact C-N 3.34Å; L2624-R2626 PolarHBondContact O-N 3.09Å; L2624-C2627 PolarHBondContact O-N 2.88Å; L2624-C2627 VanDerWaalsContact O-N 3.17Å; L2624-M2628 HydrophobicContact CD1-CG 4.3Å; L2624-M2628 HydrophobicContact CD1-SD 4.32Å; L2624-M2628 HydrophobicContact CG-SD 4.32Å; L2624-M2628 VanDerWaalsContact O-CG 3.28Å; L2624-M2628 WeakPolarHBondContact O-CG 3.38Å; L2624-M2628 PolarHBondContact O-N 3.3Å
2625Q79.3Confident80.5Confident51 Ų5147.1 Ų47.124%0.23823%0.231CC..Hα-helixtrans-58.5-46.6176.6-17963.233.900110.8K2621 T2622 D2623 C2627 M2628 E2629K2621-Q2625 WeakPolarHBondContact O-CB 3.29Å; K2621-Q2625 PolarHBondContact O-N 3.02Å; K2621-Q2625 VanDerWaalsContact O-N 3.12Å; T2622-Q2625 WeakPolarHBondContact O-CB 3.39Å; T2622-Q2625 PolarHBondContact O-N 3.07Å; D2623-Q2625 PolarHBondContact O-N 2.95Å; Q2625-C2627 VanDerWaalsContact C-N 3.33Å; Q2625-C2627 PolarHBondContact O-N 3.11Å; Q2625-M2628 WeakPolarHBondContact O-CB 3.36Å; Q2625-M2628 PolarHBondContact O-N 3.13Å; Q2625-M2628 VanDerWaalsContact O-N 3.16Å; Q2625-E2629 WeakPolarHBondContact CG-OE1 3.34Å; Q2625-E2629 PolarHBondContact NE2-OE1 2.93Å; Q2625-E2629 VanDerWaalsContact O-CG 3.29Å; Q2625-E2629 WeakPolarHBondContact O-CG 3.35Å; Q2625-E2629 PolarHBondContact O-N 3.19Å; Q2625-E2629 VanDerWaalsContact O-N 3.11Å
2626R80.5Confident81.5Confident163 Ų16345.6 Ų45.662%0.61522%0.218SC*.Hα-helixtrans-59.6-41.7176.5-174.1177.9-178.71670.4112.6T2622 D2623 L2624 M2628 E2629 L2630T2622-R2626 WeakPolarHBondContact O-CB 3.26Å; T2622-R2626 PolarHBondContact O-N 2.97Å; T2622-R2626 VanDerWaalsContact O-N 3.09Å; D2623-R2626 WeakPolarHBondContact O-CB 3.5Å; D2623-R2626 PolarHBondContact O-N 3.15Å; L2624-R2626 VanDerWaalsContact C-N 3.34Å; L2624-R2626 PolarHBondContact O-N 3.09Å; R2626-M2628 VanDerWaalsContact C-N 3.33Å; R2626-M2628 PolarHBondContact O-N 2.67Å; R2626-E2629 PolarHBondContact O-N 3.09Å; R2626-L2630 WeakPolarHBondContact O-CB 3.43Å; R2626-L2630 WeakPolarHBondContact O-CG 3.32Å; R2626-L2630 PolarHBondContact O-N 3.01Å; R2626-L2630 VanDerWaalsContact O-N 3.1Å
2627C80.6Confident82.4Confident7.5 Ų7.546.7 Ų46.75%0.05122%0.222CC..Hα-helixtrans-66.9-36.1176.3-70.80000112.8L2423 S2426 L2434 V2437 L2547 D2623 L2624 Q2625 E2629 L2630 H2631L2423-C2627 HydrophobicContact CD2-CB 3.94Å; S2426-C2627 PolarHBondContact OG-SG 3.47Å; L2434-C2627 HydrophobicContact CD2-CB 4.23Å; L2434-C2627 WeakPolarHBondContact CD2-SG 3.46Å; V2437-C2627 HydrophobicContact CG1-CB 4.27Å; V2437-C2627 VanDerWaalsContact CG1-SG 3.57Å; V2437-C2627 WeakPolarHBondContact CG1-SG 3.48Å; L2547-C2627 HydrophobicContact CD1-CB 4.09Å; L2547-C2627 HydrophobicContact CD2-CB 4.28Å; D2623-C2627 PolarHBondContact O-N 3.13Å; D2623-C2627 PolarHBondContact O-SG 3.31Å; D2623-C2627 VanDerWaalsContact O-SG 3.38Å; L2624-C2627 PolarHBondContact O-N 2.88Å; L2624-C2627 VanDerWaalsContact O-N 3.17Å; Q2625-C2627 VanDerWaalsContact C-N 3.33Å; Q2625-C2627 PolarHBondContact O-N 3.11Å; C2627-E2629 VanDerWaalsContact C-N 3.31Å; C2627-E2629 PolarHBondContact O-N 3.18Å; C2627-L2630 PolarHBondContact O-N 3.05Å; C2627-H2631 PolarHBondContact O-CD2 2.94Å; C2627-H2631 VanDerWaalsContact O-CD2 3.31Å; C2627-H2631 PolarHBondContact O-N 3.04Å
2628M81.6Confident83.3Confident3.75 Ų3.7546.5 Ų46.52%0.01822%0.221CC..Hα-helixtrans-62.8-39.9174-69.1170.175.800111.5F2544 L2547 D2548 K2551 L2624 Q2625 R2626 H2631 A2632 F2664F2544-M2628 HydrophobicContact CD2-CB 4.3Å; F2544-M2628 HydrophobicContact CD2-CE 4.01Å; F2544-M2628 HydrophobicContact CD2-CG 4.36Å; F2544-M2628 WeakPolarHBondContact CE1-O 3.25Å; F2544-M2628 HydrophobicContact CE2-CE 3.65Å; F2544-M2628 VanDerWaalsContact CE2-CE 3.44Å; L2547-M2628 HydrophobicContact CB-CG 3.61Å; L2547-M2628 VanDerWaalsContact CB-CG 3.44Å; L2547-M2628 HydrophobicContact CB-SD 4.24Å; L2547-M2628 HydrophobicContact CD1-CB 4.16Å; L2547-M2628 HydrophobicContact CD1-CG 3.83Å; L2547-M2628 HydrophobicContact CG-CG 4.36Å; D2548-M2628 HydrophobicContact CB-CE 3.92Å; D2548-M2628 VanDerWaalsContact OD1-CE 3.24Å; D2548-M2628 WeakPolarHBondContact OD1-CE 3.46Å; K2551-M2628 HydrophobicContact CB-SD 4.43Å; K2551-M2628 HydrophobicContact CD-CE 4.34Å; K2551-M2628 HydrophobicContact CD-SD 3.99Å; L2624-M2628 HydrophobicContact CD1-CG 4.3Å; L2624-M2628 HydrophobicContact CD1-SD 4.32Å; L2624-M2628 HydrophobicContact CG-SD 4.32Å; L2624-M2628 VanDerWaalsContact O-CG 3.28Å; L2624-M2628 WeakPolarHBondContact O-CG 3.38Å; L2624-M2628 PolarHBondContact O-N 3.3Å; Q2625-M2628 WeakPolarHBondContact O-CB 3.36Å; Q2625-M2628 PolarHBondContact O-N 3.13Å; Q2625-M2628 VanDerWaalsContact O-N 3.16Å; R2626-M2628 VanDerWaalsContact C-N 3.33Å; R2626-M2628 PolarHBondContact O-N 2.67Å; M2628-H2631 PolarHBondContact O-N 2.97Å; M2628-A2632 VanDerWaalsContact O-CB 3.25Å; M2628-A2632 WeakPolarHBondContact O-CB 3.41Å; M2628-A2632 PolarHBondContact O-N 3.14Å; M2628-A2632 VanDerWaalsContact O-N 3.12Å; M2628-F2664 HydrophobicContact CB-CE1 4.14Å; M2628-F2664 HydrophobicContact CB-CZ 4.1Å; M2628-F2664 HydrophobicContact CE-CE1 3.83Å; M2628-F2664 HydrophobicContact CE-CZ 4.03Å
2629E82Confident84.1Confident60 Ų6043.3 Ų43.328%0.2820%0.201SC..Hα-helixtrans-66.5-43.1179.6-66.6174-177.700112Q2625 R2626 C2627 H2631 A2632 F2664 L2667Q2625-E2629 WeakPolarHBondContact CG-OE1 3.34Å; Q2625-E2629 PolarHBondContact NE2-OE1 2.93Å; Q2625-E2629 VanDerWaalsContact O-CG 3.29Å; Q2625-E2629 WeakPolarHBondContact O-CG 3.35Å; Q2625-E2629 PolarHBondContact O-N 3.19Å; Q2625-E2629 VanDerWaalsContact O-N 3.11Å; R2626-E2629 PolarHBondContact O-N 3.09Å; C2627-E2629 VanDerWaalsContact C-N 3.31Å; C2627-E2629 PolarHBondContact O-N 3.18Å; E2629-H2631 VanDerWaalsContact C-N 3.3Å; E2629-H2631 PolarHBondContact O-N 3.04Å; E2629-A2632 PolarHBondContact O-N 3.15Å; E2629-A2632 VanDerWaalsContact O-N 3.12Å; E2629-F2664 HydrophobicContact CG-CD1 4.15Å; E2629-F2664 HydrophobicContact CG-CE1 4.26Å; E2629-L2667 HydrophobicContact CB-CD1 4.23Å; E2629-L2667 HydrophobicContact CG-CD1 3.54Å; E2629-L2667 VanDerWaalsContact CG-CD1 3.47Å; E2629-L2667 HydrophobicContact CG-CD2 4.14Å
2630L85.1Confident84.7Confident92.25 Ų92.2536.5 Ų36.548%0.48318%0.176SC..Hα-helixtrans-58.3-34.3177.8-92.3162.3000113.5V2414 V2437 R2626 C2627 P2634V2414-L2630 HydrophobicContact CG1-CD1 3.37Å; V2414-L2630 HydrophobicContact CG1-CD2 3.68Å; V2414-L2630 HydrophobicContact CG1-CG 4.17Å; V2437-L2630 HydrophobicContact CG1-CD1 4.22Å; R2626-L2630 WeakPolarHBondContact O-CB 3.43Å; R2626-L2630 WeakPolarHBondContact O-CG 3.32Å; R2626-L2630 PolarHBondContact O-N 3.01Å; R2626-L2630 VanDerWaalsContact O-N 3.1Å; C2627-L2630 PolarHBondContact O-N 3.05Å; L2630-P2634 WeakPolarHBondContact O-CD 3.36Å; L2630-P2634 WeakPolarHBondContact O-CG 3.4Å
2631H86.4Confident85.5Confident28.75 Ų28.7537.6 Ų37.613%0.13318%0.182CC..Hα-helixtrans-89.1-20.4177.2-72.3-68.1000113.7F2415 N2540 F2544 C2627 M2628 E2629 P2634 S2635F2415-H2631 AromaticContact CE1-NE2 3.76Å; F2415-H2631 AromaticContact CZ-NE2 3.48Å; F2415-H2631 WeakPolarHBondContact CZ-NE2 3.32Å; N2540-H2631 HydrophobicContact CB-CB 4.41Å; N2540-H2631 PolarHBondContact OD1-ND1 3.31Å; N2540-H2631 VanDerWaalsContact OD1-ND1 3.08Å; F2544-H2631 HydrophobicContact CE1-CB 3.82Å; F2544-H2631 HydrophobicContact CZ-CB 3.79Å; F2544-H2631 WeakPolarHBondContact CZ-O 3.48Å; C2627-H2631 PolarHBondContact O-CD2 2.94Å; C2627-H2631 VanDerWaalsContact O-CD2 3.31Å; C2627-H2631 PolarHBondContact O-N 3.04Å; M2628-H2631 PolarHBondContact O-N 2.97Å; E2629-H2631 VanDerWaalsContact C-N 3.3Å; E2629-H2631 PolarHBondContact O-N 3.04Å; H2631-P2634 WeakPolarHBondContact O-CD 3.41Å; H2631-S2635 WeakPolarHBondContact O-CB 3.41Å; H2631-S2635 PolarHBondContact O-N 3.02Å; H2631-S2635 VanDerWaalsContact O-N 3.11Å
2632A86.4Confident86.1Confident0.25 Ų0.2534.6 Ų34.60%0.00217%0.169CC..Hα-helixtrans-68.1-47.3-17600000112.5F2544 M2628 E2629 S2635 V2636 F2664 I2670F2544-A2632 HydrophobicContact CE1-CB 3.98Å; F2544-A2632 HydrophobicContact CZ-CB 3.92Å; F2544-A2632 VanDerWaalsContact CZ-N 3.34Å; M2628-A2632 VanDerWaalsContact O-CB 3.25Å; M2628-A2632 WeakPolarHBondContact O-CB 3.41Å; M2628-A2632 PolarHBondContact O-N 3.14Å; M2628-A2632 VanDerWaalsContact O-N 3.12Å; E2629-A2632 PolarHBondContact O-N 3.15Å; E2629-A2632 VanDerWaalsContact O-N 3.12Å; A2632-S2635 PolarHBondContact O-N 3.14Å; A2632-V2636 VanDerWaalsContact O-CG2 3.3Å; A2632-V2636 WeakPolarHBondContact O-CG2 3.39Å; A2632-V2636 PolarHBondContact O-N 3.07Å; A2632-F2664 HydrophobicContact CB-CD1 4.43Å; A2632-F2664 HydrophobicContact CB-CD2 3.92Å; A2632-F2664 HydrophobicContact CB-CE1 4.49Å; A2632-F2664 HydrophobicContact CB-CE2 4.09Å; A2632-F2664 HydrophobicContact CB-CG 4.13Å; A2632-F2664 HydrophobicContact CB-CZ 4.35Å; A2632-I2670 HydrophobicContact CB-CD1 3.56Å; A2632-I2670 VanDerWaalsContact CB-CD1 3.44Å; A2632-I2670 HydrophobicContact CB-CG1 4.34Å
2633A87.7Confident86.7Confident5.5 Ų5.530.6 Ų30.65%0.04515%0.145CC..Hα-helixtrans-62.8-45.8179.600000113.4S2635 V2636 K2637 E2669 I2670A2633-S2635 VanDerWaalsContact C-N 3.33Å; A2633-S2635 PolarHBondContact O-N 3.1Å; A2633-V2636 PolarHBondContact O-N 3.19Å; A2633-K2637 WeakPolarHBondContact O-CB 3.34Å; A2633-K2637 PolarHBondContact O-N 3.34Å; A2633-E2669 VanDerWaalsContact CB-CD 3.44Å; A2633-E2669 HydrophobicContact CB-CG 4.06Å; A2633-E2669 WeakPolarHBondContact CB-OE1 3.33Å; A2633-I2670 HydrophobicContact CB-CG1 4.1Å
2634P90.2Very high87.2Confident32.5 Ų32.529.9 Ų29.921%0.21114%0.144CC..Hα-helixtrans-55.9-43.6169.7-29.336.6000113.9W2536 L2630 H2631 K2637 G2638W2536-P2634 HydrophobicContact CH2-CB 3.82Å; W2536-P2634 HydrophobicContact CZ2-CB 3.74Å; W2536-P2634 HydrophobicContact CZ2-CG 4.49Å; W2536-P2634 VanDerWaalsContact CZ3-O 3.29Å; W2536-P2634 WeakPolarHBondContact CZ3-O 3.42Å; L2630-P2634 WeakPolarHBondContact O-CD 3.36Å; L2630-P2634 WeakPolarHBondContact O-CG 3.4Å; H2631-P2634 WeakPolarHBondContact O-CD 3.41Å; P2634-K2637 PolarHBondContact O-N 3.13Å; P2634-G2638 PolarHBondContact O-N 3.21Å
2635S90.9Very high87.7Confident0.5 Ų0.533 Ų330%0.00316%0.16CC..Hα-helixtrans-63.8-45.8179.9-167.60000112A2537 H2631 A2632 A2633 G2638 F2639A2537-S2635 PolarHBondContact O-OG 3.09Å; H2631-S2635 WeakPolarHBondContact O-CB 3.41Å; H2631-S2635 PolarHBondContact O-N 3.02Å; H2631-S2635 VanDerWaalsContact O-N 3.11Å; A2632-S2635 PolarHBondContact O-N 3.14Å; A2633-S2635 VanDerWaalsContact C-N 3.33Å; A2633-S2635 PolarHBondContact O-N 3.1Å; S2635-G2638 PolarHBondContact O-N 3.15Å; S2635-F2639 WeakPolarHBondContact O-CD2 3.27Å; S2635-F2639 PolarHBondContact O-N 3.2Å; S2635-F2639 VanDerWaalsContact OG-CE2 3.28Å; S2635-F2639 WeakPolarHBondContact OG-CE2 3.41Å
2636V91.3Very high87.8Confident0.25 Ų0.2530.8 Ų30.80%0.00215%0.15CC..Hα-helixtrans-58.2-49.9174.7169.50000110.9A2632 A2633 G2638 F2639 V2640 L2657 L2660 I2670 V2673 I2674A2632-V2636 VanDerWaalsContact O-CG2 3.3Å; A2632-V2636 WeakPolarHBondContact O-CG2 3.39Å; A2632-V2636 PolarHBondContact O-N 3.07Å; A2633-V2636 PolarHBondContact O-N 3.19Å; V2636-G2638 VanDerWaalsContact C-N 3.29Å; V2636-G2638 PolarHBondContact O-N 3.09Å; V2636-F2639 PolarHBondContact O-N 3.21Å; V2636-V2640 HydrophobicContact CG1-CG2 4.4Å; V2636-V2640 WeakPolarHBondContact O-CB 3.4Å; V2636-V2640 WeakPolarHBondContact O-CG2 3.31Å; V2636-V2640 PolarHBondContact O-N 3.17Å; V2636-L2657 HydrophobicContact CB-CD1 4.4Å; V2636-L2657 HydrophobicContact CG1-CD1 3.83Å; V2636-L2657 HydrophobicContact CG2-CD1 4.39Å; V2636-L2660 HydrophobicContact CG2-CB 3.88Å; V2636-L2660 HydrophobicContact CG2-CD1 3.83Å; V2636-L2660 HydrophobicContact CG2-CG 4.43Å; V2636-I2670 HydrophobicContact CG2-CG2 4.21Å; V2636-V2673 HydrophobicContact CB-CG1 4.34Å; V2636-V2673 HydrophobicContact CG1-CB 4.38Å; V2636-V2673 HydrophobicContact CG1-CG1 3.79Å; V2636-I2674 HydrophobicContact CG1-CD1 4.28Å; V2636-I2674 HydrophobicContact CG1-CG1 3.55Å; V2636-I2674 VanDerWaalsContact CG1-CG1 3.5Å
2637K91.6Very high87.5Confident108.25 Ų108.2528.3 Ų28.347%0.47116%0.155SC..Hα-helixtrans-58.7-41.4178.6-174.6173.3-177171.90111.9W2536 A2633 P2634 V2640 N2641 V2673W2536-K2637 HydrophobicContact CH2-CB 4.47Å; W2536-K2637 HydrophobicContact CH2-CD 4.21Å; W2536-K2637 HydrophobicContact CZ3-CB 4.27Å; W2536-K2637 HydrophobicContact CZ3-CD 4.24Å; W2536-K2637 HydrophobicContact CZ3-CG 4.36Å; A2633-K2637 WeakPolarHBondContact O-CB 3.34Å; A2633-K2637 PolarHBondContact O-N 3.34Å; P2634-K2637 PolarHBondContact O-N 3.13Å; K2637-V2640 PolarHBondContact O-N 2.71Å; K2637-N2641 PolarHBondContact O-N 3.19Å; K2637-N2641 VanDerWaalsContact O-N 3.12Å; K2637-N2641 PolarHBondContact O-ND2 3.42Å; K2637-V2673 HydrophobicContact CB-CG1 4.1Å
2638G91.9Very high87.2Confident0 Ų032.7 Ų32.70%018%0.182CC..Hα-helixtrans-63.7-45.8175.700000113.1P2634 S2635 V2636 N2641 S2642P2634-G2638 PolarHBondContact O-N 3.21Å; S2635-G2638 PolarHBondContact O-N 3.15Å; V2636-G2638 VanDerWaalsContact C-N 3.29Å; V2636-G2638 PolarHBondContact O-N 3.09Å; G2638-N2641 PolarHBondContact O-N 2.97Å; G2638-S2642 VanDerWaalsContact O-CB 3.31Å; G2638-S2642 WeakPolarHBondContact O-CB 3.37Å; G2638-S2642 PolarHBondContact O-N 3.19Å
2639F92.1Very high86.5Confident0 Ų034 Ų340%019%0.194CC..Hα-helixtrans-66.7-40.5177.3-73-54.9000112.3A2537 M2538 Y2541 S2635 V2636 N2641 S2642 I2643 D2653 R2656 L2657 L2660A2537-F2639 HydrophobicContact CB-CD1 3.66Å; A2537-F2639 HydrophobicContact CB-CD2 3.96Å; A2537-F2639 HydrophobicContact CB-CE1 3.65Å; A2537-F2639 HydrophobicContact CB-CE2 3.96Å; A2537-F2639 HydrophobicContact CB-CG 3.8Å; A2537-F2639 HydrophobicContact CB-CZ 3.79Å; M2538-F2639 HydrophobicContact CG-CE1 4.38Å; M2538-F2639 HydrophobicContact CG-CZ 4.42Å; M2538-F2639 HydrophobicContact SD-CE1 4.23Å; M2538-F2639 HydrophobicContact SD-CZ 3.95Å; Y2541-F2639 AromaticContact CD2-CE2 3.96Å; Y2541-F2639 HydrophobicContact CD2-CE2 4.09Å; Y2541-F2639 HydrophobicContact CD2-CZ 4.38Å; Y2541-F2639 HydrophobicContact CG-CE2 4.24Å; Y2541-F2639 HydrophobicContact CG-CZ 4.34Å; S2635-F2639 WeakPolarHBondContact O-CD2 3.27Å; S2635-F2639 PolarHBondContact O-N 3.2Å; S2635-F2639 VanDerWaalsContact OG-CE2 3.28Å; S2635-F2639 WeakPolarHBondContact OG-CE2 3.41Å; V2636-F2639 PolarHBondContact O-N 3.21Å; F2639-N2641 VanDerWaalsContact C-N 3.33Å; F2639-N2641 PolarHBondContact O-N 3.14Å; F2639-S2642 PolarHBondContact O-N 3.21Å; F2639-I2643 HydrophobicContact CB-CD1 4.49Å; F2639-I2643 WeakPolarHBondContact O-CB 3.42Å; F2639-I2643 WeakPolarHBondContact O-CD1 3.22Å; F2639-I2643 WeakPolarHBondContact O-CG1 3.44Å; F2639-I2643 PolarHBondContact O-N 3.13Å; F2639-D2653 HydrophobicContact CD1-CB 3.8Å; F2639-D2653 HydrophobicContact CE1-CB 4.4Å; F2639-R2656 HydrophobicContact CD2-CB 4.28Å; F2639-R2656 HydrophobicContact CE1-CB 4.22Å; F2639-R2656 HydrophobicContact CE2-CB 3.84Å; F2639-R2656 HydrophobicContact CZ-CB 3.83Å; F2639-R2656 VanDerWaalsContact CZ-CD 3.46Å; F2639-R2656 HydrophobicContact CZ-CG 4.28Å; F2639-L2657 HydrophobicContact CB-CB 4.23Å; F2639-L2657 HydrophobicContact CB-CD1 4.41Å; F2639-L2660 HydrophobicContact CD2-CD1 3.87Å; F2639-L2660 HydrophobicContact CE2-CD1 4Å
2640V92.1Very high86.2Confident6.25 Ų6.2532.1 Ų32.14%0.03819%0.185CC..Hα-helixtrans-54.8-50.1175.1162.80000111.2V2636 K2637 I2643 S2644 L2657 I2681V2636-V2640 HydrophobicContact CG1-CG2 4.4Å; V2636-V2640 WeakPolarHBondContact O-CB 3.4Å; V2636-V2640 WeakPolarHBondContact O-CG2 3.31Å; V2636-V2640 PolarHBondContact O-N 3.17Å; K2637-V2640 PolarHBondContact O-N 2.71Å; V2640-I2643 PolarHBondContact O-N 3.02Å; V2640-S2644 WeakPolarHBondContact O-CB 3.42Å; V2640-S2644 PolarHBondContact O-N 3.06Å; V2640-S2644 PolarHBondContact O-OG 3.03Å; V2640-L2657 HydrophobicContact CG2-CD1 4.2Å; V2640-L2657 HydrophobicContact CG2-CD2 4.02Å; V2640-I2681 HydrophobicContact CG1-CD1 4.4Å; V2640-I2681 HydrophobicContact CG2-CD1 4.35Å
2641N91.6Very high85.8Confident25.75 Ų25.7528.6 Ų28.614%0.13817%0.167CC..Hα-helixtrans-70-36179.4-71.2-19.1000112.4W2533 K2637 G2638 F2639 I2643 S2644 L2645W2533-N2641 HydrophobicContact CB-CB 4.16Å; W2533-N2641 HydrophobicContact CD2-CB 3.52Å; W2533-N2641 VanDerWaalsContact CD2-CB 3.48Å; W2533-N2641 HydrophobicContact CE3-CB 3.87Å; W2533-N2641 HydrophobicContact CG-CB 3.66Å; W2533-N2641 VanDerWaalsContact CH2-ND2 3.26Å; W2533-N2641 WeakPolarHBondContact CH2-ND2 3.43Å; W2533-N2641 HydrophobicContact CZ2-CB 4.45Å; W2533-N2641 WeakPolarHBondContact CZ2-ND2 3.35Å; W2533-N2641 HydrophobicContact CZ3-CB 4.48Å; W2533-N2641 VanDerWaalsContact CZ3-ND2 3.28Å; W2533-N2641 WeakPolarHBondContact CZ3-ND2 3.34Å; K2637-N2641 PolarHBondContact O-N 3.19Å; K2637-N2641 VanDerWaalsContact O-N 3.12Å; K2637-N2641 PolarHBondContact O-ND2 3.42Å; G2638-N2641 PolarHBondContact O-N 2.97Å; F2639-N2641 VanDerWaalsContact C-N 3.33Å; F2639-N2641 PolarHBondContact O-N 3.14Å; N2641-I2643 VanDerWaalsContact C-N 3.33Å; N2641-I2643 PolarHBondContact O-N 2.95Å; N2641-S2644 WeakPolarHBondContact CA-OG 3.26Å; N2641-S2644 PolarHBondContact O-N 3.19Å; N2641-S2644 PolarHBondContact O-OG 3.08Å; N2641-L2645 VanDerWaalsContact O-CB 3.31Å; N2641-L2645 WeakPolarHBondContact O-CB 3.35Å; N2641-L2645 WeakPolarHBondContact O-CD1 3.45Å; N2641-L2645 VanDerWaalsContact O-CG 3.26Å; N2641-L2645 WeakPolarHBondContact O-CG 3.32Å; N2641-L2645 PolarHBondContact O-N 2.86Å; N2641-L2645 VanDerWaalsContact O-N 3.16Å
2642S90.9Very high85.4Confident0 Ų029.2 Ų29.20%017%0.17CC..Hα-helixtrans-62.4-42175.1-169.90000112.1R2530 Q2534 G2638 F2639 S2646 D2653R2530-S2642 VanDerWaalsContact CD-O 3.3Å; R2530-S2642 WeakPolarHBondContact CD-O 3.37Å; R2530-S2642 WeakPolarHBondContact CG-O 3.45Å; R2530-S2642 VanDerWaalsContact CG-OG 3.27Å; R2530-S2642 WeakPolarHBondContact CG-OG 3.42Å; R2530-S2642 PolarHBondContact NE-OG 3.44Å; R2530-S2642 PolarHBondContact O-OG 2.96Å; Q2534-S2642 VanDerWaalsContact CB-OG 3.32Å; Q2534-S2642 WeakPolarHBondContact CB-OG 3.42Å; G2638-S2642 VanDerWaalsContact O-CB 3.31Å; G2638-S2642 WeakPolarHBondContact O-CB 3.37Å; G2638-S2642 PolarHBondContact O-N 3.19Å; F2639-S2642 PolarHBondContact O-N 3.21Å; S2642-S2646 PolarHBondContact O-N 2.98Å; S2642-D2653 WeakPolarHBondContact CB-OD2 3.38Å; S2642-D2653 PolarHBondContact OG-OD2 3.23Å
2643I89.9Confident85.2Confident0 Ų029.2 Ų29.20%017%0.17CC..Hα-helixtrans-71.6-42.6179.5-63.8161.4000110.7F2639 V2640 N2641 L2645 S2646 D2653 L2657 I2681 N2685F2639-I2643 HydrophobicContact CB-CD1 4.49Å; F2639-I2643 WeakPolarHBondContact O-CB 3.42Å; F2639-I2643 WeakPolarHBondContact O-CD1 3.22Å; F2639-I2643 WeakPolarHBondContact O-CG1 3.44Å; F2639-I2643 PolarHBondContact O-N 3.13Å; V2640-I2643 PolarHBondContact O-N 3.02Å; N2641-I2643 VanDerWaalsContact C-N 3.33Å; N2641-I2643 PolarHBondContact O-N 2.95Å; I2643-L2645 VanDerWaalsContact C-N 3.31Å; I2643-L2645 PolarHBondContact O-N 3.1Å; I2643-S2646 VanDerWaalsContact O-CB 3.31Å; I2643-S2646 WeakPolarHBondContact O-CB 3.46Å; I2643-S2646 PolarHBondContact O-N 3.3Å; I2643-S2646 VanDerWaalsContact O-N 3.15Å; I2643-D2653 HydrophobicContact CD1-CB 4.08Å; I2643-D2653 HydrophobicContact CG1-CB 3.7Å; I2643-L2657 HydrophobicContact CD1-CB 4.31Å; I2643-L2657 HydrophobicContact CD1-CD2 3.72Å; I2643-I2681 HydrophobicContact CB-CD1 4.27Å; I2643-I2681 HydrophobicContact CB-CG1 4.3Å; I2643-I2681 HydrophobicContact CD1-CD1 4.36Å; I2643-I2681 HydrophobicContact CG2-CB 4.45Å; I2643-I2681 HydrophobicContact CG2-CD1 4.13Å; I2643-I2681 HydrophobicContact CG2-CG1 4.02Å; I2643-I2681 HydrophobicContact CG2-CG2 3.68Å; I2643-N2685 HydrophobicContact CG2-CB 4.1Å; I2643-N2685 WeakPolarHBondContact CG2-ND2 3.28Å; I2643-N2685 PolarHBondContact O-ND2 3.11Å
2644S90.3Very high85.2Confident39.25 Ų39.2529 Ų2927%0.27417%0.168SC..Hα-helixtrans-65.7-33.6-179.768.50000113.2V2640 N2641 S2646 K2680V2640-S2644 WeakPolarHBondContact O-CB 3.42Å; V2640-S2644 PolarHBondContact O-N 3.06Å; V2640-S2644 PolarHBondContact O-OG 3.03Å; N2641-S2644 WeakPolarHBondContact CA-OG 3.26Å; N2641-S2644 PolarHBondContact O-N 3.19Å; N2641-S2644 PolarHBondContact O-OG 3.08Å; S2644-S2646 VanDerWaalsContact C-N 3.32Å; S2644-S2646 PolarHBondContact O-N 2.99Å; S2644-K2680 WeakPolarHBondContact CB-O 3.28Å
2645L88.7Confident84.8Confident67.5 Ų67.528.4 Ų28.435%0.35316%0.163SC..THydrogen-bonded Turntrans-82.4-6.2175.8-66.2170.4000113.7P2527 R2530 W2533 N2641 I2643 P2647P2527-L2645 WeakPolarHBondContact O-CD1 3.39Å; R2530-L2645 HydrophobicContact CB-CB 4.19Å; W2533-L2645 VanDerWaalsContact CD1-CD1 3.45Å; W2533-L2645 HydrophobicContact CG-CD1 4.48Å; N2641-L2645 VanDerWaalsContact O-CB 3.31Å; N2641-L2645 WeakPolarHBondContact O-CB 3.35Å; N2641-L2645 WeakPolarHBondContact O-CD1 3.45Å; N2641-L2645 VanDerWaalsContact O-CG 3.26Å; N2641-L2645 WeakPolarHBondContact O-CG 3.32Å; N2641-L2645 PolarHBondContact O-N 2.86Å; N2641-L2645 VanDerWaalsContact O-N 3.16Å; I2643-L2645 VanDerWaalsContact C-N 3.31Å; I2643-L2645 PolarHBondContact O-N 3.1Å; L2645-P2647 WeakPolarHBondContact O-CD 3.15Å
2646S82.7Confident84.5Confident4.5 Ų4.529.5 Ų29.53%0.03117%0.167CC..  trans-81.5123.8-179.5-163.10000110.6R2530 S2642 I2643 S2644 T2648 R2682R2530-S2646 PolarHBondContact NH1-OG 3.25Å; R2530-S2646 VanDerWaalsContact NH1-OG 3.1Å; S2642-S2646 PolarHBondContact O-N 2.98Å; I2643-S2646 VanDerWaalsContact O-CB 3.31Å; I2643-S2646 WeakPolarHBondContact O-CB 3.46Å; I2643-S2646 PolarHBondContact O-N 3.3Å; I2643-S2646 VanDerWaalsContact O-N 3.15Å; S2644-S2646 VanDerWaalsContact C-N 3.32Å; S2644-S2646 PolarHBondContact O-N 2.99Å; S2646-T2648 VanDerWaalsContact C-N 3.32Å; S2646-T2648 VanDerWaalsContact CB-O 3.31Å; S2646-T2648 WeakPolarHBondContact CB-O 3.35Å; S2646-T2648 PolarHBondContact O-N 3.08Å; S2646-T2648 PolarHBondContact OG-O 3.12Å; S2646-R2682 PolarHBondContact O-NH2 2.87Å
2647P74.3Confident84.3Confident112.25 Ų112.2529.8 Ų29.873%0.72917%0.169SC*.SBendtrans-68.4-29.1177.627.4-33.9000112L2645 R2682L2645-P2647 WeakPolarHBondContact O-CD 3.15Å; P2647-R2682 VanDerWaalsContact C-NH2 3.33Å; P2647-R2682 PolarHBondContact O-NH2 3.19Å
2648T73.3Confident84.1Confident99.25 Ų99.2525.1 Ų25.161%0.60915%0.148SC*.SBendtrans-113.9146.6175.556.60000110.2S2646 N2650S2646-T2648 VanDerWaalsContact C-N 3.32Å; S2646-T2648 VanDerWaalsContact CB-O 3.31Å; S2646-T2648 WeakPolarHBondContact CB-O 3.35Å; S2646-T2648 PolarHBondContact O-N 3.08Å; S2646-T2648 PolarHBondContact OG-O 3.12Å; T2648-N2650 PolarHBondContact O-N 3.12Å; T2648-N2650 VanDerWaalsContact O-N 3.09Å
2649A67.2Low83.6Confident32 Ų3226.6 Ų26.626%0.26416%0.157SC..  trans-57.1116.9178.500000111.8L2651 N2685 L2688A2649-L2651 PolarHBondContact O-N 2.97Å; A2649-N2685 VanDerWaalsContact CA-OD1 3.28Å; A2649-N2685 WeakPolarHBondContact CA-OD1 3.32Å; A2649-N2685 HydrophobicContact CB-CB 4.27Å; A2649-N2685 PolarHBondContact N-OD1 3.41Å; A2649-L2688 HydrophobicContact CB-CD1 3.51Å; A2649-L2688 VanDerWaalsContact CB-CD1 3.49Å; A2649-L2688 HydrophobicContact CB-CG 4.1Å
2650N75.4Confident83.3Confident18.5 Ų18.526.6 Ų26.610%0.09916%0.157CC..  trans-94.493.1179.1-1769000111.2R2530 Q2534 T2648 Q2652 D2653 S2654R2530-N2650 PolarHBondContact NH2-ND2 3.31Å; R2530-N2650 VanDerWaalsContact NH2-ND2 3.17Å; Q2534-N2650 PolarHBondContact NE2-ND2 3.23Å; T2648-N2650 PolarHBondContact O-N 3.12Å; T2648-N2650 VanDerWaalsContact O-N 3.09Å; N2650-Q2652 VanDerWaalsContact C-N 3.32Å; N2650-Q2652 PolarHBondContact O-N 2.99Å; N2650-Q2652 VanDerWaalsContact O-N 3.12Å; N2650-Q2652 WeakPolarHBondContact OD1-CB 3.24Å; N2650-Q2652 PolarHBondContact OD1-N 3.29Å; N2650-Q2652 VanDerWaalsContact OD1-N 3.13Å; N2650-D2653 HydrophobicContact CB-CB 4.43Å; N2650-D2653 PolarHBondContact ND2-OD1 3Å; N2650-D2653 PolarHBondContact ND2-OD2 3.11Å; N2650-D2653 PolarHBondContact O-N 3.21Å; N2650-D2653 VanDerWaalsContact O-N 3.16Å; N2650-D2653 PolarHBondContact OD1-N 3Å; N2650-S2654 WeakPolarHBondContact O-CB 3.25Å; N2650-S2654 PolarHBondContact O-N 3.01Å; N2650-S2654 VanDerWaalsContact O-N 3.11Å; N2650-S2654 PolarHBondContact O-OG 3.18Å
2651L76.2Confident83.1Confident20.25 Ų20.2526.9 Ų26.911%0.10616%0.158CC..Hα-helixtrans-51.9-38.5178.3-179.756.9000113.1A2649 S2654 L2655 L2688 V2689 L2957A2649-L2651 PolarHBondContact O-N 2.97Å; L2651-S2654 PolarHBondContact O-N 3.38Å; L2651-L2655 HydrophobicContact CD1-CD1 3.75Å; L2651-L2655 HydrophobicContact CD1-CD2 4.32Å; L2651-L2655 HydrophobicContact CD1-CG 3.83Å; L2651-L2655 HydrophobicContact CG-CD1 3.84Å; L2651-L2655 HydrophobicContact CG-CG 4.36Å; L2651-L2655 WeakPolarHBondContact O-CB 3.37Å; L2651-L2655 WeakPolarHBondContact O-CD1 3.31Å; L2651-L2655 VanDerWaalsContact O-CG 3.26Å; L2651-L2655 WeakPolarHBondContact O-CG 3.36Å; L2651-L2655 PolarHBondContact O-N 3.13Å; L2651-L2688 HydrophobicContact CB-CD1 4.19Å; L2651-L2688 HydrophobicContact CD1-CB 4.12Å; L2651-V2689 HydrophobicContact CD1-CG1 3.49Å; L2651-V2689 VanDerWaalsContact CD1-CG1 3.41Å; L2651-L2957 HydrophobicContact CB-CD1 4.4Å; L2651-L2957 HydrophobicContact CD2-CB 3.82Å; L2651-L2957 HydrophobicContact CD2-CD1 3.95Å; L2651-L2957 HydrophobicContact CD2-CG 4.33Å; L2651-L2957 HydrophobicContact CG-CD1 4.25Å
2652Q77.9Confident82.7Confident41 Ų4127.1 Ų27.119%0.19216%0.157CC..Hα-helixtrans-64-47.5-177-118.7-169.3-2.700112.6N2650 R2656 L2957 L2961 N3163 S3166N2650-Q2652 VanDerWaalsContact C-N 3.32Å; N2650-Q2652 PolarHBondContact O-N 2.99Å; N2650-Q2652 VanDerWaalsContact O-N 3.12Å; N2650-Q2652 WeakPolarHBondContact OD1-CB 3.24Å; N2650-Q2652 PolarHBondContact OD1-N 3.29Å; N2650-Q2652 VanDerWaalsContact OD1-N 3.13Å; Q2652-R2656 VanDerWaalsContact CD-NH1 3.3Å; Q2652-R2656 VanDerWaalsContact CG-NH1 3.26Å; Q2652-R2656 VanDerWaalsContact NE2-NH1 3.16Å; Q2652-R2656 WeakPolarHBondContact O-CG 3.43Å; Q2652-R2656 PolarHBondContact O-N 3.24Å; Q2652-L2957 HydrophobicContact CG-CD1 4.41Å; Q2652-L2961 VanDerWaalsContact NE2-CD2 3.34Å; Q2652-N3163 PolarHBondContact NE2-OD1 3.3Å; Q2652-S3166 WeakPolarHBondContact CB-OG 3.29Å; Q2652-S3166 VanDerWaalsContact CG-OG 3.29Å; Q2652-S3166 WeakPolarHBondContact CG-OG 3.31Å; Q2652-S3166 PolarHBondContact NE2-OG 3.2Å
2653D83.3Confident82.2Confident0 Ų030.4 Ų30.40%017%0.172CC..Hα-helixtrans-74.1-37.4-177.9-66.7-10.9000110.6R2530 Q2534 F2639 S2642 I2643 N2650 L2655 R2656 L2657R2530-D2653 IonicContact NE-OD2 3.22Å; Q2534-D2653 WeakPolarHBondContact CG-OD2 3.38Å; Q2534-D2653 VanDerWaalsContact NE2-CG 3.34Å; Q2534-D2653 PolarHBondContact NE2-OD1 2.89Å; Q2534-D2653 PolarHBondContact NE2-OD2 3.26Å; Q2534-D2653 VanDerWaalsContact NE2-OD2 3.14Å; F2639-D2653 HydrophobicContact CD1-CB 3.8Å; F2639-D2653 HydrophobicContact CE1-CB 4.4Å; S2642-D2653 WeakPolarHBondContact CB-OD2 3.38Å; S2642-D2653 PolarHBondContact OG-OD2 3.23Å; I2643-D2653 HydrophobicContact CD1-CB 4.08Å; I2643-D2653 HydrophobicContact CG1-CB 3.7Å; N2650-D2653 HydrophobicContact CB-CB 4.43Å; N2650-D2653 PolarHBondContact ND2-OD1 3Å; N2650-D2653 PolarHBondContact ND2-OD2 3.11Å; N2650-D2653 PolarHBondContact O-N 3.21Å; N2650-D2653 VanDerWaalsContact O-N 3.16Å; N2650-D2653 PolarHBondContact OD1-N 3Å; D2653-L2655 VanDerWaalsContact C-N 3.34Å; D2653-L2655 PolarHBondContact O-N 3.12Å; D2653-R2656 PolarHBondContact O-N 2.96Å; D2653-R2656 IonicContact OD1-NH1 2.92Å; D2653-L2657 WeakPolarHBondContact O-CB 3.3Å; D2653-L2657 PolarHBondContact O-N 3.05Å
2654S86.9Confident81.9Confident1 Ų130.7 Ų30.71%0.00717%0.173CC..Hα-helixtrans-59.5-43.1174.7-61.70000112.2N2650 L2651 R2656 L2657 I2658N2650-S2654 WeakPolarHBondContact O-CB 3.25Å; N2650-S2654 PolarHBondContact O-N 3.01Å; N2650-S2654 VanDerWaalsContact O-N 3.11Å; N2650-S2654 PolarHBondContact O-OG 3.18Å; L2651-S2654 PolarHBondContact O-N 3.38Å; S2654-R2656 PolarHBondContact O-N 2.99Å; S2654-L2657 PolarHBondContact O-N 3.07Å; S2654-I2658 WeakPolarHBondContact O-CB 3.36Å; S2654-I2658 VanDerWaalsContact O-CG1 3.27Å; S2654-I2658 WeakPolarHBondContact O-CG1 3.36Å; S2654-I2658 PolarHBondContact O-N 3.3Å
2655L81.9Confident81.5Confident20.5 Ų20.528.9 Ų28.911%0.10716%0.16CC..Hα-helixtrans-65.6-39.5177-71.6169.5000112.7L2651 D2653 I2658 N2659 V2689 Q2692 A3169 V3170L2651-L2655 HydrophobicContact CD1-CD1 3.75Å; L2651-L2655 HydrophobicContact CD1-CD2 4.32Å; L2651-L2655 HydrophobicContact CD1-CG 3.83Å; L2651-L2655 HydrophobicContact CG-CD1 3.84Å; L2651-L2655 HydrophobicContact CG-CG 4.36Å; L2651-L2655 WeakPolarHBondContact O-CB 3.37Å; L2651-L2655 WeakPolarHBondContact O-CD1 3.31Å; L2651-L2655 VanDerWaalsContact O-CG 3.26Å; L2651-L2655 WeakPolarHBondContact O-CG 3.36Å; L2651-L2655 PolarHBondContact O-N 3.13Å; D2653-L2655 VanDerWaalsContact C-N 3.34Å; D2653-L2655 PolarHBondContact O-N 3.12Å; L2655-I2658 PolarHBondContact O-N 3.03Å; L2655-N2659 PolarHBondContact O-N 3.29Å; L2655-V2689 HydrophobicContact CD2-CG1 3.89Å; L2655-V2689 HydrophobicContact CG-CG1 4.17Å; L2655-Q2692 HydrophobicContact CD2-CB 4.37Å; L2655-Q2692 HydrophobicContact CD2-CG 3.75Å; L2655-A3169 HydrophobicContact CB-CB 4.04Å; L2655-A3169 HydrophobicContact CD1-CB 4.3Å; L2655-V3170 HydrophobicContact CD1-CG2 3.45Å
2656R84Confident81.1Confident23 Ų2329.5 Ų29.59%0.08716%0.161CC..Hα-helixtrans-66.4-42.5176.5-70.9178.8-179.1132.7-6.4111.8M2538 Y2541 F2639 Q2652 D2653 S2654 I2658 N2659 L2660M2538-R2656 PolarHBondContact SD-NE 2.82Å; M2538-R2656 VanDerWaalsContact SD-NE 3.44Å; M2538-R2656 PolarHBondContact SD-NH1 3.04Å; M2538-R2656 PolarHBondContact SD-NH2 2.96Å; Y2541-R2656 HydrophobicContact CD1-CG 4.49Å; Y2541-R2656 HydrophobicContact CE1-CG 4.12Å; Y2541-R2656 HydrophobicContact CE2-CB 4.42Å; Y2541-R2656 HydrophobicContact CE2-CG 4.49Å; F2639-R2656 HydrophobicContact CD2-CB 4.28Å; F2639-R2656 HydrophobicContact CE1-CB 4.22Å; F2639-R2656 HydrophobicContact CE2-CB 3.84Å; F2639-R2656 HydrophobicContact CZ-CB 3.83Å; F2639-R2656 VanDerWaalsContact CZ-CD 3.46Å; F2639-R2656 HydrophobicContact CZ-CG 4.28Å; Q2652-R2656 VanDerWaalsContact CD-NH1 3.3Å; Q2652-R2656 VanDerWaalsContact CG-NH1 3.26Å; Q2652-R2656 VanDerWaalsContact NE2-NH1 3.16Å; Q2652-R2656 WeakPolarHBondContact O-CG 3.43Å; Q2652-R2656 PolarHBondContact O-N 3.24Å; D2653-R2656 PolarHBondContact O-N 2.96Å; D2653-R2656 IonicContact OD1-NH1 2.92Å; S2654-R2656 PolarHBondContact O-N 2.99Å; R2656-I2658 VanDerWaalsContact C-N 3.32Å; R2656-I2658 PolarHBondContact O-N 3.13Å; R2656-N2659 WeakPolarHBondContact O-CB 3.37Å; R2656-N2659 PolarHBondContact O-N 3.05Å; R2656-L2660 WeakPolarHBondContact O-CG 3.34Å; R2656-L2660 PolarHBondContact O-N 3.08Å
2657L89Confident81.2Confident6.5 Ų6.531.1 Ų31.13%0.03417%0.169CC..Hα-helixtrans-60-42174.2179.857.9000111.6V2636 F2639 V2640 I2643 D2653 S2654 N2659 L2660 L2661 I2674 I2681 W2686V2636-L2657 HydrophobicContact CB-CD1 4.4Å; V2636-L2657 HydrophobicContact CG1-CD1 3.83Å; V2636-L2657 HydrophobicContact CG2-CD1 4.39Å; F2639-L2657 HydrophobicContact CB-CB 4.23Å; F2639-L2657 HydrophobicContact CB-CD1 4.41Å; V2640-L2657 HydrophobicContact CG2-CD1 4.2Å; V2640-L2657 HydrophobicContact CG2-CD2 4.02Å; I2643-L2657 HydrophobicContact CD1-CB 4.31Å; I2643-L2657 HydrophobicContact CD1-CD2 3.72Å; D2653-L2657 WeakPolarHBondContact O-CB 3.3Å; D2653-L2657 PolarHBondContact O-N 3.05Å; S2654-L2657 PolarHBondContact O-N 3.07Å; L2657-N2659 VanDerWaalsContact C-N 3.35Å; L2657-N2659 PolarHBondContact O-N 2.98Å; L2657-L2660 PolarHBondContact O-N 3.42Å; L2657-L2661 WeakPolarHBondContact O-CB 3.49Å; L2657-L2661 PolarHBondContact O-N 3.14Å; L2657-I2674 HydrophobicContact CD1-CG1 4.41Å; L2657-I2681 HydrophobicContact CD2-CD1 4.05Å; L2657-W2686 HydrophobicContact CD2-CH2 3.89Å; L2657-W2686 HydrophobicContact CD2-CZ2 4.49Å
2658I85.6Confident81.6Confident9 Ų929.9 Ų29.95%0.04616%0.16CC..Hα-helixtrans-63.9-41.5174.9-73.2170.1000111.7S2654 L2655 R2656 L2660 L2661 F2662 W2686 V2689 L2693S2654-I2658 WeakPolarHBondContact O-CB 3.36Å; S2654-I2658 VanDerWaalsContact O-CG1 3.27Å; S2654-I2658 WeakPolarHBondContact O-CG1 3.36Å; S2654-I2658 PolarHBondContact O-N 3.3Å; L2655-I2658 PolarHBondContact O-N 3.03Å; R2656-I2658 VanDerWaalsContact C-N 3.32Å; R2656-I2658 PolarHBondContact O-N 3.13Å; I2658-L2660 VanDerWaalsContact C-N 3.35Å; I2658-L2660 PolarHBondContact O-N 3.08Å; I2658-L2661 WeakPolarHBondContact O-CB 3.45Å; I2658-L2661 PolarHBondContact O-N 3Å; I2658-F2662 HydrophobicContact CG2-CD2 3.69Å; I2658-F2662 HydrophobicContact CG2-CE1 4.06Å; I2658-F2662 HydrophobicContact CG2-CE2 3.27Å; I2658-F2662 VanDerWaalsContact CG2-CE2 3.41Å; I2658-F2662 HydrophobicContact CG2-CZ 3.89Å; I2658-F2662 WeakPolarHBondContact O-CD2 3.33Å; I2658-F2662 VanDerWaalsContact O-CG 3.28Å; I2658-F2662 WeakPolarHBondContact O-CG 3.42Å; I2658-F2662 PolarHBondContact O-N 2.87Å; I2658-W2686 HydrophobicContact CD1-CE3 4.39Å; I2658-W2686 HydrophobicContact CD1-CZ3 4.13Å; I2658-W2686 HydrophobicContact CG1-CZ3 4.1Å; I2658-V2689 HydrophobicContact CD1-CB 3.68Å; I2658-V2689 HydrophobicContact CD1-CG1 4.15Å; I2658-V2689 HydrophobicContact CD1-CG2 3.65Å; I2658-L2693 HydrophobicContact CD1-CD2 3.85Å; I2658-L2693 HydrophobicContact CD1-CG 4.05Å; I2658-L2693 HydrophobicContact CG1-CD2 4.04Å; I2658-L2693 HydrophobicContact CG2-CD2 4.29Å
2659N83.2Confident82.1Confident32.25 Ų32.2531.2 Ų31.217%0.17216%0.159CC..Hα-helixtrans-61.6-45.2176.3-164.8-18000111.3Y2541 L2655 R2656 L2657 L2661 F2662 K2663Y2541-N2659 PolarHBondContact OH-ND2 2.9Å; Y2541-N2659 VanDerWaalsContact OH-ND2 3.09Å; L2655-N2659 PolarHBondContact O-N 3.29Å; R2656-N2659 WeakPolarHBondContact O-CB 3.37Å; R2656-N2659 PolarHBondContact O-N 3.05Å; L2657-N2659 VanDerWaalsContact C-N 3.35Å; L2657-N2659 PolarHBondContact O-N 2.98Å; N2659-L2661 PolarHBondContact O-N 3.39Å; N2659-F2662 PolarHBondContact O-N 3.02Å; N2659-K2663 PolarHBondContact O-N 3.22Å; N2659-K2663 WeakPolarHBondContact OD1-CE 3.37Å
2660L85.9Confident82.9Confident0.75 Ų0.7529.8 Ų29.80%0.00415%0.147CC..Hα-helixtrans-61.7-41.8175.3-69.3170.6000112.3Y2541 F2544 V2636 F2639 R2656 L2657 I2658 F2662 K2663 F2664Y2541-L2660 HydrophobicContact CD2-CD1 4.14Å; Y2541-L2660 HydrophobicContact CD2-CD2 4.08Å; Y2541-L2660 HydrophobicContact CD2-CG 4.22Å; Y2541-L2660 HydrophobicContact CE2-CD1 4.41Å; Y2541-L2660 HydrophobicContact CE2-CD2 4.07Å; Y2541-L2660 HydrophobicContact CE2-CG 4.1Å; F2544-L2660 HydrophobicContact CD1-CD2 4.31Å; F2544-L2660 HydrophobicContact CD2-CD2 3.75Å; F2544-L2660 HydrophobicContact CE1-CD2 4.4Å; F2544-L2660 HydrophobicContact CE2-CD2 3.64Å; F2544-L2660 HydrophobicContact CZ-CD2 4.38Å; V2636-L2660 HydrophobicContact CG2-CB 3.88Å; V2636-L2660 HydrophobicContact CG2-CD1 3.83Å; V2636-L2660 HydrophobicContact CG2-CG 4.43Å; F2639-L2660 HydrophobicContact CD2-CD1 3.87Å; F2639-L2660 HydrophobicContact CE2-CD1 4Å; R2656-L2660 WeakPolarHBondContact O-CG 3.34Å; R2656-L2660 PolarHBondContact O-N 3.08Å; L2657-L2660 PolarHBondContact O-N 3.42Å; I2658-L2660 VanDerWaalsContact C-N 3.35Å; I2658-L2660 PolarHBondContact O-N 3.08Å; L2660-F2662 PolarHBondContact O-N 3.31Å; L2660-K2663 PolarHBondContact O-N 3.18Å; L2660-F2664 HydrophobicContact CD2-CD2 4.06Å; L2660-F2664 HydrophobicContact CD2-CE2 4.06Å; L2660-F2664 WeakPolarHBondContact O-CB 3.28Å; L2660-F2664 PolarHBondContact O-N 3.26Å
2661L87.5Confident83.3Confident12.25 Ų12.2530.7 Ų30.76%0.06415%0.149CC..Hα-helixtrans-57.8-47.6173.5172.559.6000111.5L2657 I2658 N2659 K2663 G2665 I2674 V2704 I2707 I2708L2657-L2661 WeakPolarHBondContact O-CB 3.49Å; L2657-L2661 PolarHBondContact O-N 3.14Å; I2658-L2661 WeakPolarHBondContact O-CB 3.45Å; I2658-L2661 PolarHBondContact O-N 3Å; N2659-L2661 PolarHBondContact O-N 3.39Å; L2661-K2663 PolarHBondContact O-N 3.49Å; L2661-G2665 VanDerWaalsContact O-CA 3.26Å; L2661-G2665 WeakPolarHBondContact O-CA 3.35Å; L2661-G2665 PolarHBondContact O-N 2.95Å; L2661-I2674 HydrophobicContact CB-CD1 3.89Å; L2661-I2674 HydrophobicContact CD1-CD1 3.66Å; L2661-I2674 HydrophobicContact CD1-CG2 4.43Å; L2661-I2674 HydrophobicContact CG-CD1 4.31Å; L2661-V2704 HydrophobicContact CD1-CG1 4.21Å; L2661-V2704 HydrophobicContact CD1-CG2 4.36Å; L2661-V2704 HydrophobicContact CD2-CG1 4.43Å; L2661-V2704 HydrophobicContact CG-CG1 4.12Å; L2661-I2707 HydrophobicContact CD1-CD1 4.27Å; L2661-I2707 HydrophobicContact CD1-CG2 4.34Å; L2661-I2707 HydrophobicContact CD2-CG2 4.3Å; L2661-I2708 HydrophobicContact CD2-CD1 4.42Å; L2661-I2708 HydrophobicContact CD2-CG1 4.17Å
2662F82.5Confident83.8Confident28.5 Ų28.534.3 Ų34.313%0.12517%0.165CC..Hα-helixtrans-66.8-39-179.6-72.4-48.6000113I2658 N2659 L2660 R2696 T2699 R2701 V2704 I2708I2658-F2662 HydrophobicContact CG2-CD2 3.69Å; I2658-F2662 HydrophobicContact CG2-CE1 4.06Å; I2658-F2662 HydrophobicContact CG2-CE2 3.27Å; I2658-F2662 VanDerWaalsContact CG2-CE2 3.41Å; I2658-F2662 HydrophobicContact CG2-CZ 3.89Å; I2658-F2662 WeakPolarHBondContact O-CD2 3.33Å; I2658-F2662 VanDerWaalsContact O-CG 3.28Å; I2658-F2662 WeakPolarHBondContact O-CG 3.42Å; I2658-F2662 PolarHBondContact O-N 2.87Å; N2659-F2662 PolarHBondContact O-N 3.02Å; L2660-F2662 PolarHBondContact O-N 3.31Å; F2662-R2696 HydrophobicContact CD1-CB 4.41Å; F2662-R2696 HydrophobicContact CD2-CG 4.28Å; F2662-R2696 HydrophobicContact CE1-CB 3.61Å; F2662-R2696 VanDerWaalsContact CE1-CB 3.46Å; F2662-R2696 HydrophobicContact CE1-CG 4.03Å; F2662-R2696 HydrophobicContact CE2-CB 4.15Å; F2662-R2696 HydrophobicContact CE2-CG 3.82Å; F2662-R2696 VanDerWaalsContact CE2-CG 3.49Å; F2662-R2696 HydrophobicContact CZ-CB 3.39Å; F2662-R2696 HydrophobicContact CZ-CG 3.57Å; F2662-R2696 VanDerWaalsContact CZ-CG 3.45Å; F2662-T2699 HydrophobicContact CE1-CG2 4.29Å; F2662-R2701 PolarHBondContact O-NH1 3.11Å; F2662-V2704 HydrophobicContact CD1-CG1 4.02Å; F2662-V2704 HydrophobicContact CE1-CG1 4.15Å; F2662-I2708 HydrophobicContact CD1-CD1 4.27Å; F2662-I2708 HydrophobicContact CE1-CD1 3.48Å; F2662-I2708 HydrophobicContact CE1-CG1 4.42Å; F2662-I2708 HydrophobicContact CE2-CD1 4.31Å; F2662-I2708 HydrophobicContact CZ-CD1 3.58Å; F2662-I2708 VanDerWaalsContact CZ-CD1 3.43Å
2663K81.4Confident84.2Confident71 Ų7133.8 Ų33.831%0.30917%0.165SC..Hα-helixtrans-73.3-47.8179.2-73.5-172.5176.1-1730112.4F2544 D2548 N2659 L2660 L2661 H2666 R2701F2544-K2663 HydrophobicContact CE1-CD 4.42Å; F2544-K2663 HydrophobicContact CE2-CD 4.32Å; F2544-K2663 HydrophobicContact CZ-CD 3.6Å; D2548-K2663 IonicContact OD1-NZ 2.92Å; D2548-K2663 IonicContact OD2-NZ 3.59Å; D2548-K2663 PolarHBondContact OD2-NZ 3.06Å; N2659-K2663 PolarHBondContact O-N 3.22Å; N2659-K2663 WeakPolarHBondContact OD1-CE 3.37Å; L2660-K2663 PolarHBondContact O-N 3.18Å; L2661-K2663 PolarHBondContact O-N 3.49Å; K2663-H2666 PolarHBondContact O-CE1 3.22Å; K2663-H2666 VanDerWaalsContact O-CE1 3.23Å; K2663-H2666 PolarHBondContact O-ND1 3.33Å; K2663-H2666 VanDerWaalsContact O-ND1 3.14Å; K2663-R2701 PolarHBondContact O-NH1 3.04Å
2664F83.2Confident84.4Confident6.25 Ų6.2534.1 Ų34.13%0.02717%0.167CC..Hα-helixtrans-116.3-1.1-167.1-60.3-75.4000116.1F2544 M2628 E2629 A2632 L2660 H2666 L2667 I2670F2544-F2664 HydrophobicContact CD1-CE2 4.08Å; F2544-F2664 HydrophobicContact CD1-CZ 4.03Å; F2544-F2664 AromaticContact CD2-CE2 3.7Å; F2544-F2664 HydrophobicContact CD2-CE2 3.7Å; F2544-F2664 AromaticContact CD2-CZ 3.66Å; F2544-F2664 HydrophobicContact CD2-CZ 3.66Å; F2544-F2664 HydrophobicContact CE1-CE2 4.21Å; F2544-F2664 HydrophobicContact CE1-CZ 4.28Å; F2544-F2664 AromaticContact CE2-CE2 3.4Å; F2544-F2664 HydrophobicContact CE2-CE2 3.4Å; F2544-F2664 VanDerWaalsContact CE2-CE2 3.47Å; F2544-F2664 AromaticContact CE2-CZ 3.42Å; F2544-F2664 HydrophobicContact CE2-CZ 3.42Å; F2544-F2664 VanDerWaalsContact CE2-CZ 3.42Å; F2544-F2664 HydrophobicContact CG-CE2 4.29Å; F2544-F2664 AromaticContact CZ-CE2 3.96Å; F2544-F2664 HydrophobicContact CZ-CE2 3.99Å; F2544-F2664 HydrophobicContact CZ-CZ 4.39Å; M2628-F2664 HydrophobicContact CB-CE1 4.14Å; M2628-F2664 HydrophobicContact CB-CZ 4.1Å; M2628-F2664 HydrophobicContact CE-CE1 3.83Å; M2628-F2664 HydrophobicContact CE-CZ 4.03Å; E2629-F2664 HydrophobicContact CG-CD1 4.15Å; E2629-F2664 HydrophobicContact CG-CE1 4.26Å; A2632-F2664 HydrophobicContact CB-CD1 4.43Å; A2632-F2664 HydrophobicContact CB-CD2 3.92Å; A2632-F2664 HydrophobicContact CB-CE1 4.49Å; A2632-F2664 HydrophobicContact CB-CE2 4.09Å; A2632-F2664 HydrophobicContact CB-CG 4.13Å; A2632-F2664 HydrophobicContact CB-CZ 4.35Å; L2660-F2664 HydrophobicContact CD2-CD2 4.06Å; L2660-F2664 HydrophobicContact CD2-CE2 4.06Å; L2660-F2664 WeakPolarHBondContact O-CB 3.28Å; L2660-F2664 PolarHBondContact O-N 3.26Å; F2664-H2666 PolarHBondContact O-N 3.34Å; F2664-L2667 HydrophobicContact CB-CD1 4.28Å; F2664-L2667 HydrophobicContact CD1-CD1 4.11Å; F2664-L2667 WeakPolarHBondContact O-CB 3.37Å; F2664-L2667 PolarHBondContact O-N 3.13Å; F2664-I2670 HydrophobicContact CB-CD1 3.48Å; F2664-I2670 HydrophobicContact CB-CG2 4.22Å; F2664-I2670 HydrophobicContact CG-CD1 4.18Å
2665G80.4Confident84.4Confident0 Ų039.8 Ų39.80%019%0.188CC..THydrogen-bonded Turntrans-64.55.5-178.100000116.5L2661 R2671L2661-G2665 VanDerWaalsContact O-CA 3.26Å; L2661-G2665 WeakPolarHBondContact O-CA 3.35Å; L2661-G2665 PolarHBondContact O-N 2.95Å; G2665-R2671 WeakPolarHBondContact O-CD 3.31Å; G2665-R2671 VanDerWaalsContact O-CG 3.3Å; G2665-R2671 WeakPolarHBondContact O-CG 3.43Å
2666H81.1Confident84.6Confident81.25 Ų81.2543.9 Ų43.938%0.37621%0.207SC..THydrogen-bonded Turntrans-80.6-23.416758.2-80000112.3K2663 F2664 R2671 R2701K2663-H2666 PolarHBondContact O-CE1 3.22Å; K2663-H2666 VanDerWaalsContact O-CE1 3.23Å; K2663-H2666 PolarHBondContact O-ND1 3.33Å; K2663-H2666 VanDerWaalsContact O-ND1 3.14Å; F2664-H2666 PolarHBondContact O-N 3.34Å; H2666-R2671 PolarHBondContact O-NH1 2.84Å; H2666-R2701 PolarHBondContact ND1-NH1 3.16Å
2667L84.3Confident84.6Confident38.25 Ų38.2542.9 Ų42.920%0.220%0.203CC..SBendtrans-80134-179-59.7170.3000111.2E2629 F2664 E2669 I2670 R2671E2629-L2667 HydrophobicContact CB-CD1 4.23Å; E2629-L2667 HydrophobicContact CG-CD1 3.54Å; E2629-L2667 VanDerWaalsContact CG-CD1 3.47Å; E2629-L2667 HydrophobicContact CG-CD2 4.14Å; F2664-L2667 HydrophobicContact CB-CD1 4.28Å; F2664-L2667 HydrophobicContact CD1-CD1 4.11Å; F2664-L2667 WeakPolarHBondContact O-CB 3.37Å; F2664-L2667 PolarHBondContact O-N 3.13Å; L2667-E2669 PolarHBondContact O-N 3.27Å; L2667-I2670 HydrophobicContact CB-CB 4.45Å; L2667-I2670 HydrophobicContact CB-CD1 4.34Å; L2667-I2670 HydrophobicContact CB-CG1 4.42Å; L2667-I2670 HydrophobicContact CD1-CD1 3.98Å; L2667-I2670 PolarHBondContact O-N 3.2Å; L2667-R2671 WeakPolarHBondContact O-CB 3.31Å; L2667-R2671 VanDerWaalsContact O-CG 3.25Å; L2667-R2671 WeakPolarHBondContact O-CG 3.37Å; L2667-R2671 PolarHBondContact O-N 2.79Å; L2667-R2671 VanDerWaalsContact O-N 3.13Å; L2667-R2671 PolarHBondContact O-NE 3.09Å
2668T84.3Confident84.4Confident86.25 Ų86.2544.2 Ų44.253%0.52921%0.21SC..Hα-helixtrans-59.5-48.1-176.2-44.90000112.9I2670 R2671 E2672T2668-I2670 VanDerWaalsContact C-N 3.35Å; T2668-I2670 PolarHBondContact O-N 2.9Å; T2668-R2671 VanDerWaalsContact CG2-NH2 3.35Å; T2668-R2671 WeakPolarHBondContact O-CB 3.35Å; T2668-R2671 PolarHBondContact O-N 3.32Å; T2668-R2671 VanDerWaalsContact O-N 3.08Å; T2668-R2671 PolarHBondContact OG1-NH1 2.86Å; T2668-R2671 PolarHBondContact OG1-NH2 3.07Å; T2668-E2672 HydrophobicContact CG2-CG 4.42Å; T2668-E2672 WeakPolarHBondContact O-CG 3.4Å; T2668-E2672 PolarHBondContact O-N 2.93Å
2669E83.4Confident84.4Confident126.75 Ų126.7549.5 Ų49.559%0.59224%0.243SC*.Hα-helixtrans-56.4-48.8-179.1-174.6-176.4176.700111.9A2633 L2667 R2671 E2672 V2673A2633-E2669 VanDerWaalsContact CB-CD 3.44Å; A2633-E2669 HydrophobicContact CB-CG 4.06Å; A2633-E2669 WeakPolarHBondContact CB-OE1 3.33Å; L2667-E2669 PolarHBondContact O-N 3.27Å; E2669-R2671 VanDerWaalsContact C-N 3.34Å; E2669-R2671 PolarHBondContact O-N 3.28Å; E2669-E2672 PolarHBondContact O-N 3.11Å; E2669-V2673 VanDerWaalsContact O-CG2 3.31Å; E2669-V2673 WeakPolarHBondContact O-CG2 3.45Å; E2669-V2673 PolarHBondContact O-N 3.06Å
2670I84Confident84.7Confident2.75 Ų2.7552.7 Ų52.71%0.01426%0.255CS..Hα-helixtrans-67.1-37.2-179.8-68.5169000111.2A2632 A2633 V2636 F2664 L2667 T2668 E2672 V2673 I2674A2632-I2670 HydrophobicContact CB-CD1 3.56Å; A2632-I2670 VanDerWaalsContact CB-CD1 3.44Å; A2632-I2670 HydrophobicContact CB-CG1 4.34Å; A2633-I2670 HydrophobicContact CB-CG1 4.1Å; V2636-I2670 HydrophobicContact CG2-CG2 4.21Å; F2664-I2670 HydrophobicContact CB-CD1 3.48Å; F2664-I2670 HydrophobicContact CB-CG2 4.22Å; F2664-I2670 HydrophobicContact CG-CD1 4.18Å; L2667-I2670 HydrophobicContact CB-CB 4.45Å; L2667-I2670 HydrophobicContact CB-CD1 4.34Å; L2667-I2670 HydrophobicContact CB-CG1 4.42Å; L2667-I2670 HydrophobicContact CD1-CD1 3.98Å; L2667-I2670 PolarHBondContact O-N 3.2Å; T2668-I2670 VanDerWaalsContact C-N 3.35Å; T2668-I2670 PolarHBondContact O-N 2.9Å; I2670-E2672 VanDerWaalsContact C-N 3.31Å; I2670-E2672 PolarHBondContact O-N 3.14Å; I2670-V2673 PolarHBondContact O-N 3.41Å; I2670-I2674 HydrophobicContact CG2-CD1 3.63Å; I2670-I2674 HydrophobicContact CG2-CG1 4.25Å; I2670-I2674 WeakPolarHBondContact O-CB 3.39Å; I2670-I2674 WeakPolarHBondContact O-CG1 3.35Å; I2670-I2674 PolarHBondContact O-N 3.05Å
2671R84Confident84.9Confident37.75 Ų37.7552.9 Ų52.914%0.14226%0.257CS..Hα-helixtrans-60.6-45.1175.4-126.7179.78.8-126.9-3.8111.8G2665 H2666 L2667 T2668 E2669 I2674 R2675 I2707G2665-R2671 WeakPolarHBondContact O-CD 3.31Å; G2665-R2671 VanDerWaalsContact O-CG 3.3Å; G2665-R2671 WeakPolarHBondContact O-CG 3.43Å; H2666-R2671 PolarHBondContact O-NH1 2.84Å; L2667-R2671 WeakPolarHBondContact O-CB 3.31Å; L2667-R2671 VanDerWaalsContact O-CG 3.25Å; L2667-R2671 WeakPolarHBondContact O-CG 3.37Å; L2667-R2671 PolarHBondContact O-N 2.79Å; L2667-R2671 VanDerWaalsContact O-N 3.13Å; L2667-R2671 PolarHBondContact O-NE 3.09Å; T2668-R2671 VanDerWaalsContact CG2-NH2 3.35Å; T2668-R2671 WeakPolarHBondContact O-CB 3.35Å; T2668-R2671 PolarHBondContact O-N 3.32Å; T2668-R2671 VanDerWaalsContact O-N 3.08Å; T2668-R2671 PolarHBondContact OG1-NH1 2.86Å; T2668-R2671 PolarHBondContact OG1-NH2 3.07Å; E2669-R2671 VanDerWaalsContact C-N 3.34Å; E2669-R2671 PolarHBondContact O-N 3.28Å; R2671-I2674 PolarHBondContact O-N 3.04Å; R2671-R2675 WeakPolarHBondContact O-CB 3.25Å; R2671-R2675 WeakPolarHBondContact O-CG 3.35Å; R2671-R2675 PolarHBondContact O-N 3.24Å; R2671-I2707 HydrophobicContact CB-CD1 4.32Å; R2671-I2707 HydrophobicContact CG-CD1 3.89Å
2672E85.9Confident84.9Confident95.25 Ų95.2558 Ų5845%0.44528%0.275SS..Hα-helixtrans-70.1-42-179.4-60.2-54.9148.800111.6T2668 E2669 I2670 I2674 R2675 E2676T2668-E2672 HydrophobicContact CG2-CG 4.42Å; T2668-E2672 WeakPolarHBondContact O-CG 3.4Å; T2668-E2672 PolarHBondContact O-N 2.93Å; E2669-E2672 PolarHBondContact O-N 3.11Å; I2670-E2672 VanDerWaalsContact C-N 3.31Å; I2670-E2672 PolarHBondContact O-N 3.14Å; E2672-I2674 VanDerWaalsContact C-N 3.31Å; E2672-I2674 PolarHBondContact O-N 3.03Å; E2672-R2675 PolarHBondContact O-N 3.04Å; E2672-R2675 IonicContact OE1-NH1 3.37Å; E2672-R2675 PolarHBondContact OE1-NH1 3.16Å; E2672-R2675 VanDerWaalsContact OE2-CD 3.31Å; E2672-R2675 WeakPolarHBondContact OE2-CD 3.5Å; E2672-R2675 IonicContact OE2-NH1 3.7Å; E2672-E2676 WeakPolarHBondContact O-CB 3.42Å; E2672-E2676 PolarHBondContact O-N 3.15Å
2673V86.3Confident85.2Confident30.25 Ų30.2559.1 Ų59.118%0.18328%0.282CS..Hα-helixtrans-61.7-38.1174176.60000111.6V2636 K2637 E2669 I2670 G2677V2636-V2673 HydrophobicContact CB-CG1 4.34Å; V2636-V2673 HydrophobicContact CG1-CB 4.38Å; V2636-V2673 HydrophobicContact CG1-CG1 3.79Å; K2637-V2673 HydrophobicContact CB-CG1 4.1Å; E2669-V2673 VanDerWaalsContact O-CG2 3.31Å; E2669-V2673 WeakPolarHBondContact O-CG2 3.45Å; E2669-V2673 PolarHBondContact O-N 3.06Å; I2670-V2673 PolarHBondContact O-N 3.41Å; V2673-G2677 WeakPolarHBondContact O-CA 3.25Å; V2673-G2677 PolarHBondContact O-N 3.11Å
2674I86.6Confident85.5Confident6 Ų656.8 Ų56.83%0.03127%0.273CS..Hα-helixtrans-68.2-45.2175.1-70.7173.8000110.7V2636 L2657 L2661 I2670 R2671 E2672 E2676 G2677 L2678 I2707V2636-I2674 HydrophobicContact CG1-CD1 4.28Å; V2636-I2674 HydrophobicContact CG1-CG1 3.55Å; V2636-I2674 VanDerWaalsContact CG1-CG1 3.5Å; L2657-I2674 HydrophobicContact CD1-CG1 4.41Å; L2661-I2674 HydrophobicContact CB-CD1 3.89Å; L2661-I2674 HydrophobicContact CD1-CD1 3.66Å; L2661-I2674 HydrophobicContact CD1-CG2 4.43Å; L2661-I2674 HydrophobicContact CG-CD1 4.31Å; I2670-I2674 HydrophobicContact CG2-CD1 3.63Å; I2670-I2674 HydrophobicContact CG2-CG1 4.25Å; I2670-I2674 WeakPolarHBondContact O-CB 3.39Å; I2670-I2674 WeakPolarHBondContact O-CG1 3.35Å; I2670-I2674 PolarHBondContact O-N 3.05Å; R2671-I2674 PolarHBondContact O-N 3.04Å; E2672-I2674 VanDerWaalsContact C-N 3.31Å; E2672-I2674 PolarHBondContact O-N 3.03Å; I2674-E2676 PolarHBondContact O-N 3.16Å; I2674-G2677 CarbonylContact O-C 3.41Å; I2674-G2677 WeakPolarHBondContact O-CA 3.3Å; I2674-G2677 PolarHBondContact O-N 3.01Å; I2674-G2677 VanDerWaalsContact O-N 3.12Å; I2674-L2678 HydrophobicContact CG2-CD1 3.94Å; I2674-L2678 HydrophobicContact CG2-CG 4.04Å; I2674-L2678 WeakPolarHBondContact O-CB 3.44Å; I2674-L2678 VanDerWaalsContact O-CG 3.26Å; I2674-L2678 WeakPolarHBondContact O-CG 3.47Å; I2674-L2678 PolarHBondContact O-N 3.12Å; I2674-I2707 HydrophobicContact CG2-CG2 4.21Å
2675R86.9Confident85.7Confident121.75 Ų121.7556.6 Ų56.646%0.45927%0.272SS..Hα-helixtrans-61-45.3178.2-99.7179.1176.8167.2-7.5112.1R2671 E2672 G2677 L2678 T2679 D2710R2671-R2675 WeakPolarHBondContact O-CB 3.25Å; R2671-R2675 WeakPolarHBondContact O-CG 3.35Å; R2671-R2675 PolarHBondContact O-N 3.24Å; E2672-R2675 PolarHBondContact O-N 3.04Å; E2672-R2675 IonicContact OE1-NH1 3.37Å; E2672-R2675 PolarHBondContact OE1-NH1 3.16Å; E2672-R2675 VanDerWaalsContact OE2-CD 3.31Å; E2672-R2675 WeakPolarHBondContact OE2-CD 3.5Å; E2672-R2675 IonicContact OE2-NH1 3.7Å; R2675-G2677 VanDerWaalsContact C-N 3.28Å; R2675-G2677 PolarHBondContact O-N 3.08Å; R2675-L2678 PolarHBondContact O-N 3.34Å; R2675-T2679 PolarHBondContact O-N 3.15Å; R2675-D2710 IonicContact NH2-OD2 2.63Å
2676E86.8Confident86.1Confident106.5 Ų106.556.9 Ų56.950%0.49827%0.273SS..Hα-helixtrans-62-37.9172.9-163.6-156.9167.500111.3E2672 I2674 L2678 T2679 K2680E2672-E2676 WeakPolarHBondContact O-CB 3.42Å; E2672-E2676 PolarHBondContact O-N 3.15Å; I2674-E2676 PolarHBondContact O-N 3.16Å; E2676-L2678 PolarHBondContact O-N 3.32Å; E2676-T2679 PolarHBondContact O-N 3.33Å; E2676-T2679 PolarHBondContact O-OG1 3.35Å; E2676-T2679 VanDerWaalsContact O-OG1 3.13Å; E2676-K2680 WeakPolarHBondContact O-CD 3.32Å; E2676-K2680 WeakPolarHBondContact O-CE 3.47Å; E2676-K2680 WeakPolarHBondContact O-CG 3.34Å; E2676-K2680 PolarHBondContact O-N 3.47Å; E2676-K2680 VanDerWaalsContact OE1-CE 3.29Å; E2676-K2680 WeakPolarHBondContact OE1-CE 3.38Å; E2676-K2680 IonicContact OE1-NZ 3.17Å; E2676-K2680 PolarHBondContact OE1-NZ 3.06Å; E2676-K2680 IonicContact OE2-NZ 3.42Å; E2676-K2680 PolarHBondContact OE2-NZ 3.15Å
2677G84.5Confident86.4Confident1.25 Ų1.2554.4 Ų54.41%0.01326%0.262CS..Hα-helixtrans-69.7-37.3177.900000114.6V2673 I2674 R2675 T2679 K2680 I2681V2673-G2677 WeakPolarHBondContact O-CA 3.25Å; V2673-G2677 PolarHBondContact O-N 3.11Å; I2674-G2677 CarbonylContact O-C 3.41Å; I2674-G2677 WeakPolarHBondContact O-CA 3.3Å; I2674-G2677 PolarHBondContact O-N 3.01Å; I2674-G2677 VanDerWaalsContact O-N 3.12Å; R2675-G2677 VanDerWaalsContact C-N 3.28Å; R2675-G2677 PolarHBondContact O-N 3.08Å; G2677-T2679 VanDerWaalsContact C-N 3.29Å; G2677-T2679 PolarHBondContact O-N 3.06Å; G2677-K2680 PolarHBondContact O-N 3.27Å; G2677-K2680 VanDerWaalsContact O-N 3.14Å; G2677-I2681 VanDerWaalsContact O-CG1 3.28Å; G2677-I2681 WeakPolarHBondContact O-CG1 3.34Å; G2677-I2681 PolarHBondContact O-N 3.13Å; G2677-I2681 VanDerWaalsContact O-N 3.16Å
2678L84.6Confident86.3Confident34.5 Ų34.556.5 Ų56.518%0.18127%0.273CS..Hα-helixtrans-63.5-32.7178.8-73.6175.7000112I2674 R2675 E2676 K2680 W2686 I2707 L2711I2674-L2678 HydrophobicContact CG2-CD1 3.94Å; I2674-L2678 HydrophobicContact CG2-CG 4.04Å; I2674-L2678 WeakPolarHBondContact O-CB 3.44Å; I2674-L2678 VanDerWaalsContact O-CG 3.26Å; I2674-L2678 WeakPolarHBondContact O-CG 3.47Å; I2674-L2678 PolarHBondContact O-N 3.12Å; R2675-L2678 PolarHBondContact O-N 3.34Å; E2676-L2678 PolarHBondContact O-N 3.32Å; L2678-K2680 VanDerWaalsContact C-N 3.34Å; L2678-W2686 HydrophobicContact CD2-CH2 3.93Å; L2678-W2686 HydrophobicContact CD2-CZ2 3.38Å; L2678-W2686 VanDerWaalsContact CD2-CZ2 3.44Å; L2678-I2707 HydrophobicContact CD1-CG2 3.59Å; L2678-L2711 HydrophobicContact CD1-CB 4.46Å; L2678-L2711 HydrophobicContact CD2-CD1 4.19Å; L2678-L2711 HydrophobicContact CD2-CD2 3.98Å; L2678-L2711 HydrophobicContact CD2-CG 4.3Å
2679T86Confident86.4Confident120.5 Ų120.552.3 Ų52.374%0.73925%0.248SC*.Hα-helixtrans-74.8-25.1175.163.10000113.1R2675 E2676 G2677R2675-T2679 PolarHBondContact O-N 3.15Å; E2676-T2679 PolarHBondContact O-N 3.33Å; E2676-T2679 PolarHBondContact O-OG1 3.35Å; E2676-T2679 VanDerWaalsContact O-OG1 3.13Å; G2677-T2679 VanDerWaalsContact C-N 3.29Å; G2677-T2679 PolarHBondContact O-N 3.06Å
2680K88.7Confident86.6Confident98.25 Ų98.2546.7 Ų46.743%0.42722%0.222SC..Hα-helixtrans-83.9-27.3177.3-66.6175.4-173.6173.30113.4S2644 E2676 G2677 L2678S2644-K2680 WeakPolarHBondContact CB-O 3.28Å; E2676-K2680 WeakPolarHBondContact O-CD 3.32Å; E2676-K2680 WeakPolarHBondContact O-CE 3.47Å; E2676-K2680 WeakPolarHBondContact O-CG 3.34Å; E2676-K2680 PolarHBondContact O-N 3.47Å; E2676-K2680 VanDerWaalsContact OE1-CE 3.29Å; E2676-K2680 WeakPolarHBondContact OE1-CE 3.38Å; E2676-K2680 IonicContact OE1-NZ 3.17Å; E2676-K2680 PolarHBondContact OE1-NZ 3.06Å; E2676-K2680 IonicContact OE2-NZ 3.42Å; E2676-K2680 PolarHBondContact OE2-NZ 3.15Å; G2677-K2680 PolarHBondContact O-N 3.27Å; G2677-K2680 VanDerWaalsContact O-N 3.14Å; L2678-K2680 VanDerWaalsContact C-N 3.34Å
2681I89.6Confident86.5Confident6.25 Ų6.2547.8 Ų47.83%0.03223%0.227CC..SBendtrans-83.6124.9-177.8-67.4164.4000109.8V2640 I2643 L2657 G2677 L2683 N2685 W2686V2640-I2681 HydrophobicContact CG1-CD1 4.4Å; V2640-I2681 HydrophobicContact CG2-CD1 4.35Å; I2643-I2681 HydrophobicContact CB-CD1 4.27Å; I2643-I2681 HydrophobicContact CB-CG1 4.3Å; I2643-I2681 HydrophobicContact CD1-CD1 4.36Å; I2643-I2681 HydrophobicContact CG2-CB 4.45Å; I2643-I2681 HydrophobicContact CG2-CD1 4.13Å; I2643-I2681 HydrophobicContact CG2-CG1 4.02Å; I2643-I2681 HydrophobicContact CG2-CG2 3.68Å; L2657-I2681 HydrophobicContact CD2-CD1 4.05Å; G2677-I2681 VanDerWaalsContact O-CG1 3.28Å; G2677-I2681 WeakPolarHBondContact O-CG1 3.34Å; G2677-I2681 PolarHBondContact O-N 3.13Å; G2677-I2681 VanDerWaalsContact O-N 3.16Å; I2681-L2683 PolarHBondContact O-N 3.12Å; I2681-N2685 HydrophobicContact CG2-CB 3.89Å; I2681-W2686 HydrophobicContact CB-CZ2 4.25Å; I2681-W2686 HydrophobicContact CD1-CH2 4.34Å; I2681-W2686 HydrophobicContact CD1-CZ2 3.72Å; I2681-W2686 HydrophobicContact CG2-CZ2 3.97Å
2682R88.8Confident86.5Confident118 Ų11846.9 Ų46.945%0.44522%0.224SC..  trans-57.1136.3174.2-60.2179.2-6.4135.80.4111S2646 P2647 D2684 N2685S2646-R2682 PolarHBondContact O-NH2 2.87Å; P2647-R2682 VanDerWaalsContact C-NH2 3.33Å; P2647-R2682 PolarHBondContact O-NH2 3.19Å; R2682-D2684 WeakPolarHBondContact CB-OD1 3.41Å; R2682-D2684 IonicContact CZ-OD1 2.98Å; R2682-D2684 IonicContact CZ-OD2 3.41Å; R2682-D2684 VanDerWaalsContact CZ-OD2 3.29Å; R2682-D2684 IonicContact NE-OD1 2.93Å; R2682-D2684 PolarHBondContact NE-OD1 3.07Å; R2682-D2684 IonicContact NE-OD2 3.22Å; R2682-D2684 PolarHBondContact NE-OD2 3.08Å; R2682-D2684 IonicContact NH1-OD1 2.75Å; R2682-D2684 IonicContact NH1-OD2 2.67Å; R2682-D2684 PolarHBondContact NH1-OD2 3.21Å; R2682-D2684 VanDerWaalsContact NH2-CG 3.33Å; R2682-D2684 IonicContact NH2-OD1 2.78Å; R2682-D2684 IonicContact NH2-OD2 3.6Å; R2682-D2684 PolarHBondContact NH2-OD2 3.24Å; R2682-D2684 PolarHBondContact O-N 3.23Å; R2682-D2684 VanDerWaalsContact O-N 3.13Å; R2682-N2685 PolarHBondContact NH2-OD1 3.23Å; R2682-N2685 WeakPolarHBondContact O-CB 3.39Å; R2682-N2685 PolarHBondContact O-N 3.09Å; R2682-N2685 VanDerWaalsContact O-N 3.14Å; R2682-N2685 PolarHBondContact O-ND2 3.38Å
2683L89.1Confident86.6Confident52 Ų5242.4 Ų42.427%0.27220%0.203SC..G310 helixtrans-58.6-28.5-176.6-68.5176.6000114I2681 N2685 W2686 L2711 V2715 R2718 Y2719I2681-L2683 PolarHBondContact O-N 3.12Å; L2683-N2685 VanDerWaalsContact C-N 3.29Å; L2683-N2685 PolarHBondContact O-N 3.21Å; L2683-N2685 VanDerWaalsContact O-N 3.08Å; L2683-W2686 PolarHBondContact O-N 3.21Å; L2683-W2686 VanDerWaalsContact O-N 3.15Å; L2683-L2711 HydrophobicContact CD2-CD1 4.43Å; L2683-V2715 HydrophobicContact CD2-CG2 4.12Å; L2683-R2718 HydrophobicContact CD1-CB 4.01Å; L2683-R2718 HydrophobicContact CD1-CG 4.28Å; L2683-Y2719 HydrophobicContact CB-CE2 3.88Å
2684D87.6Confident86.6Confident23.25 Ų23.2541.2 Ų41.212%0.12420%0.196CC..G310 helixtrans-57.1-32.7176.1-1.1-16.2000113.2R2682 W2686 L2687 Y2719 H2900R2682-D2684 WeakPolarHBondContact CB-OD1 3.41Å; R2682-D2684 IonicContact CZ-OD1 2.98Å; R2682-D2684 IonicContact CZ-OD2 3.41Å; R2682-D2684 VanDerWaalsContact CZ-OD2 3.29Å; R2682-D2684 IonicContact NE-OD1 2.93Å; R2682-D2684 PolarHBondContact NE-OD1 3.07Å; R2682-D2684 IonicContact NE-OD2 3.22Å; R2682-D2684 PolarHBondContact NE-OD2 3.08Å; R2682-D2684 IonicContact NH1-OD1 2.75Å; R2682-D2684 IonicContact NH1-OD2 2.67Å; R2682-D2684 PolarHBondContact NH1-OD2 3.21Å; R2682-D2684 VanDerWaalsContact NH2-CG 3.33Å; R2682-D2684 IonicContact NH2-OD1 2.78Å; R2682-D2684 IonicContact NH2-OD2 3.6Å; R2682-D2684 PolarHBondContact NH2-OD2 3.24Å; R2682-D2684 PolarHBondContact O-N 3.23Å; R2682-D2684 VanDerWaalsContact O-N 3.13Å; D2684-W2686 VanDerWaalsContact C-N 3.26Å; D2684-W2686 PolarHBondContact O-N 3.09Å; D2684-L2687 HydrophobicContact CB-CD1 4.31Å; D2684-L2687 WeakPolarHBondContact O-CB 3.36Å; D2684-L2687 WeakPolarHBondContact O-CG 3.37Å; D2684-L2687 PolarHBondContact O-N 3.19Å; D2684-Y2719 HydrophobicContact CB-CE2 4.45Å; D2684-Y2719 PolarHBondContact OD1-OH 3.18Å; D2684-H2900 IonicContact OD1-CE1 2.82Å; D2684-H2900 IonicContact OD1-NE2 3.2Å; D2684-H2900 IonicContact OD2-CE1 2.7Å; D2684-H2900 IonicContact OD2-NE2 3.58Å; D2684-H2900 PolarHBondContact OD2-NE2 2.91Å
2685N87.3Confident86.4Confident2 Ų241.6 Ų41.61%0.01120%0.2CC..G310 helixtrans-64.5-28.7-179.4-68.5-44.4000112.5I2643 A2649 I2681 R2682 L2683 L2687I2643-N2685 HydrophobicContact CG2-CB 4.1Å; I2643-N2685 WeakPolarHBondContact CG2-ND2 3.28Å; I2643-N2685 PolarHBondContact O-ND2 3.11Å; A2649-N2685 VanDerWaalsContact CA-OD1 3.28Å; A2649-N2685 WeakPolarHBondContact CA-OD1 3.32Å; A2649-N2685 HydrophobicContact CB-CB 4.27Å; A2649-N2685 PolarHBondContact N-OD1 3.41Å; I2681-N2685 HydrophobicContact CG2-CB 3.89Å; R2682-N2685 PolarHBondContact NH2-OD1 3.23Å; R2682-N2685 WeakPolarHBondContact O-CB 3.39Å; R2682-N2685 PolarHBondContact O-N 3.09Å; R2682-N2685 VanDerWaalsContact O-N 3.14Å; R2682-N2685 PolarHBondContact O-ND2 3.38Å; L2683-N2685 VanDerWaalsContact C-N 3.29Å; L2683-N2685 PolarHBondContact O-N 3.21Å; L2683-N2685 VanDerWaalsContact O-N 3.08Å; N2685-L2687 VanDerWaalsContact C-N 3.3Å; N2685-L2687 PolarHBondContact O-N 3.44Å
2686W89.1Confident86.2Confident7 Ų739.8 Ų39.83%0.02719%0.193CC..G310 helixtrans-79-17-178.6-60109.1000113.3L2657 I2658 L2678 I2681 L2683 D2684 L2688 V2689 I2690 L2693 L2711 V2715L2657-W2686 HydrophobicContact CD2-CH2 3.89Å; L2657-W2686 HydrophobicContact CD2-CZ2 4.49Å; I2658-W2686 HydrophobicContact CD1-CE3 4.39Å; I2658-W2686 HydrophobicContact CD1-CZ3 4.13Å; I2658-W2686 HydrophobicContact CG1-CZ3 4.1Å; L2678-W2686 HydrophobicContact CD2-CH2 3.93Å; L2678-W2686 HydrophobicContact CD2-CZ2 3.38Å; L2678-W2686 VanDerWaalsContact CD2-CZ2 3.44Å; I2681-W2686 HydrophobicContact CB-CZ2 4.25Å; I2681-W2686 HydrophobicContact CD1-CH2 4.34Å; I2681-W2686 HydrophobicContact CD1-CZ2 3.72Å; I2681-W2686 HydrophobicContact CG2-CZ2 3.97Å; L2683-W2686 PolarHBondContact O-N 3.21Å; L2683-W2686 VanDerWaalsContact O-N 3.15Å; D2684-W2686 VanDerWaalsContact C-N 3.26Å; D2684-W2686 PolarHBondContact O-N 3.09Å; W2686-L2688 VanDerWaalsContact C-N 3.25Å; W2686-L2688 PolarHBondContact O-N 3.03Å; W2686-V2689 HydrophobicContact CB-CG2 4.42Å; W2686-V2689 HydrophobicContact CE3-CG2 3.71Å; W2686-V2689 HydrophobicContact CZ3-CG2 4.4Å; W2686-V2689 CarbonylContact O-C 3.54Å; W2686-V2689 VanDerWaalsContact O-CG2 3.26Å; W2686-V2689 WeakPolarHBondContact O-CG2 3.27Å; W2686-V2689 PolarHBondContact O-N 3.31Å; W2686-I2690 PolarHBondContact O-N 3.17Å; W2686-I2690 VanDerWaalsContact O-N 3.12Å; W2686-L2693 HydrophobicContact CE3-CD1 4.32Å; W2686-L2711 HydrophobicContact CD2-CD1 4.31Å; W2686-L2711 HydrophobicContact CD2-CD2 3.85Å; W2686-L2711 HydrophobicContact CD2-CG 4.49Å; W2686-L2711 HydrophobicContact CE3-CD2 3.98Å; W2686-L2711 HydrophobicContact CG-CD1 4.04Å; W2686-L2711 HydrophobicContact CG-CD2 4.23Å; W2686-L2711 HydrophobicContact CG-CG 4.46Å; W2686-L2711 HydrophobicContact CH2-CD2 4.47Å; W2686-L2711 HydrophobicContact CZ2-CD2 4.45Å; W2686-L2711 HydrophobicContact CZ3-CD2 4.29Å; W2686-V2715 HydrophobicContact CB-CG2 4.07Å
2687L87.7Confident86.2Confident27.75 Ų27.7534.7 Ų34.715%0.14517%0.17CC..G310 helixtrans-60.7-32.9-178.3-62.1179000112.8D2684 N2685 V2689 I2690 V2715 Y2719 P2899D2684-L2687 HydrophobicContact CB-CD1 4.31Å; D2684-L2687 WeakPolarHBondContact O-CB 3.36Å; D2684-L2687 WeakPolarHBondContact O-CG 3.37Å; D2684-L2687 PolarHBondContact O-N 3.19Å; N2685-L2687 VanDerWaalsContact C-N 3.3Å; N2685-L2687 PolarHBondContact O-N 3.44Å; L2687-V2689 VanDerWaalsContact C-N 3.26Å; L2687-V2689 PolarHBondContact O-N 3.14Å; L2687-I2690 HydrophobicContact CB-CD1 4.45Å; L2687-I2690 HydrophobicContact CD2-CD1 3.72Å; L2687-V2715 HydrophobicContact CD2-CG1 3.76Å; L2687-Y2719 HydrophobicContact CD1-CD2 4.01Å; L2687-Y2719 HydrophobicContact CD1-CE2 4.21Å; L2687-Y2719 HydrophobicContact CD1-CG 4.24Å; L2687-Y2719 HydrophobicContact CD2-CD2 3.77Å; L2687-Y2719 HydrophobicContact CD2-CG 4.11Å; L2687-Y2719 HydrophobicContact CG-CD2 4.21Å; L2687-P2899 HydrophobicContact CD1-CB 4.24Å; L2687-P2899 HydrophobicContact CD1-CG 3.32Å
2688L81.3Confident86.2Confident81.5 Ų81.536.5 Ų36.543%0.42718%0.179SC..G310 helixtrans-72.2-15.8177.7-60.9-176.4000113.9A2649 L2651 W2686 Q2953A2649-L2688 HydrophobicContact CB-CD1 3.51Å; A2649-L2688 VanDerWaalsContact CB-CD1 3.49Å; A2649-L2688 HydrophobicContact CB-CG 4.1Å; L2651-L2688 HydrophobicContact CB-CD1 4.19Å; L2651-L2688 HydrophobicContact CD1-CB 4.12Å; W2686-L2688 VanDerWaalsContact C-N 3.25Å; W2686-L2688 PolarHBondContact O-N 3.03Å; L2688-Q2953 PolarHBondContact O-NE2 3.18Å
2689V85.9Confident86.1Confident0 Ų035.7 Ų35.70%018%0.176CC..G310 helixtrans-122.88.3-173.2-66.40000113.6L2651 L2655 I2658 W2686 L2687 Q2691 Q2692 L2693L2651-V2689 HydrophobicContact CD1-CG1 3.49Å; L2651-V2689 VanDerWaalsContact CD1-CG1 3.41Å; L2655-V2689 HydrophobicContact CD2-CG1 3.89Å; L2655-V2689 HydrophobicContact CG-CG1 4.17Å; I2658-V2689 HydrophobicContact CD1-CB 3.68Å; I2658-V2689 HydrophobicContact CD1-CG1 4.15Å; I2658-V2689 HydrophobicContact CD1-CG2 3.65Å; W2686-V2689 HydrophobicContact CB-CG2 4.42Å; W2686-V2689 HydrophobicContact CE3-CG2 3.71Å; W2686-V2689 HydrophobicContact CZ3-CG2 4.4Å; W2686-V2689 CarbonylContact O-C 3.54Å; W2686-V2689 VanDerWaalsContact O-CG2 3.26Å; W2686-V2689 WeakPolarHBondContact O-CG2 3.27Å; W2686-V2689 PolarHBondContact O-N 3.31Å; L2687-V2689 VanDerWaalsContact C-N 3.26Å; L2687-V2689 PolarHBondContact O-N 3.14Å; V2689-Q2691 PolarHBondContact O-N 3.08Å; V2689-Q2691 VanDerWaalsContact O-N 3.15Å; V2689-Q2692 VanDerWaalsContact CA-OE1 3.28Å; V2689-Q2692 WeakPolarHBondContact O-CB 3.41Å; V2689-Q2692 PolarHBondContact O-N 3.07Å; V2689-Q2692 VanDerWaalsContact O-N 3.08Å; V2689-Q2692 PolarHBondContact O-OE1 3.15Å; V2689-L2693 HydrophobicContact CG2-CD1 4.37Å; V2689-L2693 WeakPolarHBondContact O-CG 3.45Å; V2689-L2693 PolarHBondContact O-N 3.16Å; V2689-L2693 VanDerWaalsContact O-N 3.1Å
2690I88.1Confident85.9Confident8.25 Ų8.2534.8 Ų34.84%0.04217%0.172CC..Hα-helixtrans-46.3-47.9174.7-76.3168000110.7W2686 L2687 Q2692 L2693 L2694 V2715 M2723 P2726W2686-I2690 PolarHBondContact O-N 3.17Å; W2686-I2690 VanDerWaalsContact O-N 3.12Å; L2687-I2690 HydrophobicContact CB-CD1 4.45Å; L2687-I2690 HydrophobicContact CD2-CD1 3.72Å; I2690-Q2692 VanDerWaalsContact C-N 3.31Å; I2690-Q2692 PolarHBondContact O-N 3.22Å; I2690-L2693 PolarHBondContact O-N 3.35Å; I2690-L2694 HydrophobicContact CG2-CD1 3.56Å; I2690-L2694 HydrophobicContact CG2-CG 4.16Å; I2690-L2694 WeakPolarHBondContact O-CB 3.3Å; I2690-L2694 WeakPolarHBondContact O-CG 3.31Å; I2690-L2694 PolarHBondContact O-N 3.03Å; I2690-V2715 HydrophobicContact CD1-CG1 4.27Å; I2690-V2715 HydrophobicContact CG1-CG1 4.39Å; I2690-M2723 HydrophobicContact CB-SD 4.36Å; I2690-M2723 HydrophobicContact CD1-CG 4.38Å; I2690-M2723 HydrophobicContact CD1-SD 3.62Å; I2690-M2723 VanDerWaalsContact CD1-SD 3.54Å; I2690-M2723 HydrophobicContact CG1-SD 3.77Å; I2690-M2723 HydrophobicContact CG2-CE 4.48Å; I2690-M2723 HydrophobicContact CG2-SD 3.63Å; I2690-M2723 VanDerWaalsContact CG2-SD 3.57Å; I2690-P2726 HydrophobicContact CG2-CB 4.2Å; I2690-P2726 HydrophobicContact CG2-CG 4.33Å
2691Q82.7Confident85.8Confident25 Ų2535.3 Ų35.312%0.11717%0.171CC..Hα-helixtrans-72.9-21.6-174.2-66.7-70.62500113.6V2689 A2695 P2726 E2949 R2950 Q2953V2689-Q2691 PolarHBondContact O-N 3.08Å; V2689-Q2691 VanDerWaalsContact O-N 3.15Å; Q2691-A2695 VanDerWaalsContact O-CB 3.3Å; Q2691-A2695 WeakPolarHBondContact O-CB 3.33Å; Q2691-A2695 PolarHBondContact O-N 3.11Å; Q2691-A2695 VanDerWaalsContact O-N 3.17Å; Q2691-P2726 VanDerWaalsContact NE2-CG 3.31Å; Q2691-E2949 PolarHBondContact NE2-OE1 3.07Å; Q2691-E2949 PolarHBondContact NE2-OE2 3.06Å; Q2691-R2950 VanDerWaalsContact CB-NH1 3.29Å; Q2691-R2950 PolarHBondContact O-NH1 3.08Å; Q2691-R2950 PolarHBondContact O-NH2 3.25Å; Q2691-R2950 VanDerWaalsContact O-NH2 3.12Å; Q2691-Q2953 VanDerWaalsContact CB-NE2 3.28Å; Q2691-Q2953 VanDerWaalsContact CG-NE2 3.28Å
2692Q83Confident85.5Confident18.75 Ų18.7540.4 Ų40.49%0.08820%0.195CC..Hα-helixtrans-79.1-35.7172.4-76.171.515.800111L2655 V2689 I2690 A3173L2655-Q2692 HydrophobicContact CD2-CB 4.37Å; L2655-Q2692 HydrophobicContact CD2-CG 3.75Å; V2689-Q2692 VanDerWaalsContact CA-OE1 3.28Å; V2689-Q2692 WeakPolarHBondContact O-CB 3.41Å; V2689-Q2692 PolarHBondContact O-N 3.07Å; V2689-Q2692 VanDerWaalsContact O-N 3.08Å; V2689-Q2692 PolarHBondContact O-OE1 3.15Å; I2690-Q2692 VanDerWaalsContact C-N 3.31Å; I2690-Q2692 PolarHBondContact O-N 3.22Å; Q2692-A3173 HydrophobicContact CG-CB 3.96Å
2693L88.5Confident85.3Confident1.5 Ų1.541.8 Ų41.81%0.00820%0.201CC..Hα-helixtrans-68.9-47.2173.6-66170.9000111.1I2658 W2686 V2689 I2690 A2695 R2696 I2697 I2708 L2711 L2712I2658-L2693 HydrophobicContact CD1-CD2 3.85Å; I2658-L2693 HydrophobicContact CD1-CG 4.05Å; I2658-L2693 HydrophobicContact CG1-CD2 4.04Å; I2658-L2693 HydrophobicContact CG2-CD2 4.29Å; W2686-L2693 HydrophobicContact CE3-CD1 4.32Å; V2689-L2693 HydrophobicContact CG2-CD1 4.37Å; V2689-L2693 WeakPolarHBondContact O-CG 3.45Å; V2689-L2693 PolarHBondContact O-N 3.16Å; V2689-L2693 VanDerWaalsContact O-N 3.1Å; I2690-L2693 PolarHBondContact O-N 3.35Å; L2693-A2695 VanDerWaalsContact C-N 3.32Å; L2693-A2695 PolarHBondContact O-N 3.01Å; L2693-R2696 CarbonylContact O-C 3.51Å; L2693-R2696 PolarHBondContact O-N 3.18Å; L2693-R2696 VanDerWaalsContact O-N 3.1Å; L2693-I2697 PolarHBondContact O-N 3.18Å; L2693-I2708 HydrophobicContact CB-CG2 4.23Å; L2693-I2708 HydrophobicContact CD2-CG1 4.34Å; L2693-I2708 HydrophobicContact CD2-CG2 4.42Å; L2693-L2711 HydrophobicContact CD1-CD2 3.93Å; L2693-L2712 HydrophobicContact CB-CD1 4.33Å; L2693-L2712 HydrophobicContact CB-CD2 4.12Å; L2693-L2712 HydrophobicContact CB-CG 4.46Å; L2693-L2712 HydrophobicContact CD1-CD2 4.07Å
2694L86.4Confident85.2Confident5.25 Ų5.2539.4 Ų39.43%0.02719%0.188CC..Hα-helixtrans-64.3-32.4178.7-74.2176000113.4I2690 R2696 I2697 L2712 M2723 P2726 L2727I2690-L2694 HydrophobicContact CG2-CD1 3.56Å; I2690-L2694 HydrophobicContact CG2-CG 4.16Å; I2690-L2694 WeakPolarHBondContact O-CB 3.3Å; I2690-L2694 WeakPolarHBondContact O-CG 3.31Å; I2690-L2694 PolarHBondContact O-N 3.03Å; L2694-R2696 PolarHBondContact O-N 3.14Å; L2694-R2696 VanDerWaalsContact O-N 3.1Å; L2694-I2697 HydrophobicContact CD2-CD1 4.12Å; L2694-I2697 HydrophobicContact CD2-CG2 4.17Å; L2694-I2697 WeakPolarHBondContact O-CB 3.33Å; L2694-I2697 VanDerWaalsContact O-CG2 3.22Å; L2694-I2697 WeakPolarHBondContact O-CG2 3.39Å; L2694-I2697 PolarHBondContact O-N 2.84Å; L2694-I2697 VanDerWaalsContact O-N 3.16Å; L2694-L2712 HydrophobicContact CD2-CD1 3.74Å; L2694-L2712 HydrophobicContact CG-CD1 4.31Å; L2694-M2723 HydrophobicContact CD1-CE 4.4Å; L2694-M2723 HydrophobicContact CD2-CE 4.44Å; L2694-P2726 HydrophobicContact CD1-CB 3.31Å; L2694-P2726 HydrophobicContact CD1-CG 4.42Å; L2694-L2727 HydrophobicContact CD1-CD2 4.46Å; L2694-L2727 HydrophobicContact CD2-CD2 3.77Å
2695A81.7Confident85.1Confident14.75 Ų14.7538.4 Ų38.412%0.12218%0.184CC..THydrogen-bonded Turntrans-62.6-15.4174.600000113.6Q2691 L2693 R2739 D3177Q2691-A2695 VanDerWaalsContact O-CB 3.3Å; Q2691-A2695 WeakPolarHBondContact O-CB 3.33Å; Q2691-A2695 PolarHBondContact O-N 3.11Å; Q2691-A2695 VanDerWaalsContact O-N 3.17Å; L2693-A2695 VanDerWaalsContact C-N 3.32Å; L2693-A2695 PolarHBondContact O-N 3.01Å; A2695-R2739 PolarHBondContact O-NH2 2.82Å; A2695-D3177 HydrophobicContact CB-CB 4.1Å
2696R83.4Confident85.2Confident82.75 Ų82.7540.6 Ų40.631%0.31220%0.197SC..THydrogen-bonded Turntrans-124.513.7-176-61.3-65-157.3108.62.9113.6F2662 L2693 L2694 D2698 T2699 I2708 H3176F2662-R2696 HydrophobicContact CD1-CB 4.41Å; F2662-R2696 HydrophobicContact CD2-CG 4.28Å; F2662-R2696 HydrophobicContact CE1-CB 3.61Å; F2662-R2696 VanDerWaalsContact CE1-CB 3.46Å; F2662-R2696 HydrophobicContact CE1-CG 4.03Å; F2662-R2696 HydrophobicContact CE2-CB 4.15Å; F2662-R2696 HydrophobicContact CE2-CG 3.82Å; F2662-R2696 VanDerWaalsContact CE2-CG 3.49Å; F2662-R2696 HydrophobicContact CZ-CB 3.39Å; F2662-R2696 HydrophobicContact CZ-CG 3.57Å; F2662-R2696 VanDerWaalsContact CZ-CG 3.45Å; L2693-R2696 CarbonylContact O-C 3.51Å; L2693-R2696 PolarHBondContact O-N 3.18Å; L2693-R2696 VanDerWaalsContact O-N 3.1Å; L2694-R2696 PolarHBondContact O-N 3.14Å; L2694-R2696 VanDerWaalsContact O-N 3.1Å; R2696-D2698 PolarHBondContact O-N 3.06Å; R2696-D2698 VanDerWaalsContact O-N 3.13Å; R2696-T2699 VanDerWaalsContact O-CB 3.31Å; R2696-T2699 WeakPolarHBondContact O-CB 3.38Å; R2696-T2699 VanDerWaalsContact O-CG2 3.31Å; R2696-T2699 WeakPolarHBondContact O-CG2 3.35Å; R2696-T2699 PolarHBondContact O-N 2.99Å; R2696-I2708 HydrophobicContact CB-CD1 4.41Å; R2696-H3176 VanDerWaalsContact CZ-CD2 3.5Å; R2696-H3176 VanDerWaalsContact NE-CB 3.25Å; R2696-H3176 VanDerWaalsContact NE-CG 3.29Å; R2696-H3176 PolarHBondContact NH1-ND1 3.46Å; R2696-H3176 PolarHBondContact NH2-CD2 3.08Å; R2696-H3176 PolarHBondContact NH2-CE1 3.02Å; R2696-H3176 VanDerWaalsContact NH2-CE1 3.3Å; R2696-H3176 PolarHBondContact NH2-ND1 3.13Å; R2696-H3176 VanDerWaalsContact NH2-ND1 3.15Å; R2696-H3176 PolarHBondContact NH2-NE2 3.45Å
2697I86.1Confident85.2Confident0.5 Ų0.540.7 Ų40.70%0.00320%0.198CC..THydrogen-bonded Turntrans-62.1-19.2-178.7-179.8176.3000113.2L2693 L2694 T2699 I2708 I2709 L2712 R2739 N2742 A2743 I2746L2693-I2697 PolarHBondContact O-N 3.18Å; L2694-I2697 HydrophobicContact CD2-CD1 4.12Å; L2694-I2697 HydrophobicContact CD2-CG2 4.17Å; L2694-I2697 WeakPolarHBondContact O-CB 3.33Å; L2694-I2697 VanDerWaalsContact O-CG2 3.22Å; L2694-I2697 WeakPolarHBondContact O-CG2 3.39Å; L2694-I2697 PolarHBondContact O-N 2.84Å; L2694-I2697 VanDerWaalsContact O-N 3.16Å; I2697-T2699 VanDerWaalsContact C-N 3.34Å; I2697-I2708 HydrophobicContact CG2-CG2 4.19Å; I2697-I2709 HydrophobicContact CD1-CG1 4.48Å; I2697-I2709 HydrophobicContact CG1-CG1 4.25Å; I2697-L2712 HydrophobicContact CD1-CD1 4.23Å; I2697-L2712 HydrophobicContact CG2-CD1 3.83Å; I2697-R2739 HydrophobicContact CD1-CG 3.94Å; I2697-R2739 WeakPolarHBondContact CD1-O 3.47Å; I2697-R2739 HydrophobicContact CG1-CG 3.88Å; I2697-R2739 HydrophobicContact CG2-CB 4.34Å; I2697-R2739 HydrophobicContact CG2-CG 3.78Å; I2697-N2742 HydrophobicContact CB-CB 4.38Å; I2697-N2742 HydrophobicContact CD1-CB 3.91Å; I2697-N2742 HydrophobicContact CG1-CB 3.72Å; I2697-N2742 PolarHBondContact O-ND2 3.13Å; I2697-A2743 HydrophobicContact CD1-CB 4.07Å; I2697-I2746 HydrophobicContact CD1-CD1 3.57Å; I2697-I2746 VanDerWaalsContact CD1-CD1 3.43Å
2698D83.7Confident85.4Confident39.25 Ų39.2539.4 Ų39.421%0.2119%0.191CC..THydrogen-bonded Turntrans-97.415.8175.959.9-23.5000114.1R2696 S2736 R2738 R2739R2696-D2698 PolarHBondContact O-N 3.06Å; R2696-D2698 VanDerWaalsContact O-N 3.13Å; D2698-S2736 VanDerWaalsContact CB-OG 3.24Å; D2698-S2736 WeakPolarHBondContact CB-OG 3.32Å; D2698-S2736 PolarHBondContact OD2-OG 3.22Å; D2698-R2738 HydrophobicContact CB-CB 4.2Å; D2698-R2738 HydrophobicContact CB-CG 4.26Å; D2698-R2738 PolarHBondContact O-NE 2.93Å; D2698-R2739 HydrophobicContact CB-CB 3.93Å; D2698-R2739 IonicContact OD1-CZ 2.95Å; D2698-R2739 IonicContact OD1-NE 3.01Å; D2698-R2739 PolarHBondContact OD1-NE 3.23Å; D2698-R2739 IonicContact OD1-NH2 3.02Å; D2698-R2739 PolarHBondContact OD1-NH2 2.77Å; D2698-R2739 IonicContact OD2-CZ 3.54Å; D2698-R2739 IonicContact OD2-NE 2.98Å; D2698-R2739 PolarHBondContact OD2-NE 3.27Å; D2698-R2739 IonicContact OD2-NH2 2.98Å
2699T83.9Confident85.8Confident18 Ų1835.6 Ų35.611%0.1117%0.171CC..  trans-49.9133.5174.4-176.20000111.5F2662 R2696 I2697 R2701 V2704 A2705 I2708 R2738F2662-T2699 HydrophobicContact CE1-CG2 4.29Å; R2696-T2699 VanDerWaalsContact O-CB 3.31Å; R2696-T2699 WeakPolarHBondContact O-CB 3.38Å; R2696-T2699 VanDerWaalsContact O-CG2 3.31Å; R2696-T2699 WeakPolarHBondContact O-CG2 3.35Å; R2696-T2699 PolarHBondContact O-N 2.99Å; I2697-T2699 VanDerWaalsContact C-N 3.34Å; T2699-R2701 PolarHBondContact O-N 3.02Å; T2699-V2704 HydrophobicContact CG2-CB 4.35Å; T2699-V2704 HydrophobicContact CG2-CG1 4.33Å; T2699-A2705 HydrophobicContact CG2-CB 3.74Å; T2699-I2708 HydrophobicContact CG2-CD1 4.18Å; T2699-R2738 VanDerWaalsContact O-CZ 3.25Å; T2699-R2738 PolarHBondContact O-NE 3.34Å; T2699-R2738 PolarHBondContact O-NH1 2.83Å; T2699-R2738 PolarHBondContact O-NH2 3.2Å
2700P82.2Confident86.1Confident101.5 Ų101.539 Ų3966%0.65919%0.19SC*.SBendtrans-67.5-22.7-178.426.2-34.2000112.6E2702 R2738P2700-E2702 PolarHBondContact O-N 3.08Å; P2700-E2702 VanDerWaalsContact O-N 3.09Å; P2700-R2738 VanDerWaalsContact CA-NH1 3.33Å; P2700-R2738 PolarHBondContact O-NH1 3.13Å; P2700-R2738 PolarHBondContact O-NH2 3.36Å
2701R84.8Confident86.3Confident107 Ų10739.3 Ų39.340%0.40419%0.191SC..  trans-73.897.9-179.8-65.8178.1174.5-168.6-9.6110.5F2662 K2663 H2666 T2699 Y2703 V2704 A2705F2662-R2701 PolarHBondContact O-NH1 3.11Å; K2663-R2701 PolarHBondContact O-NH1 3.04Å; H2666-R2701 PolarHBondContact ND1-NH1 3.16Å; T2699-R2701 PolarHBondContact O-N 3.02Å; R2701-Y2703 VanDerWaalsContact C-N 3.34Å; R2701-Y2703 PolarHBondContact O-N 3.1Å; R2701-V2704 HydrophobicContact CB-CB 4.08Å; R2701-V2704 HydrophobicContact CB-CG2 4.01Å; R2701-V2704 WeakPolarHBondContact O-CA 3.3Å; R2701-V2704 WeakPolarHBondContact O-CB 3.46Å; R2701-V2704 PolarHBondContact O-N 3.11Å; R2701-A2705 PolarHBondContact O-N 3.05Å
2702E84.1Confident86.8Confident115 Ų11538.2 Ų38.254%0.53719%0.186SC..Hα-helixtrans-56.2-43.9-172-169.4144.3-151.500114.2P2700 V2704 A2705 T2706 R2738P2700-E2702 PolarHBondContact O-N 3.08Å; P2700-E2702 VanDerWaalsContact O-N 3.09Å; E2702-V2704 VanDerWaalsContact C-N 3.3Å; E2702-V2704 PolarHBondContact O-N 3.09Å; E2702-A2705 WeakPolarHBondContact O-CB 3.28Å; E2702-A2705 PolarHBondContact O-N 3.02Å; E2702-A2705 VanDerWaalsContact O-N 3.1Å; E2702-T2706 WeakPolarHBondContact O-CB 3.3Å; E2702-T2706 PolarHBondContact O-N 3.2Å; E2702-T2706 PolarHBondContact O-OG1 3.17Å; E2702-T2706 VanDerWaalsContact O-OG1 3.08Å; E2702-R2738 IonicContact OE2-CZ 3.27Å; E2702-R2738 IonicContact OE2-NH1 2.99Å; E2702-R2738 PolarHBondContact OE2-NH1 3.32Å; E2702-R2738 IonicContact OE2-NH2 3.87Å; E2702-R2738 PolarHBondContact OE2-NH2 2.72Å
2703Y84.1Confident87.3Confident147 Ų14738.8 Ų38.858%0.57619%0.19SC*.Hα-helixtrans-60.6-39.9176.6-63-73.5000113.1R2701 A2705 T2706 I2707R2701-Y2703 VanDerWaalsContact C-N 3.34Å; R2701-Y2703 PolarHBondContact O-N 3.1Å; Y2703-A2705 VanDerWaalsContact C-N 3.33Å; Y2703-T2706 PolarHBondContact O-N 3.32Å; Y2703-I2707 VanDerWaalsContact O-CD1 3.28Å; Y2703-I2707 WeakPolarHBondContact O-CD1 3.47Å; Y2703-I2707 VanDerWaalsContact O-CG1 3.23Å; Y2703-I2707 WeakPolarHBondContact O-CG1 3.3Å; Y2703-I2707 PolarHBondContact O-N 3.19Å; Y2703-I2707 VanDerWaalsContact O-N 3.14Å
2704V86.8Confident87.5Confident0.75 Ų0.7541.2 Ų41.21%0.00521%0.207CC..Hα-helixtrans-70.3-40.7177.4-179.70000110.2L2661 F2662 T2699 R2701 E2702 T2706 I2707 I2708L2661-V2704 HydrophobicContact CD1-CG1 4.21Å; L2661-V2704 HydrophobicContact CD1-CG2 4.36Å; L2661-V2704 HydrophobicContact CD2-CG1 4.43Å; L2661-V2704 HydrophobicContact CG-CG1 4.12Å; F2662-V2704 HydrophobicContact CD1-CG1 4.02Å; F2662-V2704 HydrophobicContact CE1-CG1 4.15Å; T2699-V2704 HydrophobicContact CG2-CB 4.35Å; T2699-V2704 HydrophobicContact CG2-CG1 4.33Å; R2701-V2704 HydrophobicContact CB-CB 4.08Å; R2701-V2704 HydrophobicContact CB-CG2 4.01Å; R2701-V2704 WeakPolarHBondContact O-CA 3.3Å; R2701-V2704 WeakPolarHBondContact O-CB 3.46Å; R2701-V2704 PolarHBondContact O-N 3.11Å; E2702-V2704 VanDerWaalsContact C-N 3.3Å; E2702-V2704 PolarHBondContact O-N 3.09Å; V2704-T2706 VanDerWaalsContact C-N 3.33Å; V2704-T2706 PolarHBondContact O-N 3.01Å; V2704-I2707 PolarHBondContact O-N 3.27Å; V2704-I2708 HydrophobicContact CG1-CD1 3.86Å; V2704-I2708 HydrophobicContact CG1-CG1 4.46Å; V2704-I2708 WeakPolarHBondContact O-CD1 3.3Å; V2704-I2708 VanDerWaalsContact O-CG1 3.27Å; V2704-I2708 WeakPolarHBondContact O-CG1 3.46Å; V2704-I2708 PolarHBondContact O-N 3.09Å; V2704-I2708 VanDerWaalsContact O-N 3.1Å
2705A87.2Confident87.8Confident3 Ų341 Ų413%0.02521%0.206CC..Hα-helixtrans-59.1-45.2174.200000111.4T2699 R2701 E2702 Y2703 I2708 I2709T2699-A2705 HydrophobicContact CG2-CB 3.74Å; R2701-A2705 PolarHBondContact O-N 3.05Å; E2702-A2705 WeakPolarHBondContact O-CB 3.28Å; E2702-A2705 PolarHBondContact O-N 3.02Å; E2702-A2705 VanDerWaalsContact O-N 3.1Å; Y2703-A2705 VanDerWaalsContact C-N 3.33Å; A2705-I2708 PolarHBondContact O-N 3.32Å; A2705-I2709 HydrophobicContact CB-CD1 4.4Å; A2705-I2709 WeakPolarHBondContact O-CB 3.4Å; A2705-I2709 VanDerWaalsContact O-CD1 3.31Å; A2705-I2709 WeakPolarHBondContact O-CD1 3.38Å; A2705-I2709 WeakPolarHBondContact O-CG1 3.36Å; A2705-I2709 PolarHBondContact O-N 3.19Å
2706T89.2Confident88.3Confident48.25 Ų48.2540.3 Ų40.330%0.29620%0.2SC..Hα-helixtrans-60.1-49.7178.8-570000111.5E2702 Y2703 V2704 I2708 I2709 D2710E2702-T2706 WeakPolarHBondContact O-CB 3.3Å; E2702-T2706 PolarHBondContact O-N 3.2Å; E2702-T2706 PolarHBondContact O-OG1 3.17Å; E2702-T2706 VanDerWaalsContact O-OG1 3.08Å; Y2703-T2706 PolarHBondContact O-N 3.32Å; V2704-T2706 VanDerWaalsContact C-N 3.33Å; V2704-T2706 PolarHBondContact O-N 3.01Å; T2706-I2708 VanDerWaalsContact C-N 3.29Å; T2706-I2708 PolarHBondContact O-N 3.23Å; T2706-I2709 PolarHBondContact O-N 3.25Å; T2706-I2709 VanDerWaalsContact O-N 3.09Å; T2706-D2710 WeakPolarHBondContact CG2-OD2 3.19Å; T2706-D2710 WeakPolarHBondContact O-CB 3.47Å; T2706-D2710 PolarHBondContact O-N 3.12Å
2707I89.4Confident88.7Confident8.25 Ų8.2539.8 Ų39.84%0.04220%0.201CC..Hα-helixtrans-57-41.4177.3-65.9164.2000111.7L2661 R2671 I2674 L2678 Y2703 V2704 L2711L2661-I2707 HydrophobicContact CD1-CD1 4.27Å; L2661-I2707 HydrophobicContact CD1-CG2 4.34Å; L2661-I2707 HydrophobicContact CD2-CG2 4.3Å; R2671-I2707 HydrophobicContact CB-CD1 4.32Å; R2671-I2707 HydrophobicContact CG-CD1 3.89Å; I2674-I2707 HydrophobicContact CG2-CG2 4.21Å; L2678-I2707 HydrophobicContact CD1-CG2 3.59Å; Y2703-I2707 VanDerWaalsContact O-CD1 3.28Å; Y2703-I2707 WeakPolarHBondContact O-CD1 3.47Å; Y2703-I2707 VanDerWaalsContact O-CG1 3.23Å; Y2703-I2707 WeakPolarHBondContact O-CG1 3.3Å; Y2703-I2707 PolarHBondContact O-N 3.19Å; Y2703-I2707 VanDerWaalsContact O-N 3.14Å; V2704-I2707 PolarHBondContact O-N 3.27Å; I2707-L2711 VanDerWaalsContact O-CB 3.3Å; I2707-L2711 WeakPolarHBondContact O-CB 3.24Å; I2707-L2711 PolarHBondContact O-N 3.14Å; I2707-L2711 VanDerWaalsContact O-N 3.11Å
2708I90.2Very high89Confident1 Ų147.9 Ų47.91%0.00523%0.232CC..Hα-helixtrans-68.6-43.9178.3-66.7165.4000110.9L2661 F2662 L2693 R2696 I2697 T2699 V2704 A2705 T2706 L2711 L2712L2661-I2708 HydrophobicContact CD2-CD1 4.42Å; L2661-I2708 HydrophobicContact CD2-CG1 4.17Å; F2662-I2708 HydrophobicContact CD1-CD1 4.27Å; F2662-I2708 HydrophobicContact CE1-CD1 3.48Å; F2662-I2708 HydrophobicContact CE1-CG1 4.42Å; F2662-I2708 HydrophobicContact CE2-CD1 4.31Å; F2662-I2708 HydrophobicContact CZ-CD1 3.58Å; F2662-I2708 VanDerWaalsContact CZ-CD1 3.43Å; L2693-I2708 HydrophobicContact CB-CG2 4.23Å; L2693-I2708 HydrophobicContact CD2-CG1 4.34Å; L2693-I2708 HydrophobicContact CD2-CG2 4.42Å; R2696-I2708 HydrophobicContact CB-CD1 4.41Å; I2697-I2708 HydrophobicContact CG2-CG2 4.19Å; T2699-I2708 HydrophobicContact CG2-CD1 4.18Å; V2704-I2708 HydrophobicContact CG1-CD1 3.86Å; V2704-I2708 HydrophobicContact CG1-CG1 4.46Å; V2704-I2708 WeakPolarHBondContact O-CD1 3.3Å; V2704-I2708 VanDerWaalsContact O-CG1 3.27Å; V2704-I2708 WeakPolarHBondContact O-CG1 3.46Å; V2704-I2708 PolarHBondContact O-N 3.09Å; V2704-I2708 VanDerWaalsContact O-N 3.1Å; A2705-I2708 PolarHBondContact O-N 3.32Å; T2706-I2708 VanDerWaalsContact C-N 3.29Å; T2706-I2708 PolarHBondContact O-N 3.23Å; I2708-L2711 PolarHBondContact O-N 2.97Å; I2708-L2712 HydrophobicContact CG2-CD1 3.76Å; I2708-L2712 HydrophobicContact CG2-CG 4.22Å; I2708-L2712 WeakPolarHBondContact O-CB 3.41Å; I2708-L2712 VanDerWaalsContact O-CG 3.23Å; I2708-L2712 WeakPolarHBondContact O-CG 3.42Å; I2708-L2712 PolarHBondContact O-N 3.1Å
2709I91.2Very high89.4Confident1.5 Ų1.547.2 Ų47.21%0.00823%0.226CC..Hα-helixtrans-65.9-45.5-179.1-68.4161.5000110.4I2697 A2705 T2706 L2711 L2712 I2713 N2742 I2746I2697-I2709 HydrophobicContact CD1-CG1 4.48Å; I2697-I2709 HydrophobicContact CG1-CG1 4.25Å; A2705-I2709 HydrophobicContact CB-CD1 4.4Å; A2705-I2709 WeakPolarHBondContact O-CB 3.4Å; A2705-I2709 VanDerWaalsContact O-CD1 3.31Å; A2705-I2709 WeakPolarHBondContact O-CD1 3.38Å; A2705-I2709 WeakPolarHBondContact O-CG1 3.36Å; A2705-I2709 PolarHBondContact O-N 3.19Å; T2706-I2709 PolarHBondContact O-N 3.25Å; T2706-I2709 VanDerWaalsContact O-N 3.09Å; I2709-L2711 VanDerWaalsContact C-N 3.3Å; I2709-L2711 PolarHBondContact O-N 3.29Å; I2709-L2712 PolarHBondContact O-N 3.1Å; I2709-I2713 HydrophobicContact CG2-CD1 3.77Å; I2709-I2713 HydrophobicContact CG2-CG1 4.34Å; I2709-I2713 WeakPolarHBondContact O-CB 3.42Å; I2709-I2713 VanDerWaalsContact O-CG1 3.29Å; I2709-I2713 WeakPolarHBondContact O-CG1 3.31Å; I2709-I2713 PolarHBondContact O-N 3.05Å; I2709-N2742 HydrophobicContact CD1-CB 4Å; I2709-N2742 VanDerWaalsContact CD1-CG 3.42Å; I2709-N2742 WeakPolarHBondContact CD1-OD1 3.32Å; I2709-N2742 HydrophobicContact CG1-CB 4.42Å; I2709-I2746 HydrophobicContact CG2-CG1 4.21Å
2710D91.3Very high89.9Confident72.75 Ų72.7547.2 Ų47.239%0.38923%0.226SC..Hα-helixtrans-59.8-41.7177.5-62.7-15.7000111.2R2675 T2706 S2714R2675-D2710 IonicContact NH2-OD2 2.63Å; T2706-D2710 WeakPolarHBondContact CG2-OD2 3.19Å; T2706-D2710 WeakPolarHBondContact O-CB 3.47Å; T2706-D2710 PolarHBondContact O-N 3.12Å; D2710-S2714 WeakPolarHBondContact O-CB 3.38Å; D2710-S2714 PolarHBondContact O-N 3.25Å; D2710-S2714 VanDerWaalsContact O-N 3.11Å; D2710-S2714 PolarHBondContact O-OG 3.1Å
2711L92Very high90.5Very high14 Ų1443.4 Ų43.47%0.07320%0.2CC..Hα-helixtrans-64.4-47174.1176.461.1000111.9L2678 L2683 W2686 L2693 I2707 I2708 I2709 I2713 S2714 V2715L2678-L2711 HydrophobicContact CD1-CB 4.46Å; L2678-L2711 HydrophobicContact CD2-CD1 4.19Å; L2678-L2711 HydrophobicContact CD2-CD2 3.98Å; L2678-L2711 HydrophobicContact CD2-CG 4.3Å; L2683-L2711 HydrophobicContact CD2-CD1 4.43Å; W2686-L2711 HydrophobicContact CD2-CD1 4.31Å; W2686-L2711 HydrophobicContact CD2-CD2 3.85Å; W2686-L2711 HydrophobicContact CD2-CG 4.49Å; W2686-L2711 HydrophobicContact CE3-CD2 3.98Å; W2686-L2711 HydrophobicContact CG-CD1 4.04Å; W2686-L2711 HydrophobicContact CG-CD2 4.23Å; W2686-L2711 HydrophobicContact CG-CG 4.46Å; W2686-L2711 HydrophobicContact CH2-CD2 4.47Å; W2686-L2711 HydrophobicContact CZ2-CD2 4.45Å; W2686-L2711 HydrophobicContact CZ3-CD2 4.29Å; L2693-L2711 HydrophobicContact CD1-CD2 3.93Å; I2707-L2711 VanDerWaalsContact O-CB 3.3Å; I2707-L2711 WeakPolarHBondContact O-CB 3.24Å; I2707-L2711 PolarHBondContact O-N 3.14Å; I2707-L2711 VanDerWaalsContact O-N 3.11Å; I2708-L2711 PolarHBondContact O-N 2.97Å; I2709-L2711 VanDerWaalsContact C-N 3.3Å; I2709-L2711 PolarHBondContact O-N 3.29Å; L2711-I2713 VanDerWaalsContact C-N 3.33Å; L2711-I2713 PolarHBondContact O-N 2.96Å; L2711-S2714 WeakPolarHBondContact O-CB 3.41Å; L2711-S2714 PolarHBondContact O-N 3.09Å; L2711-V2715 HydrophobicContact CD1-CG2 4.21Å; L2711-V2715 HydrophobicContact CG-CG2 4.47Å; L2711-V2715 VanDerWaalsContact O-CG2 3.31Å; L2711-V2715 WeakPolarHBondContact O-CG2 3.31Å; L2711-V2715 PolarHBondContact O-N 2.95Å
2712L93.2Very high90.8Very high1 Ų139.7 Ų39.71%0.00519%0.191CC..Hα-helixtrans-69.2-30.6-179.1-69.9176.9000112.7L2693 L2694 I2697 I2708 I2709 G2716 M2723 I2746L2693-L2712 HydrophobicContact CB-CD1 4.33Å; L2693-L2712 HydrophobicContact CB-CD2 4.12Å; L2693-L2712 HydrophobicContact CB-CG 4.46Å; L2693-L2712 HydrophobicContact CD1-CD2 4.07Å; L2694-L2712 HydrophobicContact CD2-CD1 3.74Å; L2694-L2712 HydrophobicContact CG-CD1 4.31Å; I2697-L2712 HydrophobicContact CD1-CD1 4.23Å; I2697-L2712 HydrophobicContact CG2-CD1 3.83Å; I2708-L2712 HydrophobicContact CG2-CD1 3.76Å; I2708-L2712 HydrophobicContact CG2-CG 4.22Å; I2708-L2712 WeakPolarHBondContact O-CB 3.41Å; I2708-L2712 VanDerWaalsContact O-CG 3.23Å; I2708-L2712 WeakPolarHBondContact O-CG 3.42Å; I2708-L2712 PolarHBondContact O-N 3.1Å; I2709-L2712 PolarHBondContact O-N 3.1Å; L2712-G2716 WeakPolarHBondContact O-CA 3.38Å; L2712-G2716 PolarHBondContact O-N 2.85Å; L2712-M2723 HydrophobicContact CB-CE 4.13Å; L2712-M2723 HydrophobicContact CD2-CE 3.89Å; L2712-M2723 HydrophobicContact CD2-SD 4.29Å; L2712-M2723 HydrophobicContact CG-CE 4.44Å; L2712-I2746 HydrophobicContact CB-CD1 3.83Å; L2712-I2746 HydrophobicContact CB-CG1 4.47Å; L2712-I2746 HydrophobicContact CD1-CD1 3.94Å; L2712-I2746 HydrophobicContact CG-CD1 4.47Å
2713I93.5Very high91.2Very high31.75 Ų31.7534.3 Ų34.316%0.16317%0.165CC..Hα-helixtrans-63.7-49.4168.8-71.4168.8000109.6I2709 L2711 V2715 G2716 Q2717 I2746 S2749I2709-I2713 HydrophobicContact CG2-CD1 3.77Å; I2709-I2713 HydrophobicContact CG2-CG1 4.34Å; I2709-I2713 WeakPolarHBondContact O-CB 3.42Å; I2709-I2713 VanDerWaalsContact O-CG1 3.29Å; I2709-I2713 WeakPolarHBondContact O-CG1 3.31Å; I2709-I2713 PolarHBondContact O-N 3.05Å; L2711-I2713 VanDerWaalsContact C-N 3.33Å; L2711-I2713 PolarHBondContact O-N 2.96Å; I2713-V2715 VanDerWaalsContact C-N 3.33Å; I2713-V2715 PolarHBondContact O-N 3.12Å; I2713-G2716 PolarHBondContact O-N 3.21Å; I2713-G2716 VanDerWaalsContact O-N 3.13Å; I2713-Q2717 HydrophobicContact CG2-CG 4.43Å; I2713-Q2717 WeakPolarHBondContact O-CG 3.3Å; I2713-Q2717 PolarHBondContact O-N 3.01Å; I2713-I2746 HydrophobicContact CG1-CB 4.42Å; I2713-I2746 HydrophobicContact CG1-CG1 4.09Å; I2713-I2746 HydrophobicContact CG1-CG2 4.29Å; I2713-S2749 WeakPolarHBondContact CG2-OG 3.4Å
2714S93Very high91.6Very high52.5 Ų52.527.3 Ų27.337%0.36714%0.138SC..Hα-helixtrans-60-41.5179.2-56.50000112.4D2710 L2711 R2718D2710-S2714 WeakPolarHBondContact O-CB 3.38Å; D2710-S2714 PolarHBondContact O-N 3.25Å; D2710-S2714 VanDerWaalsContact O-N 3.11Å; D2710-S2714 PolarHBondContact O-OG 3.1Å; L2711-S2714 WeakPolarHBondContact O-CB 3.41Å; L2711-S2714 PolarHBondContact O-N 3.09Å; S2714-R2718 PolarHBondContact O-N 3.1Å
2715V92.9Very high91.9Very high0.75 Ų0.7528.4 Ų28.41%0.00514%0.142CC..Hα-helixtrans-68.3-41.4174.2172.40000111.3L2683 W2686 L2687 I2690 L2711 I2713 R2718 Y2719 M2723L2683-V2715 HydrophobicContact CD2-CG2 4.12Å; W2686-V2715 HydrophobicContact CB-CG2 4.07Å; L2687-V2715 HydrophobicContact CD2-CG1 3.76Å; I2690-V2715 HydrophobicContact CD1-CG1 4.27Å; I2690-V2715 HydrophobicContact CG1-CG1 4.39Å; L2711-V2715 HydrophobicContact CD1-CG2 4.21Å; L2711-V2715 HydrophobicContact CG-CG2 4.47Å; L2711-V2715 VanDerWaalsContact O-CG2 3.31Å; L2711-V2715 WeakPolarHBondContact O-CG2 3.31Å; L2711-V2715 PolarHBondContact O-N 2.95Å; I2713-V2715 VanDerWaalsContact C-N 3.33Å; I2713-V2715 PolarHBondContact O-N 3.12Å; V2715-R2718 PolarHBondContact O-N 3.23Å; V2715-Y2719 WeakPolarHBondContact O-CA 3.44Å; V2715-Y2719 PolarHBondContact O-N 3.09Å; V2715-M2723 HydrophobicContact CG1-CG 4.07Å; V2715-M2723 HydrophobicContact CG1-SD 4.11Å
2716G92.3Very high92Very high0 Ų029.1 Ų29.10%015%0.146CC..Hα-helixtrans-65.5-38.5179.800000114L2712 I2713 P2720L2712-G2716 WeakPolarHBondContact O-CA 3.38Å; L2712-G2716 PolarHBondContact O-N 2.85Å; I2713-G2716 PolarHBondContact O-N 3.21Å; I2713-G2716 VanDerWaalsContact O-N 3.13Å; G2716-P2720 VanDerWaalsContact O-CA 3.23Å; G2716-P2720 WeakPolarHBondContact O-CA 3.31Å; G2716-P2720 VanDerWaalsContact O-CB 3.31Å; G2716-P2720 WeakPolarHBondContact O-CB 3.31Å; G2716-P2720 WeakPolarHBondContact O-CD 3.37Å
2717Q91.3Very high92.1Very high71.25 Ų71.2526.8 Ų26.833%0.33313%0.132SC..Hα-helixtrans-66.1-40.5174.1-70.9175.1-300111.6I2713 S2749I2713-Q2717 HydrophobicContact CG2-CG 4.43Å; I2713-Q2717 WeakPolarHBondContact O-CG 3.3Å; I2713-Q2717 PolarHBondContact O-N 3.01Å; Q2717-S2749 PolarHBondContact NE2-OG 3.03Å; Q2717-S2749 VanDerWaalsContact NE2-OG 3.11Å
2718R91.7Very high92.1Very high172.25 Ų172.2526.5 Ų26.565%0.6513%0.13SC*.Hα-helixtrans-81.9-36.2-177.6-172.957.1177.5176.70.6114.1L2683 S2714 V2715 P2720L2683-R2718 HydrophobicContact CD1-CB 4.01Å; L2683-R2718 HydrophobicContact CD1-CG 4.28Å; S2714-R2718 PolarHBondContact O-N 3.1Å; V2715-R2718 PolarHBondContact O-N 3.23Å; R2718-P2720 VanDerWaalsContact C-CD 3.43Å; R2718-P2720 WeakPolarHBondContact O-CD 3.3Å
2719Y93.8Very high92Very high24.5 Ų24.527 Ų2710%0.09613%0.133CC..  trans-132.160-173.4-56.9-58.9000111.6L2683 D2684 L2687 V2715 Q2721 S2722 Y2897L2683-Y2719 HydrophobicContact CB-CE2 3.88Å; D2684-Y2719 HydrophobicContact CB-CE2 4.45Å; D2684-Y2719 PolarHBondContact OD1-OH 3.18Å; L2687-Y2719 HydrophobicContact CD1-CD2 4.01Å; L2687-Y2719 HydrophobicContact CD1-CE2 4.21Å; L2687-Y2719 HydrophobicContact CD1-CG 4.24Å; L2687-Y2719 HydrophobicContact CD2-CD2 3.77Å; L2687-Y2719 HydrophobicContact CD2-CG 4.11Å; L2687-Y2719 HydrophobicContact CG-CD2 4.21Å; V2715-Y2719 WeakPolarHBondContact O-CA 3.44Å; V2715-Y2719 PolarHBondContact O-N 3.09Å; Y2719-Q2721 VanDerWaalsContact C-N 3.28Å; Y2719-Q2721 PolarHBondContact O-N 3.01Å; Y2719-Q2721 VanDerWaalsContact O-N 3.15Å; Y2719-S2722 PolarHBondContact O-N 3.28Å; Y2719-S2722 VanDerWaalsContact O-N 3.07Å; Y2719-Y2897 WeakPolarHBondContact CD1-OH 3.48Å
2720P93.8Very high91.8Very high18 Ų1827.3 Ų27.312%0.11714%0.136CC..Hα-helixtrans-61.6-34.2-169.924.6-35.6000113.3G2716 R2718 S2722 M2723 V2724 M2750 L2757G2716-P2720 VanDerWaalsContact O-CA 3.23Å; G2716-P2720 WeakPolarHBondContact O-CA 3.31Å; G2716-P2720 VanDerWaalsContact O-CB 3.31Å; G2716-P2720 WeakPolarHBondContact O-CB 3.31Å; G2716-P2720 WeakPolarHBondContact O-CD 3.37Å; R2718-P2720 VanDerWaalsContact C-CD 3.43Å; R2718-P2720 WeakPolarHBondContact O-CD 3.3Å; P2720-S2722 VanDerWaalsContact C-N 3.29Å; P2720-S2722 PolarHBondContact O-N 3.12Å; P2720-M2723 PolarHBondContact O-N 2.96Å; P2720-M2723 VanDerWaalsContact O-N 3.12Å; P2720-V2724 WeakPolarHBondContact O-CG2 3.42Å; P2720-V2724 PolarHBondContact O-N 3.02Å; P2720-V2724 VanDerWaalsContact O-N 3.11Å; P2720-M2750 HydrophobicContact CB-CE 3.76Å; P2720-L2757 HydrophobicContact CB-CD2 3.74Å; P2720-L2757 HydrophobicContact CG-CD2 4.05Å
2721Q94.3Very high91.5Very high20.5 Ų20.525.7 Ų25.710%0.09613%0.125CC..Hα-helixtrans-60.7-32.5178.6-63-74.1-2.800113.4Y2719 M2723 L2757 Q2890 A2892 Y2897 L2903Y2719-Q2721 VanDerWaalsContact C-N 3.28Å; Y2719-Q2721 PolarHBondContact O-N 3.01Å; Y2719-Q2721 VanDerWaalsContact O-N 3.15Å; Q2721-M2723 VanDerWaalsContact C-N 3.32Å; Q2721-M2723 PolarHBondContact O-N 2.97Å; Q2721-L2757 VanDerWaalsContact NE2-CD1 3.34Å; Q2721-Q2890 PolarHBondContact NE2-O 3.31Å; Q2721-A2892 HydrophobicContact CB-CB 4.46Å; Q2721-A2892 HydrophobicContact CG-CB 4.48Å; Q2721-A2892 VanDerWaalsContact OE1-CB 3.28Å; Q2721-Y2897 HydrophobicContact CB-CD1 4.08Å; Q2721-Y2897 HydrophobicContact CB-CD2 3.55Å; Q2721-Y2897 VanDerWaalsContact CB-CD2 3.49Å; Q2721-Y2897 HydrophobicContact CB-CE1 4.33Å; Q2721-Y2897 HydrophobicContact CB-CE2 3.82Å; Q2721-Y2897 HydrophobicContact CB-CG 3.68Å; Q2721-Y2897 HydrophobicContact CG-CD2 4.01Å; Q2721-Y2897 HydrophobicContact CG-CE2 4.13Å; Q2721-L2903 HydrophobicContact CG-CD1 4Å
2722S92Very high90.9Very high30.5 Ų30.527 Ų2721%0.21313%0.13CC..Hα-helixtrans-74.2-26.8175-73.60000113.2Y2719 P2720 P2726 Y2897Y2719-S2722 PolarHBondContact O-N 3.28Å; Y2719-S2722 VanDerWaalsContact O-N 3.07Å; P2720-S2722 VanDerWaalsContact C-N 3.29Å; P2720-S2722 PolarHBondContact O-N 3.12Å; S2722-P2726 WeakPolarHBondContact O-CG 3.5Å; S2722-Y2897 VanDerWaalsContact OG-CD1 3.29Å; S2722-Y2897 WeakPolarHBondContact OG-CD1 3.35Å; S2722-Y2897 WeakPolarHBondContact OG-CE1 3.4Å
2723M92.6Very high89.8Confident0 Ų027.2 Ų27.20%013%0.132CC..Hα-helixtrans-95.8-24.6-171.3-73.5-64-6200113.2I2690 L2694 L2712 V2715 P2720 Q2721 P2726 L2727 I2746 M2750I2690-M2723 HydrophobicContact CB-SD 4.36Å; I2690-M2723 HydrophobicContact CD1-CG 4.38Å; I2690-M2723 HydrophobicContact CD1-SD 3.62Å; I2690-M2723 VanDerWaalsContact CD1-SD 3.54Å; I2690-M2723 HydrophobicContact CG1-SD 3.77Å; I2690-M2723 HydrophobicContact CG2-CE 4.48Å; I2690-M2723 HydrophobicContact CG2-SD 3.63Å; I2690-M2723 VanDerWaalsContact CG2-SD 3.57Å; L2694-M2723 HydrophobicContact CD1-CE 4.4Å; L2694-M2723 HydrophobicContact CD2-CE 4.44Å; L2712-M2723 HydrophobicContact CB-CE 4.13Å; L2712-M2723 HydrophobicContact CD2-CE 3.89Å; L2712-M2723 HydrophobicContact CD2-SD 4.29Å; L2712-M2723 HydrophobicContact CG-CE 4.44Å; V2715-M2723 HydrophobicContact CG1-CG 4.07Å; V2715-M2723 HydrophobicContact CG1-SD 4.11Å; P2720-M2723 PolarHBondContact O-N 2.96Å; P2720-M2723 VanDerWaalsContact O-N 3.12Å; Q2721-M2723 VanDerWaalsContact C-N 3.32Å; Q2721-M2723 PolarHBondContact O-N 2.97Å; M2723-P2726 WeakPolarHBondContact O-CD 3.37Å; M2723-L2727 HydrophobicContact CB-CD1 4.01Å; M2723-L2727 HydrophobicContact CE-CD1 3.82Å; M2723-L2727 HydrophobicContact CE-CD2 4.17Å; M2723-L2727 HydrophobicContact CE-CG 3.94Å; M2723-L2727 VanDerWaalsContact O-CB 3.29Å; M2723-L2727 WeakPolarHBondContact O-CB 3.41Å; M2723-L2727 VanDerWaalsContact O-CG 3.24Å; M2723-L2727 WeakPolarHBondContact O-CG 3.37Å; M2723-L2727 PolarHBondContact O-N 3.02Å; M2723-I2746 HydrophobicContact CE-CG2 4.35Å; M2723-M2750 HydrophobicContact CB-CE 3.91Å; M2723-M2750 HydrophobicContact CB-SD 3.98Å
2724V92.9Very high88.3Confident0.5 Ų0.528.3 Ų28.30%0.00315%0.151CC..Hα-helixtrans-62.6-53.3-169.893.30000113.6P2720 L2727 V2728 M2750 L2757 I2758 A2761 L2891P2720-V2724 WeakPolarHBondContact O-CG2 3.42Å; P2720-V2724 PolarHBondContact O-N 3.02Å; P2720-V2724 VanDerWaalsContact O-N 3.11Å; V2724-L2727 PolarHBondContact O-N 3.11Å; V2724-V2728 HydrophobicContact CG2-CG2 4.47Å; V2724-V2728 WeakPolarHBondContact O-CB 3.22Å; V2724-V2728 VanDerWaalsContact O-CG2 3.28Å; V2724-V2728 WeakPolarHBondContact O-CG2 3.42Å; V2724-V2728 PolarHBondContact O-N 3.29Å; V2724-M2750 HydrophobicContact CG2-CE 4.21Å; V2724-L2757 HydrophobicContact CG2-CD2 4.08Å; V2724-L2757 HydrophobicContact CG2-CG 4.12Å; V2724-I2758 HydrophobicContact CG2-CG1 4.35Å; V2724-A2761 HydrophobicContact CB-CB 4.44Å; V2724-A2761 HydrophobicContact CG1-CB 3.98Å; V2724-A2761 HydrophobicContact CG2-CB 3.32Å; V2724-L2891 HydrophobicContact CG1-CD1 3.82Å
2725Y92Very high87.1Confident24.5 Ų24.527.2 Ų27.210%0.09615%0.148CC..Hα-helixtrans-64-47.2-180-62.4-77.1000112.9L2727 V2728 L2729 L2764 L2891 A2892 P2894 I2981Y2725-L2727 VanDerWaalsContact C-N 3.32Å; Y2725-L2727 PolarHBondContact O-N 3.25Å; Y2725-V2728 PolarHBondContact O-N 3.24Å; Y2725-L2729 WeakPolarHBondContact O-CB 3.39Å; Y2725-L2729 PolarHBondContact O-N 3.35Å; Y2725-L2764 HydrophobicContact CE1-CD2 4.19Å; Y2725-L2764 WeakPolarHBondContact OH-CD2 3.12Å; Y2725-L2891 HydrophobicContact CE1-CD2 4.37Å; Y2725-L2891 HydrophobicContact CE2-CD1 4.13Å; Y2725-L2891 WeakPolarHBondContact OH-CD2 3.43Å; Y2725-L2891 VanDerWaalsContact OH-CG 3.31Å; Y2725-L2891 WeakPolarHBondContact OH-CG 3.4Å; Y2725-A2892 PolarHBondContact OH-O 3.19Å; Y2725-P2894 HydrophobicContact CE1-CB 4.23Å; Y2725-P2894 HydrophobicContact CE1-CG 4.09Å; Y2725-P2894 HydrophobicContact CE2-CB 4.31Å; Y2725-P2894 WeakPolarHBondContact OH-CD 3.46Å; Y2725-P2894 VanDerWaalsContact OH-CG 3.3Å; Y2725-P2894 WeakPolarHBondContact OH-CG 3.43Å; Y2725-I2981 HydrophobicContact CD1-CG2 3.99Å; Y2725-I2981 HydrophobicContact CG-CG2 3.97Å
2726P90.3Very high86.3Confident17.25 Ų17.2529.5 Ų29.511%0.11216%0.164CC..Hα-helixtrans-60.6-36.1176.7-26.436.7000114.1I2690 Q2691 L2694 S2722 M2723 A2730I2690-P2726 HydrophobicContact CG2-CB 4.2Å; I2690-P2726 HydrophobicContact CG2-CG 4.33Å; Q2691-P2726 VanDerWaalsContact NE2-CG 3.31Å; L2694-P2726 HydrophobicContact CD1-CB 3.31Å; L2694-P2726 HydrophobicContact CD1-CG 4.42Å; S2722-P2726 WeakPolarHBondContact O-CG 3.5Å; M2723-P2726 WeakPolarHBondContact O-CD 3.37Å; P2726-A2730 VanDerWaalsContact O-CB 3.3Å; P2726-A2730 WeakPolarHBondContact O-CB 3.38Å; P2726-A2730 PolarHBondContact O-N 3.12Å
2727L90.9Very high85.6Confident0 Ų034.5 Ų34.50%019%0.191CC..Hα-helixtrans-74.3-41.5178.2-73.8172.8000112.8L2694 M2723 V2724 Y2725 L2729 A2730 F2731 A2743 I2746 L2747 M2750L2694-L2727 HydrophobicContact CD1-CD2 4.46Å; L2694-L2727 HydrophobicContact CD2-CD2 3.77Å; M2723-L2727 HydrophobicContact CB-CD1 4.01Å; M2723-L2727 HydrophobicContact CE-CD1 3.82Å; M2723-L2727 HydrophobicContact CE-CD2 4.17Å; M2723-L2727 HydrophobicContact CE-CG 3.94Å; M2723-L2727 VanDerWaalsContact O-CB 3.29Å; M2723-L2727 WeakPolarHBondContact O-CB 3.41Å; M2723-L2727 VanDerWaalsContact O-CG 3.24Å; M2723-L2727 WeakPolarHBondContact O-CG 3.37Å; M2723-L2727 PolarHBondContact O-N 3.02Å; V2724-L2727 PolarHBondContact O-N 3.11Å; Y2725-L2727 VanDerWaalsContact C-N 3.32Å; Y2725-L2727 PolarHBondContact O-N 3.25Å; L2727-L2729 VanDerWaalsContact C-N 3.28Å; L2727-L2729 PolarHBondContact O-N 3.32Å; L2727-A2730 PolarHBondContact O-N 3.1Å; L2727-A2730 VanDerWaalsContact O-N 3.14Å; L2727-F2731 WeakPolarHBondContact O-CB 3.4Å; L2727-F2731 PolarHBondContact O-N 3.16Å; L2727-A2743 HydrophobicContact CD2-CB 4.45Å; L2727-I2746 HydrophobicContact CD1-CB 4.24Å; L2727-I2746 HydrophobicContact CD1-CG2 3.6Å; L2727-I2746 HydrophobicContact CD2-CB 4.1Å; L2727-I2746 HydrophobicContact CD2-CD1 4.03Å; L2727-I2746 HydrophobicContact CD2-CG2 4.12Å; L2727-I2746 HydrophobicContact CG-CG2 4.49Å; L2727-L2747 HydrophobicContact CB-CD1 4.28Å; L2727-L2747 HydrophobicContact CB-CD2 3.7Å; L2727-L2747 HydrophobicContact CB-CG 3.92Å; L2727-L2747 HydrophobicContact CD1-CD2 4.05Å; L2727-L2747 HydrophobicContact CD1-CG 4.29Å; L2727-L2747 HydrophobicContact CG-CD2 4.5Å; L2727-M2750 HydrophobicContact CD1-CE 4.4Å; L2727-M2750 HydrophobicContact CD1-SD 3.47Å; L2727-M2750 VanDerWaalsContact CD1-SD 3.52Å; L2727-M2750 WeakPolarHBondContact CD1-SD 3.32Å
2728V89.8Confident85.3Confident1.25 Ų1.2534.8 Ų34.81%0.00819%0.189CC..Hα-helixtrans-60-42.4173.8171.30000110V2724 Y2725 F2731 K2732 A2761 F2762 N2765V2724-V2728 HydrophobicContact CG2-CG2 4.47Å; V2724-V2728 WeakPolarHBondContact O-CB 3.22Å; V2724-V2728 VanDerWaalsContact O-CG2 3.28Å; V2724-V2728 WeakPolarHBondContact O-CG2 3.42Å; V2724-V2728 PolarHBondContact O-N 3.29Å; Y2725-V2728 PolarHBondContact O-N 3.24Å; V2728-F2731 PolarHBondContact O-N 3.2Å; V2728-K2732 HydrophobicContact CG1-CD 4.38Å; V2728-K2732 WeakPolarHBondContact O-CG 3.33Å; V2728-K2732 PolarHBondContact O-N 3.26Å; V2728-A2761 HydrophobicContact CG2-CB 4.38Å; V2728-F2762 HydrophobicContact CG1-CD1 4.19Å; V2728-F2762 HydrophobicContact CG1-CE1 4.14Å; V2728-F2762 HydrophobicContact CG2-CD1 4.35Å; V2728-F2762 HydrophobicContact CG2-CD2 4.19Å; V2728-F2762 HydrophobicContact CG2-CE1 4.3Å; V2728-F2762 HydrophobicContact CG2-CE2 4.01Å; V2728-F2762 HydrophobicContact CG2-CG 4.41Å; V2728-F2762 HydrophobicContact CG2-CZ 4.12Å; V2728-N2765 HydrophobicContact CG1-CB 3.9Å
2729L88Confident85Confident13.25 Ų13.2527.5 Ų27.57%0.06916%0.162CC..Hα-helixtrans-60.3-47.6172.5179.668.8000111.7Y2725 L2727 F2731 K2732 S2733 R2946 P2982Y2725-L2729 WeakPolarHBondContact O-CB 3.39Å; Y2725-L2729 PolarHBondContact O-N 3.35Å; L2727-L2729 VanDerWaalsContact C-N 3.28Å; L2727-L2729 PolarHBondContact O-N 3.32Å; L2729-F2731 VanDerWaalsContact C-N 3.28Å; L2729-F2731 PolarHBondContact O-N 3.03Å; L2729-K2732 PolarHBondContact O-N 3.02Å; L2729-S2733 VanDerWaalsContact CD1-OG 3.28Å; L2729-S2733 WeakPolarHBondContact CD1-OG 3.23Å; L2729-S2733 WeakPolarHBondContact O-CB 3.42Å; L2729-S2733 PolarHBondContact O-N 3.28Å; L2729-S2733 PolarHBondContact O-OG 3.23Å; L2729-R2946 HydrophobicContact CD2-CG 4.4Å; L2729-P2982 HydrophobicContact CD1-CB 4.28Å; L2729-P2982 HydrophobicContact CD2-CB 3.87Å; L2729-P2982 HydrophobicContact CD2-CG 4.35Å
2730A86.2Confident84.5Confident6.25 Ų6.2530.2 Ų30.25%0.05217%0.172CC..Hα-helixtrans-65.2-28.8179.800000113.4P2726 L2727 A2743P2726-A2730 VanDerWaalsContact O-CB 3.3Å; P2726-A2730 WeakPolarHBondContact O-CB 3.38Å; P2726-A2730 PolarHBondContact O-N 3.12Å; L2727-A2730 PolarHBondContact O-N 3.1Å; L2727-A2730 VanDerWaalsContact O-N 3.14Å; A2730-A2743 HydrophobicContact CB-CB 4Å
2731F85.6Confident84.2Confident38.75 Ų38.7534.2 Ų34.217%0.1719%0.185CC..Hα-helixtrans-75.7-44175177.6-98.1000112.5L2727 V2728 L2729 R2740 A2743 N2744 L2747 F2762 W3331 Y3335L2727-F2731 WeakPolarHBondContact O-CB 3.4Å; L2727-F2731 PolarHBondContact O-N 3.16Å; V2728-F2731 PolarHBondContact O-N 3.2Å; L2729-F2731 VanDerWaalsContact C-N 3.28Å; L2729-F2731 PolarHBondContact O-N 3.03Å; F2731-R2740 HydrophobicContact CD2-CG 3.71Å; F2731-R2740 HydrophobicContact CE2-CG 3.98Å; F2731-R2740 HydrophobicContact CG-CG 4.35Å; F2731-R2740 WeakPolarHBondContact O-CD 3.4Å; F2731-R2740 WeakPolarHBondContact O-CG 3.15Å; F2731-R2740 PolarHBondContact O-NE 3.15Å; F2731-R2740 VanDerWaalsContact O-NE 3.16Å; F2731-A2743 HydrophobicContact CB-CB 4.37Å; F2731-N2744 HydrophobicContact CD2-CB 4.04Å; F2731-N2744 HydrophobicContact CE2-CB 4.04Å; F2731-N2744 WeakPolarHBondContact CE2-OD1 3.21Å; F2731-L2747 HydrophobicContact CB-CD1 4.07Å; F2731-L2747 HydrophobicContact CD2-CD1 4.31Å; F2731-L2747 HydrophobicContact CG-CD1 4.33Å; F2731-F2762 AromaticContact CD1-CE1 3.75Å; F2731-F2762 HydrophobicContact CD1-CE1 3.75Å; F2731-F2762 AromaticContact CD1-CZ 3.84Å; F2731-F2762 HydrophobicContact CD1-CZ 3.84Å; F2731-F2762 AromaticContact CE1-CE1 3.98Å; F2731-F2762 HydrophobicContact CE1-CE1 4.01Å; F2731-F2762 HydrophobicContact CE1-CZ 4.17Å; F2731-F2762 HydrophobicContact CG-CZ 4.38Å; F2731-W3331 HydrophobicContact CE1-CE3 4.22Å; F2731-Y3335 HydrophobicContact CE2-CD2 4.34Å; F2731-Y3335 HydrophobicContact CZ-CD2 4.38Å
2732K79.5Confident83.9Confident41.5 Ų41.533.4 Ų33.418%0.1818%0.182CC..Hα-helixtrans-85-31-176.6-69.1-163.4178.8-172.80114.9V2728 L2729 G2734 F2762 N2765 E2766 W3331V2728-K2732 HydrophobicContact CG1-CD 4.38Å; V2728-K2732 WeakPolarHBondContact O-CG 3.33Å; V2728-K2732 PolarHBondContact O-N 3.26Å; L2729-K2732 PolarHBondContact O-N 3.02Å; K2732-G2734 PolarHBondContact O-N 3.03Å; K2732-F2762 HydrophobicContact CG-CE1 4.35Å; K2732-N2765 VanDerWaalsContact CD-OD1 3.25Å; K2732-N2765 WeakPolarHBondContact CD-OD1 3.38Å; K2732-N2765 WeakPolarHBondContact CE-OD1 3.38Å; K2732-N2765 PolarHBondContact NZ-OD1 3Å; K2732-E2766 VanDerWaalsContact NZ-CG 3.34Å; K2732-E2766 IonicContact NZ-OE1 3.21Å; K2732-E2766 PolarHBondContact NZ-OE1 3.3Å; K2732-W3331 HydrophobicContact CB-CD2 4.47Å; K2732-W3331 HydrophobicContact CB-CE3 4.33Å; K2732-W3331 HydrophobicContact CB-CH2 4.48Å; K2732-W3331 HydrophobicContact CB-CZ3 4.35Å; K2732-W3331 HydrophobicContact CD-CB 4.21Å; K2732-W3331 HydrophobicContact CD-CD2 3.88Å; K2732-W3331 HydrophobicContact CD-CE3 4.42Å; K2732-W3331 HydrophobicContact CD-CG 3.79Å; K2732-W3331 VanDerWaalsContact CE-CB 3.41Å; K2732-W3331 VanDerWaalsContact CE-CG 3.47Å; K2732-W3331 HydrophobicContact CG-CB 4.45Å; K2732-W3331 HydrophobicContact CG-CD2 3.8Å; K2732-W3331 HydrophobicContact CG-CE3 3.82Å; K2732-W3331 HydrophobicContact CG-CG 4.11Å; K2732-W3331 HydrophobicContact CG-CZ3 4.33Å
2733S70Confident83.8Confident5.5 Ų5.532 Ų324%0.03817%0.172CC..SBendtrans-64.8135.2-177.738.20000111.1L2729 G2735 R2739 L3179L2729-S2733 VanDerWaalsContact CD1-OG 3.28Å; L2729-S2733 WeakPolarHBondContact CD1-OG 3.23Å; L2729-S2733 WeakPolarHBondContact O-CB 3.42Å; L2729-S2733 PolarHBondContact O-N 3.28Å; L2729-S2733 PolarHBondContact O-OG 3.23Å; S2733-G2735 VanDerWaalsContact C-N 3.29Å; S2733-G2735 PolarHBondContact O-N 2.97Å; S2733-R2739 PolarHBondContact OG-NH1 3.18Å; S2733-L3179 VanDerWaalsContact OG-CD1 3.25Å; S2733-L3179 WeakPolarHBondContact OG-CD1 3.41Å
2734G61.6Low83.6Confident54.75 Ų54.7533.7 Ų33.756%0.56418%0.181SC*.SBendtrans-65.385.6-179.800000112.6K2732 L3179K2732-G2734 PolarHBondContact O-N 3.03Å; G2734-L3179 VanDerWaalsContact O-CD2 3.3Å; G2734-L3179 WeakPolarHBondContact O-CD2 3.42Å
2735G67.4Low83.4Confident30.5 Ų30.537.6 Ų37.631%0.31420%0.195SC..  trans-127-167177.700000112S2733S2733-G2735 VanDerWaalsContact C-N 3.29Å; S2733-G2735 PolarHBondContact O-N 2.97Å
2736S76.1Confident83.4Confident48.5 Ų48.536.5 Ų36.534%0.33919%0.191SC..  trans-60.7148.1178.968.50000112.3D2698 R2738 R2739 R2740D2698-S2736 VanDerWaalsContact CB-OG 3.24Å; D2698-S2736 WeakPolarHBondContact CB-OG 3.32Å; D2698-S2736 PolarHBondContact OD2-OG 3.22Å; S2736-R2738 PolarHBondContact O-N 3.25Å; S2736-R2739 WeakPolarHBondContact O-CA 3.34Å; S2736-R2739 VanDerWaalsContact O-CB 3.28Å; S2736-R2739 WeakPolarHBondContact O-CB 3.42Å; S2736-R2739 PolarHBondContact O-N 3.26Å; S2736-R2739 WeakPolarHBondContact OG-CB 3.41Å; S2736-R2739 PolarHBondContact OG-N 3.19Å; S2736-R2739 VanDerWaalsContact OG-N 3.12Å; S2736-R2740 PolarHBondContact O-N 3.26Å
2737D78.6Confident83.4Confident104.5 Ų104.535.8 Ų35.856%0.55919%0.186SC*.Hα-helixtrans-59.5-31.9175.5-64.8-37.6000111.9R2739 R2740 Y2741 A3364D2737-R2739 VanDerWaalsContact C-N 3.32Å; D2737-R2739 PolarHBondContact O-N 3.39Å; D2737-R2740 PolarHBondContact O-N 3.05Å; D2737-R2740 IonicContact OD1-CZ 3.57Å; D2737-R2740 IonicContact OD1-NE 2.69Å; D2737-R2740 IonicContact OD1-NH1 2.74Å; D2737-R2740 PolarHBondContact OD1-NH1 2.76Å; D2737-R2740 IonicContact OD1-NH2 2.9Å; D2737-R2740 PolarHBondContact OD1-NH2 3.17Å; D2737-Y2741 VanDerWaalsContact O-CB 3.27Å; D2737-Y2741 WeakPolarHBondContact O-CB 3.42Å; D2737-Y2741 PolarHBondContact O-N 3.19Å; D2737-A3364 HydrophobicContact CB-CB 4.35Å
2738R83.4Confident83.3Confident77.25 Ų77.2540.3 Ų40.329%0.29220%0.204SC..Hα-helixtrans-61.9-38.9173.2-169.2173.8-1781410.9112.3D2698 T2699 P2700 E2702 S2736 Y2741 N2742D2698-R2738 HydrophobicContact CB-CB 4.2Å; D2698-R2738 HydrophobicContact CB-CG 4.26Å; D2698-R2738 PolarHBondContact O-NE 2.93Å; T2699-R2738 VanDerWaalsContact O-CZ 3.25Å; T2699-R2738 PolarHBondContact O-NE 3.34Å; T2699-R2738 PolarHBondContact O-NH1 2.83Å; T2699-R2738 PolarHBondContact O-NH2 3.2Å; P2700-R2738 VanDerWaalsContact CA-NH1 3.33Å; P2700-R2738 PolarHBondContact O-NH1 3.13Å; P2700-R2738 PolarHBondContact O-NH2 3.36Å; E2702-R2738 IonicContact OE2-CZ 3.27Å; E2702-R2738 IonicContact OE2-NH1 2.99Å; E2702-R2738 PolarHBondContact OE2-NH1 3.32Å; E2702-R2738 IonicContact OE2-NH2 3.87Å; E2702-R2738 PolarHBondContact OE2-NH2 2.72Å; S2736-R2738 PolarHBondContact O-N 3.25Å; R2738-Y2741 PolarHBondContact O-N 3.4Å; R2738-N2742 WeakPolarHBondContact O-CB 3.31Å; R2738-N2742 PolarHBondContact O-N 3.34Å; R2738-N2742 PolarHBondContact O-ND2 3.17Å
2739R85.6Confident83.3Confident20.25 Ų20.2541.2 Ų41.28%0.07621%0.21CC..Hα-helixtrans-62.8-49.1175.1-173.5169-123.1-160.5-8.1110.9A2695 I2697 D2698 S2733 S2736 D2737 Y2741 N2742 A2743 D3177 P3178 L3179A2695-R2739 PolarHBondContact O-NH2 2.82Å; I2697-R2739 HydrophobicContact CD1-CG 3.94Å; I2697-R2739 WeakPolarHBondContact CD1-O 3.47Å; I2697-R2739 HydrophobicContact CG1-CG 3.88Å; I2697-R2739 HydrophobicContact CG2-CB 4.34Å; I2697-R2739 HydrophobicContact CG2-CG 3.78Å; D2698-R2739 HydrophobicContact CB-CB 3.93Å; D2698-R2739 IonicContact OD1-CZ 2.95Å; D2698-R2739 IonicContact OD1-NE 3.01Å; D2698-R2739 PolarHBondContact OD1-NE 3.23Å; D2698-R2739 IonicContact OD1-NH2 3.02Å; D2698-R2739 PolarHBondContact OD1-NH2 2.77Å; D2698-R2739 IonicContact OD2-CZ 3.54Å; D2698-R2739 IonicContact OD2-NE 2.98Å; D2698-R2739 PolarHBondContact OD2-NE 3.27Å; D2698-R2739 IonicContact OD2-NH2 2.98Å; S2733-R2739 PolarHBondContact OG-NH1 3.18Å; S2736-R2739 WeakPolarHBondContact O-CA 3.34Å; S2736-R2739 VanDerWaalsContact O-CB 3.28Å; S2736-R2739 WeakPolarHBondContact O-CB 3.42Å; S2736-R2739 PolarHBondContact O-N 3.26Å; S2736-R2739 WeakPolarHBondContact OG-CB 3.41Å; S2736-R2739 PolarHBondContact OG-N 3.19Å; S2736-R2739 VanDerWaalsContact OG-N 3.12Å; D2737-R2739 VanDerWaalsContact C-N 3.32Å; D2737-R2739 PolarHBondContact O-N 3.39Å; R2739-Y2741 PolarHBondContact O-N 3.48Å; R2739-N2742 PolarHBondContact O-N 3.25Å; R2739-A2743 WeakPolarHBondContact O-CB 3.33Å; R2739-A2743 PolarHBondContact O-N 3.28Å; R2739-D3177 IonicContact CZ-OD1 3.16Å; R2739-D3177 IonicContact NH1-OD1 3.01Å; R2739-D3177 PolarHBondContact NH1-OD1 3.3Å; R2739-D3177 IonicContact NH2-OD1 3.29Å; R2739-P3178 VanDerWaalsContact NH2-CD 3.3Å; R2739-L3179 VanDerWaalsContact NH1-CD1 3.31Å
2740R83.9Confident83.4Confident80.5 Ų80.540.6 Ų40.630%0.30421%0.207SC..Hα-helixtrans-62.6-44.3178.8-84.1-173-68.5157.8-0.4111.7F2731 S2736 D2737 N2742 A2743 N2744F2731-R2740 HydrophobicContact CD2-CG 3.71Å; F2731-R2740 HydrophobicContact CE2-CG 3.98Å; F2731-R2740 HydrophobicContact CG-CG 4.35Å; F2731-R2740 WeakPolarHBondContact O-CD 3.4Å; F2731-R2740 WeakPolarHBondContact O-CG 3.15Å; F2731-R2740 PolarHBondContact O-NE 3.15Å; F2731-R2740 VanDerWaalsContact O-NE 3.16Å; S2736-R2740 PolarHBondContact O-N 3.26Å; D2737-R2740 PolarHBondContact O-N 3.05Å; D2737-R2740 IonicContact OD1-CZ 3.57Å; D2737-R2740 IonicContact OD1-NE 2.69Å; D2737-R2740 IonicContact OD1-NH1 2.74Å; D2737-R2740 PolarHBondContact OD1-NH1 2.76Å; D2737-R2740 IonicContact OD1-NH2 2.9Å; D2737-R2740 PolarHBondContact OD1-NH2 3.17Å; R2740-N2742 PolarHBondContact O-N 2.82Å; R2740-A2743 PolarHBondContact O-N 2.84Å; R2740-N2744 VanDerWaalsContact O-CB 3.31Å; R2740-N2744 WeakPolarHBondContact O-CB 3.28Å; R2740-N2744 PolarHBondContact O-N 3.11Å
2741Y86.8Confident83.6Confident102 Ų10242.6 Ų42.640%0.422%0.216SC..Hα-helixtrans-59.2-49.2176.2176.1-104.8000112.3D2737 R2738 R2739 N2744 R2745 A3364D2737-Y2741 VanDerWaalsContact O-CB 3.27Å; D2737-Y2741 WeakPolarHBondContact O-CB 3.42Å; D2737-Y2741 PolarHBondContact O-N 3.19Å; R2738-Y2741 PolarHBondContact O-N 3.4Å; R2739-Y2741 PolarHBondContact O-N 3.48Å; Y2741-N2744 WeakPolarHBondContact O-CB 3.23Å; Y2741-N2744 PolarHBondContact O-N 3.16Å; Y2741-R2745 VanDerWaalsContact CE1-CD 3.48Å; Y2741-R2745 HydrophobicContact CE1-CG 4.34Å; Y2741-R2745 HydrophobicContact CE2-CG 4.48Å; Y2741-R2745 WeakPolarHBondContact O-CG 3.34Å; Y2741-R2745 PolarHBondContact O-N 3.17Å; Y2741-A3364 WeakPolarHBondContact CD1-O 3.41Å; Y2741-A3364 WeakPolarHBondContact CD2-O 3.31Å
2742N89Confident83.6Confident4.75 Ų4.7547.5 Ų47.53%0.02524%0.239CC..Hα-helixtrans-69.9-37.5-179.6-72.3-22.4000112.6I2697 I2709 R2738 R2739 R2740 N2744 R2745 I2746I2697-N2742 HydrophobicContact CB-CB 4.38Å; I2697-N2742 HydrophobicContact CD1-CB 3.91Å; I2697-N2742 HydrophobicContact CG1-CB 3.72Å; I2697-N2742 PolarHBondContact O-ND2 3.13Å; I2709-N2742 HydrophobicContact CD1-CB 4Å; I2709-N2742 VanDerWaalsContact CD1-CG 3.42Å; I2709-N2742 WeakPolarHBondContact CD1-OD1 3.32Å; I2709-N2742 HydrophobicContact CG1-CB 4.42Å; R2738-N2742 WeakPolarHBondContact O-CB 3.31Å; R2738-N2742 PolarHBondContact O-N 3.34Å; R2738-N2742 PolarHBondContact O-ND2 3.17Å; R2739-N2742 PolarHBondContact O-N 3.25Å; R2740-N2742 PolarHBondContact O-N 2.82Å; N2742-N2744 VanDerWaalsContact C-N 3.33Å; N2742-N2744 PolarHBondContact O-N 3.38Å; N2742-R2745 WeakPolarHBondContact O-CB 3.45Å; N2742-R2745 PolarHBondContact O-N 2.98Å; N2742-R2745 PolarHBondContact OD1-NH1 3.1Å; N2742-I2746 WeakPolarHBondContact O-CG1 3.39Å; N2742-I2746 PolarHBondContact O-N 3.14Å
2743A89.5Confident83.9Confident0 Ų051.1 Ų51.10%026%0.256CS..Hα-helixtrans-61.9-43.5172.500000111.5I2697 L2727 A2730 F2731 R2739 R2740 R2745 I2746 L2747I2697-A2743 HydrophobicContact CD1-CB 4.07Å; L2727-A2743 HydrophobicContact CD2-CB 4.45Å; A2730-A2743 HydrophobicContact CB-CB 4Å; F2731-A2743 HydrophobicContact CB-CB 4.37Å; R2739-A2743 WeakPolarHBondContact O-CB 3.33Å; R2739-A2743 PolarHBondContact O-N 3.28Å; R2740-A2743 PolarHBondContact O-N 2.84Å; A2743-R2745 VanDerWaalsContact C-N 3.35Å; A2743-R2745 PolarHBondContact O-N 3.13Å; A2743-I2746 PolarHBondContact O-N 3.04Å; A2743-L2747 WeakPolarHBondContact O-CG 3.41Å; A2743-L2747 PolarHBondContact O-N 3.02Å
2744N88.4Confident84.9Confident36.5 Ų36.552.7 Ų52.720%0.19527%0.265CS..Hα-helixtrans-62.7-39.1176.9-16746.1000112.4F2731 R2740 Y2741 N2742 I2746 L2747 Y2748 Y3335F2731-N2744 HydrophobicContact CD2-CB 4.04Å; F2731-N2744 HydrophobicContact CE2-CB 4.04Å; F2731-N2744 WeakPolarHBondContact CE2-OD1 3.21Å; R2740-N2744 VanDerWaalsContact O-CB 3.31Å; R2740-N2744 WeakPolarHBondContact O-CB 3.28Å; R2740-N2744 PolarHBondContact O-N 3.11Å; Y2741-N2744 WeakPolarHBondContact O-CB 3.23Å; Y2741-N2744 PolarHBondContact O-N 3.16Å; N2742-N2744 VanDerWaalsContact C-N 3.33Å; N2742-N2744 PolarHBondContact O-N 3.38Å; N2744-I2746 VanDerWaalsContact C-N 3.33Å; N2744-I2746 PolarHBondContact O-N 3.09Å; N2744-L2747 PolarHBondContact O-N 3.17Å; N2744-Y2748 VanDerWaalsContact CG-CE2 3.47Å; N2744-Y2748 WeakPolarHBondContact ND2-CE2 3.48Å; N2744-Y2748 VanDerWaalsContact O-CB 3.3Å; N2744-Y2748 WeakPolarHBondContact O-CB 3.29Å; N2744-Y2748 VanDerWaalsContact O-CD2 3.23Å; N2744-Y2748 WeakPolarHBondContact O-CD2 3.48Å; N2744-Y2748 PolarHBondContact O-N 3.08Å; N2744-Y2748 WeakPolarHBondContact OD1-CE2 3.45Å; N2744-Y3335 VanDerWaalsContact OD1-CD2 3.24Å; N2744-Y3335 WeakPolarHBondContact OD1-CD2 3.37Å; N2744-Y3335 VanDerWaalsContact OD1-CE2 3.24Å; N2744-Y3335 WeakPolarHBondContact OD1-CE2 3.36Å
2745R88.8Confident86.3Confident82.25 Ų82.2553 Ų5331%0.3126%0.258SS..Hα-helixtrans-59.4-41.9174.7-76.4175.962-159.32112.6Y2741 N2742 A2743 S2749Y2741-R2745 VanDerWaalsContact CE1-CD 3.48Å; Y2741-R2745 HydrophobicContact CE1-CG 4.34Å; Y2741-R2745 HydrophobicContact CE2-CG 4.48Å; Y2741-R2745 WeakPolarHBondContact O-CG 3.34Å; Y2741-R2745 PolarHBondContact O-N 3.17Å; N2742-R2745 WeakPolarHBondContact O-CB 3.45Å; N2742-R2745 PolarHBondContact O-N 2.98Å; N2742-R2745 PolarHBondContact OD1-NH1 3.1Å; A2743-R2745 VanDerWaalsContact C-N 3.35Å; A2743-R2745 PolarHBondContact O-N 3.13Å; R2745-S2749 PolarHBondContact O-N 2.97Å
2746I91.6Very high87.5Confident0 Ų056.1 Ų56.10%026%0.26CS..Hα-helixtrans-71-45.1178.9-58163.2000110.2I2697 I2709 L2712 I2713 M2723 L2727 N2742 A2743 N2744 Y2748 S2749 M2750I2697-I2746 HydrophobicContact CD1-CD1 3.57Å; I2697-I2746 VanDerWaalsContact CD1-CD1 3.43Å; I2709-I2746 HydrophobicContact CG2-CG1 4.21Å; L2712-I2746 HydrophobicContact CB-CD1 3.83Å; L2712-I2746 HydrophobicContact CB-CG1 4.47Å; L2712-I2746 HydrophobicContact CD1-CD1 3.94Å; L2712-I2746 HydrophobicContact CG-CD1 4.47Å; I2713-I2746 HydrophobicContact CG1-CB 4.42Å; I2713-I2746 HydrophobicContact CG1-CG1 4.09Å; I2713-I2746 HydrophobicContact CG1-CG2 4.29Å; M2723-I2746 HydrophobicContact CE-CG2 4.35Å; L2727-I2746 HydrophobicContact CD1-CB 4.24Å; L2727-I2746 HydrophobicContact CD1-CG2 3.6Å; L2727-I2746 HydrophobicContact CD2-CB 4.1Å; L2727-I2746 HydrophobicContact CD2-CD1 4.03Å; L2727-I2746 HydrophobicContact CD2-CG2 4.12Å; L2727-I2746 HydrophobicContact CG-CG2 4.49Å; N2742-I2746 WeakPolarHBondContact O-CG1 3.39Å; N2742-I2746 PolarHBondContact O-N 3.14Å; A2743-I2746 PolarHBondContact O-N 3.04Å; N2744-I2746 VanDerWaalsContact C-N 3.33Å; N2744-I2746 PolarHBondContact O-N 3.09Å; I2746-Y2748 VanDerWaalsContact C-N 3.3Å; I2746-Y2748 PolarHBondContact O-N 3.05Å; I2746-S2749 PolarHBondContact O-N 3.07Å; I2746-M2750 HydrophobicContact CG2-CG 4.49Å; I2746-M2750 HydrophobicContact CG2-SD 4.15Å; I2746-M2750 WeakPolarHBondContact O-CG 3.45Å; I2746-M2750 PolarHBondContact O-N 3.26Å; I2746-M2750 VanDerWaalsContact O-N 3.11Å
2747L90.1Very high88.3Confident3.25 Ų3.2553.9 Ų53.92%0.01725%0.245CC..Hα-helixtrans-57.4-45176.6-76.5168.8000111.9L2727 F2731 A2743 N2744 S2749 M2750 E2751 I2758 F2762 Y3335L2727-L2747 HydrophobicContact CB-CD1 4.28Å; L2727-L2747 HydrophobicContact CB-CD2 3.7Å; L2727-L2747 HydrophobicContact CB-CG 3.92Å; L2727-L2747 HydrophobicContact CD1-CD2 4.05Å; L2727-L2747 HydrophobicContact CD1-CG 4.29Å; L2727-L2747 HydrophobicContact CG-CD2 4.5Å; F2731-L2747 HydrophobicContact CB-CD1 4.07Å; F2731-L2747 HydrophobicContact CD2-CD1 4.31Å; F2731-L2747 HydrophobicContact CG-CD1 4.33Å; A2743-L2747 WeakPolarHBondContact O-CG 3.41Å; A2743-L2747 PolarHBondContact O-N 3.02Å; N2744-L2747 PolarHBondContact O-N 3.17Å; L2747-S2749 PolarHBondContact O-N 2.84Å; L2747-M2750 CarbonylContact O-C 3.59Å; L2747-M2750 WeakPolarHBondContact O-CA 3.36Å; L2747-M2750 WeakPolarHBondContact O-CB 3.42Å; L2747-M2750 PolarHBondContact O-N 2.91Å; L2747-M2750 VanDerWaalsContact O-N 3.12Å; L2747-E2751 WeakPolarHBondContact O-CB 3.39Å; L2747-E2751 PolarHBondContact O-N 3.18Å; L2747-I2758 HydrophobicContact CD2-CD1 4.43Å; L2747-I2758 HydrophobicContact CD2-CG2 4.41Å; L2747-I2758 VanDerWaalsContact O-CD1 3.31Å; L2747-I2758 WeakPolarHBondContact O-CD1 3.35Å; L2747-F2762 HydrophobicContact CD1-CE2 4.27Å; L2747-F2762 HydrophobicContact CD1-CZ 4.07Å; L2747-Y3335 HydrophobicContact CB-CE2 3.85Å; L2747-Y3335 HydrophobicContact CD1-CE2 4.44Å
2748Y89.1Confident88.9Confident95.25 Ų95.2549.1 Ų49.137%0.37422%0.219SC..Hα-helixtrans-59-45.7177.9-157.3-81.3000112.5N2744 I2746 M2750 E2751 E2752 Y3335 K3339 K3343N2744-Y2748 VanDerWaalsContact CG-CE2 3.47Å; N2744-Y2748 WeakPolarHBondContact ND2-CE2 3.48Å; N2744-Y2748 VanDerWaalsContact O-CB 3.3Å; N2744-Y2748 WeakPolarHBondContact O-CB 3.29Å; N2744-Y2748 VanDerWaalsContact O-CD2 3.23Å; N2744-Y2748 WeakPolarHBondContact O-CD2 3.48Å; N2744-Y2748 PolarHBondContact O-N 3.08Å; N2744-Y2748 WeakPolarHBondContact OD1-CE2 3.45Å; I2746-Y2748 VanDerWaalsContact C-N 3.3Å; I2746-Y2748 PolarHBondContact O-N 3.05Å; Y2748-M2750 VanDerWaalsContact C-N 3.26Å; Y2748-M2750 PolarHBondContact O-N 3.19Å; Y2748-E2751 VanDerWaalsContact O-CB 3.28Å; Y2748-E2751 WeakPolarHBondContact O-CB 3.3Å; Y2748-E2751 PolarHBondContact O-N 3.23Å; Y2748-E2751 VanDerWaalsContact O-N 3.13Å; Y2748-E2752 WeakPolarHBondContact CE1-OE1 3.46Å; Y2748-E2752 PolarHBondContact O-N 3.12Å; Y2748-Y3335 WeakPolarHBondContact CA-OH 3.48Å; Y2748-K3339 HydrophobicContact CD2-CG 3.98Å; Y2748-K3339 HydrophobicContact CE2-CG 3.95Å; Y2748-K3343 HydrophobicContact CE2-CG 4.44Å; Y2748-K3343 WeakPolarHBondContact OH-CE 3.4Å
2749S89.4Confident89.3Confident19.25 Ų19.2547.7 Ų47.714%0.13522%0.221CC..Hα-helixtrans-67.8-28.4177.5-173.90000113I2713 Q2717 R2745 I2746 L2747 E2751 E2752I2713-S2749 WeakPolarHBondContact CG2-OG 3.4Å; Q2717-S2749 PolarHBondContact NE2-OG 3.03Å; Q2717-S2749 VanDerWaalsContact NE2-OG 3.11Å; R2745-S2749 PolarHBondContact O-N 2.97Å; I2746-S2749 PolarHBondContact O-N 3.07Å; L2747-S2749 PolarHBondContact O-N 2.84Å; S2749-E2751 VanDerWaalsContact C-N 3.29Å; S2749-E2751 PolarHBondContact O-N 2.82Å; S2749-E2752 PolarHBondContact OG-OE2 3.13Å
2750M91.3Very high89.7Confident0.25 Ų0.2546.8 Ų46.80%0.00122%0.217CC..Hα-helixtrans-73.3-30171-70.3175.555.100112.3P2720 M2723 V2724 L2727 I2746 L2747 Y2748 E2752 Q2753 N2754 I2758P2720-M2750 HydrophobicContact CB-CE 3.76Å; M2723-M2750 HydrophobicContact CB-CE 3.91Å; M2723-M2750 HydrophobicContact CB-SD 3.98Å; V2724-M2750 HydrophobicContact CG2-CE 4.21Å; L2727-M2750 HydrophobicContact CD1-CE 4.4Å; L2727-M2750 HydrophobicContact CD1-SD 3.47Å; L2727-M2750 VanDerWaalsContact CD1-SD 3.52Å; L2727-M2750 WeakPolarHBondContact CD1-SD 3.32Å; I2746-M2750 HydrophobicContact CG2-CG 4.49Å; I2746-M2750 HydrophobicContact CG2-SD 4.15Å; I2746-M2750 WeakPolarHBondContact O-CG 3.45Å; I2746-M2750 PolarHBondContact O-N 3.26Å; I2746-M2750 VanDerWaalsContact O-N 3.11Å; L2747-M2750 CarbonylContact O-C 3.59Å; L2747-M2750 WeakPolarHBondContact O-CA 3.36Å; L2747-M2750 WeakPolarHBondContact O-CB 3.42Å; L2747-M2750 PolarHBondContact O-N 2.91Å; L2747-M2750 VanDerWaalsContact O-N 3.12Å; Y2748-M2750 VanDerWaalsContact C-N 3.26Å; Y2748-M2750 PolarHBondContact O-N 3.19Å; M2750-E2752 VanDerWaalsContact C-N 3.32Å; M2750-E2752 PolarHBondContact O-N 3.02Å; M2750-Q2753 PolarHBondContact O-N 3.19Å; M2750-N2754 WeakPolarHBondContact O-CB 3.37Å; M2750-N2754 PolarHBondContact O-N 3.3Å; M2750-N2754 PolarHBondContact O-ND2 2.86Å; M2750-I2758 HydrophobicContact CB-CD1 3.7Å
2751E88.9Confident90.1Very high49.5 Ų49.543 Ų4323%0.23120%0.203CC..Hα-helixtrans-66.9-35.1-178-159-177-179.700112.4L2747 Y2748 S2749 Q2753 N2754 S2755 I2758 Y3335 K3339L2747-E2751 WeakPolarHBondContact O-CB 3.39Å; L2747-E2751 PolarHBondContact O-N 3.18Å; Y2748-E2751 VanDerWaalsContact O-CB 3.28Å; Y2748-E2751 WeakPolarHBondContact O-CB 3.3Å; Y2748-E2751 PolarHBondContact O-N 3.23Å; Y2748-E2751 VanDerWaalsContact O-N 3.13Å; S2749-E2751 VanDerWaalsContact C-N 3.29Å; S2749-E2751 PolarHBondContact O-N 2.82Å; E2751-Q2753 PolarHBondContact O-N 3.15Å; E2751-Q2753 VanDerWaalsContact O-N 3.16Å; E2751-N2754 PolarHBondContact O-N 3.18Å; E2751-S2755 VanDerWaalsContact CG-CA 3.48Å; E2751-S2755 WeakPolarHBondContact O-CA 3.32Å; E2751-S2755 WeakPolarHBondContact O-CB 3.44Å; E2751-S2755 PolarHBondContact O-N 3.36Å; E2751-S2755 PolarHBondContact OE1-OG 2.92Å; E2751-I2758 VanDerWaalsContact CA-CD1 3.5Å; E2751-I2758 HydrophobicContact CB-CD1 3.86Å; E2751-I2758 HydrophobicContact CG-CB 4.48Å; E2751-I2758 HydrophobicContact CG-CD1 4.33Å; E2751-I2758 VanDerWaalsContact N-CD1 3.3Å; E2751-Y3335 WeakPolarHBondContact OE2-CE1 3.34Å; E2751-Y3335 PolarHBondContact OE2-OH 3.08Å; E2751-K3339 IonicContact OE1-NZ 3.46Å; E2751-K3339 PolarHBondContact OE1-NZ 2.9Å; E2751-K3339 WeakPolarHBondContact OE2-CD 3.38Å; E2751-K3339 WeakPolarHBondContact OE2-CE 3.32Å; E2751-K3339 IonicContact OE2-NZ 3.62Å; E2751-K3339 PolarHBondContact OE2-NZ 2.89Å
2752E87.2Confident90.4Very high142.25 Ų142.2539.1 Ų39.167%0.66519%0.188SC*.Hα-helixtrans-53.9-30.6175.3-67.2176.3166.900112.9Y2748 S2749 M2750Y2748-E2752 WeakPolarHBondContact CE1-OE1 3.46Å; Y2748-E2752 PolarHBondContact O-N 3.12Å; S2749-E2752 PolarHBondContact OG-OE2 3.13Å; M2750-E2752 VanDerWaalsContact C-N 3.32Å; M2750-E2752 PolarHBondContact O-N 3.02Å
2753Q86Confident90.5Very high116 Ų11639.5 Ų39.554%0.54219%0.191SC..Hα-helixtrans-106.9-27.3179.4-64-179.82.500113.3M2750 E2751M2750-Q2753 PolarHBondContact O-N 3.19Å; E2751-Q2753 PolarHBondContact O-N 3.15Å; E2751-Q2753 VanDerWaalsContact O-N 3.16Å
2754N90.7Very high90.7Very high39.5 Ų39.539.6 Ų39.621%0.21119%0.191CC..Hα-helixtrans-137.541.3-168.6-59.1-85.3000113.3M2750 E2751 R2756 L2757 I2758M2750-N2754 WeakPolarHBondContact O-CB 3.37Å; M2750-N2754 PolarHBondContact O-N 3.3Å; M2750-N2754 PolarHBondContact O-ND2 2.86Å; E2751-N2754 PolarHBondContact O-N 3.18Å; N2754-R2756 VanDerWaalsContact C-N 3.33Å; N2754-R2756 PolarHBondContact O-N 3.12Å; N2754-L2757 HydrophobicContact CB-CB 4.07Å; N2754-L2757 HydrophobicContact CB-CD2 4.24Å; N2754-L2757 WeakPolarHBondContact O-CB 3.34Å; N2754-L2757 PolarHBondContact O-N 3.01Å; N2754-L2757 VanDerWaalsContact O-N 3.16Å; N2754-I2758 PolarHBondContact O-N 3.27Å; N2754-I2758 VanDerWaalsContact O-N 3.16Å
2755S90.4Very high90.9Very high60.25 Ų60.2538 Ų3842%0.42118%0.183SC..Hα-helixtrans-54-42.9-175.7126.50000114.3E2751 L2757 I2758 S2759E2751-S2755 VanDerWaalsContact CG-CA 3.48Å; E2751-S2755 WeakPolarHBondContact O-CA 3.32Å; E2751-S2755 WeakPolarHBondContact O-CB 3.44Å; E2751-S2755 PolarHBondContact O-N 3.36Å; E2751-S2755 PolarHBondContact OE1-OG 2.92Å; S2755-L2757 PolarHBondContact O-N 3.43Å; S2755-I2758 PolarHBondContact O-N 3.18Å; S2755-I2758 VanDerWaalsContact O-N 3.15Å; S2755-S2759 PolarHBondContact O-N 2.96Å; S2755-S2759 PolarHBondContact O-OG 3.24Å; S2755-S2759 VanDerWaalsContact O-OG 3.09Å
2756R91.8Very high91Very high96 Ų9635.9 Ų35.936%0.36218%0.176SC..Hα-helixtrans-60.5-44.7176.8178.3172.1174.3-169.5-2112.2N2754 I2758 S2759 E2760 Y2885 D2888 Q2890N2754-R2756 VanDerWaalsContact C-N 3.33Å; N2754-R2756 PolarHBondContact O-N 3.12Å; R2756-I2758 VanDerWaalsContact C-N 3.32Å; R2756-I2758 PolarHBondContact O-N 3.04Å; R2756-S2759 WeakPolarHBondContact CA-OG 3.28Å; R2756-S2759 PolarHBondContact O-N 3.29Å; R2756-S2759 PolarHBondContact O-OG 3.34Å; R2756-S2759 VanDerWaalsContact O-OG 3.06Å; R2756-E2760 HydrophobicContact CG-CG 4.37Å; R2756-E2760 WeakPolarHBondContact CG-OE1 3.41Å; R2756-E2760 IonicContact CZ-OE1 3.06Å; R2756-E2760 IonicContact NE-OE1 3.06Å; R2756-E2760 PolarHBondContact NE-OE1 3.09Å; R2756-E2760 IonicContact NH2-OE1 3.37Å; R2756-E2760 PolarHBondContact NH2-OE1 2.96Å; R2756-E2760 VanDerWaalsContact O-CB 3.29Å; R2756-E2760 WeakPolarHBondContact O-CB 3.4Å; R2756-E2760 VanDerWaalsContact O-CG 3.31Å; R2756-E2760 WeakPolarHBondContact O-CG 3.39Å; R2756-E2760 PolarHBondContact O-N 2.99Å; R2756-Y2885 PolarHBondContact NE-OH 3.48Å; R2756-Y2885 PolarHBondContact NH2-OH 3.11Å; R2756-D2888 IonicContact NH1-OD2 3.76Å; R2756-D2888 PolarHBondContact NH2-O 3.11Å; R2756-Q2890 HydrophobicContact CG-CG 4.24Å
2757L93.2Very high91.1Very high3.25 Ų3.2536 Ų362%0.01718%0.177CC..Hα-helixtrans-60.6-40.3178.4178.665.7000112.4P2720 Q2721 V2724 N2754 S2755 A2761 Q2890 L2891P2720-L2757 HydrophobicContact CB-CD2 3.74Å; P2720-L2757 HydrophobicContact CG-CD2 4.05Å; Q2721-L2757 VanDerWaalsContact NE2-CD1 3.34Å; V2724-L2757 HydrophobicContact CG2-CD2 4.08Å; V2724-L2757 HydrophobicContact CG2-CG 4.12Å; N2754-L2757 HydrophobicContact CB-CB 4.07Å; N2754-L2757 HydrophobicContact CB-CD2 4.24Å; N2754-L2757 WeakPolarHBondContact O-CB 3.34Å; N2754-L2757 PolarHBondContact O-N 3.01Å; N2754-L2757 VanDerWaalsContact O-N 3.16Å; S2755-L2757 PolarHBondContact O-N 3.43Å; L2757-A2761 WeakPolarHBondContact O-CB 3.32Å; L2757-A2761 PolarHBondContact O-N 3.29Å; L2757-A2761 VanDerWaalsContact O-N 3.08Å; L2757-Q2890 HydrophobicContact CD1-CB 4.5Å; L2757-L2891 VanDerWaalsContact CD1-CA 3.45Å; L2757-L2891 HydrophobicContact CD1-CB 3.98Å; L2757-L2891 HydrophobicContact CD1-CD1 3.6Å; L2757-L2891 HydrophobicContact CD1-CG 4.4Å
2758I92.5Very high91.2Very high3 Ų335.9 Ų35.92%0.01518%0.176CC..Hα-helixtrans-71.1-45.3179.7-66.4178.2000110.6V2724 L2747 M2750 E2751 N2754 S2755 R2756 E2760 A2761 F2762V2724-I2758 HydrophobicContact CG2-CG1 4.35Å; L2747-I2758 HydrophobicContact CD2-CD1 4.43Å; L2747-I2758 HydrophobicContact CD2-CG2 4.41Å; L2747-I2758 VanDerWaalsContact O-CD1 3.31Å; L2747-I2758 WeakPolarHBondContact O-CD1 3.35Å; M2750-I2758 HydrophobicContact CB-CD1 3.7Å; E2751-I2758 VanDerWaalsContact CA-CD1 3.5Å; E2751-I2758 HydrophobicContact CB-CD1 3.86Å; E2751-I2758 HydrophobicContact CG-CB 4.48Å; E2751-I2758 HydrophobicContact CG-CD1 4.33Å; E2751-I2758 VanDerWaalsContact N-CD1 3.3Å; N2754-I2758 PolarHBondContact O-N 3.27Å; N2754-I2758 VanDerWaalsContact O-N 3.16Å; S2755-I2758 PolarHBondContact O-N 3.18Å; S2755-I2758 VanDerWaalsContact O-N 3.15Å; R2756-I2758 VanDerWaalsContact C-N 3.32Å; R2756-I2758 PolarHBondContact O-N 3.04Å; I2758-E2760 VanDerWaalsContact C-N 3.32Å; I2758-E2760 PolarHBondContact O-N 3.07Å; I2758-A2761 WeakPolarHBondContact O-CB 3.35Å; I2758-A2761 PolarHBondContact O-N 2.97Å; I2758-A2761 VanDerWaalsContact O-N 3.1Å; I2758-F2762 HydrophobicContact CG2-CD2 3.76Å; I2758-F2762 HydrophobicContact CG2-CE2 3.77Å; I2758-F2762 WeakPolarHBondContact O-CD2 3.34Å; I2758-F2762 PolarHBondContact O-N 3.14Å
2759S91Very high91.4Very high47.5 Ų47.532.3 Ų32.333%0.33216%0.163SC..Hα-helixtrans-61.4-41.1176.236.50000112.3S2755 R2756 A2761 F2762 L2763S2755-S2759 PolarHBondContact O-N 2.96Å; S2755-S2759 PolarHBondContact O-OG 3.24Å; S2755-S2759 VanDerWaalsContact O-OG 3.09Å; R2756-S2759 WeakPolarHBondContact CA-OG 3.28Å; R2756-S2759 PolarHBondContact O-N 3.29Å; R2756-S2759 PolarHBondContact O-OG 3.34Å; R2756-S2759 VanDerWaalsContact O-OG 3.06Å; S2759-A2761 VanDerWaalsContact C-N 3.31Å; S2759-A2761 PolarHBondContact O-N 2.79Å; S2759-F2762 PolarHBondContact O-N 3.12Å; S2759-L2763 WeakPolarHBondContact O-CB 3.41Å; S2759-L2763 PolarHBondContact O-N 3.37Å
2760E93.5Very high91.5Very high0.75 Ų0.7533.3 Ų33.30%0.00416%0.164CC..Hα-helixtrans-59.3-45.2171.7-80.3179.2-173.700112R2756 I2758 F2762 L2763 L2764 Y2885 W2889 Q2890 L2891R2756-E2760 HydrophobicContact CG-CG 4.37Å; R2756-E2760 WeakPolarHBondContact CG-OE1 3.41Å; R2756-E2760 IonicContact CZ-OE1 3.06Å; R2756-E2760 IonicContact NE-OE1 3.06Å; R2756-E2760 PolarHBondContact NE-OE1 3.09Å; R2756-E2760 IonicContact NH2-OE1 3.37Å; R2756-E2760 PolarHBondContact NH2-OE1 2.96Å; R2756-E2760 VanDerWaalsContact O-CB 3.29Å; R2756-E2760 WeakPolarHBondContact O-CB 3.4Å; R2756-E2760 VanDerWaalsContact O-CG 3.31Å; R2756-E2760 WeakPolarHBondContact O-CG 3.39Å; R2756-E2760 PolarHBondContact O-N 2.99Å; I2758-E2760 VanDerWaalsContact C-N 3.32Å; I2758-E2760 PolarHBondContact O-N 3.07Å; E2760-F2762 VanDerWaalsContact C-N 3.35Å; E2760-F2762 PolarHBondContact O-N 3.43Å; E2760-L2763 PolarHBondContact O-N 3.04Å; E2760-L2764 WeakPolarHBondContact O-CB 3.42Å; E2760-L2764 PolarHBondContact O-N 3.39Å; E2760-Y2885 HydrophobicContact CG-CE1 3.72Å; E2760-Y2885 VanDerWaalsContact CG-OH 3.31Å; E2760-Y2885 WeakPolarHBondContact CG-OH 3.21Å; E2760-Y2885 PolarHBondContact OE1-OH 3.14Å; E2760-Y2885 VanDerWaalsContact OE1-OH 3.09Å; E2760-W2889 HydrophobicContact CB-CE3 3.76Å; E2760-W2889 HydrophobicContact CB-CZ3 3.83Å; E2760-W2889 HydrophobicContact CG-CD2 4.31Å; E2760-W2889 HydrophobicContact CG-CE3 3.82Å; E2760-W2889 HydrophobicContact CG-CZ3 4.15Å; E2760-W2889 WeakPolarHBondContact O-CZ3 3.44Å; E2760-W2889 WeakPolarHBondContact OE1-CA 3.44Å; E2760-Q2890 VanDerWaalsContact CD-N 3.33Å; E2760-Q2890 PolarHBondContact OE1-N 3.17Å; E2760-Q2890 VanDerWaalsContact OE1-N 3.11Å; E2760-Q2890 WeakPolarHBondContact OE2-CA 3.33Å; E2760-Q2890 PolarHBondContact OE2-N 3.16Å; E2760-L2891 HydrophobicContact CB-CB 4.28Å; E2760-L2891 HydrophobicContact CB-CD2 4.42Å; E2760-L2891 WeakPolarHBondContact OE2-CB 3.3Å; E2760-L2891 PolarHBondContact OE2-N 3.14Å
2761A92.9Very high91.6Very high0.75 Ų0.7533.3 Ų33.31%0.00616%0.164CC..Hα-helixtrans-66.7-37.6-179.900000113.2V2724 V2728 L2757 I2758 S2759 N2765 L2891V2724-A2761 HydrophobicContact CB-CB 4.44Å; V2724-A2761 HydrophobicContact CG1-CB 3.98Å; V2724-A2761 HydrophobicContact CG2-CB 3.32Å; V2728-A2761 HydrophobicContact CG2-CB 4.38Å; L2757-A2761 WeakPolarHBondContact O-CB 3.32Å; L2757-A2761 PolarHBondContact O-N 3.29Å; L2757-A2761 VanDerWaalsContact O-N 3.08Å; I2758-A2761 WeakPolarHBondContact O-CB 3.35Å; I2758-A2761 PolarHBondContact O-N 2.97Å; I2758-A2761 VanDerWaalsContact O-N 3.1Å; S2759-A2761 VanDerWaalsContact C-N 3.31Å; S2759-A2761 PolarHBondContact O-N 2.79Å; A2761-N2765 VanDerWaalsContact O-CB 3.27Å; A2761-N2765 WeakPolarHBondContact O-CB 3.35Å; A2761-N2765 PolarHBondContact O-N 3.29Å; A2761-L2891 HydrophobicContact CB-CD1 4.13Å; A2761-L2891 HydrophobicContact CB-CD2 4.17Å
2762F92.3Very high91.7Very high20 Ų2031 Ų319%0.08815%0.153CC..Hα-helixtrans-64.6-46172.5-89-77000111.6V2728 F2731 K2732 L2747 I2758 S2759 E2760 N2765 E2766 W3331 F3332 Y3335V2728-F2762 HydrophobicContact CG1-CD1 4.19Å; V2728-F2762 HydrophobicContact CG1-CE1 4.14Å; V2728-F2762 HydrophobicContact CG2-CD1 4.35Å; V2728-F2762 HydrophobicContact CG2-CD2 4.19Å; V2728-F2762 HydrophobicContact CG2-CE1 4.3Å; V2728-F2762 HydrophobicContact CG2-CE2 4.01Å; V2728-F2762 HydrophobicContact CG2-CG 4.41Å; V2728-F2762 HydrophobicContact CG2-CZ 4.12Å; F2731-F2762 AromaticContact CD1-CE1 3.75Å; F2731-F2762 HydrophobicContact CD1-CE1 3.75Å; F2731-F2762 AromaticContact CD1-CZ 3.84Å; F2731-F2762 HydrophobicContact CD1-CZ 3.84Å; F2731-F2762 AromaticContact CE1-CE1 3.98Å; F2731-F2762 HydrophobicContact CE1-CE1 4.01Å; F2731-F2762 HydrophobicContact CE1-CZ 4.17Å; F2731-F2762 HydrophobicContact CG-CZ 4.38Å; K2732-F2762 HydrophobicContact CG-CE1 4.35Å; L2747-F2762 HydrophobicContact CD1-CE2 4.27Å; L2747-F2762 HydrophobicContact CD1-CZ 4.07Å; I2758-F2762 HydrophobicContact CG2-CD2 3.76Å; I2758-F2762 HydrophobicContact CG2-CE2 3.77Å; I2758-F2762 WeakPolarHBondContact O-CD2 3.34Å; I2758-F2762 PolarHBondContact O-N 3.14Å; S2759-F2762 PolarHBondContact O-N 3.12Å; E2760-F2762 VanDerWaalsContact C-N 3.35Å; E2760-F2762 PolarHBondContact O-N 3.43Å; F2762-N2765 PolarHBondContact O-N 3.23Å; F2762-E2766 WeakPolarHBondContact O-CB 3.39Å; F2762-E2766 VanDerWaalsContact O-CG 3.27Å; F2762-E2766 WeakPolarHBondContact O-CG 3.34Å; F2762-E2766 PolarHBondContact O-N 3.11Å; F2762-W3331 HydrophobicContact CD1-CB 4.15Å; F2762-W3331 HydrophobicContact CE1-CB 4.25Å; F2762-F3332 HydrophobicContact CB-CB 4.05Å; F2762-F3332 HydrophobicContact CB-CD2 4Å; F2762-F3332 HydrophobicContact CB-CG 4.45Å; F2762-F3332 HydrophobicContact CD2-CD2 4.06Å; F2762-F3332 HydrophobicContact CG-CB 4.37Å; F2762-F3332 HydrophobicContact CG-CD2 4.14Å; F2762-Y3335 HydrophobicContact CE2-CD1 4.34Å; F2762-Y3335 HydrophobicContact CE2-CD2 4.24Å; F2762-Y3335 HydrophobicContact CE2-CG 4.05Å; F2762-Y3335 HydrophobicContact CZ-CD2 4.23Å; F2762-Y3335 HydrophobicContact CZ-CG 4.12Å
2763L92.2Very high91.9Very high14.5 Ų14.524.9 Ų24.98%0.07613%0.125CC..Hα-helixtrans-57.3-52175.9172.363.6000111.5S2759 E2760 N2765 E2766 E2767 R2881 L2882 Y2885 W2889S2759-L2763 WeakPolarHBondContact O-CB 3.41Å; S2759-L2763 PolarHBondContact O-N 3.37Å; E2760-L2763 PolarHBondContact O-N 3.04Å; L2763-N2765 VanDerWaalsContact C-N 3.32Å; L2763-N2765 PolarHBondContact O-N 2.96Å; L2763-E2766 PolarHBondContact O-N 3.35Å; L2763-E2767 HydrophobicContact CD1-CG 3.89Å; L2763-E2767 WeakPolarHBondContact O-CB 3.35Å; L2763-E2767 WeakPolarHBondContact O-CG 3.44Å; L2763-E2767 PolarHBondContact O-N 3Å; L2763-E2767 VanDerWaalsContact O-N 3.09Å; L2763-R2881 HydrophobicContact CD1-CB 3.91Å; L2763-L2882 HydrophobicContact CG-CD2 4.46Å; L2763-Y2885 HydrophobicContact CD2-CD1 4.24Å; L2763-Y2885 HydrophobicContact CD2-CD2 3.6Å; L2763-Y2885 HydrophobicContact CD2-CE1 4.45Å; L2763-Y2885 HydrophobicContact CD2-CE2 4.08Å; L2763-Y2885 HydrophobicContact CD2-CG 3.69Å; L2763-Y2885 VanDerWaalsContact CD2-CG 3.47Å; L2763-W2889 HydrophobicContact CD2-CH2 4.22Å; L2763-W2889 HydrophobicContact CG-CH2 4.35Å
2764L93.7Very high92.1Very high0.75 Ų0.7519.7 Ų19.70%0.00410%0.101CC..Hα-helixtrans-60.9-42.1179.7-175.966.6000111.4Y2725 E2760 L2768 L2882 W2889 L2891 P2894 I2906 I2909Y2725-L2764 HydrophobicContact CE1-CD2 4.19Å; Y2725-L2764 WeakPolarHBondContact OH-CD2 3.12Å; E2760-L2764 WeakPolarHBondContact O-CB 3.42Å; E2760-L2764 PolarHBondContact O-N 3.39Å; L2764-L2768 HydrophobicContact CD1-CD1 3.8Å; L2764-L2768 HydrophobicContact CD1-CD2 4.49Å; L2764-L2768 HydrophobicContact CD1-CG 3.99Å; L2764-L2768 HydrophobicContact CD2-CD1 4.45Å; L2764-L2768 HydrophobicContact CG-CD1 3.8Å; L2764-L2768 HydrophobicContact CG-CG 4.3Å; L2764-L2768 VanDerWaalsContact O-CB 3.26Å; L2764-L2768 WeakPolarHBondContact O-CB 3.35Å; L2764-L2768 WeakPolarHBondContact O-CG 3.36Å; L2764-L2768 PolarHBondContact O-N 2.95Å; L2764-L2768 VanDerWaalsContact O-N 3.12Å; L2764-L2882 HydrophobicContact CD1-CD1 4.07Å; L2764-L2882 HydrophobicContact CD1-CD2 3.83Å; L2764-W2889 HydrophobicContact CB-CH2 4.05Å; L2764-W2889 HydrophobicContact CB-CZ3 3.91Å; L2764-W2889 HydrophobicContact CD1-CH2 4.28Å; L2764-W2889 HydrophobicContact CD2-CZ3 4.46Å; L2764-L2891 HydrophobicContact CB-CD2 4.21Å; L2764-L2891 HydrophobicContact CD2-CD2 3.62Å; L2764-P2894 HydrophobicContact CD2-CG 4.44Å; L2764-I2906 HydrophobicContact CD2-CD1 3.73Å; L2764-I2909 HydrophobicContact CD1-CD1 3.8Å
2765N92.9Very high92.2Very high4 Ų418.7 Ų18.72%0.02110%0.095CC..Hα-helixtrans-65.9-44.7179177.7-90.8000112.3V2728 K2732 A2761 F2762 L2763 I2769 L2983V2728-N2765 HydrophobicContact CG1-CB 3.9Å; K2732-N2765 VanDerWaalsContact CD-OD1 3.25Å; K2732-N2765 WeakPolarHBondContact CD-OD1 3.38Å; K2732-N2765 WeakPolarHBondContact CE-OD1 3.38Å; K2732-N2765 PolarHBondContact NZ-OD1 3Å; A2761-N2765 VanDerWaalsContact O-CB 3.27Å; A2761-N2765 WeakPolarHBondContact O-CB 3.35Å; A2761-N2765 PolarHBondContact O-N 3.29Å; F2762-N2765 PolarHBondContact O-N 3.23Å; L2763-N2765 VanDerWaalsContact C-N 3.32Å; L2763-N2765 PolarHBondContact O-N 2.96Å; N2765-I2769 VanDerWaalsContact O-CD1 3.3Å; N2765-I2769 WeakPolarHBondContact O-CD1 3.36Å; N2765-I2769 WeakPolarHBondContact O-CG1 3.34Å; N2765-I2769 PolarHBondContact O-N 3.22Å; N2765-I2769 VanDerWaalsContact O-N 3.09Å; N2765-I2769 WeakPolarHBondContact OD1-CD1 3.3Å; N2765-L2983 WeakPolarHBondContact ND2-CA 3.42Å; N2765-L2983 PolarHBondContact ND2-O 3.31Å
2766E90.8Very high92.3Very high38.75 Ų38.7516.3 Ų16.318%0.1818%0.077CC..Hα-helixtrans-59.4-52177.2-74.9173.4-177.700112.1K2732 F2762 L2763 L2768 I2769 R2770 R2881 W3331 F3332K2732-E2766 VanDerWaalsContact NZ-CG 3.34Å; K2732-E2766 IonicContact NZ-OE1 3.21Å; K2732-E2766 PolarHBondContact NZ-OE1 3.3Å; F2762-E2766 WeakPolarHBondContact O-CB 3.39Å; F2762-E2766 VanDerWaalsContact O-CG 3.27Å; F2762-E2766 WeakPolarHBondContact O-CG 3.34Å; F2762-E2766 PolarHBondContact O-N 3.11Å; L2763-E2766 PolarHBondContact O-N 3.35Å; E2766-L2768 PolarHBondContact O-N 3.16Å; E2766-I2769 WeakPolarHBondContact O-CB 3.27Å; E2766-I2769 PolarHBondContact O-N 3.04Å; E2766-R2770 PolarHBondContact O-N 3.24Å; E2766-R2881 IonicContact OE2-CZ 3.14Å; E2766-R2881 VanDerWaalsContact OE2-CZ 3.28Å; E2766-R2881 IonicContact OE2-NH1 3.31Å; E2766-R2881 PolarHBondContact OE2-NH1 3.27Å; E2766-R2881 VanDerWaalsContact OE2-NH1 3.1Å; E2766-R2881 IonicContact OE2-NH2 3.6Å; E2766-R2881 PolarHBondContact OE2-NH2 3.09Å; E2766-W3331 HydrophobicContact CG-CB 4.38Å; E2766-W3331 WeakPolarHBondContact OE1-CA 3.36Å; E2766-W3331 PolarHBondContact OE1-N 3.25Å; E2766-F3332 PolarHBondContact OE1-N 3.36Å
2767E92.6Very high92.3Very high1 Ų112.4 Ų12.41%0.0056%0.063CC..Hα-helixtrans-73.7-32.9-172.9-67.2-53.5138.400112.1L2763 I2769 R2770 L2771 S2879 R2881 L2882L2763-E2767 HydrophobicContact CD1-CG 3.89Å; L2763-E2767 WeakPolarHBondContact O-CB 3.35Å; L2763-E2767 WeakPolarHBondContact O-CG 3.44Å; L2763-E2767 PolarHBondContact O-N 3Å; L2763-E2767 VanDerWaalsContact O-N 3.09Å; E2767-I2769 VanDerWaalsContact C-N 3.31Å; E2767-I2769 PolarHBondContact O-N 3.14Å; E2767-R2770 WeakPolarHBondContact O-CB 3.41Å; E2767-R2770 PolarHBondContact O-N 3.14Å; E2767-R2770 IonicContact OE1-CZ 2.95Å; E2767-R2770 IonicContact OE1-NE 3.06Å; E2767-R2770 PolarHBondContact OE1-NE 3.23Å; E2767-R2770 IonicContact OE1-NH2 3.4Å; E2767-R2770 PolarHBondContact OE1-NH2 3.19Å; E2767-R2770 IonicContact OE2-CZ 3.57Å; E2767-R2770 IonicContact OE2-NE 3.65Å; E2767-R2770 PolarHBondContact OE2-NE 3.08Å; E2767-R2770 IonicContact OE2-NH2 3.15Å; E2767-L2771 WeakPolarHBondContact O-CB 3.33Å; E2767-L2771 WeakPolarHBondContact O-CD1 3.38Å; E2767-L2771 WeakPolarHBondContact O-CG 3.38Å; E2767-L2771 PolarHBondContact O-N 2.95Å; E2767-S2879 VanDerWaalsContact CB-OG 3.28Å; E2767-S2879 WeakPolarHBondContact CB-OG 3.4Å; E2767-S2879 VanDerWaalsContact CD-OG 3.3Å; E2767-S2879 WeakPolarHBondContact CG-OG 3.34Å; E2767-S2879 WeakPolarHBondContact OE2-CB 3.39Å; E2767-S2879 PolarHBondContact OE2-OG 3.05Å; E2767-R2881 HydrophobicContact CG-CB 4.31Å; E2767-R2881 WeakPolarHBondContact OE1-CD 3.44Å; E2767-R2881 IonicContact OE1-CZ 3.25Å; E2767-R2881 IonicContact OE1-NE 2.81Å; E2767-R2881 IonicContact OE1-NH1 3.83Å; E2767-R2881 PolarHBondContact OE1-NH1 3.34Å; E2767-L2882 HydrophobicContact CB-CB 4.09Å; E2767-L2882 HydrophobicContact CB-CD1 4.1Å; E2767-L2882 VanDerWaalsContact CB-CD1 3.4Å; E2767-L2882 HydrophobicContact CB-CD2 4.27Å; E2767-L2882 HydrophobicContact CB-CG 3.98Å; E2767-L2882 VanDerWaalsContact CB-CG 3.48Å; E2767-L2882 HydrophobicContact CG-CB 4.28Å; E2767-L2882 HydrophobicContact CG-CD1 4.5Å; E2767-L2882 HydrophobicContact CG-CG 4.08Å
2768L93.9Very high92.2Very high0.5 Ų0.513.7 Ų13.70%0.0037%0.069CC..Hα-helixtrans-68-33.2170.8-70.4-179.6000112.9L2764 E2766 L2771 S2772 L2882 L2925 L2939 L2983 L2989L2764-L2768 HydrophobicContact CD1-CD1 3.8Å; L2764-L2768 HydrophobicContact CD1-CD2 4.49Å; L2764-L2768 HydrophobicContact CD1-CG 3.99Å; L2764-L2768 HydrophobicContact CD2-CD1 4.45Å; L2764-L2768 HydrophobicContact CG-CD1 3.8Å; L2764-L2768 HydrophobicContact CG-CG 4.3Å; L2764-L2768 VanDerWaalsContact O-CB 3.26Å; L2764-L2768 WeakPolarHBondContact O-CB 3.35Å; L2764-L2768 WeakPolarHBondContact O-CG 3.36Å; L2764-L2768 PolarHBondContact O-N 2.95Å; L2764-L2768 VanDerWaalsContact O-N 3.12Å; E2766-L2768 PolarHBondContact O-N 3.16Å; L2768-L2771 HydrophobicContact CD2-CD1 4.34Å; L2768-L2771 PolarHBondContact O-N 3.27Å; L2768-S2772 WeakPolarHBondContact O-CB 3.45Å; L2768-S2772 PolarHBondContact O-N 3.1Å; L2768-S2772 VanDerWaalsContact O-N 3.1Å; L2768-L2882 HydrophobicContact CD2-CD1 4.45Å; L2768-L2925 HydrophobicContact CD1-CD2 4.44Å; L2768-L2925 HydrophobicContact CD2-CD1 4.35Å; L2768-L2925 HydrophobicContact CD2-CD2 3.68Å; L2768-L2939 HydrophobicContact CB-CD1 4.47Å; L2768-L2939 HydrophobicContact CD2-CD2 4.41Å; L2768-L2983 HydrophobicContact CB-CD1 3.59Å; L2768-L2983 HydrophobicContact CD1-CD1 4.09Å; L2768-L2989 HydrophobicContact CD1-CD1 3.85Å; L2768-L2989 HydrophobicContact CD1-CD2 4.3Å; L2768-L2989 HydrophobicContact CD1-CG 4.33Å
2769I91.8Very high92.3Very high20 Ų2013.5 Ų13.510%0.1037%0.069CC..Hα-helixtrans-64.6-44.8171.3-70165.9000109.8N2765 E2766 E2767 L2771 S2772 L2983 T2987 H3325N2765-I2769 VanDerWaalsContact O-CD1 3.3Å; N2765-I2769 WeakPolarHBondContact O-CD1 3.36Å; N2765-I2769 WeakPolarHBondContact O-CG1 3.34Å; N2765-I2769 PolarHBondContact O-N 3.22Å; N2765-I2769 VanDerWaalsContact O-N 3.09Å; N2765-I2769 WeakPolarHBondContact OD1-CD1 3.3Å; E2766-I2769 WeakPolarHBondContact O-CB 3.27Å; E2766-I2769 PolarHBondContact O-N 3.04Å; E2767-I2769 VanDerWaalsContact C-N 3.31Å; E2767-I2769 PolarHBondContact O-N 3.14Å; I2769-L2771 VanDerWaalsContact C-N 3.3Å; I2769-L2771 PolarHBondContact O-N 3.3Å; I2769-S2772 WeakPolarHBondContact O-CB 3.42Å; I2769-S2772 PolarHBondContact O-N 3.33Å; I2769-S2772 VanDerWaalsContact O-N 3.11Å; I2769-S2772 PolarHBondContact O-OG 3.1Å; I2769-L2983 HydrophobicContact CD1-CB 4.48Å; I2769-L2983 HydrophobicContact CG1-CB 4.13Å; I2769-T2987 HydrophobicContact CG2-CG2 4.47Å; I2769-H3325 PolarHBondContact O-CE1 3.26Å; I2769-H3325 VanDerWaalsContact O-CE1 3.23Å
2770R91.2Very high92.3Very high40.25 Ų40.2512 Ų1215%0.1526%0.058CC..Hα-helixtrans-59.8-40.8175.7-165.1-166.5-53.9-84.4-3.8112.5E2766 E2767 S2772 I2773 E2815 E2819 S2878E2766-R2770 PolarHBondContact O-N 3.24Å; E2767-R2770 WeakPolarHBondContact O-CB 3.41Å; E2767-R2770 PolarHBondContact O-N 3.14Å; E2767-R2770 IonicContact OE1-CZ 2.95Å; E2767-R2770 IonicContact OE1-NE 3.06Å; E2767-R2770 PolarHBondContact OE1-NE 3.23Å; E2767-R2770 IonicContact OE1-NH2 3.4Å; E2767-R2770 PolarHBondContact OE1-NH2 3.19Å; E2767-R2770 IonicContact OE2-CZ 3.57Å; E2767-R2770 IonicContact OE2-NE 3.65Å; E2767-R2770 PolarHBondContact OE2-NE 3.08Å; E2767-R2770 IonicContact OE2-NH2 3.15Å; R2770-S2772 VanDerWaalsContact C-N 3.29Å; R2770-S2772 PolarHBondContact O-N 2.92Å; R2770-I2773 VanDerWaalsContact O-O 3.11Å; R2770-E2815 IonicContact CZ-OE2 3.42Å; R2770-E2815 VanDerWaalsContact CZ-OE2 3.26Å; R2770-E2815 IonicContact NH1-OE2 3.58Å; R2770-E2815 PolarHBondContact NH1-OE2 3.29Å; R2770-E2815 VanDerWaalsContact NH1-OE2 3.11Å; R2770-E2815 IonicContact NH2-OE2 3.27Å; R2770-E2815 PolarHBondContact NH2-OE2 3.25Å; R2770-E2819 WeakPolarHBondContact CD-OE1 3.26Å; R2770-E2819 IonicContact CZ-OE1 3.25Å; R2770-E2819 IonicContact NH1-OE1 3.13Å; R2770-E2819 PolarHBondContact NH1-OE1 2.93Å; R2770-E2819 IonicContact NH1-OE2 3.56Å; R2770-S2878 WeakPolarHBondContact CD-O 3.44Å
2771L93.4Very high92.2Very high1 Ų115.3 Ų15.31%0.0057%0.073CC..Hα-helixtrans-73.8-20.8179.1-67.6164.6000113.5E2767 L2768 I2769 I2773 L2873 L2875 L2882 L2913 R2923 L2939E2767-L2771 WeakPolarHBondContact O-CB 3.33Å; E2767-L2771 WeakPolarHBondContact O-CD1 3.38Å; E2767-L2771 WeakPolarHBondContact O-CG 3.38Å; E2767-L2771 PolarHBondContact O-N 2.95Å; L2768-L2771 HydrophobicContact CD2-CD1 4.34Å; L2768-L2771 PolarHBondContact O-N 3.27Å; I2769-L2771 VanDerWaalsContact C-N 3.3Å; I2769-L2771 PolarHBondContact O-N 3.3Å; L2771-I2773 VanDerWaalsContact C-N 3.25Å; L2771-I2773 PolarHBondContact O-N 2.74Å; L2771-L2873 HydrophobicContact CD2-CD2 3.75Å; L2771-L2873 HydrophobicContact CD2-CG 4.45Å; L2771-L2875 HydrophobicContact CD1-CD2 3.45Å; L2771-L2875 HydrophobicContact CD1-CG 4.29Å; L2771-L2875 HydrophobicContact CD2-CD2 3.85Å; L2771-L2875 HydrophobicContact CG-CD2 4.25Å; L2771-L2882 HydrophobicContact CD1-CD1 3.91Å; L2771-L2882 HydrophobicContact CD1-CD2 3.99Å; L2771-L2913 HydrophobicContact CB-CD2 4.43Å; L2771-R2923 PolarHBondContact O-NE 3.24Å; L2771-R2923 VanDerWaalsContact O-NE 3.16Å; L2771-L2939 HydrophobicContact CB-CD2 4.05Å
2772S92Very high92.1Very high1.25 Ų1.2515.7 Ų15.71%0.0098%0.076CC..Hα-helixtrans-72.8-26.5-176.8720000113.8L2768 I2769 R2770 R2923 T2987L2768-S2772 WeakPolarHBondContact O-CB 3.45Å; L2768-S2772 PolarHBondContact O-N 3.1Å; L2768-S2772 VanDerWaalsContact O-N 3.1Å; I2769-S2772 WeakPolarHBondContact O-CB 3.42Å; I2769-S2772 PolarHBondContact O-N 3.33Å; I2769-S2772 VanDerWaalsContact O-N 3.11Å; I2769-S2772 PolarHBondContact O-OG 3.1Å; R2770-S2772 VanDerWaalsContact C-N 3.29Å; R2770-S2772 PolarHBondContact O-N 2.92Å; S2772-R2923 PolarHBondContact O-NE 3.08Å; S2772-R2923 VanDerWaalsContact O-NE 3.14Å; S2772-R2923 PolarHBondContact O-NH1 3.15Å; S2772-R2923 PolarHBondContact O-NH2 3.22Å; S2772-T2987 WeakPolarHBondContact OG-CG2 3.29Å
2773I90.6Very high92.2Very high13.25 Ų13.2514.8 Ų14.87%0.0687%0.073CC..SBendtrans-148.7122.8176.9-110.1173.2000109.5R2770 L2771 E2777 M2778 H2942 Y2986 W3322R2770-I2773 VanDerWaalsContact O-O 3.11Å; L2771-I2773 VanDerWaalsContact C-N 3.25Å; L2771-I2773 PolarHBondContact O-N 2.74Å; I2773-E2777 HydrophobicContact CD1-CB 3.62Å; I2773-E2777 HydrophobicContact CG1-CB 3.82Å; I2773-E2777 VanDerWaalsContact CG1-CB 3.46Å; I2773-E2777 HydrophobicContact CG1-CG 4.38Å; I2773-E2777 HydrophobicContact CG2-CB 4.17Å; I2773-M2778 HydrophobicContact CB-CE 4.29Å; I2773-M2778 HydrophobicContact CB-CG 4.38Å; I2773-M2778 HydrophobicContact CD1-CB 4.3Å; I2773-M2778 HydrophobicContact CD1-CE 3.95Å; I2773-M2778 HydrophobicContact CD1-CG 3.67Å; I2773-M2778 HydrophobicContact CD1-SD 4.43Å; I2773-M2778 HydrophobicContact CG1-CE 4.13Å; I2773-M2778 HydrophobicContact CG1-CG 3.88Å; I2773-M2778 HydrophobicContact CG2-CE 3.51Å; I2773-M2778 HydrophobicContact CG2-CG 3.6Å; I2773-M2778 VanDerWaalsContact CG2-CG 3.45Å; I2773-M2778 HydrophobicContact CG2-SD 4.43Å; I2773-H2942 VanDerWaalsContact CD1-CD2 3.49Å; I2773-H2942 WeakPolarHBondContact CD1-CD2 3.42Å; I2773-H2942 WeakPolarHBondContact CD1-CE1 3.44Å; I2773-H2942 WeakPolarHBondContact CD1-NE2 3.34Å; I2773-H2942 WeakPolarHBondContact CG1-NE2 3.46Å; I2773-H2942 WeakPolarHBondContact CG2-NE2 3.42Å; I2773-Y2986 HydrophobicContact CD1-CD2 4.38Å; I2773-W3322 HydrophobicContact CD1-CH2 3.83Å; I2773-W3322 HydrophobicContact CD1-CZ3 3.81Å; I2773-W3322 HydrophobicContact CG2-CZ3 4.24Å
2774T91.6Very high92.2Very high6.75 Ų6.7518.3 Ų18.34%0.0419%0.089CC..  trans-85.3158.2177.864.30000111.4V2776 E2777 M2778 M2870 L2873T2774-V2776 VanDerWaalsContact C-N 3.28Å; T2774-V2776 PolarHBondContact O-N 2.99Å; T2774-V2776 VanDerWaalsContact O-N 3.16Å; T2774-E2777 WeakPolarHBondContact CB-OE2 3.42Å; T2774-E2777 PolarHBondContact N-OE2 2.94Å; T2774-E2777 WeakPolarHBondContact O-CB 3.42Å; T2774-E2777 PolarHBondContact O-N 3.12Å; T2774-E2777 VanDerWaalsContact O-N 3.16Å; T2774-E2777 VanDerWaalsContact OG1-CD 3.31Å; T2774-E2777 VanDerWaalsContact OG1-CG 3.3Å; T2774-E2777 WeakPolarHBondContact OG1-CG 3.3Å; T2774-E2777 PolarHBondContact OG1-N 3.31Å; T2774-E2777 PolarHBondContact OG1-OE2 3.19Å; T2774-M2778 WeakPolarHBondContact O-CG 3.37Å; T2774-M2778 PolarHBondContact O-N 3.16Å; T2774-M2870 HydrophobicContact CG2-CE 4.33Å; T2774-L2873 HydrophobicContact CG2-CD1 4.15Å; T2774-L2873 HydrophobicContact CG2-CD2 4.3Å
2775W92.4Very high92.1Very high20 Ų2019.9 Ų19.98%0.07610%0.097CC..Hα-helixtrans-57.9-34.7178.3-72.410.2000113.3E2777 M2778 W2779 M2809 M2810 E2819 F2822 L2823W2775-E2777 VanDerWaalsContact C-N 3.31Å; W2775-E2777 PolarHBondContact O-N 3.08Å; W2775-M2778 PolarHBondContact O-N 3.11Å; W2775-W2779 WeakPolarHBondContact O-CB 3.41Å; W2775-W2779 VanDerWaalsContact O-CD1 3.26Å; W2775-W2779 PolarHBondContact O-N 3.1Å; W2775-M2809 VanDerWaalsContact CD1-CE 3.47Å; W2775-M2809 HydrophobicContact CD2-CE 3.84Å; W2775-M2809 HydrophobicContact CE3-CE 4.42Å; W2775-M2809 HydrophobicContact CG-CE 3.77Å; W2775-M2809 HydrophobicContact CZ2-CE 4.39Å; W2775-M2809 HydrophobicContact CZ2-CG 4.2Å; W2775-M2809 HydrophobicContact CZ2-SD 4.42Å; W2775-M2809 PolarHBondContact NE1-SD 2.88Å; W2775-M2810 HydrophobicContact CE3-CE 4.02Å; W2775-M2810 HydrophobicContact CE3-SD 4.11Å; W2775-M2810 HydrophobicContact CH2-CE 4.43Å; W2775-M2810 HydrophobicContact CH2-SD 4.45Å; W2775-M2810 HydrophobicContact CZ3-CE 3.83Å; W2775-M2810 HydrophobicContact CZ3-CG 4.21Å; W2775-M2810 HydrophobicContact CZ3-SD 4.11Å; W2775-E2819 HydrophobicContact CD2-CB 4.32Å; W2775-E2819 HydrophobicContact CD2-CG 3.94Å; W2775-E2819 HydrophobicContact CE3-CB 4.14Å; W2775-E2819 HydrophobicContact CE3-CG 4.13Å; W2775-E2819 HydrophobicContact CG-CG 4.46Å; W2775-E2819 HydrophobicContact CH2-CB 3.96Å; W2775-E2819 HydrophobicContact CH2-CG 4.22Å; W2775-E2819 HydrophobicContact CZ2-CB 4.1Å; W2775-E2819 HydrophobicContact CZ2-CG 3.83Å; W2775-E2819 HydrophobicContact CZ3-CB 3.96Å; W2775-E2819 HydrophobicContact CZ3-CG 4.23Å; W2775-F2822 HydrophobicContact CB-CD1 4.23Å; W2775-F2822 HydrophobicContact CB-CD2 4.42Å; W2775-F2822 HydrophobicContact CB-CE1 4.38Å; W2775-F2822 HydrophobicContact CB-CG 4.27Å; W2775-F2822 HydrophobicContact CE3-CB 4.31Å; W2775-F2822 AromaticContact CE3-CD1 3.67Å; W2775-F2822 HydrophobicContact CE3-CD1 3.67Å; W2775-F2822 HydrophobicContact CE3-CE1 4.32Å; W2775-F2822 HydrophobicContact CE3-CG 4.22Å; W2775-F2822 HydrophobicContact CZ3-CD1 4.43Å; W2775-L2823 HydrophobicContact CH2-CD1 4.33Å; W2775-L2823 HydrophobicContact CZ3-CD1 3.96Å; W2775-L2823 HydrophobicContact CZ3-CD2 3.98Å; W2775-L2823 HydrophobicContact CZ3-CG 3.95Å
2776V92.7Very high92.1Very high9 Ų919.7 Ų19.76%0.05510%0.096CC..Hα-helixtrans-61.1-42.8175.6-173.10000110.9T2774 S2780 F2822 F2863 Q2866 V2867 M2870T2774-V2776 VanDerWaalsContact C-N 3.28Å; T2774-V2776 PolarHBondContact O-N 2.99Å; T2774-V2776 VanDerWaalsContact O-N 3.16Å; V2776-S2780 VanDerWaalsContact O-CB 3.28Å; V2776-S2780 WeakPolarHBondContact O-CB 3.37Å; V2776-S2780 PolarHBondContact O-N 2.87Å; V2776-S2780 PolarHBondContact O-OG 2.86Å; V2776-F2822 HydrophobicContact CB-CE2 4.36Å; V2776-F2822 HydrophobicContact CG2-CD2 3.57Å; V2776-F2822 VanDerWaalsContact CG2-CD2 3.49Å; V2776-F2822 HydrophobicContact CG2-CE2 3.81Å; V2776-F2863 HydrophobicContact CG1-CB 3.92Å; V2776-F2863 HydrophobicContact CG1-CD1 4.06Å; V2776-F2863 HydrophobicContact CG1-CG 4.24Å; V2776-Q2866 HydrophobicContact CG1-CB 3.97Å; V2776-V2867 HydrophobicContact CG1-CG2 3.85Å; V2776-M2870 HydrophobicContact CG2-CE 4.07Å
2777E91.3Very high92.2Very high15 Ų1519.7 Ų19.77%0.0710%0.1CC..Hα-helixtrans-69.2-44.5177.3-68.2162.6125.600111.3I2773 T2774 W2775 W2779 S2780 E2781 V2867 R2921 R2923I2773-E2777 HydrophobicContact CD1-CB 3.62Å; I2773-E2777 HydrophobicContact CG1-CB 3.82Å; I2773-E2777 VanDerWaalsContact CG1-CB 3.46Å; I2773-E2777 HydrophobicContact CG1-CG 4.38Å; I2773-E2777 HydrophobicContact CG2-CB 4.17Å; T2774-E2777 WeakPolarHBondContact CB-OE2 3.42Å; T2774-E2777 PolarHBondContact N-OE2 2.94Å; T2774-E2777 WeakPolarHBondContact O-CB 3.42Å; T2774-E2777 PolarHBondContact O-N 3.12Å; T2774-E2777 VanDerWaalsContact O-N 3.16Å; T2774-E2777 VanDerWaalsContact OG1-CD 3.31Å; T2774-E2777 VanDerWaalsContact OG1-CG 3.3Å; T2774-E2777 WeakPolarHBondContact OG1-CG 3.3Å; T2774-E2777 PolarHBondContact OG1-N 3.31Å; T2774-E2777 PolarHBondContact OG1-OE2 3.19Å; W2775-E2777 VanDerWaalsContact C-N 3.31Å; W2775-E2777 PolarHBondContact O-N 3.08Å; E2777-W2779 VanDerWaalsContact C-N 3.32Å; E2777-W2779 PolarHBondContact O-N 3.21Å; E2777-S2780 WeakPolarHBondContact CA-OG 3.16Å; E2777-S2780 PolarHBondContact O-N 3.28Å; E2777-S2780 VanDerWaalsContact O-N 3.15Å; E2777-S2780 PolarHBondContact O-OG 3.07Å; E2777-E2781 WeakPolarHBondContact O-CB 3.43Å; E2777-E2781 PolarHBondContact O-N 3.1Å; E2777-V2867 HydrophobicContact CB-CG2 4.42Å; E2777-V2867 HydrophobicContact CG-CG1 4.31Å; E2777-V2867 HydrophobicContact CG-CG2 3.9Å; E2777-R2921 IonicContact OE1-CZ 2.96Å; E2777-R2921 IonicContact OE1-NH1 3.12Å; E2777-R2921 PolarHBondContact OE1-NH1 3.01Å; E2777-R2923 VanDerWaalsContact CD-NH2 3.27Å; E2777-R2923 IonicContact OE1-CZ 3.35Å; E2777-R2923 IonicContact OE1-NH1 3.4Å; E2777-R2923 PolarHBondContact OE1-NH1 3.3Å; E2777-R2923 IonicContact OE1-NH2 3.19Å; E2777-R2923 PolarHBondContact OE1-NH2 3.39Å; E2777-R2923 IonicContact OE2-CZ 3.03Å; E2777-R2923 IonicContact OE2-NH1 3.05Å; E2777-R2923 PolarHBondContact OE2-NH1 3.12Å; E2777-R2923 IonicContact OE2-NH2 2.89Å; E2777-R2923 PolarHBondContact OE2-NH2 3.29Å
2778M90.7Very high92.2Very high28.75 Ų28.7525.8 Ų25.814%0.14212%0.123CC..Hα-helixtrans-55.1-48.5176.3-65.5178.593.100111.6I2773 T2774 W2775 A2782 L2806 M2809 W3322 H3325I2773-M2778 HydrophobicContact CB-CE 4.29Å; I2773-M2778 HydrophobicContact CB-CG 4.38Å; I2773-M2778 HydrophobicContact CD1-CB 4.3Å; I2773-M2778 HydrophobicContact CD1-CE 3.95Å; I2773-M2778 HydrophobicContact CD1-CG 3.67Å; I2773-M2778 HydrophobicContact CD1-SD 4.43Å; I2773-M2778 HydrophobicContact CG1-CE 4.13Å; I2773-M2778 HydrophobicContact CG1-CG 3.88Å; I2773-M2778 HydrophobicContact CG2-CE 3.51Å; I2773-M2778 HydrophobicContact CG2-CG 3.6Å; I2773-M2778 VanDerWaalsContact CG2-CG 3.45Å; I2773-M2778 HydrophobicContact CG2-SD 4.43Å; T2774-M2778 WeakPolarHBondContact O-CG 3.37Å; T2774-M2778 PolarHBondContact O-N 3.16Å; W2775-M2778 PolarHBondContact O-N 3.11Å; M2778-A2782 VanDerWaalsContact O-CB 3.24Å; M2778-A2782 WeakPolarHBondContact O-CB 3.39Å; M2778-A2782 PolarHBondContact O-N 3.12Å; M2778-L2806 HydrophobicContact CB-CD2 4.21Å; M2778-L2806 HydrophobicContact CE-CD2 3.75Å; M2778-L2806 HydrophobicContact SD-CD2 4.49Å; M2778-M2809 HydrophobicContact CE-CE 4.12Å; M2778-M2809 HydrophobicContact CE-SD 3.82Å; M2778-M2809 HydrophobicContact SD-CE 3.97Å; M2778-M2809 HydrophobicContact SD-SD 3.99Å; M2778-W3322 VanDerWaalsContact CA-CH2 3.5Å; M2778-W3322 HydrophobicContact CB-CD2 4.46Å; M2778-W3322 HydrophobicContact CB-CE3 4.23Å; M2778-W3322 HydrophobicContact CB-CH2 3.97Å; M2778-W3322 HydrophobicContact CB-CZ2 4.21Å; M2778-W3322 HydrophobicContact CB-CZ3 3.97Å; M2778-W3322 HydrophobicContact CE-CB 4.1Å; M2778-W3322 HydrophobicContact CE-CD2 3.89Å; M2778-W3322 HydrophobicContact CE-CE3 3.58Å; M2778-W3322 HydrophobicContact CE-CG 4.12Å; M2778-W3322 HydrophobicContact CE-CZ3 4.3Å; M2778-W3322 HydrophobicContact CG-CE3 3.86Å; M2778-W3322 HydrophobicContact CG-CH2 4.05Å; M2778-W3322 HydrophobicContact CG-CZ3 3.58Å; M2778-W3322 VanDerWaalsContact O-CZ2 3.23Å; M2778-W3322 WeakPolarHBondContact O-CZ2 3.41Å; M2778-W3322 HydrophobicContact SD-CE3 4.48Å; M2778-H3325 HydrophobicContact CE-CB 3.48Å; M2778-H3325 VanDerWaalsContact CE-CB 3.48Å; M2778-H3325 HydrophobicContact SD-CB 4.11Å
2779W93.9Very high92Very high0 Ų026 Ų260%012%0.124CC..Hα-helixtrans-67.4-41.2177.2-82.8106.9000112.1W2775 E2777 E2781 A2782 L2783 L2803 L2806 H2807 M2810 F2822 L2830 Y2856 F2863W2775-W2779 WeakPolarHBondContact O-CB 3.41Å; W2775-W2779 VanDerWaalsContact O-CD1 3.26Å; W2775-W2779 PolarHBondContact O-N 3.1Å; E2777-W2779 VanDerWaalsContact C-N 3.32Å; E2777-W2779 PolarHBondContact O-N 3.21Å; W2779-E2781 PolarHBondContact O-N 3.01Å; W2779-A2782 PolarHBondContact O-N 3.11Å; W2779-L2783 HydrophobicContact CE3-CD1 4.4Å; W2779-L2783 HydrophobicContact CE3-CD2 4.45Å; W2779-L2783 HydrophobicContact CE3-CG 4.27Å; W2779-L2783 VanDerWaalsContact O-CB 3.24Å; W2779-L2783 WeakPolarHBondContact O-CB 3.38Å; W2779-L2783 WeakPolarHBondContact O-CD1 3.43Å; W2779-L2783 WeakPolarHBondContact O-CG 3.33Å; W2779-L2783 PolarHBondContact O-N 3.18Å; W2779-L2803 HydrophobicContact CZ3-CD2 4.41Å; W2779-L2806 HydrophobicContact CD2-CB 4.37Å; W2779-L2806 HydrophobicContact CD2-CD1 3.9Å; W2779-L2806 HydrophobicContact CE3-CB 4.33Å; W2779-L2806 HydrophobicContact CE3-CD1 3.86Å; W2779-L2806 HydrophobicContact CG-CD1 4.38Å; W2779-L2806 HydrophobicContact CH2-CB 3.6Å; W2779-L2806 HydrophobicContact CH2-CD1 4.41Å; W2779-L2806 HydrophobicContact CZ2-CB 3.51Å; W2779-L2806 VanDerWaalsContact CZ2-CB 3.43Å; W2779-L2806 HydrophobicContact CZ2-CD1 4.44Å; W2779-L2806 HydrophobicContact CZ3-CB 4.11Å; W2779-L2806 HydrophobicContact CZ3-CD1 4.14Å; W2779-H2807 AromaticContact CH2-CD2 3.85Å; W2779-H2807 AromaticContact CH2-CE1 3.49Å; W2779-H2807 VanDerWaalsContact CH2-CE1 3.47Å; W2779-H2807 WeakPolarHBondContact CH2-CE1 3.3Å; W2779-H2807 AromaticContact CH2-CG 3.9Å; W2779-H2807 AromaticContact CH2-ND1 3.65Å; W2779-H2807 AromaticContact CH2-NE2 3.66Å; W2779-H2807 AromaticContact CZ2-ND1 3.99Å; W2779-M2810 HydrophobicContact CZ2-CE 4.05Å; W2779-M2810 HydrophobicContact CZ2-CG 4.06Å; W2779-M2810 HydrophobicContact CZ2-SD 4.22Å; W2779-M2810 PolarHBondContact NE1-SD 3.32Å; W2779-F2822 AromaticContact CD1-CE1 3.7Å; W2779-F2822 AromaticContact CD1-CZ 3.38Å; W2779-F2822 HydrophobicContact CG-CZ 4.1Å; W2779-F2822 AromaticContact NE1-CE1 3.83Å; W2779-F2822 AromaticContact NE1-CZ 3.96Å; W2779-L2830 HydrophobicContact CD2-CD1 4.31Å; W2779-L2830 HydrophobicContact CD2-CD2 3.96Å; W2779-L2830 HydrophobicContact CE3-CD2 3.79Å; W2779-L2830 HydrophobicContact CH2-CD2 3.79Å; W2779-L2830 HydrophobicContact CZ2-CD1 4.03Å; W2779-L2830 HydrophobicContact CZ2-CD2 3.93Å; W2779-L2830 HydrophobicContact CZ2-CG 4.45Å; W2779-L2830 HydrophobicContact CZ3-CD2 3.71Å; W2779-Y2856 HydrophobicContact CZ3-CE1 4.42Å; W2779-F2863 HydrophobicContact CB-CD2 3.75Å; W2779-F2863 HydrophobicContact CB-CE2 3.59Å; W2779-F2863 HydrophobicContact CB-CZ 4.38Å; W2779-F2863 HydrophobicContact CG-CE2 4.16Å
2780S92.6Very high91.9Very high15.5 Ų15.527.2 Ų27.211%0.10813%0.128CC..Hα-helixtrans-60.8-45.2178.6171.30000112.3V2776 E2777 E2784 Y2860V2776-S2780 VanDerWaalsContact O-CB 3.28Å; V2776-S2780 WeakPolarHBondContact O-CB 3.37Å; V2776-S2780 PolarHBondContact O-N 2.87Å; V2776-S2780 PolarHBondContact O-OG 2.86Å; E2777-S2780 WeakPolarHBondContact CA-OG 3.16Å; E2777-S2780 PolarHBondContact O-N 3.28Å; E2777-S2780 VanDerWaalsContact O-N 3.15Å; E2777-S2780 PolarHBondContact O-OG 3.07Å; S2780-E2784 PolarHBondContact O-N 3.19Å; S2780-E2784 VanDerWaalsContact O-N 3.1Å; S2780-Y2860 WeakPolarHBondContact O-CD2 3.32Å; S2780-Y2860 WeakPolarHBondContact O-CE2 3.36Å
2781E89.6Confident91.9Very high70.75 Ų70.7531.4 Ų31.433%0.33115%0.147SC..Hα-helixtrans-70.1-47.3179.1-178.8179.1168.600111.5E2777 W2779 L2783 E2784 D2785 H2942 W3322E2777-E2781 WeakPolarHBondContact O-CB 3.43Å; E2777-E2781 PolarHBondContact O-N 3.1Å; W2779-E2781 PolarHBondContact O-N 3.01Å; E2781-L2783 VanDerWaalsContact C-N 3.29Å; E2781-L2783 PolarHBondContact O-N 3.04Å; E2781-E2784 WeakPolarHBondContact O-CB 3.39Å; E2781-E2784 PolarHBondContact O-N 3.14Å; E2781-E2784 VanDerWaalsContact O-N 3.12Å; E2781-D2785 PolarHBondContact O-N 3.11Å; E2781-H2942 VanDerWaalsContact CD-ND1 3.26Å; E2781-H2942 IonicContact OE1-CE1 3.35Å; E2781-H2942 PolarHBondContact OE1-CE1 3.3Å; E2781-H2942 IonicContact OE1-CG 3.6Å; E2781-H2942 IonicContact OE1-ND1 3.46Å; E2781-H2942 PolarHBondContact OE1-ND1 2.91Å; E2781-H2942 IonicContact OE2-CD2 2.74Å; E2781-H2942 IonicContact OE2-CE1 3.27Å; E2781-H2942 PolarHBondContact OE2-CE1 3.2Å; E2781-H2942 IonicContact OE2-CG 3.1Å; E2781-H2942 IonicContact OE2-ND1 3.08Å; E2781-H2942 PolarHBondContact OE2-ND1 2.9Å; E2781-H2942 VanDerWaalsContact OE2-ND1 3.11Å; E2781-H2942 IonicContact OE2-NE2 3.26Å; E2781-H2942 PolarHBondContact OE2-NE2 3.42Å; E2781-W3322 HydrophobicContact CB-CH2 4.17Å; E2781-W3322 HydrophobicContact CB-CZ2 4.06Å; E2781-W3322 HydrophobicContact CG-CH2 4.35Å; E2781-W3322 HydrophobicContact CG-CZ2 4.21Å
2782A91.9Very high91.7Very high8 Ų834.2 Ų34.27%0.06618%0.177CC..Hα-helixtrans-63.8-34.5-179.500000112.8M2778 W2779 A2786 L2803 L2806 W3322M2778-A2782 VanDerWaalsContact O-CB 3.24Å; M2778-A2782 WeakPolarHBondContact O-CB 3.39Å; M2778-A2782 PolarHBondContact O-N 3.12Å; W2779-A2782 PolarHBondContact O-N 3.11Å; A2782-A2786 WeakPolarHBondContact O-CB 3.38Å; A2782-A2786 PolarHBondContact O-N 3.03Å; A2782-L2803 HydrophobicContact CB-CD2 4.5Å; A2782-L2806 HydrophobicContact CB-CD1 3.33Å; A2782-L2806 VanDerWaalsContact CB-CD1 3.42Å; A2782-L2806 HydrophobicContact CB-CG 4.47Å; A2782-W3322 HydrophobicContact CB-CZ2 4.21Å
2783L94.7Very high91.6Very high2.25 Ų2.2538.8 Ų38.81%0.01220%0.198CC..Hα-helixtrans-70.2-36.9174.2-71173.9000111.9W2779 E2781 S2787 L2803 Y2856 L2859 Y2860 F2863W2779-L2783 HydrophobicContact CE3-CD1 4.4Å; W2779-L2783 HydrophobicContact CE3-CD2 4.45Å; W2779-L2783 HydrophobicContact CE3-CG 4.27Å; W2779-L2783 VanDerWaalsContact O-CB 3.24Å; W2779-L2783 WeakPolarHBondContact O-CB 3.38Å; W2779-L2783 WeakPolarHBondContact O-CD1 3.43Å; W2779-L2783 WeakPolarHBondContact O-CG 3.33Å; W2779-L2783 PolarHBondContact O-N 3.18Å; E2781-L2783 VanDerWaalsContact C-N 3.29Å; E2781-L2783 PolarHBondContact O-N 3.04Å; L2783-S2787 VanDerWaalsContact O-CB 3.29Å; L2783-S2787 WeakPolarHBondContact O-CB 3.3Å; L2783-S2787 PolarHBondContact O-N 3.17Å; L2783-S2787 PolarHBondContact O-OG 3.22Å; L2783-L2803 HydrophobicContact CD2-CD2 3.84Å; L2783-Y2856 HydrophobicContact CD2-CD1 3.61Å; L2783-Y2856 HydrophobicContact CD2-CE1 4.35Å; L2783-Y2856 HydrophobicContact CD2-CG 3.78Å; L2783-L2859 HydrophobicContact CD1-CB 4.48Å; L2783-Y2860 HydrophobicContact CB-CD2 4.04Å; L2783-F2863 HydrophobicContact CD1-CD2 4.05Å; L2783-F2863 HydrophobicContact CD1-CE2 4.1Å
2784E92.2Very high91.5Very high88 Ų8846.1 Ų46.141%0.41123%0.229SC..Hα-helixtrans-63.9-48.9173.5-167.4-179.9142.500111.1S2780 E2781 A2786 S2787 R2788 Y2860S2780-E2784 PolarHBondContact O-N 3.19Å; S2780-E2784 VanDerWaalsContact O-N 3.1Å; E2781-E2784 WeakPolarHBondContact O-CB 3.39Å; E2781-E2784 PolarHBondContact O-N 3.14Å; E2781-E2784 VanDerWaalsContact O-N 3.12Å; E2784-A2786 PolarHBondContact O-N 3.23Å; E2784-S2787 WeakPolarHBondContact O-CB 3.17Å; E2784-S2787 PolarHBondContact O-N 3.07Å; E2784-S2787 PolarHBondContact O-OG 2.92Å; E2784-R2788 WeakPolarHBondContact O-CB 3.38Å; E2784-R2788 PolarHBondContact O-N 3.05Å; E2784-R2788 IonicContact OE1-CZ 3.84Å; E2784-R2788 VanDerWaalsContact OE1-CZ 3.23Å; E2784-R2788 IonicContact OE1-NH1 3.98Å; E2784-R2788 PolarHBondContact OE1-NH1 3.07Å; E2784-R2788 IonicContact OE1-NH2 3.21Å; E2784-R2788 PolarHBondContact OE1-NH2 3.05Å; E2784-Y2860 HydrophobicContact CB-CE2 3.93Å; E2784-Y2860 HydrophobicContact CG-CE2 4.42Å; E2784-Y2860 PolarHBondContact OE2-OH 3.43Å
2785D90.9Very high91.4Very high34.5 Ų34.548.5 Ų48.518%0.18424%0.242CC..Hα-helixtrans-66.7-40.8178.6-95.9-4.1000112.4E2781 S2787 R2788 V2789 L2802 R3188E2781-D2785 PolarHBondContact O-N 3.11Å; D2785-S2787 VanDerWaalsContact C-N 3.28Å; D2785-S2787 PolarHBondContact O-N 3.35Å; D2785-R2788 WeakPolarHBondContact O-CB 3.49Å; D2785-R2788 PolarHBondContact O-N 3.19Å; D2785-R2788 IonicContact OD1-CZ 3.29Å; D2785-R2788 IonicContact OD1-NE 3.23Å; D2785-R2788 PolarHBondContact OD1-NE 3.37Å; D2785-R2788 IonicContact OD1-NH1 3.05Å; D2785-R2788 PolarHBondContact OD1-NH1 3.17Å; D2785-R2788 VanDerWaalsContact OD1-NH1 3.11Å; D2785-R2788 IonicContact OD1-NH2 3.17Å; D2785-R2788 PolarHBondContact OD1-NH2 3.02Å; D2785-R2788 IonicContact OD2-NH2 2.86Å; D2785-V2789 WeakPolarHBondContact O-CB 3.48Å; D2785-V2789 VanDerWaalsContact O-CG2 3.3Å; D2785-V2789 WeakPolarHBondContact O-CG2 3.44Å; D2785-V2789 PolarHBondContact O-N 3.03Å; D2785-L2802 HydrophobicContact CB-CD1 4.18Å; D2785-R3188 VanDerWaalsContact CG-NH2 3.28Å; D2785-R3188 IonicContact OD1-CZ 2.75Å; D2785-R3188 IonicContact OD1-NH1 3.68Å; D2785-R3188 IonicContact OD1-NH2 2.68Å; D2785-R3188 PolarHBondContact OD1-NH2 2.97Å; D2785-R3188 IonicContact OD2-NH2 3.87Å; D2785-R3188 PolarHBondContact OD2-NH2 3.09Å
2786A92.9Very high91.3Very high0 Ų049.5 Ų49.50%025%0.248CC..Hα-helixtrans-60.9-37.7172.800000111.6A2782 E2784 V2789 Y2790 M2799 L2802 L2803 W2853A2782-A2786 WeakPolarHBondContact O-CB 3.38Å; A2782-A2786 PolarHBondContact O-N 3.03Å; E2784-A2786 PolarHBondContact O-N 3.23Å; A2786-V2789 PolarHBondContact O-N 3.14Å; A2786-Y2790 VanDerWaalsContact O-CB 3.27Å; A2786-Y2790 WeakPolarHBondContact O-CB 3.27Å; A2786-Y2790 PolarHBondContact O-N 3.15Å; A2786-M2799 HydrophobicContact CB-CG 3.93Å; A2786-L2802 HydrophobicContact CB-CB 4.46Å; A2786-L2802 HydrophobicContact CB-CD1 4.37Å; A2786-L2803 HydrophobicContact CB-CD1 4.08Å; A2786-L2803 HydrophobicContact CB-CD2 3.79Å; A2786-L2803 HydrophobicContact CB-CG 3.89Å; A2786-W2853 HydrophobicContact CB-CH2 4Å; A2786-W2853 HydrophobicContact CB-CZ2 4.39Å
2787S93.3Very high91.2Very high37.25 Ų37.2551.3 Ų51.326%0.2626%0.264SS..Hα-helixtrans-67.5-41.7176100.10000111.6L2783 E2784 D2785 V2789 Y2790 F2791 W2853L2783-S2787 VanDerWaalsContact O-CB 3.29Å; L2783-S2787 WeakPolarHBondContact O-CB 3.3Å; L2783-S2787 PolarHBondContact O-N 3.17Å; L2783-S2787 PolarHBondContact O-OG 3.22Å; E2784-S2787 WeakPolarHBondContact O-CB 3.17Å; E2784-S2787 PolarHBondContact O-N 3.07Å; E2784-S2787 PolarHBondContact O-OG 2.92Å; D2785-S2787 VanDerWaalsContact C-N 3.28Å; D2785-S2787 PolarHBondContact O-N 3.35Å; S2787-V2789 VanDerWaalsContact C-N 3.33Å; S2787-V2789 PolarHBondContact O-N 3.2Å; S2787-Y2790 PolarHBondContact O-N 3.27Å; S2787-F2791 WeakPolarHBondContact O-CB 3.47Å; S2787-F2791 VanDerWaalsContact O-CD2 3.3Å; S2787-F2791 WeakPolarHBondContact O-CD2 3.44Å; S2787-F2791 PolarHBondContact O-N 3.2Å; S2787-W2853 VanDerWaalsContact CA-CH2 3.49Å
2788R91.6Very high91Very high129.25 Ų129.2554 Ų5449%0.48828%0.275SS..Iπ-helixtrans-60.3-44.3176-178.1-178.8-0.2-124.9-0.4111.2E2784 D2785 G2792 E2793E2784-R2788 WeakPolarHBondContact O-CB 3.38Å; E2784-R2788 PolarHBondContact O-N 3.05Å; E2784-R2788 IonicContact OE1-CZ 3.84Å; E2784-R2788 VanDerWaalsContact OE1-CZ 3.23Å; E2784-R2788 IonicContact OE1-NH1 3.98Å; E2784-R2788 PolarHBondContact OE1-NH1 3.07Å; E2784-R2788 IonicContact OE1-NH2 3.21Å; E2784-R2788 PolarHBondContact OE1-NH2 3.05Å; D2785-R2788 WeakPolarHBondContact O-CB 3.49Å; D2785-R2788 PolarHBondContact O-N 3.19Å; D2785-R2788 IonicContact OD1-CZ 3.29Å; D2785-R2788 IonicContact OD1-NE 3.23Å; D2785-R2788 PolarHBondContact OD1-NE 3.37Å; D2785-R2788 IonicContact OD1-NH1 3.05Å; D2785-R2788 PolarHBondContact OD1-NH1 3.17Å; D2785-R2788 VanDerWaalsContact OD1-NH1 3.11Å; D2785-R2788 IonicContact OD1-NH2 3.17Å; D2785-R2788 PolarHBondContact OD1-NH2 3.02Å; D2785-R2788 IonicContact OD2-NH2 2.86Å; R2788-G2792 VanDerWaalsContact O-CA 3.28Å; R2788-G2792 WeakPolarHBondContact O-CA 3.37Å; R2788-G2792 PolarHBondContact O-N 2.94Å; R2788-E2793 PolarHBondContact O-N 3.13Å
2789V90.7Very high91.1Very high4.5 Ų4.552.6 Ų52.63%0.02727%0.269CS..Iπ-helixtrans-68-45.3177.11720000111.3D2785 A2786 S2787 E2793 K2794 D2795 K2798 M2799 L2802D2785-V2789 WeakPolarHBondContact O-CB 3.48Å; D2785-V2789 VanDerWaalsContact O-CG2 3.3Å; D2785-V2789 WeakPolarHBondContact O-CG2 3.44Å; D2785-V2789 PolarHBondContact O-N 3.03Å; A2786-V2789 PolarHBondContact O-N 3.14Å; S2787-V2789 VanDerWaalsContact C-N 3.33Å; S2787-V2789 PolarHBondContact O-N 3.2Å; V2789-E2793 CarbonylContact O-C 3.5Å; V2789-E2793 WeakPolarHBondContact O-CA 3.38Å; V2789-E2793 WeakPolarHBondContact O-CB 3.39Å; V2789-E2793 PolarHBondContact O-N 3.38Å; V2789-E2793 VanDerWaalsContact O-N 3.15Å; V2789-K2794 PolarHBondContact O-N 3.11Å; V2789-D2795 HydrophobicContact CG1-CB 4.03Å; V2789-D2795 VanDerWaalsContact CG1-O 3.24Å; V2789-D2795 WeakPolarHBondContact CG1-O 3.36Å; V2789-D2795 PolarHBondContact O-N 3.1Å; V2789-K2798 HydrophobicContact CG1-CB 3.76Å; V2789-K2798 HydrophobicContact CG1-CD 3.81Å; V2789-K2798 HydrophobicContact CG1-CG 3.78Å; V2789-K2798 HydrophobicContact CG2-CD 4.03Å; V2789-K2798 HydrophobicContact CG2-CG 4.23Å; V2789-M2799 HydrophobicContact CG1-CB 4.37Å; V2789-L2802 HydrophobicContact CG2-CD1 4.11Å
2790Y90.7Very high91Very high46 Ų4653.4 Ų53.418%0.1827%0.272CS..Iπ-helixtrans-70.2-48.1-176.9178.4-112.8000113.5A2786 S2787 K2794 I2796 M2799 L2849 W2853A2786-Y2790 VanDerWaalsContact O-CB 3.27Å; A2786-Y2790 WeakPolarHBondContact O-CB 3.27Å; A2786-Y2790 PolarHBondContact O-N 3.15Å; S2787-Y2790 PolarHBondContact O-N 3.27Å; Y2790-K2794 VanDerWaalsContact O-CA 3.27Å; Y2790-K2794 WeakPolarHBondContact O-CA 3.26Å; Y2790-K2794 PolarHBondContact O-N 3.16Å; Y2790-I2796 HydrophobicContact CD2-CG1 4.14Å; Y2790-I2796 HydrophobicContact CE2-CD1 4.36Å; Y2790-I2796 HydrophobicContact CE2-CG1 4.06Å; Y2790-M2799 HydrophobicContact CD2-SD 3.81Å; Y2790-M2799 HydrophobicContact CE2-SD 4.5Å; Y2790-M2799 HydrophobicContact CG-SD 3.89Å; Y2790-L2849 HydrophobicContact CD2-CD2 4.45Å; Y2790-L2849 HydrophobicContact CE2-CD2 3.55Å; Y2790-L2849 HydrophobicContact CE2-CG 4.25Å; Y2790-W2853 AromaticContact CD1-CD1 3.76Å; Y2790-W2853 HydrophobicContact CD1-CD2 4.41Å; Y2790-W2853 AromaticContact CD1-CE2 3.64Å; Y2790-W2853 HydrophobicContact CD1-CG 4.47Å; Y2790-W2853 AromaticContact CD1-CZ2 3.99Å; Y2790-W2853 HydrophobicContact CD1-CZ2 4.11Å; Y2790-W2853 AromaticContact CD1-NE1 3.16Å; Y2790-W2853 AromaticContact CD2-NE1 3.93Å; Y2790-W2853 AromaticContact CE1-CD1 3.5Å; Y2790-W2853 VanDerWaalsContact CE1-CD1 3.49Å; Y2790-W2853 HydrophobicContact CE1-CG 4.34Å; Y2790-W2853 AromaticContact CE1-NE1 3.38Å; Y2790-W2853 VanDerWaalsContact CE1-NE1 3.35Å; Y2790-W2853 AromaticContact CG-CE2 3.94Å; Y2790-W2853 HydrophobicContact CG-CZ2 4.09Å; Y2790-W2853 AromaticContact CG-NE1 3.45Å; Y2790-W2853 AromaticContact CZ-CD1 3.95Å; Y2790-W2853 AromaticContact CZ-NE1 3.86Å
2791F90.7Very high90.7Very high128.25 Ų128.2560.2 Ų60.256%0.56330%0.295SS*.Iπ-helixtrans-85.4-33.4-177.5-65.8-69.9000113.1S2787 W2853S2787-F2791 WeakPolarHBondContact O-CB 3.47Å; S2787-F2791 VanDerWaalsContact O-CD2 3.3Å; S2787-F2791 WeakPolarHBondContact O-CD2 3.44Å; S2787-F2791 PolarHBondContact O-N 3.2Å; F2791-W2853 HydrophobicContact CE2-CD2 4.27Å; F2791-W2853 HydrophobicContact CE2-CE3 4.32Å; F2791-W2853 HydrophobicContact CZ-CD2 4.37Å; F2791-W2853 HydrophobicContact CZ-CG 4.42Å
2792G88.4Confident90.7Very high60.25 Ų60.2558.5 Ų58.562%0.62129%0.288SS*.Iπ-helixtrans-85.4-60.4-17900000112.9R2788R2788-G2792 VanDerWaalsContact O-CA 3.28Å; R2788-G2792 WeakPolarHBondContact O-CA 3.37Å; R2788-G2792 PolarHBondContact O-N 2.94Å
2793E90.1Very high90.7Very high97.25 Ų97.2558.2 Ų58.245%0.45429%0.286SS..Iπ-helixtrans-84.9-21.1-175.8-57.4175.7-166.700113.2R2788 V2789 D2795 K2798R2788-E2793 PolarHBondContact O-N 3.13Å; V2789-E2793 CarbonylContact O-C 3.5Å; V2789-E2793 WeakPolarHBondContact O-CA 3.38Å; V2789-E2793 WeakPolarHBondContact O-CB 3.39Å; V2789-E2793 PolarHBondContact O-N 3.38Å; V2789-E2793 VanDerWaalsContact O-N 3.15Å; E2793-D2795 VanDerWaalsContact C-N 3.26Å; E2793-D2795 HydrophobicContact CB-CB 4.4Å; E2793-D2795 PolarHBondContact O-N 3.33Å; E2793-K2798 VanDerWaalsContact CD-NZ 3.32Å; E2793-K2798 IonicContact OE1-NZ 3.24Å; E2793-K2798 PolarHBondContact OE1-NZ 3.09Å; E2793-K2798 VanDerWaalsContact OE1-NZ 3.08Å; E2793-K2798 WeakPolarHBondContact OE2-CD 3.49Å; E2793-K2798 WeakPolarHBondContact OE2-CE 3.38Å; E2793-K2798 IonicContact OE2-NZ 3.18Å; E2793-K2798 PolarHBondContact OE2-NZ 3.13Å
2794K88.8Confident90.4Very high167.5 Ų167.560.2 Ų60.273%0.72830%0.295SS*.  trans62.921-174.4-55.7177.4-176.91730114.5V2789 Y2790 I2796V2789-K2794 PolarHBondContact O-N 3.11Å; Y2790-K2794 VanDerWaalsContact O-CA 3.27Å; Y2790-K2794 WeakPolarHBondContact O-CA 3.26Å; Y2790-K2794 PolarHBondContact O-N 3.16Å; K2794-I2796 PolarHBondContact O-N 3.07Å
2795D90.1Very high90.2Very high56.5 Ų56.557.7 Ų57.730%0.30229%0.287SS..  trans-90.594.6177.5-174.5-11.3000111.7V2789 E2793 A2797 K2798 M2799 R2801V2789-D2795 HydrophobicContact CG1-CB 4.03Å; V2789-D2795 VanDerWaalsContact CG1-O 3.24Å; V2789-D2795 WeakPolarHBondContact CG1-O 3.36Å; V2789-D2795 PolarHBondContact O-N 3.1Å; E2793-D2795 VanDerWaalsContact C-N 3.26Å; E2793-D2795 HydrophobicContact CB-CB 4.4Å; E2793-D2795 PolarHBondContact O-N 3.33Å; D2795-A2797 VanDerWaalsContact C-N 3.29Å; D2795-A2797 PolarHBondContact O-N 2.98Å; D2795-A2797 WeakPolarHBondContact OD1-CA 3.37Å; D2795-A2797 WeakPolarHBondContact OD1-CB 3.32Å; D2795-A2797 PolarHBondContact OD1-N 3.03Å; D2795-A2797 VanDerWaalsContact OD1-N 3.1Å; D2795-K2798 HydrophobicContact CB-CB 4.02Å; D2795-K2798 HydrophobicContact CB-CD 4.5Å; D2795-K2798 PolarHBondContact O-N 3.13Å; D2795-K2798 PolarHBondContact OD1-N 3.25Å; D2795-K2798 VanDerWaalsContact OD2-CB 3.24Å; D2795-K2798 WeakPolarHBondContact OD2-CB 3.35Å; D2795-M2799 WeakPolarHBondContact O-CB 3.47Å; D2795-M2799 PolarHBondContact O-N 3.33Å; D2795-M2799 VanDerWaalsContact O-N 3.13Å; D2795-R2801 IonicContact OD2-NH1 3.16Å
2796I89.3Confident90.1Very high41.75 Ų41.7556.3 Ų56.321%0.21428%0.279CS..Hα-helixtrans-66.9-32.7179.2-53.2175.3000111.4Y2790 K2794 M2799 F2800 Y2840 L2849Y2790-I2796 HydrophobicContact CD2-CG1 4.14Å; Y2790-I2796 HydrophobicContact CE2-CD1 4.36Å; Y2790-I2796 HydrophobicContact CE2-CG1 4.06Å; K2794-I2796 PolarHBondContact O-N 3.07Å; I2796-M2799 HydrophobicContact CG2-CE 4.04Å; I2796-M2799 WeakPolarHBondContact O-CB 3.29Å; I2796-M2799 PolarHBondContact O-N 3.22Å; I2796-F2800 HydrophobicContact CG2-CD2 4.07Å; I2796-F2800 HydrophobicContact CG2-CE1 4.28Å; I2796-F2800 HydrophobicContact CG2-CE2 3.59Å; I2796-F2800 HydrophobicContact CG2-CZ 3.93Å; I2796-F2800 VanDerWaalsContact O-CD2 3.3Å; I2796-F2800 WeakPolarHBondContact O-CD2 3.38Å; I2796-F2800 WeakPolarHBondContact O-CG 3.45Å; I2796-F2800 PolarHBondContact O-N 3.23Å; I2796-Y2840 HydrophobicContact CD1-CE1 4.46Å; I2796-Y2840 WeakPolarHBondContact CD1-OH 3.21Å; I2796-Y2840 HydrophobicContact CG2-CE1 3.97Å; I2796-L2849 HydrophobicContact CD1-CD2 4.04Å; I2796-L2849 HydrophobicContact CG1-CD2 4.39Å; I2796-L2849 HydrophobicContact CG2-CD2 4.04Å
2797A90Very high90Very high45.75 Ų45.7556.6 Ų56.638%0.37828%0.28SS..Hα-helixtrans-70.1-41.2-179.400000111.3D2795 F2800 R2801D2795-A2797 VanDerWaalsContact C-N 3.29Å; D2795-A2797 PolarHBondContact O-N 2.98Å; D2795-A2797 WeakPolarHBondContact OD1-CA 3.37Å; D2795-A2797 WeakPolarHBondContact OD1-CB 3.32Å; D2795-A2797 PolarHBondContact OD1-N 3.03Å; D2795-A2797 VanDerWaalsContact OD1-N 3.1Å; A2797-F2800 PolarHBondContact O-N 3.35Å; A2797-R2801 VanDerWaalsContact O-CG 3.25Å; A2797-R2801 WeakPolarHBondContact O-CG 3.38Å; A2797-R2801 PolarHBondContact O-N 3.18Å
2798K88.2Confident89.7Confident71.5 Ų71.559.1 Ų59.131%0.31129%0.288SS..Hα-helixtrans-67.1-37.1173.7-178.2-179.7172.6-170.90111.9V2789 E2793 D2795 F2800 R2801 L2802V2789-K2798 HydrophobicContact CG1-CB 3.76Å; V2789-K2798 HydrophobicContact CG1-CD 3.81Å; V2789-K2798 HydrophobicContact CG1-CG 3.78Å; V2789-K2798 HydrophobicContact CG2-CD 4.03Å; V2789-K2798 HydrophobicContact CG2-CG 4.23Å; E2793-K2798 VanDerWaalsContact CD-NZ 3.32Å; E2793-K2798 IonicContact OE1-NZ 3.24Å; E2793-K2798 PolarHBondContact OE1-NZ 3.09Å; E2793-K2798 VanDerWaalsContact OE1-NZ 3.08Å; E2793-K2798 WeakPolarHBondContact OE2-CD 3.49Å; E2793-K2798 WeakPolarHBondContact OE2-CE 3.38Å; E2793-K2798 IonicContact OE2-NZ 3.18Å; E2793-K2798 PolarHBondContact OE2-NZ 3.13Å; D2795-K2798 HydrophobicContact CB-CB 4.02Å; D2795-K2798 HydrophobicContact CB-CD 4.5Å; D2795-K2798 PolarHBondContact O-N 3.13Å; D2795-K2798 PolarHBondContact OD1-N 3.25Å; D2795-K2798 VanDerWaalsContact OD2-CB 3.24Å; D2795-K2798 WeakPolarHBondContact OD2-CB 3.35Å; K2798-F2800 VanDerWaalsContact C-N 3.35Å; K2798-F2800 PolarHBondContact O-N 3.31Å; K2798-R2801 WeakPolarHBondContact O-CB 3.3Å; K2798-R2801 PolarHBondContact O-N 2.97Å; K2798-L2802 WeakPolarHBondContact O-CG 3.31Å; K2798-L2802 PolarHBondContact O-N 3.17Å; K2798-L2802 VanDerWaalsContact O-N 3.12Å
2799M92Very high89.5Confident0.75 Ų0.7553.7 Ų53.70%0.00427%0.268CS..Hα-helixtrans-56.6-48.5170.4-178-155.275.300111.5A2786 V2789 Y2790 D2795 I2796 R2801 L2802 L2803 L2849 W2853A2786-M2799 HydrophobicContact CB-CG 3.93Å; V2789-M2799 HydrophobicContact CG1-CB 4.37Å; Y2790-M2799 HydrophobicContact CD2-SD 3.81Å; Y2790-M2799 HydrophobicContact CE2-SD 4.5Å; Y2790-M2799 HydrophobicContact CG-SD 3.89Å; D2795-M2799 WeakPolarHBondContact O-CB 3.47Å; D2795-M2799 PolarHBondContact O-N 3.33Å; D2795-M2799 VanDerWaalsContact O-N 3.13Å; I2796-M2799 HydrophobicContact CG2-CE 4.04Å; I2796-M2799 WeakPolarHBondContact O-CB 3.29Å; I2796-M2799 PolarHBondContact O-N 3.22Å; M2799-R2801 PolarHBondContact O-N 3.08Å; M2799-L2802 WeakPolarHBondContact O-CB 3.42Å; M2799-L2802 PolarHBondContact O-N 3.02Å; M2799-L2802 VanDerWaalsContact O-N 3.15Å; M2799-L2803 HydrophobicContact CG-CD1 4.32Å; M2799-L2803 PolarHBondContact O-N 3.35Å; M2799-L2803 VanDerWaalsContact O-N 3.16Å; M2799-L2849 HydrophobicContact CE-CD1 3.87Å; M2799-L2849 HydrophobicContact SD-CD1 4.27Å; M2799-W2853 HydrophobicContact CG-CZ2 4Å; M2799-W2853 HydrophobicContact SD-CZ2 3.64Å; M2799-W2853 VanDerWaalsContact SD-CZ2 3.52Å; M2799-W2853 PolarHBondContact SD-NE1 3.02Å; M2799-W2853 VanDerWaalsContact SD-NE1 3.45Å
2800F91.6Very high89.2Confident16.5 Ų16.554.5 Ų54.57%0.07227%0.272CS..Hα-helixtrans-64.6-38.4176.4-69.3-36.7000113.3I2796 A2797 K2798 L2802 L2803 H2804 C2837 Y2840 E2841 L2849I2796-F2800 HydrophobicContact CG2-CD2 4.07Å; I2796-F2800 HydrophobicContact CG2-CE1 4.28Å; I2796-F2800 HydrophobicContact CG2-CE2 3.59Å; I2796-F2800 HydrophobicContact CG2-CZ 3.93Å; I2796-F2800 VanDerWaalsContact O-CD2 3.3Å; I2796-F2800 WeakPolarHBondContact O-CD2 3.38Å; I2796-F2800 WeakPolarHBondContact O-CG 3.45Å; I2796-F2800 PolarHBondContact O-N 3.23Å; A2797-F2800 PolarHBondContact O-N 3.35Å; K2798-F2800 VanDerWaalsContact C-N 3.35Å; K2798-F2800 PolarHBondContact O-N 3.31Å; F2800-L2802 PolarHBondContact O-N 3.25Å; F2800-L2802 VanDerWaalsContact O-N 3.16Å; F2800-L2803 PolarHBondContact O-N 3.26Å; F2800-H2804 WeakPolarHBondContact O-CB 3.25Å; F2800-H2804 PolarHBondContact O-N 3.32Å; F2800-C2837 HydrophobicContact CD1-CB 4.47Å; F2800-C2837 HydrophobicContact CE1-CB 3.68Å; F2800-C2837 HydrophobicContact CZ-CB 4.33Å; F2800-Y2840 AromaticContact CE2-CD1 3.93Å; F2800-Y2840 HydrophobicContact CE2-CD1 3.95Å; F2800-Y2840 HydrophobicContact CE2-CE1 4.21Å; F2800-Y2840 AromaticContact CZ-CD1 3.76Å; F2800-Y2840 HydrophobicContact CZ-CD1 3.76Å; F2800-Y2840 HydrophobicContact CZ-CE1 4.37Å; F2800-E2841 HydrophobicContact CD2-CG 4.12Å; F2800-E2841 WeakPolarHBondContact CD2-OE1 3.48Å; F2800-E2841 HydrophobicContact CE2-CG 3.56Å; F2800-E2841 VanDerWaalsContact CE2-CG 3.44Å; F2800-E2841 HydrophobicContact CZ-CG 3.92Å; F2800-L2849 HydrophobicContact CE1-CD1 4.34Å; F2800-L2849 HydrophobicContact CZ-CD1 4.4Å
2801R87.6Confident89Confident157 Ų15757.3 Ų57.359%0.59229%0.29SS*.Hα-helixtrans-59.9-27.6174.4-71.2171.8-163.6137.52.5113.1D2795 A2797 K2798 M2799 P2805 N3320D2795-R2801 IonicContact OD2-NH1 3.16Å; A2797-R2801 VanDerWaalsContact O-CG 3.25Å; A2797-R2801 WeakPolarHBondContact O-CG 3.38Å; A2797-R2801 PolarHBondContact O-N 3.18Å; K2798-R2801 WeakPolarHBondContact O-CB 3.3Å; K2798-R2801 PolarHBondContact O-N 2.97Å; M2799-R2801 PolarHBondContact O-N 3.08Å; R2801-P2805 WeakPolarHBondContact O-CD 3.28Å; R2801-P2805 WeakPolarHBondContact O-CG 3.47Å; R2801-N3320 PolarHBondContact O-ND2 3.35Å
2802L88.7Confident88.6Confident36 Ų3658.7 Ų58.719%0.18829%0.292CS..Hα-helixtrans-78.2-45.8175.3-67.8170000112.2D2785 A2786 V2789 K2798 M2799 F2800 N3320D2785-L2802 HydrophobicContact CB-CD1 4.18Å; A2786-L2802 HydrophobicContact CB-CB 4.46Å; A2786-L2802 HydrophobicContact CB-CD1 4.37Å; V2789-L2802 HydrophobicContact CG2-CD1 4.11Å; K2798-L2802 WeakPolarHBondContact O-CG 3.31Å; K2798-L2802 PolarHBondContact O-N 3.17Å; K2798-L2802 VanDerWaalsContact O-N 3.12Å; M2799-L2802 WeakPolarHBondContact O-CB 3.42Å; M2799-L2802 PolarHBondContact O-N 3.02Å; M2799-L2802 VanDerWaalsContact O-N 3.15Å; F2800-L2802 PolarHBondContact O-N 3.25Å; F2800-L2802 VanDerWaalsContact O-N 3.16Å; L2802-N3320 PolarHBondContact O-ND2 3.12Å
2803L91.2Very high88.5Confident1.33333 Ų1.3333357.3 Ų57.31%0.00728%0.277CS..Hα-helixtrans-84.7-38.7-172-60.1179.1000114.2W2779 A2782 L2783 A2786 M2799 F2800 P2805 L2806 H2807 Y2856W2779-L2803 HydrophobicContact CZ3-CD2 4.41Å; A2782-L2803 HydrophobicContact CB-CD2 4.5Å; L2783-L2803 HydrophobicContact CD2-CD2 3.84Å; A2786-L2803 HydrophobicContact CB-CD1 4.08Å; A2786-L2803 HydrophobicContact CB-CD2 3.79Å; A2786-L2803 HydrophobicContact CB-CG 3.89Å; M2799-L2803 HydrophobicContact CG-CD1 4.32Å; M2799-L2803 PolarHBondContact O-N 3.35Å; M2799-L2803 VanDerWaalsContact O-N 3.16Å; F2800-L2803 PolarHBondContact O-N 3.26Å; L2803-P2805 VanDerWaalsContact C-N 3.33Å; L2803-L2806 WeakPolarHBondContact O-CB 3.46Å; L2803-L2806 PolarHBondContact O-N 3.35Å; L2803-L2806 VanDerWaalsContact O-N 3.11Å; L2803-H2807 PolarHBondContact O-CD2 3.19Å; L2803-H2807 PolarHBondContact O-N 3.18Å; L2803-Y2856 HydrophobicContact CD1-CD2 4.4Å; L2803-Y2856 HydrophobicContact CD1-CE2 3.92Å
2804H89.2Confident88.5Confident44 Ų4457.8 Ų57.820%0.20428%0.279CS..Hα-helixtrans-57-42.3-175.8-152.993.7000113.4F2800 L2806 H2807 Q2808 E2841F2800-H2804 WeakPolarHBondContact O-CB 3.25Å; F2800-H2804 PolarHBondContact O-N 3.32Å; H2804-L2806 VanDerWaalsContact C-N 3.29Å; H2804-L2806 PolarHBondContact O-N 3.21Å; H2804-H2807 WeakPolarHBondContact O-CB 3.27Å; H2804-H2807 PolarHBondContact O-N 3.22Å; H2804-H2807 VanDerWaalsContact O-N 3.15Å; H2804-Q2808 PolarHBondContact CD2-NE2 3.31Å; H2804-Q2808 PolarHBondContact NE2-NE2 3.06Å; H2804-Q2808 WeakPolarHBondContact O-CB 3.22Å; H2804-Q2808 WeakPolarHBondContact O-CG 3.45Å; H2804-Q2808 PolarHBondContact O-N 3.02Å; H2804-Q2808 VanDerWaalsContact O-N 3.09Å; H2804-E2841 IonicContact CE1-OE1 3.34Å; H2804-E2841 IonicContact CE1-OE2 3.18Å; H2804-E2841 PolarHBondContact CE1-OE2 2.74Å
2805P87.6Confident88.4Confident36.6667 Ų36.666755.1 Ų55.124%0.23827%0.269CS..Hα-helixtrans-64.5-30.7178.2-25.839.2000113.4R2801 L2803 Q2808 M2809 N3320 L3326R2801-P2805 WeakPolarHBondContact O-CD 3.28Å; R2801-P2805 WeakPolarHBondContact O-CG 3.47Å; L2803-P2805 VanDerWaalsContact C-N 3.33Å; P2805-Q2808 WeakPolarHBondContact O-CB 3.37Å; P2805-Q2808 PolarHBondContact O-N 3.05Å; P2805-M2809 WeakPolarHBondContact O-CB 3.24Å; P2805-M2809 PolarHBondContact O-N 3.29Å; P2805-M2809 VanDerWaalsContact O-N 3.08Å; P2805-N3320 HydrophobicContact CB-CB 4.42Å; P2805-N3320 HydrophobicContact CG-CB 4.22Å; P2805-N3320 WeakPolarHBondContact CG-ND2 3.35Å; P2805-L3326 HydrophobicContact CB-CD1 3.27Å; P2805-L3326 WeakPolarHBondContact O-CD1 3.16Å; P2805-L3326 WeakPolarHBondContact O-CD2 3.47Å
2806L89.9Confident88.6Confident5 Ų552.8 Ų52.83%0.02626%0.257CS..Hα-helixtrans-71.2-37.5174-67.1-177.2000112.1M2778 W2779 A2782 L2803 H2804 Q2808 M2809 M2810 W3322 L3326M2778-L2806 HydrophobicContact CB-CD2 4.21Å; M2778-L2806 HydrophobicContact CE-CD2 3.75Å; M2778-L2806 HydrophobicContact SD-CD2 4.49Å; W2779-L2806 HydrophobicContact CD2-CB 4.37Å; W2779-L2806 HydrophobicContact CD2-CD1 3.9Å; W2779-L2806 HydrophobicContact CE3-CB 4.33Å; W2779-L2806 HydrophobicContact CE3-CD1 3.86Å; W2779-L2806 HydrophobicContact CG-CD1 4.38Å; W2779-L2806 HydrophobicContact CH2-CB 3.6Å; W2779-L2806 HydrophobicContact CH2-CD1 4.41Å; W2779-L2806 HydrophobicContact CZ2-CB 3.51Å; W2779-L2806 VanDerWaalsContact CZ2-CB 3.43Å; W2779-L2806 HydrophobicContact CZ2-CD1 4.44Å; W2779-L2806 HydrophobicContact CZ3-CB 4.11Å; W2779-L2806 HydrophobicContact CZ3-CD1 4.14Å; A2782-L2806 HydrophobicContact CB-CD1 3.33Å; A2782-L2806 VanDerWaalsContact CB-CD1 3.42Å; A2782-L2806 HydrophobicContact CB-CG 4.47Å; L2803-L2806 WeakPolarHBondContact O-CB 3.46Å; L2803-L2806 PolarHBondContact O-N 3.35Å; L2803-L2806 VanDerWaalsContact O-N 3.11Å; H2804-L2806 VanDerWaalsContact C-N 3.29Å; H2804-L2806 PolarHBondContact O-N 3.21Å; L2806-Q2808 VanDerWaalsContact C-N 3.32Å; L2806-Q2808 PolarHBondContact O-N 2.88Å; L2806-M2809 HydrophobicContact CD2-CE 4.18Å; L2806-M2809 WeakPolarHBondContact O-CA 3.42Å; L2806-M2809 WeakPolarHBondContact O-CB 3.39Å; L2806-M2809 PolarHBondContact O-N 3.07Å; L2806-M2809 VanDerWaalsContact O-N 3.12Å; L2806-M2810 WeakPolarHBondContact O-CG 3.4Å; L2806-M2810 PolarHBondContact O-N 3Å; L2806-M2810 VanDerWaalsContact O-N 3.11Å; L2806-W3322 HydrophobicContact CD2-CB 4.17Å; L2806-W3322 HydrophobicContact CD2-CD2 4.2Å; L2806-W3322 HydrophobicContact CD2-CG 3.71Å; L2806-W3322 HydrophobicContact CG-CG 4.37Å; L2806-L3326 HydrophobicContact CD2-CD2 4.31Å
2807H90.9Very high88.7Confident6 Ų655.5 Ų55.53%0.02827%0.271CS..Hα-helixtrans-61.7-42.2171.3-77.4-58.3000111.9W2779 L2803 H2804 M2809 M2810 D2811 L2830 Y2856W2779-H2807 AromaticContact CH2-CD2 3.85Å; W2779-H2807 AromaticContact CH2-CE1 3.49Å; W2779-H2807 VanDerWaalsContact CH2-CE1 3.47Å; W2779-H2807 WeakPolarHBondContact CH2-CE1 3.3Å; W2779-H2807 AromaticContact CH2-CG 3.9Å; W2779-H2807 AromaticContact CH2-ND1 3.65Å; W2779-H2807 AromaticContact CH2-NE2 3.66Å; W2779-H2807 AromaticContact CZ2-ND1 3.99Å; L2803-H2807 PolarHBondContact O-CD2 3.19Å; L2803-H2807 PolarHBondContact O-N 3.18Å; H2804-H2807 WeakPolarHBondContact O-CB 3.27Å; H2804-H2807 PolarHBondContact O-N 3.22Å; H2804-H2807 VanDerWaalsContact O-N 3.15Å; H2807-M2809 PolarHBondContact O-N 3.13Å; H2807-M2809 VanDerWaalsContact O-N 3.11Å; H2807-M2810 WeakPolarHBondContact O-CB 3.43Å; H2807-M2810 PolarHBondContact O-N 3.28Å; H2807-M2810 VanDerWaalsContact O-N 3.12Å; H2807-D2811 VanDerWaalsContact O-CG 3.31Å; H2807-D2811 PolarHBondContact O-N 3.25Å; H2807-D2811 VanDerWaalsContact O-N 3.12Å; H2807-L2830 PolarHBondContact CE1-O 3.24Å; H2807-L2830 VanDerWaalsContact CE1-O 3.32Å; H2807-Y2856 AromaticContact NE2-CE1 3.92Å; H2807-Y2856 AromaticContact NE2-CZ 3.83Å; H2807-Y2856 PolarHBondContact NE2-OH 2.97Å
2808Q86.9Confident88.8Confident88.6667 Ų88.666755.5 Ų55.541%0.41426%0.263SS..Hα-helixtrans-64.9-16.6172.4-67.1-179.7-5.300114H2804 P2805 L2806 R2812H2804-Q2808 PolarHBondContact CD2-NE2 3.31Å; H2804-Q2808 PolarHBondContact NE2-NE2 3.06Å; H2804-Q2808 WeakPolarHBondContact O-CB 3.22Å; H2804-Q2808 WeakPolarHBondContact O-CG 3.45Å; H2804-Q2808 PolarHBondContact O-N 3.02Å; H2804-Q2808 VanDerWaalsContact O-N 3.09Å; P2805-Q2808 WeakPolarHBondContact O-CB 3.37Å; P2805-Q2808 PolarHBondContact O-N 3.05Å; L2806-Q2808 VanDerWaalsContact C-N 3.32Å; L2806-Q2808 PolarHBondContact O-N 2.88Å; Q2808-R2812 PolarHBondContact O-NE 3.15Å
2809M86.4Confident89.1Confident16.6667 Ų16.666752.5 Ų52.58%0.08225%0.25CC..Hα-helixtrans-73.9-47.3169-163.4173.960.200110.4W2775 M2778 P2805 L2806 H2807 D2811 R2812 L3326W2775-M2809 VanDerWaalsContact CD1-CE 3.47Å; W2775-M2809 HydrophobicContact CD2-CE 3.84Å; W2775-M2809 HydrophobicContact CE3-CE 4.42Å; W2775-M2809 HydrophobicContact CG-CE 3.77Å; W2775-M2809 HydrophobicContact CZ2-CE 4.39Å; W2775-M2809 HydrophobicContact CZ2-CG 4.2Å; W2775-M2809 HydrophobicContact CZ2-SD 4.42Å; W2775-M2809 PolarHBondContact NE1-SD 2.88Å; M2778-M2809 HydrophobicContact CE-CE 4.12Å; M2778-M2809 HydrophobicContact CE-SD 3.82Å; M2778-M2809 HydrophobicContact SD-CE 3.97Å; M2778-M2809 HydrophobicContact SD-SD 3.99Å; P2805-M2809 WeakPolarHBondContact O-CB 3.24Å; P2805-M2809 PolarHBondContact O-N 3.29Å; P2805-M2809 VanDerWaalsContact O-N 3.08Å; L2806-M2809 HydrophobicContact CD2-CE 4.18Å; L2806-M2809 WeakPolarHBondContact O-CA 3.42Å; L2806-M2809 WeakPolarHBondContact O-CB 3.39Å; L2806-M2809 PolarHBondContact O-N 3.07Å; L2806-M2809 VanDerWaalsContact O-N 3.12Å; H2807-M2809 PolarHBondContact O-N 3.13Å; H2807-M2809 VanDerWaalsContact O-N 3.11Å; M2809-D2811 VanDerWaalsContact C-N 3.29Å; M2809-D2811 PolarHBondContact O-N 3.02Å; M2809-R2812 WeakPolarHBondContact O-CB 3.34Å; M2809-R2812 PolarHBondContact O-N 3.08Å; M2809-R2812 VanDerWaalsContact O-N 3.13Å; M2809-L3326 HydrophobicContact CB-CD2 3.57Å; M2809-L3326 HydrophobicContact CG-CD2 3.89Å; M2809-L3326 HydrophobicContact SD-CD2 3.86Å
2810M85.8Confident89.1Confident20.6667 Ų20.666753.6 Ų53.610%0.10226%0.26CS..Hα-helixtrans-63.4-36.2-178.9-55.7-81-59.200111.7W2775 W2779 L2806 H2807 R2812 G2813 F2822 L2823 L2830W2775-M2810 HydrophobicContact CE3-CE 4.02Å; W2775-M2810 HydrophobicContact CE3-SD 4.11Å; W2775-M2810 HydrophobicContact CH2-CE 4.43Å; W2775-M2810 HydrophobicContact CH2-SD 4.45Å; W2775-M2810 HydrophobicContact CZ3-CE 3.83Å; W2775-M2810 HydrophobicContact CZ3-CG 4.21Å; W2775-M2810 HydrophobicContact CZ3-SD 4.11Å; W2779-M2810 HydrophobicContact CZ2-CE 4.05Å; W2779-M2810 HydrophobicContact CZ2-CG 4.06Å; W2779-M2810 HydrophobicContact CZ2-SD 4.22Å; W2779-M2810 PolarHBondContact NE1-SD 3.32Å; L2806-M2810 WeakPolarHBondContact O-CG 3.4Å; L2806-M2810 PolarHBondContact O-N 3Å; L2806-M2810 VanDerWaalsContact O-N 3.11Å; H2807-M2810 WeakPolarHBondContact O-CB 3.43Å; H2807-M2810 PolarHBondContact O-N 3.28Å; H2807-M2810 VanDerWaalsContact O-N 3.12Å; M2810-R2812 PolarHBondContact O-N 3.16Å; M2810-G2813 PolarHBondContact O-N 3.05Å; M2810-F2822 HydrophobicContact CE-CD1 3.82Å; M2810-F2822 HydrophobicContact CE-CE1 3.72Å; M2810-F2822 HydrophobicContact SD-CE1 4.28Å; M2810-L2823 HydrophobicContact CB-CD2 4.13Å; M2810-L2823 HydrophobicContact CE-CD1 4.44Å; M2810-L2823 HydrophobicContact CE-CD2 3.47Å; M2810-L2823 HydrophobicContact CE-CG 3.65Å; M2810-L2823 HydrophobicContact CG-CD2 4.07Å; M2810-L2823 HydrophobicContact SD-CD2 3.75Å; M2810-L2830 HydrophobicContact CE-CB 3.66Å; M2810-L2830 HydrophobicContact CE-CD1 4.15Å; M2810-L2830 HydrophobicContact CE-CG 4.38Å; M2810-L2830 HydrophobicContact SD-CB 4.44Å; M2810-L2830 HydrophobicContact SD-CD1 3.59Å; M2810-L2830 VanDerWaalsContact SD-CD1 3.59Å
2811D85.4Confident89.3Confident104.333 Ų104.33355.5 Ų55.556%0.55827%0.273SS*.THydrogen-bonded Turntrans-58.5-20.2177-67.2-16.1000113.6H2807 M2809 G2813 R2834H2807-D2811 VanDerWaalsContact O-CG 3.31Å; H2807-D2811 PolarHBondContact O-N 3.25Å; H2807-D2811 VanDerWaalsContact O-N 3.12Å; M2809-D2811 VanDerWaalsContact C-N 3.29Å; M2809-D2811 PolarHBondContact O-N 3.02Å; D2811-G2813 VanDerWaalsContact C-N 3.27Å; D2811-G2813 PolarHBondContact O-N 2.62Å; D2811-R2834 IonicContact OD1-CZ 3.77Å; D2811-R2834 IonicContact OD1-NH1 3.22Å; D2811-R2834 PolarHBondContact OD1-NH1 3.4Å; D2811-R2834 IonicContact OD2-CZ 3.56Å; D2811-R2834 IonicContact OD2-NH1 3.28Å; D2811-R2834 PolarHBondContact OD2-NH1 3.23Å; D2811-R2834 IonicContact OD2-NH2 3.35Å; D2811-R2834 PolarHBondContact OD2-NH2 3.17Å
2812R82.6Confident89.6Confident159.333 Ų159.33348.5 Ų48.560%0.60125%0.246SC*.THydrogen-bonded Turntrans-83.2-13178.2-57.8178.7-167.6-179.35.2113.3Q2808 M2809 M2810 L3326Q2808-R2812 PolarHBondContact O-NE 3.15Å; M2809-R2812 WeakPolarHBondContact O-CB 3.34Å; M2809-R2812 PolarHBondContact O-N 3.08Å; M2809-R2812 VanDerWaalsContact O-N 3.13Å; M2810-R2812 PolarHBondContact O-N 3.16Å; R2812-L3326 PolarHBondContact NH1-O 3.38Å; R2812-L3326 PolarHBondContact NH2-O 3.45Å
2813G86.5Confident89.8Confident30.3333 Ų30.333348.7 Ų48.731%0.31325%0.247SC..  trans79-174.5-171.500000113.5M2810 D2811M2810-G2813 PolarHBondContact O-N 3.05Å; D2811-G2813 VanDerWaalsContact C-N 3.27Å; D2811-G2813 PolarHBondContact O-N 2.62Å
2814H88.9Confident89.9Confident106.667 Ų106.66756.5 Ų56.549%0.49428%0.284SS..  trans-95.4149.4-179.85436.6000111.8E2819 A2820 L2823H2814-E2819 HydrophobicContact CB-CB 3.7Å; H2814-A2820 HydrophobicContact CB-CB 4.09Å; H2814-A2820 VanDerWaalsContact CD2-CA 3.46Å; H2814-A2820 WeakPolarHBondContact CD2-CA 3.46Å; H2814-A2820 VanDerWaalsContact CD2-CB 3.48Å; H2814-A2820 WeakPolarHBondContact CD2-CB 3.37Å; H2814-A2820 VanDerWaalsContact CG-CB 3.48Å; H2814-L2823 HydrophobicContact CB-CD1 4.08Å
2815E88.5Confident90Very high111.333 Ų111.33359.3 Ų59.352%0.5230%0.297SS..SBendtrans-110.1-18.4170.6-62.8-179.115800111.9R2770 E2819R2770-E2815 IonicContact CZ-OE2 3.42Å; R2770-E2815 VanDerWaalsContact CZ-OE2 3.26Å; R2770-E2815 IonicContact NH1-OE2 3.58Å; R2770-E2815 PolarHBondContact NH1-OE2 3.29Å; R2770-E2815 VanDerWaalsContact NH1-OE2 3.11Å; R2770-E2815 IonicContact NH2-OE2 3.27Å; R2770-E2815 PolarHBondContact NH2-OE2 3.25Å; E2815-E2819 WeakPolarHBondContact CA-OE2 3.37Å; E2815-E2819 PolarHBondContact N-OE2 2.96Å
2816T92.5Very high90.3Very high8.33333 Ų8.3333357.6 Ų57.65%0.05129%0.286CS..SBendtrans-126.5160.7-176.867.90000112.4H2818 E2819 A2820 P2880T2816-H2818 VanDerWaalsContact C-N 3.29Å; T2816-H2818 PolarHBondContact O-N 3.27Å; T2816-E2819 WeakPolarHBondContact CB-OE2 3.3Å; T2816-E2819 PolarHBondContact N-OE2 3Å; T2816-E2819 PolarHBondContact O-N 3.43Å; T2816-E2819 WeakPolarHBondContact OG1-CB 3.47Å; T2816-E2819 WeakPolarHBondContact OG1-CG 3.37Å; T2816-E2819 PolarHBondContact OG1-N 3.25Å; T2816-E2819 PolarHBondContact OG1-OE2 3.12Å; T2816-A2820 WeakPolarHBondContact O-CB 3.4Å; T2816-A2820 PolarHBondContact O-N 3.09Å; T2816-P2880 HydrophobicContact CG2-CG 4.5Å
2817I92.7Very high90.4Very high99 Ų9957.9 Ų57.951%0.50829%0.29SS..Hα-helixtrans-62.4-37.1178.5-57.5170.6000110.5A2820 T2821 V2877I2817-A2820 WeakPolarHBondContact O-CB 3.33Å; I2817-A2820 PolarHBondContact O-N 3.3Å; I2817-T2821 WeakPolarHBondContact O-CB 3.5Å; I2817-T2821 PolarHBondContact O-N 3.08Å; I2817-T2821 PolarHBondContact O-OG1 3.06Å; I2817-T2821 VanDerWaalsContact O-OG1 3.1Å; I2817-V2877 HydrophobicContact CB-CB 4.19Å; I2817-V2877 HydrophobicContact CB-CG1 4Å; I2817-V2877 HydrophobicContact CD1-CG1 4.48Å; I2817-V2877 HydrophobicContact CG2-CB 4.45Å; I2817-V2877 HydrophobicContact CG2-CG1 3.95Å; I2817-V2877 PolarHBondContact N-O 2.88Å
2818H92Very high90.5Very high45.3333 Ų45.333364 Ų6421%0.2132%0.324CS..Hα-helixtrans-63.6-44.3177.7-172.464000112.4T2816 A2820 T2821 F2822 V2877T2816-H2818 VanDerWaalsContact C-N 3.29Å; T2816-H2818 PolarHBondContact O-N 3.27Å; H2818-A2820 VanDerWaalsContact C-N 3.35Å; H2818-T2821 PolarHBondContact O-N 3.34Å; H2818-F2822 PolarHBondContact O-N 2.98Å; H2818-F2822 VanDerWaalsContact O-N 3.12Å; H2818-V2877 HydrophobicContact CB-CG1 4.24Å; H2818-V2877 WeakPolarHBondContact CB-O 3.33Å; H2818-V2877 PolarHBondContact N-O 3.06Å
2819E93.5Very high90.9Very high7.66667 Ų7.6666762.5 Ų62.54%0.03632%0.318CS..Hα-helixtrans-67.1-37.8175.1-67159.9167.600111.6R2770 W2775 H2814 E2815 T2816 T2821 F2822 L2823R2770-E2819 WeakPolarHBondContact CD-OE1 3.26Å; R2770-E2819 IonicContact CZ-OE1 3.25Å; R2770-E2819 IonicContact NH1-OE1 3.13Å; R2770-E2819 PolarHBondContact NH1-OE1 2.93Å; R2770-E2819 IonicContact NH1-OE2 3.56Å; W2775-E2819 HydrophobicContact CD2-CB 4.32Å; W2775-E2819 HydrophobicContact CD2-CG 3.94Å; W2775-E2819 HydrophobicContact CE3-CB 4.14Å; W2775-E2819 HydrophobicContact CE3-CG 4.13Å; W2775-E2819 HydrophobicContact CG-CG 4.46Å; W2775-E2819 HydrophobicContact CH2-CB 3.96Å; W2775-E2819 HydrophobicContact CH2-CG 4.22Å; W2775-E2819 HydrophobicContact CZ2-CB 4.1Å; W2775-E2819 HydrophobicContact CZ2-CG 3.83Å; W2775-E2819 HydrophobicContact CZ3-CB 3.96Å; W2775-E2819 HydrophobicContact CZ3-CG 4.23Å; H2814-E2819 HydrophobicContact CB-CB 3.7Å; E2815-E2819 WeakPolarHBondContact CA-OE2 3.37Å; E2815-E2819 PolarHBondContact N-OE2 2.96Å; T2816-E2819 WeakPolarHBondContact CB-OE2 3.3Å; T2816-E2819 PolarHBondContact N-OE2 3Å; T2816-E2819 PolarHBondContact O-N 3.43Å; T2816-E2819 WeakPolarHBondContact OG1-CB 3.47Å; T2816-E2819 WeakPolarHBondContact OG1-CG 3.37Å; T2816-E2819 PolarHBondContact OG1-N 3.25Å; T2816-E2819 PolarHBondContact OG1-OE2 3.12Å; E2819-T2821 VanDerWaalsContact C-N 3.32Å; E2819-T2821 PolarHBondContact O-N 3.27Å; E2819-F2822 WeakPolarHBondContact O-CB 3.33Å; E2819-F2822 PolarHBondContact O-N 3.23Å; E2819-L2823 PolarHBondContact O-N 3Å
2820A93.7Very high91.2Very high25 Ų2561.8 Ų61.821%0.20732%0.315CS..Hα-helixtrans-61.8-44.517600000112H2814 T2816 I2817 H2818 F2822 L2823 Q2824H2814-A2820 HydrophobicContact CB-CB 4.09Å; H2814-A2820 VanDerWaalsContact CD2-CA 3.46Å; H2814-A2820 WeakPolarHBondContact CD2-CA 3.46Å; H2814-A2820 VanDerWaalsContact CD2-CB 3.48Å; H2814-A2820 WeakPolarHBondContact CD2-CB 3.37Å; H2814-A2820 VanDerWaalsContact CG-CB 3.48Å; T2816-A2820 WeakPolarHBondContact O-CB 3.4Å; T2816-A2820 PolarHBondContact O-N 3.09Å; I2817-A2820 WeakPolarHBondContact O-CB 3.33Å; I2817-A2820 PolarHBondContact O-N 3.3Å; H2818-A2820 VanDerWaalsContact C-N 3.35Å; A2820-F2822 VanDerWaalsContact C-N 3.34Å; A2820-F2822 PolarHBondContact O-N 3.03Å; A2820-L2823 PolarHBondContact O-N 3.06Å; A2820-Q2824 WeakPolarHBondContact O-CB 3.34Å; A2820-Q2824 PolarHBondContact O-N 2.85Å
2821T94.1Very high91.6Very high56.6667 Ų56.666763.1 Ų63.135%0.34833%0.328SS..Hα-helixtrans-61.7-42.7176-52.10000111I2817 H2818 E2819 L2823 Q2824 E2825I2817-T2821 WeakPolarHBondContact O-CB 3.5Å; I2817-T2821 PolarHBondContact O-N 3.08Å; I2817-T2821 PolarHBondContact O-OG1 3.06Å; I2817-T2821 VanDerWaalsContact O-OG1 3.1Å; H2818-T2821 PolarHBondContact O-N 3.34Å; E2819-T2821 VanDerWaalsContact C-N 3.32Å; E2819-T2821 PolarHBondContact O-N 3.27Å; T2821-L2823 PolarHBondContact O-N 3.18Å; T2821-Q2824 PolarHBondContact O-N 2.87Å; T2821-E2825 HydrophobicContact CG2-CG 4.45Å; T2821-E2825 WeakPolarHBondContact O-CB 3.44Å; T2821-E2825 WeakPolarHBondContact O-CG 3.46Å; T2821-E2825 PolarHBondContact O-N 3.18Å
2822F94Very high92Very high8.66667 Ų8.6666764 Ų644%0.03833%0.33CS..Hα-helixtrans-60.5-44.6176.6-180-89.9000112.7W2775 V2776 W2779 M2810 H2818 E2819 A2820 E2825 N2826 L2830 F2863W2775-F2822 HydrophobicContact CB-CD1 4.23Å; W2775-F2822 HydrophobicContact CB-CD2 4.42Å; W2775-F2822 HydrophobicContact CB-CE1 4.38Å; W2775-F2822 HydrophobicContact CB-CG 4.27Å; W2775-F2822 HydrophobicContact CE3-CB 4.31Å; W2775-F2822 AromaticContact CE3-CD1 3.67Å; W2775-F2822 HydrophobicContact CE3-CD1 3.67Å; W2775-F2822 HydrophobicContact CE3-CE1 4.32Å; W2775-F2822 HydrophobicContact CE3-CG 4.22Å; W2775-F2822 HydrophobicContact CZ3-CD1 4.43Å; V2776-F2822 HydrophobicContact CB-CE2 4.36Å; V2776-F2822 HydrophobicContact CG2-CD2 3.57Å; V2776-F2822 VanDerWaalsContact CG2-CD2 3.49Å; V2776-F2822 HydrophobicContact CG2-CE2 3.81Å; W2779-F2822 AromaticContact CD1-CE1 3.7Å; W2779-F2822 AromaticContact CD1-CZ 3.38Å; W2779-F2822 HydrophobicContact CG-CZ 4.1Å; W2779-F2822 AromaticContact NE1-CE1 3.83Å; W2779-F2822 AromaticContact NE1-CZ 3.96Å; M2810-F2822 HydrophobicContact CE-CD1 3.82Å; M2810-F2822 HydrophobicContact CE-CE1 3.72Å; M2810-F2822 HydrophobicContact SD-CE1 4.28Å; H2818-F2822 PolarHBondContact O-N 2.98Å; H2818-F2822 VanDerWaalsContact O-N 3.12Å; E2819-F2822 WeakPolarHBondContact O-CB 3.33Å; E2819-F2822 PolarHBondContact O-N 3.23Å; A2820-F2822 VanDerWaalsContact C-N 3.34Å; A2820-F2822 PolarHBondContact O-N 3.03Å; F2822-E2825 PolarHBondContact O-N 3.17Å; F2822-N2826 HydrophobicContact CE1-CB 4.45Å; F2822-N2826 HydrophobicContact CE2-CB 4.45Å; F2822-N2826 HydrophobicContact CZ-CB 4.34Å; F2822-N2826 WeakPolarHBondContact O-CB 3.35Å; F2822-N2826 PolarHBondContact O-N 3.06Å; F2822-N2826 PolarHBondContact O-ND2 3.03Å; F2822-N2826 VanDerWaalsContact O-ND2 3.11Å; F2822-L2830 HydrophobicContact CE1-CD1 3.9Å; F2822-L2830 HydrophobicContact CZ-CD1 4.13Å; F2822-F2863 HydrophobicContact CE2-CD1 4.18Å; F2822-F2863 AromaticContact CE2-CE1 3.54Å; F2822-F2863 HydrophobicContact CE2-CE1 3.54Å; F2822-F2863 VanDerWaalsContact CE2-CE1 3.47Å; F2822-F2863 AromaticContact CE2-CZ 3.83Å; F2822-F2863 HydrophobicContact CE2-CZ 3.83Å; F2822-F2863 AromaticContact CZ-CE1 3.81Å; F2822-F2863 HydrophobicContact CZ-CE1 3.88Å; F2822-F2863 HydrophobicContact CZ-CE2 4.39Å; F2822-F2863 AromaticContact CZ-CZ 3.64Å; F2822-F2863 HydrophobicContact CZ-CZ 3.64Å
2823L92.7Very high92.6Very high40 Ų4056.7 Ų56.721%0.20930%0.302CS..Hα-helixtrans-63.3-42176.5-90.7169.2000111.9W2775 M2810 H2814 E2819 A2820 T2821 E2825 G2827W2775-L2823 HydrophobicContact CH2-CD1 4.33Å; W2775-L2823 HydrophobicContact CZ3-CD1 3.96Å; W2775-L2823 HydrophobicContact CZ3-CD2 3.98Å; W2775-L2823 HydrophobicContact CZ3-CG 3.95Å; M2810-L2823 HydrophobicContact CB-CD2 4.13Å; M2810-L2823 HydrophobicContact CE-CD1 4.44Å; M2810-L2823 HydrophobicContact CE-CD2 3.47Å; M2810-L2823 HydrophobicContact CE-CG 3.65Å; M2810-L2823 HydrophobicContact CG-CD2 4.07Å; M2810-L2823 HydrophobicContact SD-CD2 3.75Å; H2814-L2823 HydrophobicContact CB-CD1 4.08Å; E2819-L2823 PolarHBondContact O-N 3Å; A2820-L2823 PolarHBondContact O-N 3.06Å; T2821-L2823 PolarHBondContact O-N 3.18Å; L2823-E2825 VanDerWaalsContact C-N 3.34Å; L2823-E2825 PolarHBondContact O-N 3.07Å; L2823-G2827 VanDerWaalsContact O-CA 3.25Å; L2823-G2827 WeakPolarHBondContact O-CA 3.41Å; L2823-G2827 PolarHBondContact O-N 3.06Å
2824Q93.3Very high92.9Very high166.333 Ų166.33357.3 Ų57.378%0.77730%0.296SS*.Hα-helixtrans-63.5-39.2177.6-173.9179.42.800112.3A2820 T2821A2820-Q2824 WeakPolarHBondContact O-CB 3.34Å; A2820-Q2824 PolarHBondContact O-N 2.85Å; T2821-Q2824 PolarHBondContact O-N 2.87Å
2825E93.1Very high93.1Very high102 Ų10256.8 Ų56.848%0.47730%0.296SS..Hα-helixtrans-78.8-33.7-179.4-75.3-177.1-177.200114T2821 F2822 L2823 R2862 Q2866T2821-E2825 HydrophobicContact CG2-CG 4.45Å; T2821-E2825 WeakPolarHBondContact O-CB 3.44Å; T2821-E2825 WeakPolarHBondContact O-CG 3.46Å; T2821-E2825 PolarHBondContact O-N 3.18Å; F2822-E2825 PolarHBondContact O-N 3.17Å; L2823-E2825 VanDerWaalsContact C-N 3.34Å; L2823-E2825 PolarHBondContact O-N 3.07Å; E2825-R2862 PolarHBondContact O-NH1 3.35Å; E2825-Q2866 PolarHBondContact OE2-NE2 3.35Å; E2825-Q2866 VanDerWaalsContact OE2-NE2 3.12Å
2826N93.8Very high93.3Very high0.666667 Ų0.66666752 Ų520%0.00427%0.274CS..Hα-helixtrans-134.5-7.8-164-50.1-76.8000115F2822 N2828 D2829 L2830 L2859 R2862 F2863F2822-N2826 HydrophobicContact CE1-CB 4.45Å; F2822-N2826 HydrophobicContact CE2-CB 4.45Å; F2822-N2826 HydrophobicContact CZ-CB 4.34Å; F2822-N2826 WeakPolarHBondContact O-CB 3.35Å; F2822-N2826 PolarHBondContact O-N 3.06Å; F2822-N2826 PolarHBondContact O-ND2 3.03Å; F2822-N2826 VanDerWaalsContact O-ND2 3.11Å; N2826-N2828 PolarHBondContact O-N 3.16Å; N2826-D2829 PolarHBondContact O-N 3.42Å; N2826-L2830 HydrophobicContact CB-CD1 4.47Å; N2826-L2830 WeakPolarHBondContact O-CB 3.46Å; N2826-L2830 WeakPolarHBondContact O-CG 3.35Å; N2826-L2830 PolarHBondContact O-N 3.19Å; N2826-L2830 VanDerWaalsContact O-N 3.13Å; N2826-L2859 HydrophobicContact CB-CD2 4.23Å; N2826-R2862 VanDerWaalsContact OD1-CD 3.22Å; N2826-R2862 WeakPolarHBondContact OD1-CD 3.39Å; N2826-R2862 PolarHBondContact OD1-NH1 2.98Å; N2826-F2863 HydrophobicContact CB-CE1 4.05Å; N2826-F2863 HydrophobicContact CB-CZ 4.08Å
2827G91.8Very high93.2Very high12 Ų1251.8 Ų51.812%0.12427%0.273CS..Hα-helixtrans-62.8-39-174.300000113.6L2823 L2830 A2831L2823-G2827 VanDerWaalsContact O-CA 3.25Å; L2823-G2827 WeakPolarHBondContact O-CA 3.41Å; L2823-G2827 PolarHBondContact O-N 3.06Å; G2827-L2830 PolarHBondContact O-N 2.95Å; G2827-A2831 WeakPolarHBondContact O-CB 3.33Å; G2827-A2831 PolarHBondContact O-N 3.23Å
2828N92.7Very high93.2Very high135 Ų13549.5 Ų49.572%0.72226%0.26SS*.Hα-helixtrans-65.5-49.6178.9-66.6-19.5000111.8N2826 L2830 A2831 E2832N2826-N2828 PolarHBondContact O-N 3.16Å; N2828-L2830 VanDerWaalsContact C-N 3.28Å; N2828-L2830 PolarHBondContact O-N 2.86Å; N2828-A2831 PolarHBondContact O-N 3.31Å; N2828-A2831 VanDerWaalsContact O-N 3.11Å; N2828-E2832 PolarHBondContact O-N 3.1Å
2829D94.1Very high93.1Very high57 Ų5753 Ų5331%0.30527%0.272SS..Hα-helixtrans-58.3-39.6178.1-60.2-2.2000111.5N2826 S2833 L2859 R2862N2826-D2829 PolarHBondContact O-N 3.42Å; D2829-S2833 WeakPolarHBondContact O-CB 3.25Å; D2829-S2833 PolarHBondContact O-N 3.41Å; D2829-S2833 VanDerWaalsContact O-N 3.11Å; D2829-S2833 PolarHBondContact O-OG 2.97Å; D2829-L2859 HydrophobicContact CB-CD1 3.87Å; D2829-L2859 HydrophobicContact CB-CD2 3.77Å; D2829-L2859 HydrophobicContact CB-CG 4.07Å; D2829-R2862 IonicContact OD2-CZ 3.11Å; D2829-R2862 IonicContact OD2-NH1 2.99Å; D2829-R2862 PolarHBondContact OD2-NH1 2.89Å; D2829-R2862 IonicContact OD2-NH2 3.39Å; D2829-R2862 PolarHBondContact OD2-NH2 3.03Å
2830L94.3Very high93.1Very high2 Ų253.4 Ų53.41%0.0127%0.273CS..Hα-helixtrans-68-42.6175.3-76168.6000111.9W2779 H2807 M2810 F2822 N2826 G2827 N2828 S2833 R2834 Y2856 L2859 F2863W2779-L2830 HydrophobicContact CD2-CD1 4.31Å; W2779-L2830 HydrophobicContact CD2-CD2 3.96Å; W2779-L2830 HydrophobicContact CE3-CD2 3.79Å; W2779-L2830 HydrophobicContact CH2-CD2 3.79Å; W2779-L2830 HydrophobicContact CZ2-CD1 4.03Å; W2779-L2830 HydrophobicContact CZ2-CD2 3.93Å; W2779-L2830 HydrophobicContact CZ2-CG 4.45Å; W2779-L2830 HydrophobicContact CZ3-CD2 3.71Å; H2807-L2830 PolarHBondContact CE1-O 3.24Å; H2807-L2830 VanDerWaalsContact CE1-O 3.32Å; M2810-L2830 HydrophobicContact CE-CB 3.66Å; M2810-L2830 HydrophobicContact CE-CD1 4.15Å; M2810-L2830 HydrophobicContact CE-CG 4.38Å; M2810-L2830 HydrophobicContact SD-CB 4.44Å; M2810-L2830 HydrophobicContact SD-CD1 3.59Å; M2810-L2830 VanDerWaalsContact SD-CD1 3.59Å; F2822-L2830 HydrophobicContact CE1-CD1 3.9Å; F2822-L2830 HydrophobicContact CZ-CD1 4.13Å; N2826-L2830 HydrophobicContact CB-CD1 4.47Å; N2826-L2830 WeakPolarHBondContact O-CB 3.46Å; N2826-L2830 WeakPolarHBondContact O-CG 3.35Å; N2826-L2830 PolarHBondContact O-N 3.19Å; N2826-L2830 VanDerWaalsContact O-N 3.13Å; G2827-L2830 PolarHBondContact O-N 2.95Å; N2828-L2830 VanDerWaalsContact C-N 3.28Å; N2828-L2830 PolarHBondContact O-N 2.86Å; L2830-S2833 PolarHBondContact O-N 3.16Å; L2830-R2834 WeakPolarHBondContact O-CB 3.34Å; L2830-R2834 PolarHBondContact O-N 3.26Å; L2830-Y2856 HydrophobicContact CD2-CD1 4.47Å; L2830-Y2856 HydrophobicContact CD2-CE1 4.34Å; L2830-L2859 HydrophobicContact CD2-CD1 3.63Å; L2830-L2859 HydrophobicContact CG-CD1 3.8Å; L2830-F2863 HydrophobicContact CD1-CZ 4.37Å
2831A93Very high92.9Very high46.6667 Ų46.666755 Ų5539%0.38628%0.276SS..Hα-helixtrans-65.8-40.1177.700000112.3G2827 N2828 R2834 L2835G2827-A2831 WeakPolarHBondContact O-CB 3.33Å; G2827-A2831 PolarHBondContact O-N 3.23Å; N2828-A2831 PolarHBondContact O-N 3.31Å; N2828-A2831 VanDerWaalsContact O-N 3.11Å; A2831-R2834 WeakPolarHBondContact O-CB 3.41Å; A2831-R2834 PolarHBondContact O-N 3.12Å; A2831-L2835 WeakPolarHBondContact O-CG 3.34Å; A2831-L2835 PolarHBondContact O-N 3Å
2832E93.9Very high92.7Very high124.667 Ų124.66758.7 Ų58.758%0.58329%0.293SS*.Hα-helixtrans-64.5-43.7174.1-174.2174.6-168.100111.4N2828 R2834 L2835 C2836 K2851N2828-E2832 PolarHBondContact O-N 3.1Å; E2832-R2834 VanDerWaalsContact C-N 3.28Å; E2832-R2834 PolarHBondContact O-N 3.15Å; E2832-L2835 PolarHBondContact O-N 3.36Å; E2832-C2836 PolarHBondContact O-N 2.9Å; E2832-C2836 VanDerWaalsContact O-N 3.1Å; E2832-C2836 PolarHBondContact O-SG 3.09Å; E2832-C2836 VanDerWaalsContact O-SG 3.34Å; E2832-K2851 IonicContact OE1-NZ 3.48Å; E2832-K2851 PolarHBondContact OE1-NZ 3.47Å
2833S94.5Very high92.6Very high4.66667 Ų4.6666761.6 Ų61.63%0.03331%0.312CS..Hα-helixtrans-60.9-38.3175.6-55.80000111.6D2829 L2830 C2836 C2837 A2852 Y2856D2829-S2833 WeakPolarHBondContact O-CB 3.25Å; D2829-S2833 PolarHBondContact O-N 3.41Å; D2829-S2833 VanDerWaalsContact O-N 3.11Å; D2829-S2833 PolarHBondContact O-OG 2.97Å; L2830-S2833 PolarHBondContact O-N 3.16Å; S2833-C2836 PolarHBondContact O-N 3.04Å; S2833-C2837 PolarHBondContact O-N 3.31Å; S2833-C2837 VanDerWaalsContact O-N 3.15Å; S2833-C2837 PolarHBondContact O-SG 3.28Å; S2833-C2837 VanDerWaalsContact O-SG 3.34Å; S2833-A2852 WeakPolarHBondContact O-CB 3.3Å; S2833-Y2856 VanDerWaalsContact CB-CE1 3.45Å
2834R93Very high92.4Very high44.3333 Ų44.333365 Ų6517%0.16733%0.327CS..Hα-helixtrans-64.8-47.1173.9-177-175.9170.6162-1.6112.6D2811 L2830 A2831 E2832 C2836 C2837 E2838D2811-R2834 IonicContact OD1-CZ 3.77Å; D2811-R2834 IonicContact OD1-NH1 3.22Å; D2811-R2834 PolarHBondContact OD1-NH1 3.4Å; D2811-R2834 IonicContact OD2-CZ 3.56Å; D2811-R2834 IonicContact OD2-NH1 3.28Å; D2811-R2834 PolarHBondContact OD2-NH1 3.23Å; D2811-R2834 IonicContact OD2-NH2 3.35Å; D2811-R2834 PolarHBondContact OD2-NH2 3.17Å; L2830-R2834 WeakPolarHBondContact O-CB 3.34Å; L2830-R2834 PolarHBondContact O-N 3.26Å; A2831-R2834 WeakPolarHBondContact O-CB 3.41Å; A2831-R2834 PolarHBondContact O-N 3.12Å; E2832-R2834 VanDerWaalsContact C-N 3.28Å; E2832-R2834 PolarHBondContact O-N 3.15Å; R2834-C2836 PolarHBondContact O-N 3.14Å; R2834-C2837 CarbonylContact O-C 3.51Å; R2834-C2837 WeakPolarHBondContact O-CA 3.32Å; R2834-C2837 VanDerWaalsContact O-CB 3.28Å; R2834-C2837 WeakPolarHBondContact O-CB 3.28Å; R2834-C2837 PolarHBondContact O-N 3.15Å; R2834-E2838 HydrophobicContact CG-CG 4.37Å; R2834-E2838 IonicContact CZ-OE1 3.46Å; R2834-E2838 VanDerWaalsContact CZ-OE1 3.27Å; R2834-E2838 IonicContact NE-OE1 3.73Å; R2834-E2838 PolarHBondContact NE-OE1 3.12Å; R2834-E2838 IonicContact NE-OE2 3.85Å; R2834-E2838 IonicContact NH2-OE1 3.28Å; R2834-E2838 PolarHBondContact NH2-OE1 3Å; R2834-E2838 PolarHBondContact O-N 3.11Å
2835L93.4Very high92.2Very high96.3333 Ų96.333360.3 Ų60.350%0.50431%0.309SS..Hα-helixtrans-60.1-34178.5-73.6168.8000111.7A2831 E2832 E2838 R2839A2831-L2835 WeakPolarHBondContact O-CG 3.34Å; A2831-L2835 PolarHBondContact O-N 3Å; E2832-L2835 PolarHBondContact O-N 3.36Å; L2835-E2838 PolarHBondContact O-N 3.32Å; L2835-R2839 VanDerWaalsContact O-CB 3.29Å; L2835-R2839 WeakPolarHBondContact O-CB 3.32Å; L2835-R2839 WeakPolarHBondContact O-CG 3.33Å; L2835-R2839 PolarHBondContact O-N 2.98Å
2836C92.6Very high92Very high9.66667 Ų9.6666764.8 Ų64.87%0.06532%0.322CS..Hα-helixtrans-68.4-37.1171.9-68.90000112.5E2832 S2833 R2834 R2839 Y2840 D2848 A2852E2832-C2836 PolarHBondContact O-N 2.9Å; E2832-C2836 VanDerWaalsContact O-N 3.1Å; E2832-C2836 PolarHBondContact O-SG 3.09Å; E2832-C2836 VanDerWaalsContact O-SG 3.34Å; S2833-C2836 PolarHBondContact O-N 3.04Å; R2834-C2836 PolarHBondContact O-N 3.14Å; C2836-R2839 PolarHBondContact O-N 2.89Å; C2836-Y2840 PolarHBondContact O-N 3.14Å; C2836-D2848 WeakPolarHBondContact CB-O 3.36Å; C2836-A2852 HydrophobicContact CB-CB 3.73Å
2837C92.1Very high91.8Very high3.66667 Ų3.6666770.1 Ų70.13%0.02535%0.349CS..Hα-helixtrans-64-47.9170.7-66.10000112.7F2800 S2833 R2834 R2839 Y2840 E2841 Y2856F2800-C2837 HydrophobicContact CD1-CB 4.47Å; F2800-C2837 HydrophobicContact CE1-CB 3.68Å; F2800-C2837 HydrophobicContact CZ-CB 4.33Å; S2833-C2837 PolarHBondContact O-N 3.31Å; S2833-C2837 VanDerWaalsContact O-N 3.15Å; S2833-C2837 PolarHBondContact O-SG 3.28Å; S2833-C2837 VanDerWaalsContact O-SG 3.34Å; R2834-C2837 CarbonylContact O-C 3.51Å; R2834-C2837 WeakPolarHBondContact O-CA 3.32Å; R2834-C2837 VanDerWaalsContact O-CB 3.28Å; R2834-C2837 WeakPolarHBondContact O-CB 3.28Å; R2834-C2837 PolarHBondContact O-N 3.15Å; C2837-R2839 VanDerWaalsContact C-N 3.3Å; C2837-R2839 PolarHBondContact O-N 3.25Å; C2837-Y2840 CarbonylContact O-C 3.57Å; C2837-Y2840 WeakPolarHBondContact O-CA 3.4Å; C2837-Y2840 WeakPolarHBondContact O-CB 3.4Å; C2837-Y2840 PolarHBondContact O-N 3.07Å; C2837-E2841 PolarHBondContact O-N 3.14Å; C2837-Y2856 VanDerWaalsContact SG-CE2 3.58Å; C2837-Y2856 PolarHBondContact SG-OH 2.87Å; C2837-Y2856 VanDerWaalsContact SG-OH 3.32Å
2838E91.2Very high91.7Very high51.3333 Ų51.333370.7 Ų70.724%0.2435%0.349CS..Hα-helixtrans-63.1-39.5180-71.7172.8171.600111.2R2834 L2835 E2841 L2842R2834-E2838 HydrophobicContact CG-CG 4.37Å; R2834-E2838 IonicContact CZ-OE1 3.46Å; R2834-E2838 VanDerWaalsContact CZ-OE1 3.27Å; R2834-E2838 IonicContact NE-OE1 3.73Å; R2834-E2838 PolarHBondContact NE-OE1 3.12Å; R2834-E2838 IonicContact NE-OE2 3.85Å; R2834-E2838 IonicContact NH2-OE1 3.28Å; R2834-E2838 PolarHBondContact NH2-OE1 3Å; R2834-E2838 PolarHBondContact O-N 3.11Å; L2835-E2838 PolarHBondContact O-N 3.32Å; E2838-E2841 PolarHBondContact O-N 2.88Å; E2838-L2842 WeakPolarHBondContact O-CG 3.31Å; E2838-L2842 PolarHBondContact O-N 3.23Å; E2838-L2842 VanDerWaalsContact O-N 3.13Å
2839R91.2Very high91.7Very high118 Ų11864.3 Ų64.345%0.44532%0.315SS..Hα-helixtrans-64.3-39.5171.8-140.7176.7-86.3-172.11.5112L2835 C2836 C2837 E2841 L2842 T2843 D2848L2835-R2839 VanDerWaalsContact O-CB 3.29Å; L2835-R2839 WeakPolarHBondContact O-CB 3.32Å; L2835-R2839 WeakPolarHBondContact O-CG 3.33Å; L2835-R2839 PolarHBondContact O-N 2.98Å; C2836-R2839 PolarHBondContact O-N 2.89Å; C2837-R2839 VanDerWaalsContact C-N 3.3Å; C2837-R2839 PolarHBondContact O-N 3.25Å; R2839-E2841 VanDerWaalsContact C-N 3.3Å; R2839-E2841 PolarHBondContact O-N 3.33Å; R2839-L2842 WeakPolarHBondContact O-CB 3.35Å; R2839-L2842 PolarHBondContact O-N 2.94Å; R2839-T2843 HydrophobicContact CG-CG2 4.11Å; R2839-T2843 WeakPolarHBondContact O-CB 3.45Å; R2839-T2843 VanDerWaalsContact O-CG2 3.31Å; R2839-T2843 WeakPolarHBondContact O-CG2 3.44Å; R2839-T2843 PolarHBondContact O-N 3.26Å; R2839-T2843 PolarHBondContact O-OG1 3.07Å; R2839-D2848 HydrophobicContact CB-CB 4.42Å; R2839-D2848 WeakPolarHBondContact CD-OD1 3.49Å; R2839-D2848 VanDerWaalsContact CD-OD2 3.32Å; R2839-D2848 WeakPolarHBondContact CD-OD2 3.35Å; R2839-D2848 WeakPolarHBondContact CG-OD2 3.25Å; R2839-D2848 IonicContact CZ-OD1 3.28Å; R2839-D2848 IonicContact CZ-OD2 3.99Å; R2839-D2848 IonicContact NE-OD1 3.64Å; R2839-D2848 PolarHBondContact NE-OD1 3.24Å; R2839-D2848 VanDerWaalsContact NE-OD1 3.14Å; R2839-D2848 IonicContact NE-OD2 3.96Å; R2839-D2848 PolarHBondContact NE-OD2 3.39Å; R2839-D2848 IonicContact NH1-OD1 3.59Å; R2839-D2848 PolarHBondContact NH1-OD1 3.34Å; R2839-D2848 VanDerWaalsContact NH2-CG 3.33Å; R2839-D2848 IonicContact NH2-OD1 3.58Å; R2839-D2848 PolarHBondContact NH2-OD1 3.46Å; R2839-D2848 IonicContact NH2-OD2 2.78Å
2840Y92.4Very high91.5Very high16.6667 Ų16.666767.1 Ų67.17%0.06533%0.326CS..Hα-helixtrans-61.4-43.4172.3174-87.9000111.8I2796 F2800 C2836 C2837 L2842 T2843 Q2844 V2845 R2846 L2849I2796-Y2840 HydrophobicContact CD1-CE1 4.46Å; I2796-Y2840 WeakPolarHBondContact CD1-OH 3.21Å; I2796-Y2840 HydrophobicContact CG2-CE1 3.97Å; F2800-Y2840 AromaticContact CE2-CD1 3.93Å; F2800-Y2840 HydrophobicContact CE2-CD1 3.95Å; F2800-Y2840 HydrophobicContact CE2-CE1 4.21Å; F2800-Y2840 AromaticContact CZ-CD1 3.76Å; F2800-Y2840 HydrophobicContact CZ-CD1 3.76Å; F2800-Y2840 HydrophobicContact CZ-CE1 4.37Å; C2836-Y2840 PolarHBondContact O-N 3.14Å; C2837-Y2840 CarbonylContact O-C 3.57Å; C2837-Y2840 WeakPolarHBondContact O-CA 3.4Å; C2837-Y2840 WeakPolarHBondContact O-CB 3.4Å; C2837-Y2840 PolarHBondContact O-N 3.07Å; Y2840-L2842 VanDerWaalsContact C-N 3.29Å; Y2840-L2842 PolarHBondContact O-N 2.97Å; Y2840-T2843 PolarHBondContact O-N 3.13Å; Y2840-Q2844 VanDerWaalsContact CE1-OE1 3.27Å; Y2840-Q2844 WeakPolarHBondContact CE2-O 3.47Å; Y2840-Q2844 VanDerWaalsContact CZ-OE1 3.29Å; Y2840-Q2844 VanDerWaalsContact O-CA 3.25Å; Y2840-Q2844 WeakPolarHBondContact O-CA 3.37Å; Y2840-Q2844 PolarHBondContact O-N 3.03Å; Y2840-Q2844 PolarHBondContact O-NE2 3.42Å; Y2840-Q2844 PolarHBondContact OH-OE1 2.95Å; Y2840-V2845 WeakPolarHBondContact CD2-O 3.38Å; Y2840-R2846 HydrophobicContact CE2-CG 4.44Å; Y2840-L2849 HydrophobicContact CD1-CD2 4.37Å; Y2840-L2849 HydrophobicContact CD2-CB 3.54Å; Y2840-L2849 VanDerWaalsContact CD2-CB 3.49Å; Y2840-L2849 HydrophobicContact CD2-CD2 4.22Å; Y2840-L2849 HydrophobicContact CD2-CG 4.46Å; Y2840-L2849 HydrophobicContact CE1-CD2 4.26Å; Y2840-L2849 HydrophobicContact CE2-CB 4.1Å; Y2840-L2849 HydrophobicContact CE2-CD2 4.07Å; Y2840-L2849 HydrophobicContact CG-CB 3.81Å; Y2840-L2849 HydrophobicContact CG-CD2 4.29Å; Y2840-L2849 HydrophobicContact CG-CG 4.46Å
2841E89.7Confident91.5Very high59 Ų5971.9 Ų71.928%0.27635%0.347SS..Hα-helixtrans-61.3-36.1178.9-72.2-172.2119.500112.2F2800 H2804 C2837 E2838 R2839 Q2844F2800-E2841 HydrophobicContact CD2-CG 4.12Å; F2800-E2841 WeakPolarHBondContact CD2-OE1 3.48Å; F2800-E2841 HydrophobicContact CE2-CG 3.56Å; F2800-E2841 VanDerWaalsContact CE2-CG 3.44Å; F2800-E2841 HydrophobicContact CZ-CG 3.92Å; H2804-E2841 IonicContact CE1-OE1 3.34Å; H2804-E2841 IonicContact CE1-OE2 3.18Å; H2804-E2841 PolarHBondContact CE1-OE2 2.74Å; C2837-E2841 PolarHBondContact O-N 3.14Å; E2838-E2841 PolarHBondContact O-N 2.88Å; R2839-E2841 VanDerWaalsContact C-N 3.3Å; R2839-E2841 PolarHBondContact O-N 3.33Å; E2841-Q2844 PolarHBondContact O-NE2 3.4Å; E2841-Q2844 VanDerWaalsContact O-NE2 3.13Å
2842L89.9Confident91.5Very high134 Ų13469.7 Ų69.770%0.70233%0.329SS*.Hα-helixtrans-75.8-40.1176.4-66.9171.7000114.1E2838 R2839 Y2840E2838-L2842 WeakPolarHBondContact O-CG 3.31Å; E2838-L2842 PolarHBondContact O-N 3.23Å; E2838-L2842 VanDerWaalsContact O-N 3.13Å; R2839-L2842 WeakPolarHBondContact O-CB 3.35Å; R2839-L2842 PolarHBondContact O-N 2.94Å; Y2840-L2842 VanDerWaalsContact C-N 3.29Å; Y2840-L2842 PolarHBondContact O-N 2.97Å
2843T91.3Very high91.5Very high70 Ų7064.7 Ų64.743%0.42930%0.304SS..Hα-helixtrans-103.5-21.8-169.765.60000114.3R2839 Y2840 V2845 D2848R2839-T2843 HydrophobicContact CG-CG2 4.11Å; R2839-T2843 WeakPolarHBondContact O-CB 3.45Å; R2839-T2843 VanDerWaalsContact O-CG2 3.31Å; R2839-T2843 WeakPolarHBondContact O-CG2 3.44Å; R2839-T2843 PolarHBondContact O-N 3.26Å; R2839-T2843 PolarHBondContact O-OG1 3.07Å; Y2840-T2843 PolarHBondContact O-N 3.13Å; T2843-V2845 PolarHBondContact O-N 3.25Å; T2843-V2845 VanDerWaalsContact O-N 3.13Å; T2843-V2845 WeakPolarHBondContact OG1-CB 3.48Å; T2843-V2845 PolarHBondContact OG1-N 3.16Å; T2843-V2845 VanDerWaalsContact OG1-N 3.16Å; T2843-D2848 PolarHBondContact OG1-OD2 3.29Å; T2843-D2848 VanDerWaalsContact OG1-OD2 3.05Å
2844Q89.2Confident91.5Very high111.667 Ų111.66769.7 Ų69.752%0.52233%0.327SS..  trans54.818.9-167.6-57.2-64.5-46.700114.4Y2840 E2841 R2846Y2840-Q2844 VanDerWaalsContact CE1-OE1 3.27Å; Y2840-Q2844 WeakPolarHBondContact CE2-O 3.47Å; Y2840-Q2844 VanDerWaalsContact CZ-OE1 3.29Å; Y2840-Q2844 VanDerWaalsContact O-CA 3.25Å; Y2840-Q2844 WeakPolarHBondContact O-CA 3.37Å; Y2840-Q2844 PolarHBondContact O-N 3.03Å; Y2840-Q2844 PolarHBondContact O-NE2 3.42Å; Y2840-Q2844 PolarHBondContact OH-OE1 2.95Å; E2841-Q2844 PolarHBondContact O-NE2 3.4Å; E2841-Q2844 VanDerWaalsContact O-NE2 3.13Å; Q2844-R2846 PolarHBondContact O-N 2.81Å
2845V89.2Confident91.5Very high68 Ų6868.6 Ų68.641%0.41233%0.331SS..  trans-81.1109-180174.80000110.3Y2840 T2843 I2847 D2848Y2840-V2845 WeakPolarHBondContact CD2-O 3.38Å; T2843-V2845 PolarHBondContact O-N 3.25Å; T2843-V2845 VanDerWaalsContact O-N 3.13Å; T2843-V2845 WeakPolarHBondContact OG1-CB 3.48Å; T2843-V2845 PolarHBondContact OG1-N 3.16Å; T2843-V2845 VanDerWaalsContact OG1-N 3.16Å; V2845-I2847 HydrophobicContact CG1-CB 4.11Å; V2845-I2847 HydrophobicContact CG1-CG1 4.34Å; V2845-I2847 PolarHBondContact O-N 3.34Å; V2845-D2848 PolarHBondContact O-N 3.08Å; V2845-D2848 VanDerWaalsContact O-N 3.07Å
2846R87.9Confident91.6Very high195.667 Ų195.66764.2 Ų64.274%0.73831%0.307SS*.Hα-helixtrans-53.4-26.2-176.2-69.8-172.8176.6-166.3-0.2115.5Y2840 Q2844 D2848 L2849 Q2850Y2840-R2846 HydrophobicContact CE2-CG 4.44Å; Q2844-R2846 PolarHBondContact O-N 2.81Å; R2846-D2848 VanDerWaalsContact C-N 3.32Å; R2846-D2848 PolarHBondContact O-N 3.35Å; R2846-L2849 PolarHBondContact O-N 3.09Å; R2846-Q2850 PolarHBondContact O-N 3.32Å
2847I90.3Very high91.7Very high112.333 Ų112.33369.6 Ų69.658%0.57633%0.327SS*.Hα-helixtrans-62.3-37.2178.5-60.7172.2000111.1V2845 L2849 Q2850 K2851V2845-I2847 HydrophobicContact CG1-CB 4.11Å; V2845-I2847 HydrophobicContact CG1-CG1 4.34Å; V2845-I2847 PolarHBondContact O-N 3.34Å; I2847-L2849 VanDerWaalsContact C-N 3.31Å; I2847-L2849 PolarHBondContact O-N 3.32Å; I2847-Q2850 PolarHBondContact O-N 2.89Å; I2847-K2851 WeakPolarHBondContact O-CG 3.37Å; I2847-K2851 PolarHBondContact O-N 2.88Å
2848D90.6Very high91.8Very high23.6667 Ų23.666773 Ų7313%0.12735%0.347CS..Hα-helixtrans-68.6-38.9178.1-70.2-42.2000111.4C2836 R2839 T2843 V2845 R2846 Q2850 K2851 A2852C2836-D2848 WeakPolarHBondContact CB-O 3.36Å; R2839-D2848 HydrophobicContact CB-CB 4.42Å; R2839-D2848 WeakPolarHBondContact CD-OD1 3.49Å; R2839-D2848 VanDerWaalsContact CD-OD2 3.32Å; R2839-D2848 WeakPolarHBondContact CD-OD2 3.35Å; R2839-D2848 WeakPolarHBondContact CG-OD2 3.25Å; R2839-D2848 IonicContact CZ-OD1 3.28Å; R2839-D2848 IonicContact CZ-OD2 3.99Å; R2839-D2848 IonicContact NE-OD1 3.64Å; R2839-D2848 PolarHBondContact NE-OD1 3.24Å; R2839-D2848 VanDerWaalsContact NE-OD1 3.14Å; R2839-D2848 IonicContact NE-OD2 3.96Å; R2839-D2848 PolarHBondContact NE-OD2 3.39Å; R2839-D2848 IonicContact NH1-OD1 3.59Å; R2839-D2848 PolarHBondContact NH1-OD1 3.34Å; R2839-D2848 VanDerWaalsContact NH2-CG 3.33Å; R2839-D2848 IonicContact NH2-OD1 3.58Å; R2839-D2848 PolarHBondContact NH2-OD1 3.46Å; R2839-D2848 IonicContact NH2-OD2 2.78Å; T2843-D2848 PolarHBondContact OG1-OD2 3.29Å; T2843-D2848 VanDerWaalsContact OG1-OD2 3.05Å; V2845-D2848 PolarHBondContact O-N 3.08Å; V2845-D2848 VanDerWaalsContact O-N 3.07Å; R2846-D2848 VanDerWaalsContact C-N 3.32Å; R2846-D2848 PolarHBondContact O-N 3.35Å; D2848-Q2850 VanDerWaalsContact C-N 3.33Å; D2848-Q2850 PolarHBondContact O-N 2.9Å; D2848-K2851 PolarHBondContact O-N 3.32Å; D2848-A2852 PolarHBondContact O-N 3.04Å
2849L91.4Very high92Very high1.33333 Ų1.3333370.6 Ų70.61%0.00734%0.336CS..Hα-helixtrans-68.5-33.5174.1-175.957.2000112.4Y2790 I2796 M2799 F2800 Y2840 R2846 I2847 A2852 W2853Y2790-L2849 HydrophobicContact CD2-CD2 4.45Å; Y2790-L2849 HydrophobicContact CE2-CD2 3.55Å; Y2790-L2849 HydrophobicContact CE2-CG 4.25Å; I2796-L2849 HydrophobicContact CD1-CD2 4.04Å; I2796-L2849 HydrophobicContact CG1-CD2 4.39Å; I2796-L2849 HydrophobicContact CG2-CD2 4.04Å; M2799-L2849 HydrophobicContact CE-CD1 3.87Å; M2799-L2849 HydrophobicContact SD-CD1 4.27Å; F2800-L2849 HydrophobicContact CE1-CD1 4.34Å; F2800-L2849 HydrophobicContact CZ-CD1 4.4Å; Y2840-L2849 HydrophobicContact CD1-CD2 4.37Å; Y2840-L2849 HydrophobicContact CD2-CB 3.54Å; Y2840-L2849 VanDerWaalsContact CD2-CB 3.49Å; Y2840-L2849 HydrophobicContact CD2-CD2 4.22Å; Y2840-L2849 HydrophobicContact CD2-CG 4.46Å; Y2840-L2849 HydrophobicContact CE1-CD2 4.26Å; Y2840-L2849 HydrophobicContact CE2-CB 4.1Å; Y2840-L2849 HydrophobicContact CE2-CD2 4.07Å; Y2840-L2849 HydrophobicContact CG-CB 3.81Å; Y2840-L2849 HydrophobicContact CG-CD2 4.29Å; Y2840-L2849 HydrophobicContact CG-CG 4.46Å; R2846-L2849 PolarHBondContact O-N 3.09Å; I2847-L2849 VanDerWaalsContact C-N 3.31Å; I2847-L2849 PolarHBondContact O-N 3.32Å; L2849-A2852 WeakPolarHBondContact O-CB 3.45Å; L2849-A2852 PolarHBondContact O-N 3.03Å; L2849-W2853 VanDerWaalsContact O-CD1 3.32Å; L2849-W2853 PolarHBondContact O-N 3.13Å
2850Q91.2Very high92.1Very high115 Ų11568 Ų6854%0.53733%0.327SS..Hα-helixtrans-64.6-44.3172.9-173.9177-24.800111.3R2846 I2847 D2848 A2852 W2853 E2854R2846-Q2850 PolarHBondContact O-N 3.32Å; I2847-Q2850 PolarHBondContact O-N 2.89Å; D2848-Q2850 VanDerWaalsContact C-N 3.33Å; D2848-Q2850 PolarHBondContact O-N 2.9Å; Q2850-A2852 VanDerWaalsContact C-N 3.34Å; Q2850-A2852 PolarHBondContact O-N 2.76Å; Q2850-W2853 CarbonylContact O-C 3.52Å; Q2850-W2853 WeakPolarHBondContact O-CB 3.29Å; Q2850-W2853 PolarHBondContact O-N 2.81Å; Q2850-W2853 VanDerWaalsContact O-N 3.12Å; Q2850-E2854 PolarHBondContact NE2-OE1 3.06Å; Q2850-E2854 VanDerWaalsContact NE2-OE1 3.12Å; Q2850-E2854 WeakPolarHBondContact O-CG 3.41Å; Q2850-E2854 PolarHBondContact O-N 3.12Å
2851K92.7Very high92.2Very high103 Ų10374.1 Ų74.145%0.44835%0.35SS..Hα-helixtrans-60.9-41.9174.3-100.4178.4176.9-171.60112.3E2832 I2847 D2848 W2853 E2854 G2855E2832-K2851 IonicContact OE1-NZ 3.48Å; E2832-K2851 PolarHBondContact OE1-NZ 3.47Å; I2847-K2851 WeakPolarHBondContact O-CG 3.37Å; I2847-K2851 PolarHBondContact O-N 2.88Å; D2848-K2851 PolarHBondContact O-N 3.32Å; K2851-W2853 VanDerWaalsContact C-N 3.27Å; K2851-W2853 PolarHBondContact O-N 3.15Å; K2851-E2854 PolarHBondContact O-N 3.07Å; K2851-E2854 VanDerWaalsContact O-N 3.16Å; K2851-G2855 PolarHBondContact O-N 3.31Å; K2851-G2855 VanDerWaalsContact O-N 3.12Å
2852A94.1Very high92.4Very high0 Ų075.5 Ų75.50%035%0.353CS..Hα-helixtrans-57.1-43.2173.400000111.4S2833 C2836 D2848 L2849 Q2850 G2855 Y2856S2833-A2852 WeakPolarHBondContact O-CB 3.3Å; C2836-A2852 HydrophobicContact CB-CB 3.73Å; D2848-A2852 PolarHBondContact O-N 3.04Å; L2849-A2852 WeakPolarHBondContact O-CB 3.45Å; L2849-A2852 PolarHBondContact O-N 3.03Å; Q2850-A2852 VanDerWaalsContact C-N 3.34Å; Q2850-A2852 PolarHBondContact O-N 2.76Å; A2852-G2855 PolarHBondContact O-N 3.04Å; A2852-Y2856 HydrophobicContact CB-CD2 4.34Å; A2852-Y2856 HydrophobicContact CB-CE2 4.08Å; A2852-Y2856 WeakPolarHBondContact O-CB 3.38Å; A2852-Y2856 WeakPolarHBondContact O-CD2 3.38Å; A2852-Y2856 VanDerWaalsContact O-CG 3.32Å; A2852-Y2856 PolarHBondContact O-N 3.17Å
2853W94Very high92.7Very high19.3333 Ų19.333369.1 Ų69.17%0.07332%0.319CS..Hα-helixtrans-68.8-31.6177.5-88.2114.2000114.4A2786 S2787 Y2790 F2791 M2799 L2849 Q2850 K2851 G2855 Y2856 Y2857A2786-W2853 HydrophobicContact CB-CH2 4Å; A2786-W2853 HydrophobicContact CB-CZ2 4.39Å; S2787-W2853 VanDerWaalsContact CA-CH2 3.49Å; Y2790-W2853 AromaticContact CD1-CD1 3.76Å; Y2790-W2853 HydrophobicContact CD1-CD2 4.41Å; Y2790-W2853 AromaticContact CD1-CE2 3.64Å; Y2790-W2853 HydrophobicContact CD1-CG 4.47Å; Y2790-W2853 AromaticContact CD1-CZ2 3.99Å; Y2790-W2853 HydrophobicContact CD1-CZ2 4.11Å; Y2790-W2853 AromaticContact CD1-NE1 3.16Å; Y2790-W2853 AromaticContact CD2-NE1 3.93Å; Y2790-W2853 AromaticContact CE1-CD1 3.5Å; Y2790-W2853 VanDerWaalsContact CE1-CD1 3.49Å; Y2790-W2853 HydrophobicContact CE1-CG 4.34Å; Y2790-W2853 AromaticContact CE1-NE1 3.38Å; Y2790-W2853 VanDerWaalsContact CE1-NE1 3.35Å; Y2790-W2853 AromaticContact CG-CE2 3.94Å; Y2790-W2853 HydrophobicContact CG-CZ2 4.09Å; Y2790-W2853 AromaticContact CG-NE1 3.45Å; Y2790-W2853 AromaticContact CZ-CD1 3.95Å; Y2790-W2853 AromaticContact CZ-NE1 3.86Å; F2791-W2853 HydrophobicContact CE2-CD2 4.27Å; F2791-W2853 HydrophobicContact CE2-CE3 4.32Å; F2791-W2853 HydrophobicContact CZ-CD2 4.37Å; F2791-W2853 HydrophobicContact CZ-CG 4.42Å; M2799-W2853 HydrophobicContact CG-CZ2 4Å; M2799-W2853 HydrophobicContact SD-CZ2 3.64Å; M2799-W2853 VanDerWaalsContact SD-CZ2 3.52Å; M2799-W2853 PolarHBondContact SD-NE1 3.02Å; M2799-W2853 VanDerWaalsContact SD-NE1 3.45Å; L2849-W2853 VanDerWaalsContact O-CD1 3.32Å; L2849-W2853 PolarHBondContact O-N 3.13Å; Q2850-W2853 CarbonylContact O-C 3.52Å; Q2850-W2853 WeakPolarHBondContact O-CB 3.29Å; Q2850-W2853 PolarHBondContact O-N 2.81Å; Q2850-W2853 VanDerWaalsContact O-N 3.12Å; K2851-W2853 VanDerWaalsContact C-N 3.27Å; K2851-W2853 PolarHBondContact O-N 3.15Å; W2853-G2855 VanDerWaalsContact C-N 3.33Å; W2853-Y2856 HydrophobicContact CD2-CD2 4.49Å; W2853-Y2856 HydrophobicContact CE3-CD2 4.45Å; W2853-Y2856 PolarHBondContact O-N 3.37Å; W2853-Y2857 WeakPolarHBondContact O-CB 3.36Å; W2853-Y2857 PolarHBondContact O-N 2.95Å
2854E93.6Very high92.7Very high109.667 Ų109.66766.9 Ų66.951%0.51231%0.308SS..Hα-helixtrans-63.2-41.8172.8-72.4168.3-169.700111.4Q2850 K2851 T2858Q2850-E2854 PolarHBondContact NE2-OE1 3.06Å; Q2850-E2854 VanDerWaalsContact NE2-OE1 3.12Å; Q2850-E2854 WeakPolarHBondContact O-CG 3.41Å; Q2850-E2854 PolarHBondContact O-N 3.12Å; K2851-E2854 PolarHBondContact O-N 3.07Å; K2851-E2854 VanDerWaalsContact O-N 3.16Å; E2854-T2858 WeakPolarHBondContact O-CB 3.28Å; E2854-T2858 PolarHBondContact O-N 3.09Å; E2854-T2858 VanDerWaalsContact O-N 3.17Å; E2854-T2858 PolarHBondContact O-OG1 3.02Å
2855G93.1Very high92.8Very high23 Ų2368.7 Ų68.724%0.23731%0.314CS..Hα-helixtrans-64.2-55.8171.900000112.4K2851 A2852 W2853 Y2857 T2858 L2859K2851-G2855 PolarHBondContact O-N 3.31Å; K2851-G2855 VanDerWaalsContact O-N 3.12Å; A2852-G2855 PolarHBondContact O-N 3.04Å; W2853-G2855 VanDerWaalsContact C-N 3.33Å; G2855-Y2857 VanDerWaalsContact C-N 3.32Å; G2855-Y2857 PolarHBondContact O-N 2.97Å; G2855-T2858 WeakPolarHBondContact O-CB 3.16Å; G2855-T2858 PolarHBondContact O-N 3.02Å; G2855-T2858 VanDerWaalsContact O-N 3.12Å; G2855-L2859 WeakPolarHBondContact O-CG 3.33Å; G2855-L2859 PolarHBondContact O-N 3.05Å
2856Y95.7Very high92.9Very high2.33333 Ų2.3333368 Ų681%0.00931%0.306CS..Hα-helixtrans-57.7-38.9179.1-73.5-42.8000113.7W2779 L2783 L2803 H2807 L2830 S2833 C2837 A2852 W2853 T2858 L2859 Y2860W2779-Y2856 HydrophobicContact CZ3-CE1 4.42Å; L2783-Y2856 HydrophobicContact CD2-CD1 3.61Å; L2783-Y2856 HydrophobicContact CD2-CE1 4.35Å; L2783-Y2856 HydrophobicContact CD2-CG 3.78Å; L2803-Y2856 HydrophobicContact CD1-CD2 4.4Å; L2803-Y2856 HydrophobicContact CD1-CE2 3.92Å; H2807-Y2856 AromaticContact NE2-CE1 3.92Å; H2807-Y2856 AromaticContact NE2-CZ 3.83Å; H2807-Y2856 PolarHBondContact NE2-OH 2.97Å; L2830-Y2856 HydrophobicContact CD2-CD1 4.47Å; L2830-Y2856 HydrophobicContact CD2-CE1 4.34Å; S2833-Y2856 VanDerWaalsContact CB-CE1 3.45Å; C2837-Y2856 VanDerWaalsContact SG-CE2 3.58Å; C2837-Y2856 PolarHBondContact SG-OH 2.87Å; C2837-Y2856 VanDerWaalsContact SG-OH 3.32Å; A2852-Y2856 HydrophobicContact CB-CD2 4.34Å; A2852-Y2856 HydrophobicContact CB-CE2 4.08Å; A2852-Y2856 WeakPolarHBondContact O-CB 3.38Å; A2852-Y2856 WeakPolarHBondContact O-CD2 3.38Å; A2852-Y2856 VanDerWaalsContact O-CG 3.32Å; A2852-Y2856 PolarHBondContact O-N 3.17Å; W2853-Y2856 HydrophobicContact CD2-CD2 4.49Å; W2853-Y2856 HydrophobicContact CE3-CD2 4.45Å; W2853-Y2856 PolarHBondContact O-N 3.37Å; Y2856-T2858 VanDerWaalsContact C-N 3.32Å; Y2856-T2858 PolarHBondContact O-N 3.43Å; Y2856-L2859 PolarHBondContact O-N 3.12Å; Y2856-Y2860 WeakPolarHBondContact O-CB 3.31Å; Y2856-Y2860 PolarHBondContact O-N 2.94Å
2857Y94.3Very high93Very high123.667 Ų123.66759.4 Ų59.449%0.48528%0.276SS..Hα-helixtrans-70.1-33.8178.5-177-114.4000112.4W2853 G2855 R2861W2853-Y2857 WeakPolarHBondContact O-CB 3.36Å; W2853-Y2857 PolarHBondContact O-N 2.95Å; G2855-Y2857 VanDerWaalsContact C-N 3.32Å; G2855-Y2857 PolarHBondContact O-N 2.97Å; Y2857-R2861 VanDerWaalsContact CE1-CZ 3.48Å; Y2857-R2861 VanDerWaalsContact CE1-NE 3.29Å; Y2857-R2861 HydrophobicContact CE2-CG 4.43Å; Y2857-R2861 WeakPolarHBondContact O-CG 3.43Å; Y2857-R2861 PolarHBondContact O-N 2.99Å; Y2857-R2861 VanDerWaalsContact O-N 3.13Å; Y2857-R2861 PolarHBondContact O-NE 2.78Å; Y2857-R2861 PolarHBondContact OH-NE 3.19Å; Y2857-R2861 PolarHBondContact OH-NH2 2.8Å
2858T94.4Very high92.9Very high74.3333 Ų74.333360.2 Ų60.246%0.45628%0.281SS..Hα-helixtrans-67.7-42.5173.7-59.30000110.9E2854 G2855 Y2856 R2861 R2862E2854-T2858 WeakPolarHBondContact O-CB 3.28Å; E2854-T2858 PolarHBondContact O-N 3.09Å; E2854-T2858 VanDerWaalsContact O-N 3.17Å; E2854-T2858 PolarHBondContact O-OG1 3.02Å; G2855-T2858 WeakPolarHBondContact O-CB 3.16Å; G2855-T2858 PolarHBondContact O-N 3.02Å; G2855-T2858 VanDerWaalsContact O-N 3.12Å; Y2856-T2858 VanDerWaalsContact C-N 3.32Å; Y2856-T2858 PolarHBondContact O-N 3.43Å; T2858-R2861 PolarHBondContact O-N 2.79Å; T2858-R2861 PolarHBondContact OG1-NH2 3.32Å; T2858-R2862 PolarHBondContact O-N 3.07Å
2859L94.8Very high92.9Very high1 Ų164.5 Ų64.51%0.00530%0.304CS..Hα-helixtrans-64.3-46.9173.8-74.4169.9000112.6L2783 N2826 D2829 L2830 G2855 Y2856 R2861 R2862 F2863L2783-L2859 HydrophobicContact CD1-CB 4.48Å; N2826-L2859 HydrophobicContact CB-CD2 4.23Å; D2829-L2859 HydrophobicContact CB-CD1 3.87Å; D2829-L2859 HydrophobicContact CB-CD2 3.77Å; D2829-L2859 HydrophobicContact CB-CG 4.07Å; L2830-L2859 HydrophobicContact CD2-CD1 3.63Å; L2830-L2859 HydrophobicContact CG-CD1 3.8Å; G2855-L2859 WeakPolarHBondContact O-CG 3.33Å; G2855-L2859 PolarHBondContact O-N 3.05Å; Y2856-L2859 PolarHBondContact O-N 3.12Å; L2859-R2861 VanDerWaalsContact C-N 3.3Å; L2859-R2861 PolarHBondContact O-N 3.23Å; L2859-R2862 CarbonylContact O-C 3.06Å; L2859-R2862 WeakPolarHBondContact O-CA 3.31Å; L2859-R2862 VanDerWaalsContact O-CB 3.32Å; L2859-R2862 WeakPolarHBondContact O-CB 3.3Å; L2859-R2862 PolarHBondContact O-N 2.96Å; L2859-F2863 HydrophobicContact CB-CD2 4.34Å; L2859-F2863 HydrophobicContact CB-CE2 3.8Å; L2859-F2863 HydrophobicContact CB-CZ 4.07Å; L2859-F2863 HydrophobicContact CD2-CE1 4.27Å; L2859-F2863 HydrophobicContact CD2-CE2 4.39Å; L2859-F2863 HydrophobicContact CD2-CZ 3.8Å; L2859-F2863 HydrophobicContact CG-CZ 4.43Å; L2859-F2863 WeakPolarHBondContact O-CD2 3.43Å; L2859-F2863 VanDerWaalsContact O-CG 3.28Å; L2859-F2863 WeakPolarHBondContact O-CG 3.38Å; L2859-F2863 PolarHBondContact O-N 3.02Å
2860Y95.1Very high92.7Very high63.3333 Ų63.333366.5 Ų66.525%0.24831%0.314CS..Hα-helixtrans-55-44.1176.3173.2-101.9000112S2780 L2783 E2784 Y2856 R2862 F2863 A2864S2780-Y2860 WeakPolarHBondContact O-CD2 3.32Å; S2780-Y2860 WeakPolarHBondContact O-CE2 3.36Å; L2783-Y2860 HydrophobicContact CB-CD2 4.04Å; E2784-Y2860 HydrophobicContact CB-CE2 3.93Å; E2784-Y2860 HydrophobicContact CG-CE2 4.42Å; E2784-Y2860 PolarHBondContact OE2-OH 3.43Å; Y2856-Y2860 WeakPolarHBondContact O-CB 3.31Å; Y2856-Y2860 PolarHBondContact O-N 2.94Å; Y2860-R2862 VanDerWaalsContact C-N 3.32Å; Y2860-R2862 PolarHBondContact O-N 3.03Å; Y2860-F2863 PolarHBondContact O-N 3.01Å; Y2860-A2864 VanDerWaalsContact O-CB 3.27Å; Y2860-A2864 WeakPolarHBondContact O-CB 3.32Å; Y2860-A2864 PolarHBondContact O-N 3.3Å
2861R93.9Very high92.7Very high145.333 Ų145.33365.7 Ų65.755%0.54832%0.317SS..Hα-helixtrans-63.4-35176-74.3-173.9-115.2-176.22113Y2857 T2858 L2859 K2865Y2857-R2861 VanDerWaalsContact CE1-CZ 3.48Å; Y2857-R2861 VanDerWaalsContact CE1-NE 3.29Å; Y2857-R2861 HydrophobicContact CE2-CG 4.43Å; Y2857-R2861 WeakPolarHBondContact O-CG 3.43Å; Y2857-R2861 PolarHBondContact O-N 2.99Å; Y2857-R2861 VanDerWaalsContact O-N 3.13Å; Y2857-R2861 PolarHBondContact O-NE 2.78Å; Y2857-R2861 PolarHBondContact OH-NE 3.19Å; Y2857-R2861 PolarHBondContact OH-NH2 2.8Å; T2858-R2861 PolarHBondContact O-N 2.79Å; T2858-R2861 PolarHBondContact OG1-NH2 3.32Å; L2859-R2861 VanDerWaalsContact C-N 3.3Å; L2859-R2861 PolarHBondContact O-N 3.23Å; R2861-K2865 PolarHBondContact O-N 3.05Å
2862R94.6Very high92.8Very high88.6667 Ų88.666763.9 Ų63.934%0.33532%0.315SS..Hα-helixtrans-67.8-50.6174.4-168.7-172.4-64.6161.44110.4E2825 N2826 D2829 T2858 L2859 Y2860 K2865 Q2866E2825-R2862 PolarHBondContact O-NH1 3.35Å; N2826-R2862 VanDerWaalsContact OD1-CD 3.22Å; N2826-R2862 WeakPolarHBondContact OD1-CD 3.39Å; N2826-R2862 PolarHBondContact OD1-NH1 2.98Å; D2829-R2862 IonicContact OD2-CZ 3.11Å; D2829-R2862 IonicContact OD2-NH1 2.99Å; D2829-R2862 PolarHBondContact OD2-NH1 2.89Å; D2829-R2862 IonicContact OD2-NH2 3.39Å; D2829-R2862 PolarHBondContact OD2-NH2 3.03Å; T2858-R2862 PolarHBondContact O-N 3.07Å; L2859-R2862 CarbonylContact O-C 3.06Å; L2859-R2862 WeakPolarHBondContact O-CA 3.31Å; L2859-R2862 VanDerWaalsContact O-CB 3.32Å; L2859-R2862 WeakPolarHBondContact O-CB 3.3Å; L2859-R2862 PolarHBondContact O-N 2.96Å; Y2860-R2862 VanDerWaalsContact C-N 3.32Å; Y2860-R2862 PolarHBondContact O-N 3.03Å; R2862-K2865 PolarHBondContact O-N 3.17Å; R2862-Q2866 PolarHBondContact O-N 3.26Å
2863F94.7Very high92.8Very high0 Ų064.3 Ų64.30%032%0.317CS..Hα-helixtrans-63.5-48.6-178.9-59.1-27.1000112.2V2776 W2779 L2783 F2822 N2826 L2830 L2859 Y2860 K2865 Q2866 V2867V2776-F2863 HydrophobicContact CG1-CB 3.92Å; V2776-F2863 HydrophobicContact CG1-CD1 4.06Å; V2776-F2863 HydrophobicContact CG1-CG 4.24Å; W2779-F2863 HydrophobicContact CB-CD2 3.75Å; W2779-F2863 HydrophobicContact CB-CE2 3.59Å; W2779-F2863 HydrophobicContact CB-CZ 4.38Å; W2779-F2863 HydrophobicContact CG-CE2 4.16Å; L2783-F2863 HydrophobicContact CD1-CD2 4.05Å; L2783-F2863 HydrophobicContact CD1-CE2 4.1Å; F2822-F2863 HydrophobicContact CE2-CD1 4.18Å; F2822-F2863 AromaticContact CE2-CE1 3.54Å; F2822-F2863 HydrophobicContact CE2-CE1 3.54Å; F2822-F2863 VanDerWaalsContact CE2-CE1 3.47Å; F2822-F2863 AromaticContact CE2-CZ 3.83Å; F2822-F2863 HydrophobicContact CE2-CZ 3.83Å; F2822-F2863 AromaticContact CZ-CE1 3.81Å; F2822-F2863 HydrophobicContact CZ-CE1 3.88Å; F2822-F2863 HydrophobicContact CZ-CE2 4.39Å; F2822-F2863 AromaticContact CZ-CZ 3.64Å; F2822-F2863 HydrophobicContact CZ-CZ 3.64Å; N2826-F2863 HydrophobicContact CB-CE1 4.05Å; N2826-F2863 HydrophobicContact CB-CZ 4.08Å; L2830-F2863 HydrophobicContact CD1-CZ 4.37Å; L2859-F2863 HydrophobicContact CB-CD2 4.34Å; L2859-F2863 HydrophobicContact CB-CE2 3.8Å; L2859-F2863 HydrophobicContact CB-CZ 4.07Å; L2859-F2863 HydrophobicContact CD2-CE1 4.27Å; L2859-F2863 HydrophobicContact CD2-CE2 4.39Å; L2859-F2863 HydrophobicContact CD2-CZ 3.8Å; L2859-F2863 HydrophobicContact CG-CZ 4.43Å; L2859-F2863 WeakPolarHBondContact O-CD2 3.43Å; L2859-F2863 VanDerWaalsContact O-CG 3.28Å; L2859-F2863 WeakPolarHBondContact O-CG 3.38Å; L2859-F2863 PolarHBondContact O-N 3.02Å; Y2860-F2863 PolarHBondContact O-N 3.01Å; F2863-K2865 PolarHBondContact O-N 3.22Å; F2863-K2865 VanDerWaalsContact O-N 3.14Å; F2863-Q2866 CarbonylContact O-C 3.52Å; F2863-Q2866 WeakPolarHBondContact O-CA 3.46Å; F2863-Q2866 WeakPolarHBondContact O-CB 3.24Å; F2863-Q2866 PolarHBondContact O-N 3.16Å; F2863-V2867 WeakPolarHBondContact O-CB 3.43Å; F2863-V2867 VanDerWaalsContact O-CG2 3.27Å; F2863-V2867 WeakPolarHBondContact O-CG2 3.32Å; F2863-V2867 PolarHBondContact O-N 3.2Å
2864A91.1Very high92.8Very high23 Ų2367.9 Ų67.919%0.1933%0.334CS..Hα-helixtrans-57.2-34.1177.900000112.4Y2860 N2868Y2860-A2864 VanDerWaalsContact O-CB 3.27Å; Y2860-A2864 WeakPolarHBondContact O-CB 3.32Å; Y2860-A2864 PolarHBondContact O-N 3.3Å; A2864-N2868 WeakPolarHBondContact O-CB 3.29Å; A2864-N2868 VanDerWaalsContact O-CG 3.29Å; A2864-N2868 PolarHBondContact O-N 2.88Å; A2864-N2868 PolarHBondContact O-ND2 3.19Å; A2864-N2868 VanDerWaalsContact O-ND2 3.13Å
2865K92.4Very high92.7Very high149.333 Ų149.33362.7 Ų62.765%0.64931%0.31SS*.Hα-helixtrans-73.2-40.8174.4-164178.4-178.3-176.30112.4R2861 R2862 F2863 N2868 N2869R2861-K2865 PolarHBondContact O-N 3.05Å; R2862-K2865 PolarHBondContact O-N 3.17Å; F2863-K2865 PolarHBondContact O-N 3.22Å; F2863-K2865 VanDerWaalsContact O-N 3.14Å; K2865-N2868 PolarHBondContact O-N 2.91Å; K2865-N2869 WeakPolarHBondContact O-CB 3.31Å; K2865-N2869 VanDerWaalsContact O-CG 3.29Å; K2865-N2869 PolarHBondContact O-N 3.05Å; K2865-N2869 PolarHBondContact O-ND2 3.07Å
2866Q91.3Very high92.7Very high54 Ų5464.2 Ų64.225%0.25231%0.314SS..Hα-helixtrans-63-48.2174.1-76177.4-31.900111.4V2776 E2825 R2862 F2863 N2868 N2869 M2870V2776-Q2866 HydrophobicContact CG1-CB 3.97Å; E2825-Q2866 PolarHBondContact OE2-NE2 3.35Å; E2825-Q2866 VanDerWaalsContact OE2-NE2 3.12Å; R2862-Q2866 PolarHBondContact O-N 3.26Å; F2863-Q2866 CarbonylContact O-C 3.52Å; F2863-Q2866 WeakPolarHBondContact O-CA 3.46Å; F2863-Q2866 WeakPolarHBondContact O-CB 3.24Å; F2863-Q2866 PolarHBondContact O-N 3.16Å; Q2866-N2868 VanDerWaalsContact C-N 3.34Å; Q2866-N2868 PolarHBondContact O-N 3.01Å; Q2866-N2869 PolarHBondContact O-N 3.16Å; Q2866-N2869 VanDerWaalsContact O-N 3.1Å; Q2866-M2870 WeakPolarHBondContact O-CG 3.4Å; Q2866-M2870 PolarHBondContact O-N 3.08Å; Q2866-M2870 VanDerWaalsContact O-N 3.11Å
2867V89.9Confident92.6Very high15.3333 Ų15.333366.3 Ų66.39%0.09333%0.328CS..Hα-helixtrans-54.4-48.9177.3171.20000111.2V2776 E2777 F2863 N2869 M2870 R2921V2776-V2867 HydrophobicContact CG1-CG2 3.85Å; E2777-V2867 HydrophobicContact CB-CG2 4.42Å; E2777-V2867 HydrophobicContact CG-CG1 4.31Å; E2777-V2867 HydrophobicContact CG-CG2 3.9Å; F2863-V2867 WeakPolarHBondContact O-CB 3.43Å; F2863-V2867 VanDerWaalsContact O-CG2 3.27Å; F2863-V2867 WeakPolarHBondContact O-CG2 3.32Å; F2863-V2867 PolarHBondContact O-N 3.2Å; V2867-N2869 VanDerWaalsContact C-N 3.27Å; V2867-N2869 PolarHBondContact O-N 3.28Å; V2867-M2870 PolarHBondContact O-N 3.06Å; V2867-R2921 PolarHBondContact O-NE 3.26Å; V2867-R2921 PolarHBondContact O-NH1 2.85Å; V2867-R2921 PolarHBondContact O-NH2 3.39Å
2868N88Confident92.5Very high128.333 Ų128.33360.7 Ų60.769%0.68631%0.307SS*.Hα-helixtrans-66.4-25-179.5-75.9-42.1000113.8A2864 K2865 Q2866A2864-N2868 WeakPolarHBondContact O-CB 3.29Å; A2864-N2868 VanDerWaalsContact O-CG 3.29Å; A2864-N2868 PolarHBondContact O-N 2.88Å; A2864-N2868 PolarHBondContact O-ND2 3.19Å; A2864-N2868 VanDerWaalsContact O-ND2 3.13Å; K2865-N2868 PolarHBondContact O-N 2.91Å; Q2866-N2868 VanDerWaalsContact C-N 3.34Å; Q2866-N2868 PolarHBondContact O-N 3.01Å
2869N90.3Very high92.4Very high114.333 Ų114.33357.2 Ų57.261%0.61129%0.285SS*.Hα-helixtrans-91.1-15.5-179-71.2-9.6000114K2865 Q2866 V2867 T2871K2865-N2869 WeakPolarHBondContact O-CB 3.31Å; K2865-N2869 VanDerWaalsContact O-CG 3.29Å; K2865-N2869 PolarHBondContact O-N 3.05Å; K2865-N2869 PolarHBondContact O-ND2 3.07Å; Q2866-N2869 PolarHBondContact O-N 3.16Å; Q2866-N2869 VanDerWaalsContact O-N 3.1Å; V2867-N2869 VanDerWaalsContact C-N 3.27Å; V2867-N2869 PolarHBondContact O-N 3.28Å; N2869-T2871 PolarHBondContact O-N 3.41Å
2870M88.2Confident92.3Very high44.3333 Ų44.333358.4 Ų58.422%0.21829%0.293CS..  trans-71.8117179.6-78.2179144.800111.8T2774 V2776 Q2866 V2867 L2873 F2915 R2921T2774-M2870 HydrophobicContact CG2-CE 4.33Å; V2776-M2870 HydrophobicContact CG2-CE 4.07Å; Q2866-M2870 WeakPolarHBondContact O-CG 3.4Å; Q2866-M2870 PolarHBondContact O-N 3.08Å; Q2866-M2870 VanDerWaalsContact O-N 3.11Å; V2867-M2870 PolarHBondContact O-N 3.06Å; M2870-L2873 HydrophobicContact CE-CD1 3.94Å; M2870-F2915 HydrophobicContact CB-CE2 4.2Å; M2870-F2915 HydrophobicContact CB-CZ 4.31Å; M2870-F2915 HydrophobicContact CE-CE2 4.09Å; M2870-F2915 HydrophobicContact CE-CZ 3.8Å; M2870-F2915 HydrophobicContact SD-CZ 4.36Å; M2870-R2921 PolarHBondContact O-NH2 3.01Å
2871T91.5Very high92.1Very high97 Ų9760 Ų6060%0.59530%0.299SS*.  trans-108.5-27.1178.8530000113.8N2869 F2915N2869-T2871 PolarHBondContact O-N 3.41Å; T2871-F2915 VanDerWaalsContact C-CD2 3.48Å; T2871-F2915 WeakPolarHBondContact O-CD2 3.28Å; T2871-F2915 PolarHBondContact O-N 3.16Å
2872T93.9Very high91.9Very high66 Ų6653.4 Ų53.441%0.40527%0.274SS..EExtended strand (participates in β ladder)trans-140.6151.9-177.647.70000111.7C2912 L2913T2872-C2912 VanDerWaalsContact CG2-SG 3.57Å; T2872-L2913 CarbonylContact C-O 3.55Å; T2872-L2913 VanDerWaalsContact CA-O 3.28Å; T2872-L2913 WeakPolarHBondContact CA-O 3.44Å
2873L93.4Very high91.6Very high7.33333 Ų7.3333353.4 Ų53.44%0.03828%0.278CS..EExtended strand (participates in β ladder)trans-126.9132.6173.5-164.968.3000108.9L2771 T2774 M2870 S2878 L2913 F2915L2771-L2873 HydrophobicContact CD2-CD2 3.75Å; L2771-L2873 HydrophobicContact CD2-CG 4.45Å; T2774-L2873 HydrophobicContact CG2-CD1 4.15Å; T2774-L2873 HydrophobicContact CG2-CD2 4.3Å; M2870-L2873 HydrophobicContact CE-CD1 3.94Å; L2873-S2878 VanDerWaalsContact CD1-OG 3.28Å; L2873-S2878 WeakPolarHBondContact CD1-OG 3.41Å; L2873-S2878 WeakPolarHBondContact CG-OG 3.49Å; L2873-L2913 HydrophobicContact CB-CB 4.4Å; L2873-L2913 PolarHBondContact N-O 3.15Å; L2873-L2913 PolarHBondContact O-N 3.09Å; L2873-F2915 HydrophobicContact CB-CE2 3.81Å; L2873-F2915 HydrophobicContact CB-CZ 4.24Å; L2873-F2915 HydrophobicContact CD1-CZ 4.44Å
2874E94.1Very high91.1Very high95 Ų9560.7 Ų60.744%0.44431%0.312SS..EExtended strand (participates in β ladder)trans-105.9129.9-178-64.1-167.9166.700111.9T2876 V2877 S2878 N2911E2874-T2876 VanDerWaalsContact C-N 3.31Å; E2874-T2876 PolarHBondContact O-N 3.04Å; E2874-V2877 HydrophobicContact CB-CG2 4.27Å; E2874-V2877 WeakPolarHBondContact O-CG2 3.47Å; E2874-V2877 PolarHBondContact O-N 3.23Å; E2874-S2878 VanDerWaalsContact O-CB 3.3Å; E2874-S2878 WeakPolarHBondContact O-CB 3.42Å; E2874-S2878 PolarHBondContact O-N 3.18Å; E2874-S2878 VanDerWaalsContact O-N 3.08Å; E2874-S2878 PolarHBondContact O-OG 3.36Å; E2874-N2911 CarbonylContact C-O 3.49Å; E2874-N2911 VanDerWaalsContact CA-O 3.3Å; E2874-N2911 WeakPolarHBondContact CA-O 3.4Å
2875L92.4Very high90.6Very high1.33333 Ų1.3333363.7 Ų63.71%0.00732%0.319CS..Hα-helixtrans-61.4-38.6179.7-70.8164.2000111.7L2771 V2877 S2878 S2879 L2882 H2883 I2909 K2910 N2911 L2913L2771-L2875 HydrophobicContact CD1-CD2 3.45Å; L2771-L2875 HydrophobicContact CD1-CG 4.29Å; L2771-L2875 HydrophobicContact CD2-CD2 3.85Å; L2771-L2875 HydrophobicContact CG-CD2 4.25Å; L2875-V2877 PolarHBondContact O-N 3.1Å; L2875-V2877 VanDerWaalsContact O-N 3.11Å; L2875-S2878 PolarHBondContact O-N 2.91Å; L2875-S2879 CarbonylContact O-C 3.35Å; L2875-S2879 WeakPolarHBondContact O-CA 3.45Å; L2875-S2879 PolarHBondContact O-N 3.03Å; L2875-S2879 VanDerWaalsContact O-O 3.07Å; L2875-L2882 HydrophobicContact CD1-CD2 4.49Å; L2875-L2882 HydrophobicContact CD2-CB 3.48Å; L2875-L2882 VanDerWaalsContact CD2-CB 3.48Å; L2875-L2882 HydrophobicContact CD2-CD1 3.86Å; L2875-L2882 HydrophobicContact CD2-CD2 4.16Å; L2875-L2882 HydrophobicContact CD2-CG 4.34Å; L2875-H2883 HydrophobicContact CB-CB 4.27Å; L2875-I2909 HydrophobicContact CD1-CB 4.25Å; L2875-I2909 HydrophobicContact CD1-CG2 3.82Å; L2875-K2910 VanDerWaalsContact CD1-O 3.26Å; L2875-K2910 WeakPolarHBondContact CD1-O 3.31Å; L2875-N2911 WeakPolarHBondContact CB-OD1 3.32Å; L2875-N2911 PolarHBondContact N-O 3.13Å; L2875-N2911 PolarHBondContact N-OD1 3.26Å; L2875-L2913 HydrophobicContact CD1-CD1 4.12Å; L2875-L2913 HydrophobicContact CD2-CD1 3.64Å; L2875-L2913 HydrophobicContact CG-CD1 3.81Å
2876T92.2Very high89.2Confident53.3333 Ų53.333357.9 Ų57.933%0.32730%0.302SS..Hα-helixtrans-50.5-36176.5-21.90000113.7E2874 H2883 N2911E2874-T2876 VanDerWaalsContact C-N 3.31Å; E2874-T2876 PolarHBondContact O-N 3.04Å; T2876-H2883 VanDerWaalsContact CG2-CE1 3.5Å; T2876-H2883 WeakPolarHBondContact CG2-CE1 3.47Å; T2876-H2883 PolarHBondContact OG1-CE1 2.6Å; T2876-H2883 PolarHBondContact OG1-ND1 3.13Å; T2876-N2911 PolarHBondContact N-OD1 3.1Å; T2876-N2911 VanDerWaalsContact N-OD1 3.14Å; T2876-N2911 PolarHBondContact OG1-ND2 3.05Å; T2876-N2911 VanDerWaalsContact OG1-ND2 3.14Å; T2876-N2911 PolarHBondContact OG1-OD1 3.17Å; T2876-N2911 VanDerWaalsContact OG1-OD1 3.07Å
2877V93.4Very high88.2Confident47 Ų4763.5 Ų63.529%0.28533%0.328SS..Hα-helixtrans-100.7-33.6-176.6-133.40000112.6I2817 H2818 E2874 L2875I2817-V2877 HydrophobicContact CB-CB 4.19Å; I2817-V2877 HydrophobicContact CB-CG1 4Å; I2817-V2877 HydrophobicContact CD1-CG1 4.48Å; I2817-V2877 HydrophobicContact CG2-CB 4.45Å; I2817-V2877 HydrophobicContact CG2-CG1 3.95Å; I2817-V2877 PolarHBondContact N-O 2.88Å; H2818-V2877 HydrophobicContact CB-CG1 4.24Å; H2818-V2877 WeakPolarHBondContact CB-O 3.33Å; H2818-V2877 PolarHBondContact N-O 3.06Å; E2874-V2877 HydrophobicContact CB-CG2 4.27Å; E2874-V2877 WeakPolarHBondContact O-CG2 3.47Å; E2874-V2877 PolarHBondContact O-N 3.23Å; L2875-V2877 PolarHBondContact O-N 3.1Å; L2875-V2877 VanDerWaalsContact O-N 3.11Å
2878S92.8Very high87.7Confident7 Ų766.4 Ų66.45%0.04934%0.343CS..Hα-helixtrans-102.7-12.9-171.8-50.80000114.4R2770 L2873 E2874 L2875R2770-S2878 WeakPolarHBondContact CD-O 3.44Å; L2873-S2878 VanDerWaalsContact CD1-OG 3.28Å; L2873-S2878 WeakPolarHBondContact CD1-OG 3.41Å; L2873-S2878 WeakPolarHBondContact CG-OG 3.49Å; E2874-S2878 VanDerWaalsContact O-CB 3.3Å; E2874-S2878 WeakPolarHBondContact O-CB 3.42Å; E2874-S2878 PolarHBondContact O-N 3.18Å; E2874-S2878 VanDerWaalsContact O-N 3.08Å; E2874-S2878 PolarHBondContact O-OG 3.36Å; L2875-S2878 PolarHBondContact O-N 2.91Å
2879S93.5Very high87.9Confident0 Ų060.4 Ų60.40%031%0.311CS..  trans-161.672.1174-175.20000110.8E2767 L2875 R2881 L2882 H2883E2767-S2879 VanDerWaalsContact CB-OG 3.28Å; E2767-S2879 WeakPolarHBondContact CB-OG 3.4Å; E2767-S2879 VanDerWaalsContact CD-OG 3.3Å; E2767-S2879 WeakPolarHBondContact CG-OG 3.34Å; E2767-S2879 WeakPolarHBondContact OE2-CB 3.39Å; E2767-S2879 PolarHBondContact OE2-OG 3.05Å; L2875-S2879 CarbonylContact O-C 3.35Å; L2875-S2879 WeakPolarHBondContact O-CA 3.45Å; L2875-S2879 PolarHBondContact O-N 3.03Å; L2875-S2879 VanDerWaalsContact O-O 3.07Å; S2879-R2881 VanDerWaalsContact C-N 3.26Å; S2879-R2881 PolarHBondContact O-N 3.1Å; S2879-L2882 PolarHBondContact O-N 3.3Å; S2879-L2882 VanDerWaalsContact O-N 3.16Å; S2879-L2882 VanDerWaalsContact OG-CB 3.26Å; S2879-L2882 WeakPolarHBondContact OG-CB 3.39Å; S2879-H2883 PolarHBondContact O-N 2.91Å
2880P91.2Very high88.1Confident26 Ų2658.5 Ų58.517%0.16930%0.298CS..Hα-helixtrans-59.7-35.9-178.923.1-32.9000111.8T2816 L2882 H2883 E2884T2816-P2880 HydrophobicContact CG2-CG 4.5Å; P2880-L2882 VanDerWaalsContact C-N 3.29Å; P2880-L2882 PolarHBondContact O-N 3.26Å; P2880-H2883 WeakPolarHBondContact O-CB 3.34Å; P2880-H2883 PolarHBondContact O-N 3Å; P2880-H2883 VanDerWaalsContact O-N 3.11Å; P2880-E2884 WeakPolarHBondContact O-CB 3.34Å; P2880-E2884 WeakPolarHBondContact O-CG 3.33Å; P2880-E2884 PolarHBondContact O-N 3.1Å
2881R90.4Very high88.3Confident98 Ų9856.4 Ų56.437%0.3729%0.288SS..Hα-helixtrans-53.8-42.7175.1-64.9172.968.7-153.710.2112.6L2763 E2766 E2767 S2879 Y2885L2763-R2881 HydrophobicContact CD1-CB 3.91Å; E2766-R2881 IonicContact OE2-CZ 3.14Å; E2766-R2881 VanDerWaalsContact OE2-CZ 3.28Å; E2766-R2881 IonicContact OE2-NH1 3.31Å; E2766-R2881 PolarHBondContact OE2-NH1 3.27Å; E2766-R2881 VanDerWaalsContact OE2-NH1 3.1Å; E2766-R2881 IonicContact OE2-NH2 3.6Å; E2766-R2881 PolarHBondContact OE2-NH2 3.09Å; E2767-R2881 HydrophobicContact CG-CB 4.31Å; E2767-R2881 WeakPolarHBondContact OE1-CD 3.44Å; E2767-R2881 IonicContact OE1-CZ 3.25Å; E2767-R2881 IonicContact OE1-NE 2.81Å; E2767-R2881 IonicContact OE1-NH1 3.83Å; E2767-R2881 PolarHBondContact OE1-NH1 3.34Å; S2879-R2881 VanDerWaalsContact C-N 3.26Å; S2879-R2881 PolarHBondContact O-N 3.1Å; R2881-Y2885 WeakPolarHBondContact O-CB 3.4Å; R2881-Y2885 PolarHBondContact O-N 3.11Å
2882L90.1Very high88.5Confident6.33333 Ų6.3333351.9 Ų51.93%0.03326%0.26CS..Hα-helixtrans-76.7-28.2179.6-141.497.7000112.8L2763 L2764 E2767 L2768 L2771 L2875 S2879 P2880 W2889 I2909L2763-L2882 HydrophobicContact CG-CD2 4.46Å; L2764-L2882 HydrophobicContact CD1-CD1 4.07Å; L2764-L2882 HydrophobicContact CD1-CD2 3.83Å; E2767-L2882 HydrophobicContact CB-CB 4.09Å; E2767-L2882 HydrophobicContact CB-CD1 4.1Å; E2767-L2882 VanDerWaalsContact CB-CD1 3.4Å; E2767-L2882 HydrophobicContact CB-CD2 4.27Å; E2767-L2882 HydrophobicContact CB-CG 3.98Å; E2767-L2882 VanDerWaalsContact CB-CG 3.48Å; E2767-L2882 HydrophobicContact CG-CB 4.28Å; E2767-L2882 HydrophobicContact CG-CD1 4.5Å; E2767-L2882 HydrophobicContact CG-CG 4.08Å; L2768-L2882 HydrophobicContact CD2-CD1 4.45Å; L2771-L2882 HydrophobicContact CD1-CD1 3.91Å; L2771-L2882 HydrophobicContact CD1-CD2 3.99Å; L2875-L2882 HydrophobicContact CD1-CD2 4.49Å; L2875-L2882 HydrophobicContact CD2-CB 3.48Å; L2875-L2882 VanDerWaalsContact CD2-CB 3.48Å; L2875-L2882 HydrophobicContact CD2-CD1 3.86Å; L2875-L2882 HydrophobicContact CD2-CD2 4.16Å; L2875-L2882 HydrophobicContact CD2-CG 4.34Å; S2879-L2882 PolarHBondContact O-N 3.3Å; S2879-L2882 VanDerWaalsContact O-N 3.16Å; S2879-L2882 VanDerWaalsContact OG-CB 3.26Å; S2879-L2882 WeakPolarHBondContact OG-CB 3.39Å; P2880-L2882 VanDerWaalsContact C-N 3.29Å; P2880-L2882 PolarHBondContact O-N 3.26Å; L2882-W2889 HydrophobicContact CD1-CH2 3.8Å; L2882-W2889 HydrophobicContact CD1-CZ2 3.86Å; L2882-W2889 HydrophobicContact CD2-CH2 3.81Å; L2882-W2889 HydrophobicContact CD2-CZ2 3.99Å; L2882-I2909 HydrophobicContact CD1-CD1 3.85Å; L2882-I2909 HydrophobicContact CD2-CD1 3.99Å; L2882-I2909 HydrophobicContact CG-CD1 3.92Å
2883H88.3Confident88.6Confident88 Ų8848.8 Ų48.841%0.40724%0.241SC..Hα-helixtrans-72.7-47175.4-173.586.8000111.7L2875 T2876 S2879 P2880 Y2885 G2886 N2911L2875-H2883 HydrophobicContact CB-CB 4.27Å; T2876-H2883 VanDerWaalsContact CG2-CE1 3.5Å; T2876-H2883 WeakPolarHBondContact CG2-CE1 3.47Å; T2876-H2883 PolarHBondContact OG1-CE1 2.6Å; T2876-H2883 PolarHBondContact OG1-ND1 3.13Å; S2879-H2883 PolarHBondContact O-N 2.91Å; P2880-H2883 WeakPolarHBondContact O-CB 3.34Å; P2880-H2883 PolarHBondContact O-N 3Å; P2880-H2883 VanDerWaalsContact O-N 3.11Å; H2883-Y2885 PolarHBondContact O-N 2.89Å; H2883-G2886 PolarHBondContact O-N 3.22Å; H2883-G2886 VanDerWaalsContact O-N 3.14Å; H2883-N2911 PolarHBondContact CE1-OD1 3.28Å; H2883-N2911 VanDerWaalsContact CE1-OD1 3.31Å; H2883-N2911 PolarHBondContact ND1-OD1 3.22Å
2884E84.1Confident88.6Confident154.333 Ų154.33348.6 Ų48.672%0.72124%0.24SC*.Hα-helixtrans-76.4-30.1-173.6-70172.1-172.200113.8P2880 G2886P2880-E2884 WeakPolarHBondContact O-CB 3.34Å; P2880-E2884 WeakPolarHBondContact O-CG 3.33Å; P2880-E2884 PolarHBondContact O-N 3.1Å; E2884-G2886 PolarHBondContact O-N 3.19Å; E2884-G2886 VanDerWaalsContact O-N 3.15Å
2885Y81.2Confident88.4Confident84.6667 Ų84.666746.7 Ų46.733%0.33225%0.246SC..THydrogen-bonded Turntrans-63.3-15.6-178.8-163.3-92.8000113.7R2756 E2760 L2763 R2881 H2883 Q2887 W2889R2756-Y2885 PolarHBondContact NE-OH 3.48Å; R2756-Y2885 PolarHBondContact NH2-OH 3.11Å; E2760-Y2885 HydrophobicContact CG-CE1 3.72Å; E2760-Y2885 VanDerWaalsContact CG-OH 3.31Å; E2760-Y2885 WeakPolarHBondContact CG-OH 3.21Å; E2760-Y2885 PolarHBondContact OE1-OH 3.14Å; E2760-Y2885 VanDerWaalsContact OE1-OH 3.09Å; L2763-Y2885 HydrophobicContact CD2-CD1 4.24Å; L2763-Y2885 HydrophobicContact CD2-CD2 3.6Å; L2763-Y2885 HydrophobicContact CD2-CE1 4.45Å; L2763-Y2885 HydrophobicContact CD2-CE2 4.08Å; L2763-Y2885 HydrophobicContact CD2-CG 3.69Å; L2763-Y2885 VanDerWaalsContact CD2-CG 3.47Å; R2881-Y2885 WeakPolarHBondContact O-CB 3.4Å; R2881-Y2885 PolarHBondContact O-N 3.11Å; H2883-Y2885 PolarHBondContact O-N 2.89Å; Y2885-Q2887 VanDerWaalsContact C-N 3.27Å; Y2885-Q2887 PolarHBondContact O-N 2.9Å; Y2885-W2889 AromaticContact CD1-CD2 3.98Å; Y2885-W2889 HydrophobicContact CD1-CD2 4.06Å; Y2885-W2889 AromaticContact CD1-CE2 3.55Å; Y2885-W2889 HydrophobicContact CD1-CE3 4.47Å; Y2885-W2889 HydrophobicContact CD1-CG 4.46Å; Y2885-W2889 HydrophobicContact CD1-CH2 4.19Å; Y2885-W2889 AromaticContact CD1-CZ2 3.63Å; Y2885-W2889 HydrophobicContact CD1-CZ2 3.78Å; Y2885-W2889 AromaticContact CD1-NE1 3.78Å; Y2885-W2889 AromaticContact CE1-CD2 3.97Å; Y2885-W2889 HydrophobicContact CE1-CD2 4.01Å; Y2885-W2889 AromaticContact CE1-CE2 3.99Å; Y2885-W2889 HydrophobicContact CE1-CE3 4.33Å; Y2885-W2889 HydrophobicContact CE1-CG 4.36Å; Y2885-W2889 HydrophobicContact CE1-CZ2 4.32Å; Y2885-W2889 HydrophobicContact CG-CZ2 4.41Å
2886G63.3Low88.4Confident28.3333 Ų28.333348.2 Ų48.229%0.29226%0.257SS..  trans-80.494.1-170.500000116.6H2883 E2884 W2889H2883-G2886 PolarHBondContact O-N 3.22Å; H2883-G2886 VanDerWaalsContact O-N 3.14Å; E2884-G2886 PolarHBondContact O-N 3.19Å; E2884-G2886 VanDerWaalsContact O-N 3.15Å; G2886-W2889 PolarHBondContact O-NE1 3.25Å
2887Q69.9Low88.5Confident171.667 Ų171.66748.5 Ų48.580%0.80225%0.253SS*.SBendtrans-129.8135.6157.2-59.6-167.213.500111.1Y2885 A2907Y2885-Q2887 VanDerWaalsContact C-N 3.27Å; Y2885-Q2887 PolarHBondContact O-N 2.9Å; Q2887-A2907 VanDerWaalsContact CA-O 3.29Å; Q2887-A2907 WeakPolarHBondContact CA-O 3.37Å
2888D80Confident88.2Confident76.6667 Ų76.666750.9 Ų50.941%0.4126%0.26SS..  trans66.375.4-179.1-161.450.2000117.1R2756 R2905 A2907R2756-D2888 IonicContact NH1-OD2 3.76Å; R2756-D2888 PolarHBondContact NH2-O 3.11Å; D2888-R2905 VanDerWaalsContact CG-CZ 3.5Å; D2888-R2905 IonicContact OD1-CZ 3.27Å; D2888-R2905 IonicContact OD1-NE 3.02Å; D2888-R2905 PolarHBondContact OD1-NE 3.35Å; D2888-R2905 IonicContact OD1-NH1 3.06Å; D2888-R2905 PolarHBondContact OD1-NH1 3.01Å; D2888-R2905 IonicContact OD1-NH2 2.89Å; D2888-R2905 PolarHBondContact OD1-NH2 3.12Å; D2888-R2905 IonicContact OD2-CZ 2.93Å; D2888-R2905 IonicContact OD2-NH1 3.26Å; D2888-R2905 PolarHBondContact OD2-NH1 3.12Å; D2888-R2905 IonicContact OD2-NH2 3.57Å; D2888-R2905 PolarHBondContact OD2-NH2 3.15Å; D2888-A2907 PolarHBondContact N-O 3.02Å; D2888-A2907 VanDerWaalsContact N-O 3.16Å
2889W92.1Very high87.8Confident2.33333 Ų2.3333352.6 Ų52.61%0.00927%0.272CS..  trans-74.6158.1172.2-65.553.6000112E2760 L2763 L2764 L2882 Y2885 G2886 L2891 R2905 I2906E2760-W2889 HydrophobicContact CB-CE3 3.76Å; E2760-W2889 HydrophobicContact CB-CZ3 3.83Å; E2760-W2889 HydrophobicContact CG-CD2 4.31Å; E2760-W2889 HydrophobicContact CG-CE3 3.82Å; E2760-W2889 HydrophobicContact CG-CZ3 4.15Å; E2760-W2889 WeakPolarHBondContact O-CZ3 3.44Å; E2760-W2889 WeakPolarHBondContact OE1-CA 3.44Å; L2763-W2889 HydrophobicContact CD2-CH2 4.22Å; L2763-W2889 HydrophobicContact CG-CH2 4.35Å; L2764-W2889 HydrophobicContact CB-CH2 4.05Å; L2764-W2889 HydrophobicContact CB-CZ3 3.91Å; L2764-W2889 HydrophobicContact CD1-CH2 4.28Å; L2764-W2889 HydrophobicContact CD2-CZ3 4.46Å; L2882-W2889 HydrophobicContact CD1-CH2 3.8Å; L2882-W2889 HydrophobicContact CD1-CZ2 3.86Å; L2882-W2889 HydrophobicContact CD2-CH2 3.81Å; L2882-W2889 HydrophobicContact CD2-CZ2 3.99Å; Y2885-W2889 AromaticContact CD1-CD2 3.98Å; Y2885-W2889 HydrophobicContact CD1-CD2 4.06Å; Y2885-W2889 AromaticContact CD1-CE2 3.55Å; Y2885-W2889 HydrophobicContact CD1-CE3 4.47Å; Y2885-W2889 HydrophobicContact CD1-CG 4.46Å; Y2885-W2889 HydrophobicContact CD1-CH2 4.19Å; Y2885-W2889 AromaticContact CD1-CZ2 3.63Å; Y2885-W2889 HydrophobicContact CD1-CZ2 3.78Å; Y2885-W2889 AromaticContact CD1-NE1 3.78Å; Y2885-W2889 AromaticContact CE1-CD2 3.97Å; Y2885-W2889 HydrophobicContact CE1-CD2 4.01Å; Y2885-W2889 AromaticContact CE1-CE2 3.99Å; Y2885-W2889 HydrophobicContact CE1-CE3 4.33Å; Y2885-W2889 HydrophobicContact CE1-CG 4.36Å; Y2885-W2889 HydrophobicContact CE1-CZ2 4.32Å; Y2885-W2889 HydrophobicContact CG-CZ2 4.41Å; G2886-W2889 PolarHBondContact O-NE1 3.25Å; W2889-L2891 HydrophobicContact CB-CB 4.48Å; W2889-L2891 HydrophobicContact CE3-CB 3.98Å; W2889-L2891 HydrophobicContact CE3-CD2 4.11Å; W2889-L2891 HydrophobicContact CZ3-CD2 4.09Å; W2889-R2905 WeakPolarHBondContact O-CB 3.25Å; W2889-R2905 VanDerWaalsContact O-CD 3.32Å; W2889-R2905 WeakPolarHBondContact O-CD 3.34Å; W2889-R2905 PolarHBondContact O-NE 3.26Å; W2889-R2905 PolarHBondContact O-NH1 3.12Å; W2889-R2905 VanDerWaalsContact O-NH1 3.17Å; W2889-I2906 HydrophobicContact CB-CB 3.91Å; W2889-I2906 VanDerWaalsContact CB-O 3.29Å; W2889-I2906 WeakPolarHBondContact CB-O 3.43Å; W2889-I2906 VanDerWaalsContact CD1-O 3.27Å; W2889-I2906 HydrophobicContact CD2-CB 4.2Å; W2889-I2906 HydrophobicContact CD2-CD1 4.46Å; W2889-I2906 HydrophobicContact CD2-CG2 4.17Å; W2889-I2906 HydrophobicContact CE3-CD1 4.29Å; W2889-I2906 HydrophobicContact CG-CB 3.8Å; W2889-I2906 HydrophobicContact CG-CG2 3.96Å; W2889-I2906 PolarHBondContact N-O 3.21Å; W2889-I2906 VanDerWaalsContact N-O 3.1Å
2890Q93.1Very high87.4Confident74.6667 Ų74.666759.9 Ų59.935%0.34931%0.305SS..SBendtrans-85-28.1162.2-71.7-170.7-13.200112.4Q2721 R2756 L2757 E2760Q2721-Q2890 PolarHBondContact NE2-O 3.31Å; R2756-Q2890 HydrophobicContact CG-CG 4.24Å; L2757-Q2890 HydrophobicContact CD1-CB 4.5Å; E2760-Q2890 VanDerWaalsContact CD-N 3.33Å; E2760-Q2890 PolarHBondContact OE1-N 3.17Å; E2760-Q2890 VanDerWaalsContact OE1-N 3.11Å; E2760-Q2890 WeakPolarHBondContact OE2-CA 3.33Å; E2760-Q2890 PolarHBondContact OE2-N 3.16Å
2891L94.5Very high87.4Confident0 Ų066.5 Ų66.50%033%0.327CS..SBendtrans-63.5134.4-179.3-169.859.3000112.8V2724 Y2725 L2757 E2760 A2761 L2764 W2889 R2905 I2906V2724-L2891 HydrophobicContact CG1-CD1 3.82Å; Y2725-L2891 HydrophobicContact CE1-CD2 4.37Å; Y2725-L2891 HydrophobicContact CE2-CD1 4.13Å; Y2725-L2891 WeakPolarHBondContact OH-CD2 3.43Å; Y2725-L2891 VanDerWaalsContact OH-CG 3.31Å; Y2725-L2891 WeakPolarHBondContact OH-CG 3.4Å; L2757-L2891 VanDerWaalsContact CD1-CA 3.45Å; L2757-L2891 HydrophobicContact CD1-CB 3.98Å; L2757-L2891 HydrophobicContact CD1-CD1 3.6Å; L2757-L2891 HydrophobicContact CD1-CG 4.4Å; E2760-L2891 HydrophobicContact CB-CB 4.28Å; E2760-L2891 HydrophobicContact CB-CD2 4.42Å; E2760-L2891 WeakPolarHBondContact OE2-CB 3.3Å; E2760-L2891 PolarHBondContact OE2-N 3.14Å; A2761-L2891 HydrophobicContact CB-CD1 4.13Å; A2761-L2891 HydrophobicContact CB-CD2 4.17Å; L2764-L2891 HydrophobicContact CB-CD2 4.21Å; L2764-L2891 HydrophobicContact CD2-CD2 3.62Å; W2889-L2891 HydrophobicContact CB-CB 4.48Å; W2889-L2891 HydrophobicContact CE3-CB 3.98Å; W2889-L2891 HydrophobicContact CE3-CD2 4.11Å; W2889-L2891 HydrophobicContact CZ3-CD2 4.09Å; L2891-R2905 CarbonylContact O-C 3.18Å; L2891-R2905 WeakPolarHBondContact O-CA 3.29Å; L2891-I2906 HydrophobicContact CB-CD1 4.47Å; L2891-I2906 HydrophobicContact CD2-CD1 4.25Å; L2891-I2906 HydrophobicContact CG-CD1 4.33Å; L2891-I2906 PolarHBondContact O-N 3.19Å
2892A95.3Very high87.5Confident2.33333 Ų2.3333367.6 Ų67.62%0.01935%0.347CS..BIsolated β-bridgetrans-65.4152173.400000111.6Q2721 Y2725 P2894 L2903 V2904Q2721-A2892 HydrophobicContact CB-CB 4.46Å; Q2721-A2892 HydrophobicContact CG-CB 4.48Å; Q2721-A2892 VanDerWaalsContact OE1-CB 3.28Å; Y2725-A2892 PolarHBondContact OH-O 3.19Å; A2892-P2894 WeakPolarHBondContact O-CD 3.4Å; A2892-L2903 HydrophobicContact CB-CD1 3.83Å; A2892-V2904 CarbonylContact C-O 3.57Å; A2892-V2904 WeakPolarHBondContact CA-O 3.3Å
2893V95.2Very high87.7Confident0.333333 Ų0.33333370.5 Ų70.50%0.00236%0.362CS..PPolyproline II helixtrans-61132.4167.9178.90000109.2G2895 S2896 V2904 R2905 I2906 I2927 Y2935 F2937V2893-G2895 PolarHBondContact O-N 2.89Å; V2893-G2895 VanDerWaalsContact O-N 3.14Å; V2893-S2896 VanDerWaalsContact O-CB 3.28Å; V2893-S2896 WeakPolarHBondContact O-CB 3.35Å; V2893-S2896 PolarHBondContact O-N 3.31Å; V2893-S2896 PolarHBondContact O-OG 3.17Å; V2893-S2896 VanDerWaalsContact O-OG 3.07Å; V2893-V2904 HydrophobicContact CG2-CG1 4.04Å; V2893-V2904 PolarHBondContact N-O 3.32Å; V2893-R2905 WeakPolarHBondContact CG2-O 3.35Å; V2893-I2906 HydrophobicContact CB-CG1 4.48Å; V2893-I2906 HydrophobicContact CG2-CG1 4.09Å; V2893-I2927 HydrophobicContact CG1-CB 4.41Å; V2893-I2927 HydrophobicContact CG1-CG2 4.28Å; V2893-I2927 HydrophobicContact CG2-CG2 4.16Å; V2893-Y2935 HydrophobicContact CG1-CD1 4.07Å; V2893-Y2935 HydrophobicContact CG1-CD2 3.99Å; V2893-Y2935 HydrophobicContact CG1-CG 3.67Å; V2893-Y2935 HydrophobicContact CG2-CD2 4.3Å; V2893-Y2935 HydrophobicContact CG2-CE2 4.39Å; V2893-F2937 HydrophobicContact CG1-CE2 3.99Å; V2893-F2937 HydrophobicContact CG1-CZ 4.06Å
2894P94.3Very high88Confident2.33333 Ų2.3333367.4 Ų67.42%0.01535%0.349CS..THydrogen-bonded Turntrans-35109.6179.2-5.510.4000115.3Y2725 L2764 A2892 S2896 I2927 F2937 I2981 L2989Y2725-P2894 HydrophobicContact CE1-CB 4.23Å; Y2725-P2894 HydrophobicContact CE1-CG 4.09Å; Y2725-P2894 HydrophobicContact CE2-CB 4.31Å; Y2725-P2894 WeakPolarHBondContact OH-CD 3.46Å; Y2725-P2894 VanDerWaalsContact OH-CG 3.3Å; Y2725-P2894 WeakPolarHBondContact OH-CG 3.43Å; L2764-P2894 HydrophobicContact CD2-CG 4.44Å; A2892-P2894 WeakPolarHBondContact O-CD 3.4Å; P2894-S2896 VanDerWaalsContact C-N 3.28Å; P2894-S2896 PolarHBondContact O-N 3.28Å; P2894-I2927 HydrophobicContact CG-CD1 4.33Å; P2894-F2937 HydrophobicContact CB-CE1 4.24Å; P2894-F2937 HydrophobicContact CB-CZ 4.11Å; P2894-F2937 HydrophobicContact CG-CZ 4.44Å; P2894-F2937 WeakPolarHBondContact O-CE1 3.32Å; P2894-F2937 VanDerWaalsContact O-CZ 3.27Å; P2894-F2937 WeakPolarHBondContact O-CZ 3.39Å; P2894-I2981 HydrophobicContact CB-CD1 3.7Å; P2894-I2981 HydrophobicContact CB-CG1 3.88Å; P2894-L2989 HydrophobicContact CB-CD1 4.13Å; P2894-L2989 HydrophobicContact CG-CD1 3.89Å
2895G90.3Very high88.5Confident55.6667 Ų55.666764 Ų6457%0.57433%0.33SS*.THydrogen-bonded Turntrans71.111.6177.900000116.2V2893V2893-G2895 PolarHBondContact O-N 2.89Å; V2893-G2895 VanDerWaalsContact O-N 3.14Å
2896S92.1Very high89.2Confident33 Ų3360 Ų6023%0.23131%0.314CS..  trans-91-7.4176.7740000114.6V2893 P2894 E2898V2893-S2896 VanDerWaalsContact O-CB 3.28Å; V2893-S2896 WeakPolarHBondContact O-CB 3.35Å; V2893-S2896 PolarHBondContact O-N 3.31Å; V2893-S2896 PolarHBondContact O-OG 3.17Å; V2893-S2896 VanDerWaalsContact O-OG 3.07Å; P2894-S2896 VanDerWaalsContact C-N 3.28Å; P2894-S2896 PolarHBondContact O-N 3.28Å; S2896-E2898 PolarHBondContact O-N 3.01Å
2897Y92.7Very high90.6Very high60.6667 Ų60.666760 Ų6024%0.23831%0.312CS..  trans-75.3121-176177.1-98.2000111.7Y2719 Q2721 S2722 P2899 L2903Y2719-Y2897 WeakPolarHBondContact CD1-OH 3.48Å; Q2721-Y2897 HydrophobicContact CB-CD1 4.08Å; Q2721-Y2897 HydrophobicContact CB-CD2 3.55Å; Q2721-Y2897 VanDerWaalsContact CB-CD2 3.49Å; Q2721-Y2897 HydrophobicContact CB-CE1 4.33Å; Q2721-Y2897 HydrophobicContact CB-CE2 3.82Å; Q2721-Y2897 HydrophobicContact CB-CG 3.68Å; Q2721-Y2897 HydrophobicContact CG-CD2 4.01Å; Q2721-Y2897 HydrophobicContact CG-CE2 4.13Å; S2722-Y2897 VanDerWaalsContact OG-CD1 3.29Å; S2722-Y2897 WeakPolarHBondContact OG-CD1 3.35Å; S2722-Y2897 WeakPolarHBondContact OG-CE1 3.4Å; Y2897-P2899 HydrophobicContact CE1-CG 4.41Å; Y2897-L2903 HydrophobicContact CD2-CD1 3.82Å; Y2897-L2903 HydrophobicContact CE2-CD1 4.37Å
2898E88Confident91.6Very high95.6667 Ų95.666754 Ų5445%0.44729%0.288SS..  trans-123.9134.5169.6-72.2-177.4-165.600109.7S2896 H2900 R2901S2896-E2898 PolarHBondContact O-N 3.01Å; E2898-H2900 PolarHBondContact O-N 3.2Å; E2898-R2901 HydrophobicContact CB-CB 4.31Å; E2898-R2901 HydrophobicContact CB-CG 4.34Å; E2898-R2901 PolarHBondContact O-N 3.14Å; E2898-R2901 IonicContact OE1-CZ 2.78Å; E2898-R2901 IonicContact OE1-NH1 3.36Å; E2898-R2901 PolarHBondContact OE1-NH1 3.14Å; E2898-R2901 WeakPolarHBondContact OE2-CD 3.42Å; E2898-R2901 IonicContact OE2-CZ 2.85Å; E2898-R2901 IonicContact OE2-NE 3.21Å; E2898-R2901 PolarHBondContact OE2-NE 3.11Å; E2898-R2901 IonicContact OE2-NH1 2.78Å; E2898-R2901 PolarHBondContact OE2-NH1 3.27Å; E2898-R2901 IonicContact OE2-NH2 3.15Å
2899P84.4Confident92.3Very high44 Ų4451.4 Ų51.429%0.28628%0.275SS..THydrogen-bonded Turntrans-56142.4174.3-24.834.7000111.9L2687 Y2897 R2901L2687-P2899 HydrophobicContact CD1-CB 4.24Å; L2687-P2899 HydrophobicContact CD1-CG 3.32Å; Y2897-P2899 HydrophobicContact CE1-CG 4.41Å; P2899-R2901 PolarHBondContact O-N 3.27Å; P2899-R2901 VanDerWaalsContact O-N 3.14Å
2900H85.6Confident92.3Very high153 Ų15356.6 Ų56.671%0.70830%0.297SS*.THydrogen-bonded Turntrans65.62.8179.3-40.8-69.7000116D2684 E2898D2684-H2900 IonicContact OD1-CE1 2.82Å; D2684-H2900 IonicContact OD1-NE2 3.2Å; D2684-H2900 IonicContact OD2-CE1 2.7Å; D2684-H2900 IonicContact OD2-NE2 3.58Å; D2684-H2900 PolarHBondContact OD2-NE2 2.91Å; E2898-H2900 PolarHBondContact O-N 3.2Å
2901R90.1Very high92.3Very high164.667 Ų164.66755.3 Ų55.362%0.62129%0.293SS*.SBendtrans-98.3155.6168.6-72.1-164.2173.5164.5-4.1111.9E2898 P2899 L2903E2898-R2901 HydrophobicContact CB-CB 4.31Å; E2898-R2901 HydrophobicContact CB-CG 4.34Å; E2898-R2901 PolarHBondContact O-N 3.14Å; E2898-R2901 IonicContact OE1-CZ 2.78Å; E2898-R2901 IonicContact OE1-NH1 3.36Å; E2898-R2901 PolarHBondContact OE1-NH1 3.14Å; E2898-R2901 WeakPolarHBondContact OE2-CD 3.42Å; E2898-R2901 IonicContact OE2-CZ 2.85Å; E2898-R2901 IonicContact OE2-NE 3.21Å; E2898-R2901 PolarHBondContact OE2-NE 3.11Å; E2898-R2901 IonicContact OE2-NH1 2.78Å; E2898-R2901 PolarHBondContact OE2-NH1 3.27Å; E2898-R2901 IonicContact OE2-NH2 3.15Å; P2899-R2901 PolarHBondContact O-N 3.27Å; P2899-R2901 VanDerWaalsContact O-N 3.14Å; R2901-L2903 PolarHBondContact O-N 3.14Å
2902P92.6Very high92.3Very high120.667 Ų120.66757.1 Ų57.178%0.78431%0.305SS*.  trans-57.3134.5173.3-24.334.6000111.9V2904P2902-V2904 PolarHBondContact O-N 2.91Å
2903L93.7Very high92.2Very high68.3333 Ų68.333357 Ų5736%0.35830%0.304SS..  trans-69.8119.2-178.5-178.467000111.3Q2721 A2892 Y2897 R2901 R2905Q2721-L2903 HydrophobicContact CG-CD1 4Å; A2892-L2903 HydrophobicContact CB-CD1 3.83Å; Y2897-L2903 HydrophobicContact CD2-CD1 3.82Å; Y2897-L2903 HydrophobicContact CE2-CD1 4.37Å; R2901-L2903 PolarHBondContact O-N 3.14Å; L2903-R2905 HydrophobicContact CD2-CG 3.74Å; L2903-R2905 HydrophobicContact CG-CG 3.81Å; L2903-R2905 PolarHBondContact O-N 3.48Å
2904V95.3Very high92.2Very high22.6667 Ų22.666759.9 Ų59.914%0.13732%0.321CS..  trans-90.4102.7170.3-174.20000109A2892 V2893 P2902 N2931 Y2935A2892-V2904 CarbonylContact C-O 3.57Å; A2892-V2904 WeakPolarHBondContact CA-O 3.3Å; V2893-V2904 HydrophobicContact CG2-CG1 4.04Å; V2893-V2904 PolarHBondContact N-O 3.32Å; P2902-V2904 PolarHBondContact O-N 2.91Å; V2904-N2931 HydrophobicContact CG1-CB 4.45Å; V2904-N2931 HydrophobicContact CG2-CB 4.46Å; V2904-N2931 WeakPolarHBondContact CG2-ND2 3.49Å; V2904-Y2935 HydrophobicContact CG1-CE2 3.96Å
2905R95.2Very high92.1Very high81.3333 Ų81.333360.5 Ų60.531%0.30732%0.324SS..BIsolated β-bridgetrans-85.3160.1-179.6-56.5-174.9-62.9161.5-3.2111D2888 W2889 L2891 V2893 L2903 A2907 G2929 S2930D2888-R2905 VanDerWaalsContact CG-CZ 3.5Å; D2888-R2905 IonicContact OD1-CZ 3.27Å; D2888-R2905 IonicContact OD1-NE 3.02Å; D2888-R2905 PolarHBondContact OD1-NE 3.35Å; D2888-R2905 IonicContact OD1-NH1 3.06Å; D2888-R2905 PolarHBondContact OD1-NH1 3.01Å; D2888-R2905 IonicContact OD1-NH2 2.89Å; D2888-R2905 PolarHBondContact OD1-NH2 3.12Å; D2888-R2905 IonicContact OD2-CZ 2.93Å; D2888-R2905 IonicContact OD2-NH1 3.26Å; D2888-R2905 PolarHBondContact OD2-NH1 3.12Å; D2888-R2905 IonicContact OD2-NH2 3.57Å; D2888-R2905 PolarHBondContact OD2-NH2 3.15Å; W2889-R2905 WeakPolarHBondContact O-CB 3.25Å; W2889-R2905 VanDerWaalsContact O-CD 3.32Å; W2889-R2905 WeakPolarHBondContact O-CD 3.34Å; W2889-R2905 PolarHBondContact O-NE 3.26Å; W2889-R2905 PolarHBondContact O-NH1 3.12Å; W2889-R2905 VanDerWaalsContact O-NH1 3.17Å; L2891-R2905 CarbonylContact O-C 3.18Å; L2891-R2905 WeakPolarHBondContact O-CA 3.29Å; V2893-R2905 WeakPolarHBondContact CG2-O 3.35Å; L2903-R2905 HydrophobicContact CD2-CG 3.74Å; L2903-R2905 HydrophobicContact CG-CG 3.81Å; L2903-R2905 PolarHBondContact O-N 3.48Å; R2905-A2907 PolarHBondContact O-N 3.28Å; R2905-G2929 CarbonylContact O-C 3.51Å; R2905-G2929 WeakPolarHBondContact O-CA 3.22Å; R2905-S2930 PolarHBondContact N-OG 3.35Å; R2905-S2930 PolarHBondContact O-N 3.01Å
2906I95Very high92.1Very high0.666667 Ų0.66666760.5 Ų60.50%0.00331%0.31CS..EExtended strand (participates in β ladder)trans-70.4112.7170.5-61.6171.3000108.4L2764 W2889 L2891 V2893 I2909 I2927L2764-I2906 HydrophobicContact CD2-CD1 3.73Å; W2889-I2906 HydrophobicContact CB-CB 3.91Å; W2889-I2906 VanDerWaalsContact CB-O 3.29Å; W2889-I2906 WeakPolarHBondContact CB-O 3.43Å; W2889-I2906 VanDerWaalsContact CD1-O 3.27Å; W2889-I2906 HydrophobicContact CD2-CB 4.2Å; W2889-I2906 HydrophobicContact CD2-CD1 4.46Å; W2889-I2906 HydrophobicContact CD2-CG2 4.17Å; W2889-I2906 HydrophobicContact CE3-CD1 4.29Å; W2889-I2906 HydrophobicContact CG-CB 3.8Å; W2889-I2906 HydrophobicContact CG-CG2 3.96Å; W2889-I2906 PolarHBondContact N-O 3.21Å; W2889-I2906 VanDerWaalsContact N-O 3.1Å; L2891-I2906 HydrophobicContact CB-CD1 4.47Å; L2891-I2906 HydrophobicContact CD2-CD1 4.25Å; L2891-I2906 HydrophobicContact CG-CD1 4.33Å; L2891-I2906 PolarHBondContact O-N 3.19Å; V2893-I2906 HydrophobicContact CB-CG1 4.48Å; V2893-I2906 HydrophobicContact CG2-CG1 4.09Å; I2906-I2909 HydrophobicContact CG2-CD1 4.48Å; I2906-I2909 HydrophobicContact CG2-CG1 4.09Å; I2906-I2927 HydrophobicContact CB-CG2 4.39Å; I2906-I2927 HydrophobicContact CG1-CG2 4.06Å; I2906-I2927 HydrophobicContact CG2-CG2 3.9Å
2907A93Very high91.7Very high30 Ų3065.9 Ų65.925%0.24834%0.342CS..EExtended strand (participates in β ladder)trans-83.9-45.317500000111.1Q2887 D2888 R2905 T2928Q2887-A2907 VanDerWaalsContact CA-O 3.29Å; Q2887-A2907 WeakPolarHBondContact CA-O 3.37Å; D2888-A2907 PolarHBondContact N-O 3.02Å; D2888-A2907 VanDerWaalsContact N-O 3.16Å; R2905-A2907 PolarHBondContact O-N 3.28Å; A2907-T2928 HydrophobicContact CB-CG2 4.48Å; A2907-T2928 WeakPolarHBondContact CB-O 3.35Å; A2907-T2928 PolarHBondContact N-O 3.25Å
2908S91.9Very high91.2Very high44.3333 Ų44.333365.8 Ų65.831%0.3135%0.35SS..EExtended strand (participates in β ladder)trans-161.3161.8176.260.10000111.5T2928S2908-T2928 PolarHBondContact N-O 3.08Å; S2908-T2928 PolarHBondContact O-N 3.1Å; S2908-T2928 WeakPolarHBondContact OG-CB 3.31Å; S2908-T2928 PolarHBondContact OG-OG1 3.19Å; S2908-T2928 VanDerWaalsContact OG-OG1 3.08Å
2909I93.1Very high90.8Very high23.6667 Ų23.666770.6 Ų70.612%0.12137%0.369CS..EExtended strand (participates in β ladder)trans-114.8134.8173.2-56178.5000108.1L2764 L2875 L2882 I2906 N2911 L2925 I2927L2764-I2909 HydrophobicContact CD1-CD1 3.8Å; L2875-I2909 HydrophobicContact CD1-CB 4.25Å; L2875-I2909 HydrophobicContact CD1-CG2 3.82Å; L2882-I2909 HydrophobicContact CD1-CD1 3.85Å; L2882-I2909 HydrophobicContact CD2-CD1 3.99Å; L2882-I2909 HydrophobicContact CG-CD1 3.92Å; I2906-I2909 HydrophobicContact CG2-CD1 4.48Å; I2906-I2909 HydrophobicContact CG2-CG1 4.09Å; I2909-N2911 PolarHBondContact O-N 3.31Å; I2909-L2925 HydrophobicContact CG2-CD1 3.73Å; I2909-I2927 HydrophobicContact CG1-CG1 4.38Å
2910K93.1Very high90.7Very high110.333 Ų110.33372.2 Ų72.248%0.4837%0.373SS..  trans-67.6127.4-177.7-173.8-174.1177.2-169.30110.7L2875 C2912 T2926L2875-K2910 VanDerWaalsContact CD1-O 3.26Å; L2875-K2910 WeakPolarHBondContact CD1-O 3.31Å; K2910-C2912 VanDerWaalsContact C-N 3.28Å; K2910-C2912 PolarHBondContact O-N 3.23Å; K2910-C2912 VanDerWaalsContact O-N 3.17Å; K2910-T2926 WeakPolarHBondContact CB-O 3.37Å; K2910-T2926 PolarHBondContact N-O 3.22Å
2911N92.9Very high90.8Very high48 Ų4866.4 Ų66.426%0.25735%0.345SS..SBendtrans-57.1-31.2-174.2-165.446000115.2E2874 L2875 T2876 H2883 I2909E2874-N2911 CarbonylContact C-O 3.49Å; E2874-N2911 VanDerWaalsContact CA-O 3.3Å; E2874-N2911 WeakPolarHBondContact CA-O 3.4Å; L2875-N2911 WeakPolarHBondContact CB-OD1 3.32Å; L2875-N2911 PolarHBondContact N-O 3.13Å; L2875-N2911 PolarHBondContact N-OD1 3.26Å; T2876-N2911 PolarHBondContact N-OD1 3.1Å; T2876-N2911 VanDerWaalsContact N-OD1 3.14Å; T2876-N2911 PolarHBondContact OG1-ND2 3.05Å; T2876-N2911 VanDerWaalsContact OG1-ND2 3.14Å; T2876-N2911 PolarHBondContact OG1-OD1 3.17Å; T2876-N2911 VanDerWaalsContact OG1-OD1 3.07Å; H2883-N2911 PolarHBondContact CE1-OD1 3.28Å; H2883-N2911 VanDerWaalsContact CE1-OD1 3.31Å; H2883-N2911 PolarHBondContact ND1-OD1 3.22Å; I2909-N2911 PolarHBondContact O-N 3.31Å
2912C93.8Very high90.9Very high37 Ų3758.9 Ų58.925%0.2532%0.318CS..EExtended strand (participates in β ladder)trans-109115.4-175.5-178.90000111T2872 K2910T2872-C2912 VanDerWaalsContact CG2-SG 3.57Å; K2910-C2912 VanDerWaalsContact C-N 3.28Å; K2910-C2912 PolarHBondContact O-N 3.23Å; K2910-C2912 VanDerWaalsContact O-N 3.17Å
2913L94.9Very high91Very high1 Ų153.4 Ų53.41%0.00528%0.281CS..EExtended strand (participates in β ladder)trans-90.4136.9169.5-70.674.7000108.9L2771 T2872 L2873 L2875 R2923 L2925 L2939L2771-L2913 HydrophobicContact CB-CD2 4.43Å; T2872-L2913 CarbonylContact C-O 3.55Å; T2872-L2913 VanDerWaalsContact CA-O 3.28Å; T2872-L2913 WeakPolarHBondContact CA-O 3.44Å; L2873-L2913 HydrophobicContact CB-CB 4.4Å; L2873-L2913 PolarHBondContact N-O 3.15Å; L2873-L2913 PolarHBondContact O-N 3.09Å; L2875-L2913 HydrophobicContact CD1-CD1 4.12Å; L2875-L2913 HydrophobicContact CD2-CD1 3.64Å; L2875-L2913 HydrophobicContact CG-CD1 3.81Å; L2913-R2923 HydrophobicContact CB-CB 4.44Å; L2913-R2923 HydrophobicContact CD2-CB 4.07Å; L2913-R2923 HydrophobicContact CD2-CG 4.46Å; L2913-L2925 HydrophobicContact CD1-CD1 4.16Å; L2913-L2925 HydrophobicContact CD2-CD1 4.13Å; L2913-L2925 HydrophobicContact CG-CD1 4.17Å; L2913-L2939 HydrophobicContact CD2-CD2 4.48Å
2914T94.5Very high91.1Very high60 Ų6053.5 Ų53.537%0.36828%0.279SS..EExtended strand (participates in β ladder)trans-102.3131.8178.2-44.70000110.3R2923 K2924T2914-R2923 WeakPolarHBondContact O-CA 3.49Å; T2914-K2924 PolarHBondContact N-O 3.05Å; T2914-K2924 PolarHBondContact O-N 3.37Å
2915F92.1Very high91.2Very high15.6667 Ų15.666752.5 Ų52.57%0.06927%0.273CS..EExtended strand (participates in β ladder)trans-75135.6171.9-70.4-99.6000110.1M2870 T2871 L2873 R2921 R2923M2870-F2915 HydrophobicContact CB-CE2 4.2Å; M2870-F2915 HydrophobicContact CB-CZ 4.31Å; M2870-F2915 HydrophobicContact CE-CE2 4.09Å; M2870-F2915 HydrophobicContact CE-CZ 3.8Å; M2870-F2915 HydrophobicContact SD-CZ 4.36Å; T2871-F2915 VanDerWaalsContact C-CD2 3.48Å; T2871-F2915 WeakPolarHBondContact O-CD2 3.28Å; T2871-F2915 PolarHBondContact O-N 3.16Å; L2873-F2915 HydrophobicContact CB-CE2 3.81Å; L2873-F2915 HydrophobicContact CB-CZ 4.24Å; L2873-F2915 HydrophobicContact CD1-CZ 4.44Å; F2915-R2921 HydrophobicContact CD1-CB 4.38Å; F2915-R2921 VanDerWaalsContact CD1-NH1 3.26Å; F2915-R2921 VanDerWaalsContact CD1-NH2 3.32Å; F2915-R2923 HydrophobicContact CD1-CG 4.38Å; F2915-R2923 HydrophobicContact CE1-CG 4.4Å; F2915-R2923 VanDerWaalsContact CE1-CZ 3.45Å; F2915-R2923 VanDerWaalsContact CE1-NH1 3.32Å
2916I89.8Confident91.2Very high55.3333 Ų55.333349.3 Ų49.328%0.28426%0.262SS..PPolyproline II helixtrans-88.3131.6169.3-57.2-87.4000108.8S2918 R2921 P2922 K2924 L2938 W2992I2916-S2918 VanDerWaalsContact C-N 3.32Å; I2916-S2918 PolarHBondContact O-N 3.37Å; I2916-R2921 WeakPolarHBondContact O-CA 3.4Å; I2916-P2922 HydrophobicContact CB-CG 4.14Å; I2916-P2922 WeakPolarHBondContact CB-O 3.46Å; I2916-P2922 WeakPolarHBondContact CG1-O 3.4Å; I2916-P2922 PolarHBondContact N-O 3.18Å; I2916-K2924 HydrophobicContact CD1-CB 4.31Å; I2916-L2938 HydrophobicContact CD1-CD1 3.51Å; I2916-L2938 HydrophobicContact CG1-CD1 4.11Å; I2916-W2992 HydrophobicContact CD1-CH2 4.3Å; I2916-W2992 HydrophobicContact CD1-CZ3 3.9Å
2917T83.8Confident91.2Very high147 Ų14749.3 Ų49.390%0.90226%0.262SS*.SBendtrans-73.183178.353.70000111.1
2918S83Confident91.2Very high58.3333 Ų58.333349.5 Ų49.541%0.40826%0.261SS..SBendtrans-143.1173.2171.178.60000110.2I2916 Q2920 R2921 P2922I2916-S2918 VanDerWaalsContact C-N 3.32Å; I2916-S2918 PolarHBondContact O-N 3.37Å; S2918-Q2920 VanDerWaalsContact C-N 3.3Å; S2918-Q2920 PolarHBondContact O-N 3.21Å; S2918-R2921 VanDerWaalsContact O-CG 3.26Å; S2918-R2921 WeakPolarHBondContact O-CG 3.33Å; S2918-R2921 PolarHBondContact O-N 3.02Å; S2918-R2921 VanDerWaalsContact O-N 3.11Å; S2918-R2921 PolarHBondContact OG-N 3.47Å; S2918-P2922 VanDerWaalsContact OG-CD 3.25Å; S2918-P2922 WeakPolarHBondContact OG-CD 3.35Å
2919K79.2Confident91.4Very high195.667 Ų195.66747.5 Ų47.585%0.85125%0.247SC*.THydrogen-bonded Turntrans-54-45.9-179.6-173.1-173.8175-168.60112.8R2921K2919-R2921 VanDerWaalsContact C-N 3.3Å; K2919-R2921 PolarHBondContact O-N 3.42Å
2920Q81.4Confident91.4Very high78.6667 Ų78.666749 Ų4937%0.36826%0.26SS..THydrogen-bonded Turntrans-84.61.1-178.5-57.3-62.538.600113.8S2918 P2922S2918-Q2920 VanDerWaalsContact C-N 3.3Å; S2918-Q2920 PolarHBondContact O-N 3.21Å; Q2920-P2922 VanDerWaalsContact C-N 3.32Å; Q2920-P2922 WeakPolarHBondContact O-CD 3.3Å
2921R88.9Confident91.4Very high31 Ų3147 Ų4712%0.11725%0.254CS..  trans3950.2178-54.9-176.771.1-109.1-4.3115.1E2777 V2867 M2870 F2915 I2916 S2918 K2919 R2923E2777-R2921 IonicContact OE1-CZ 2.96Å; E2777-R2921 IonicContact OE1-NH1 3.12Å; E2777-R2921 PolarHBondContact OE1-NH1 3.01Å; V2867-R2921 PolarHBondContact O-NE 3.26Å; V2867-R2921 PolarHBondContact O-NH1 2.85Å; V2867-R2921 PolarHBondContact O-NH2 3.39Å; M2870-R2921 PolarHBondContact O-NH2 3.01Å; F2915-R2921 HydrophobicContact CD1-CB 4.38Å; F2915-R2921 VanDerWaalsContact CD1-NH1 3.26Å; F2915-R2921 VanDerWaalsContact CD1-NH2 3.32Å; I2916-R2921 WeakPolarHBondContact O-CA 3.4Å; S2918-R2921 VanDerWaalsContact O-CG 3.26Å; S2918-R2921 WeakPolarHBondContact O-CG 3.33Å; S2918-R2921 PolarHBondContact O-N 3.02Å; S2918-R2921 VanDerWaalsContact O-N 3.11Å; S2918-R2921 PolarHBondContact OG-N 3.47Å; K2919-R2921 VanDerWaalsContact C-N 3.3Å; K2919-R2921 PolarHBondContact O-N 3.42Å; R2921-R2923 PolarHBondContact O-NH1 3.11Å
2922P92.4Very high91.4Very high7.66667 Ų7.6666747.5 Ų47.55%0.0527%0.271CS..  trans-69154.3-174.630.9-35.7000111.4I2916 S2918 Q2920 L2938 L2939 K2940I2916-P2922 HydrophobicContact CB-CG 4.14Å; I2916-P2922 WeakPolarHBondContact CB-O 3.46Å; I2916-P2922 WeakPolarHBondContact CG1-O 3.4Å; I2916-P2922 PolarHBondContact N-O 3.18Å; S2918-P2922 VanDerWaalsContact OG-CD 3.25Å; S2918-P2922 WeakPolarHBondContact OG-CD 3.35Å; Q2920-P2922 VanDerWaalsContact C-N 3.32Å; Q2920-P2922 WeakPolarHBondContact O-CD 3.3Å; P2922-L2938 HydrophobicContact CB-CD1 3.79Å; P2922-L2938 HydrophobicContact CB-CD2 4.32Å; P2922-L2938 HydrophobicContact CB-CG 3.92Å; P2922-L2938 HydrophobicContact CG-CD1 3.84Å; P2922-L2938 HydrophobicContact CG-CD2 4.31Å; P2922-L2938 HydrophobicContact CG-CG 4.27Å; P2922-L2939 WeakPolarHBondContact CA-O 3.34Å; P2922-L2939 WeakPolarHBondContact CB-O 3.47Å; P2922-K2940 HydrophobicContact CB-CG 4.15Å
2923R95Very high91.4Very high4 Ų451.7 Ų51.72%0.01529%0.286CS..EExtended strand (participates in β ladder)trans-100.2135.2-173.4-63.570.6153.7123.77.9110.8L2771 S2772 E2777 L2913 T2914 F2915 R2921 L2925 L2939L2771-R2923 PolarHBondContact O-NE 3.24Å; L2771-R2923 VanDerWaalsContact O-NE 3.16Å; S2772-R2923 PolarHBondContact O-NE 3.08Å; S2772-R2923 VanDerWaalsContact O-NE 3.14Å; S2772-R2923 PolarHBondContact O-NH1 3.15Å; S2772-R2923 PolarHBondContact O-NH2 3.22Å; E2777-R2923 VanDerWaalsContact CD-NH2 3.27Å; E2777-R2923 IonicContact OE1-CZ 3.35Å; E2777-R2923 IonicContact OE1-NH1 3.4Å; E2777-R2923 PolarHBondContact OE1-NH1 3.3Å; E2777-R2923 IonicContact OE1-NH2 3.19Å; E2777-R2923 PolarHBondContact OE1-NH2 3.39Å; E2777-R2923 IonicContact OE2-CZ 3.03Å; E2777-R2923 IonicContact OE2-NH1 3.05Å; E2777-R2923 PolarHBondContact OE2-NH1 3.12Å; E2777-R2923 IonicContact OE2-NH2 2.89Å; E2777-R2923 PolarHBondContact OE2-NH2 3.29Å; L2913-R2923 HydrophobicContact CB-CB 4.44Å; L2913-R2923 HydrophobicContact CD2-CB 4.07Å; L2913-R2923 HydrophobicContact CD2-CG 4.46Å; T2914-R2923 WeakPolarHBondContact O-CA 3.49Å; F2915-R2923 HydrophobicContact CD1-CG 4.38Å; F2915-R2923 HydrophobicContact CE1-CG 4.4Å; F2915-R2923 VanDerWaalsContact CE1-CZ 3.45Å; F2915-R2923 VanDerWaalsContact CE1-NH1 3.32Å; R2921-R2923 PolarHBondContact O-NH1 3.11Å; R2923-L2925 PolarHBondContact O-N 3.2Å; R2923-L2939 HydrophobicContact CB-CB 4.27Å; R2923-L2939 PolarHBondContact N-O 3.12Å; R2923-L2939 PolarHBondContact O-N 3.19Å
2924K95.8Very high91.4Very high72 Ų7258.4 Ų58.431%0.31332%0.318SS..EExtended strand (participates in β ladder)trans-84.4100.6171.2-170.4177.5-176.2177.60109.7T2914 I2916 V2936T2914-K2924 PolarHBondContact N-O 3.05Å; T2914-K2924 PolarHBondContact O-N 3.37Å; I2916-K2924 HydrophobicContact CD1-CB 4.31Å; K2924-V2936 HydrophobicContact CD-CG1 4.31Å; K2924-V2936 VanDerWaalsContact CE-CG1 3.46Å; K2924-V2936 HydrophobicContact CG-CG1 3.85Å
2925L95.5Very high91.4Very high0 Ų058.6 Ų58.60%031%0.312CS..EExtended strand (participates in β ladder)trans-85.5147.4173.4-178.567.2000109.9L2768 I2909 L2913 R2923 I2927 V2936 F2937 L2989L2768-L2925 HydrophobicContact CD1-CD2 4.44Å; L2768-L2925 HydrophobicContact CD2-CD1 4.35Å; L2768-L2925 HydrophobicContact CD2-CD2 3.68Å; I2909-L2925 HydrophobicContact CG2-CD1 3.73Å; L2913-L2925 HydrophobicContact CD1-CD1 4.16Å; L2913-L2925 HydrophobicContact CD2-CD1 4.13Å; L2913-L2925 HydrophobicContact CG-CD1 4.17Å; R2923-L2925 PolarHBondContact O-N 3.2Å; L2925-I2927 HydrophobicContact CD2-CD1 4.08Å; L2925-I2927 HydrophobicContact CD2-CG1 4.23Å; L2925-I2927 HydrophobicContact CG-CG1 4.22Å; L2925-V2936 CarbonylContact O-C 3.58Å; L2925-V2936 WeakPolarHBondContact O-CA 3.4Å; L2925-F2937 HydrophobicContact CB-CB 4.3Å; L2925-F2937 PolarHBondContact N-O 3.29Å; L2925-F2937 PolarHBondContact O-N 3.11Å; L2925-L2989 HydrophobicContact CD2-CD2 3.76Å
2926T95.7Very high91.6Very high15 Ų1559.6 Ų59.69%0.09232%0.319CS..EExtended strand (participates in β ladder)trans-136.8125.3172.7-570000109.9K2910 Q2934 Y2935 V2936K2910-T2926 WeakPolarHBondContact CB-O 3.37Å; K2910-T2926 PolarHBondContact N-O 3.22Å; T2926-Q2934 HydrophobicContact CG2-CB 4.12Å; T2926-Q2934 HydrophobicContact CG2-CG 4.39Å; T2926-Y2935 WeakPolarHBondContact CA-O 3.42Å; T2926-V2936 HydrophobicContact CG2-CG2 4.21Å
2927I94.8Very high92Very high0 Ų057.1 Ų57.10%031%0.306CS..EExtended strand (participates in β ladder)trans-116.2130.3-178.4-56.9-178.6000108.1V2893 P2894 I2906 I2909 L2925 Y2935 F2937V2893-I2927 HydrophobicContact CG1-CB 4.41Å; V2893-I2927 HydrophobicContact CG1-CG2 4.28Å; V2893-I2927 HydrophobicContact CG2-CG2 4.16Å; P2894-I2927 HydrophobicContact CG-CD1 4.33Å; I2906-I2927 HydrophobicContact CB-CG2 4.39Å; I2906-I2927 HydrophobicContact CG1-CG2 4.06Å; I2906-I2927 HydrophobicContact CG2-CG2 3.9Å; I2909-I2927 HydrophobicContact CG1-CG1 4.38Å; L2925-I2927 HydrophobicContact CD2-CD1 4.08Å; L2925-I2927 HydrophobicContact CD2-CG1 4.23Å; L2925-I2927 HydrophobicContact CG-CG1 4.22Å; I2927-Y2935 PolarHBondContact N-O 3.3Å; I2927-Y2935 PolarHBondContact O-N 3.15Å; I2927-F2937 HydrophobicContact CD1-CD2 4.04Å; I2927-F2937 HydrophobicContact CD1-CE2 3.93Å; I2927-F2937 HydrophobicContact CG1-CD2 4.32Å; I2927-F2937 HydrophobicContact CG1-CE2 4.38Å
2928T94.7Very high92.5Very high35.6667 Ų35.666751.6 Ų51.622%0.21927%0.271CS..EExtended strand (participates in β ladder)trans-87.9124.3171.8-46.10000108.6A2907 S2908A2907-T2928 HydrophobicContact CB-CG2 4.48Å; A2907-T2928 WeakPolarHBondContact CB-O 3.35Å; A2907-T2928 PolarHBondContact N-O 3.25Å; S2908-T2928 PolarHBondContact N-O 3.08Å; S2908-T2928 PolarHBondContact O-N 3.1Å; S2908-T2928 WeakPolarHBondContact OG-CB 3.31Å; S2908-T2928 PolarHBondContact OG-OG1 3.19Å; S2908-T2928 VanDerWaalsContact OG-OG1 3.08Å
2929G94.3Very high93.1Very high1 Ų148.8 Ų48.81%0.0125%0.252CS..EExtended strand (participates in β ladder)trans-80.4159.6173.500000112.4R2905 N2931 G2932 H2933R2905-G2929 CarbonylContact O-C 3.51Å; R2905-G2929 WeakPolarHBondContact O-CA 3.22Å; G2929-N2931 PolarHBondContact O-N 3.28Å; G2929-N2931 VanDerWaalsContact O-N 3.09Å; G2929-G2932 PolarHBondContact O-N 2.94Å; G2929-H2933 PolarHBondContact N-O 3.31Å
2930S94Very high93.7Very high56.6667 Ų56.666740.2 Ų40.240%0.39621%0.214SC..THydrogen-bonded Turntrans-63-8.3174630000114.3R2905 G2932R2905-S2930 PolarHBondContact N-OG 3.35Å; R2905-S2930 PolarHBondContact O-N 3.01Å; S2930-G2932 VanDerWaalsContact C-N 3.31Å
2931N93.6Very high93.8Very high67 Ų6736.6 Ų36.636%0.35820%0.198SC..THydrogen-bonded Turntrans-90.94.4170.761.8-1000113.5V2904 G2929 H2933 Y2935V2904-N2931 HydrophobicContact CG1-CB 4.45Å; V2904-N2931 HydrophobicContact CG2-CB 4.46Å; V2904-N2931 WeakPolarHBondContact CG2-ND2 3.49Å; G2929-N2931 PolarHBondContact O-N 3.28Å; G2929-N2931 VanDerWaalsContact O-N 3.09Å; N2931-H2933 VanDerWaalsContact C-N 3.26Å; N2931-H2933 PolarHBondContact O-N 3.08Å; N2931-H2933 PolarHBondContact OD1-N 3.14Å; N2931-H2933 VanDerWaalsContact OD1-N 3.1Å; N2931-Y2935 PolarHBondContact ND2-OH 3.03Å
2932G92.1Very high93.4Very high59 Ų5937.6 Ų37.661%0.60820%0.204SC*.SBendtrans78.3-4.1-178.200000115.2G2929 S2930G2929-G2932 PolarHBondContact O-N 2.94Å; S2930-G2932 VanDerWaalsContact C-N 3.31Å
2933H94.1Very high92.9Very high124 Ų12438.8 Ų38.857%0.57421%0.209SC*.  trans-82.3146.1177.7-68.9-63.1000112G2929 N2931 Y2935G2929-H2933 PolarHBondContact N-O 3.31Å; N2931-H2933 VanDerWaalsContact C-N 3.26Å; N2931-H2933 PolarHBondContact O-N 3.08Å; N2931-H2933 PolarHBondContact OD1-N 3.14Å; N2931-H2933 VanDerWaalsContact OD1-N 3.1Å; H2933-Y2935 HydrophobicContact CB-CE2 4.02Å; H2933-Y2935 WeakPolarHBondContact O-CD2 3.41Å
2934Q94.5Very high92.3Very high143 Ų14339.7 Ų39.767%0.66821%0.214SC*.EExtended strand (participates in β ladder)trans-91.7122.8175-67.7-176.73.800110.7T2926T2926-Q2934 HydrophobicContact CG2-CB 4.12Å; T2926-Q2934 HydrophobicContact CG2-CG 4.39Å
2935Y95.6Very high91.9Very high64.3333 Ų64.333336.3 Ų36.325%0.25220%0.199SC..EExtended strand (participates in β ladder)trans-103.1115.9175.1-64.6-97.6000108.6V2893 V2904 T2926 I2927 N2931 H2933V2893-Y2935 HydrophobicContact CG1-CD1 4.07Å; V2893-Y2935 HydrophobicContact CG1-CD2 3.99Å; V2893-Y2935 HydrophobicContact CG1-CG 3.67Å; V2893-Y2935 HydrophobicContact CG2-CD2 4.3Å; V2893-Y2935 HydrophobicContact CG2-CE2 4.39Å; V2904-Y2935 HydrophobicContact CG1-CE2 3.96Å; T2926-Y2935 WeakPolarHBondContact CA-O 3.42Å; I2927-Y2935 PolarHBondContact N-O 3.3Å; I2927-Y2935 PolarHBondContact O-N 3.15Å; N2931-Y2935 PolarHBondContact ND2-OH 3.03Å; H2933-Y2935 HydrophobicContact CB-CE2 4.02Å; H2933-Y2935 WeakPolarHBondContact O-CD2 3.41Å
2936V96.2Very high91.3Very high35.6667 Ų35.666736.8 Ų36.822%0.21620%0.201CC..EExtended strand (participates in β ladder)trans-99.3135.7-177.9-178.40000108.8K2924 L2925 T2926 W2992K2924-V2936 HydrophobicContact CD-CG1 4.31Å; K2924-V2936 VanDerWaalsContact CE-CG1 3.46Å; K2924-V2936 HydrophobicContact CG-CG1 3.85Å; L2925-V2936 CarbonylContact O-C 3.58Å; L2925-V2936 WeakPolarHBondContact O-CA 3.4Å; T2926-V2936 HydrophobicContact CG2-CG2 4.21Å; V2936-W2992 HydrophobicContact CB-CB 3.7Å; V2936-W2992 HydrophobicContact CB-CG 4.11Å; V2936-W2992 HydrophobicContact CG1-CB 3.61Å; V2936-W2992 HydrophobicContact CG1-CD2 4.15Å; V2936-W2992 HydrophobicContact CG1-CE3 4.47Å; V2936-W2992 HydrophobicContact CG1-CG 3.74Å; V2936-W2992 WeakPolarHBondContact O-CB 3.33Å; V2936-W2992 PolarHBondContact O-N 3.12Å
2937F96.6Very high90.8Very high4 Ų436.9 Ų36.92%0.01820%0.201CC..EExtended strand (participates in β ladder)trans-129.1150177.5-63.8-91.3000110.5V2893 P2894 L2925 I2927 I2981 L2989 I2990V2893-F2937 HydrophobicContact CG1-CE2 3.99Å; V2893-F2937 HydrophobicContact CG1-CZ 4.06Å; P2894-F2937 HydrophobicContact CB-CE1 4.24Å; P2894-F2937 HydrophobicContact CB-CZ 4.11Å; P2894-F2937 HydrophobicContact CG-CZ 4.44Å; P2894-F2937 WeakPolarHBondContact O-CE1 3.32Å; P2894-F2937 VanDerWaalsContact O-CZ 3.27Å; P2894-F2937 WeakPolarHBondContact O-CZ 3.39Å; L2925-F2937 HydrophobicContact CB-CB 4.3Å; L2925-F2937 PolarHBondContact N-O 3.29Å; L2925-F2937 PolarHBondContact O-N 3.11Å; I2927-F2937 HydrophobicContact CD1-CD2 4.04Å; I2927-F2937 HydrophobicContact CD1-CE2 3.93Å; I2927-F2937 HydrophobicContact CG1-CD2 4.32Å; I2927-F2937 HydrophobicContact CG1-CE2 4.38Å; F2937-I2981 HydrophobicContact CE1-CD1 4.11Å; F2937-L2989 HydrophobicContact CB-CD2 4.05Å; F2937-L2989 HydrophobicContact CD1-CB 4.16Å; F2937-I2990 CarbonylContact C-O 3.57Å; F2937-I2990 WeakPolarHBondContact CA-O 3.35Å
2938L95.1Very high90.5Very high30 Ų3037.1 Ų37.116%0.15720%0.202CC..EExtended strand (participates in β ladder)trans-96110164.8-168.974.1000107.7I2916 P2922 K2940 I2990 W2992I2916-L2938 HydrophobicContact CD1-CD1 3.51Å; I2916-L2938 HydrophobicContact CG1-CD1 4.11Å; P2922-L2938 HydrophobicContact CB-CD1 3.79Å; P2922-L2938 HydrophobicContact CB-CD2 4.32Å; P2922-L2938 HydrophobicContact CB-CG 3.92Å; P2922-L2938 HydrophobicContact CG-CD1 3.84Å; P2922-L2938 HydrophobicContact CG-CD2 4.31Å; P2922-L2938 HydrophobicContact CG-CG 4.27Å; L2938-K2940 HydrophobicContact CD2-CG 4.17Å; L2938-K2940 HydrophobicContact CG-CG 4.4Å; L2938-K2940 PolarHBondContact O-N 2.87Å; L2938-I2990 HydrophobicContact CB-CB 4.36Å; L2938-I2990 PolarHBondContact N-O 3.38Å; L2938-I2990 PolarHBondContact O-N 3.08Å; L2938-W2992 HydrophobicContact CD1-CZ3 4.45Å
2939L95.7Very high90.2Very high0 Ų037 Ų370%020%0.199CC..EExtended strand (participates in β ladder)trans-84.8108.8171.7176.465.3000108L2768 L2771 L2913 P2922 R2923 L2983 L2989L2768-L2939 HydrophobicContact CB-CD1 4.47Å; L2768-L2939 HydrophobicContact CD2-CD2 4.41Å; L2771-L2939 HydrophobicContact CB-CD2 4.05Å; L2913-L2939 HydrophobicContact CD2-CD2 4.48Å; P2922-L2939 WeakPolarHBondContact CA-O 3.34Å; P2922-L2939 WeakPolarHBondContact CB-O 3.47Å; R2923-L2939 HydrophobicContact CB-CB 4.27Å; R2923-L2939 PolarHBondContact N-O 3.12Å; R2923-L2939 PolarHBondContact O-N 3.19Å; L2939-L2983 HydrophobicContact CD1-CD1 3.97Å; L2939-L2989 HydrophobicContact CB-CD2 4.05Å; L2939-L2989 HydrophobicContact CD1-CD2 3.79Å; L2939-L2989 HydrophobicContact CD1-CG 4.46Å; L2939-L2989 HydrophobicContact CG-CD2 4.44Å
2940K91.3Very high89.7Confident16 Ų1637.3 Ų37.37%0.0720%0.2CC..EExtended strand (participates in β ladder)trans-94.9137.1173.7-71.3-161.8172.5-168.40110P2922 L2938 E2943 T2987 G2988 I2990 D3110P2922-K2940 HydrophobicContact CB-CG 4.15Å; L2938-K2940 HydrophobicContact CD2-CG 4.17Å; L2938-K2940 HydrophobicContact CG-CG 4.4Å; L2938-K2940 PolarHBondContact O-N 2.87Å; K2940-E2943 HydrophobicContact CB-CB 4.49Å; K2940-E2943 HydrophobicContact CD-CB 4.38Å; K2940-E2943 HydrophobicContact CD-CG 4.48Å; K2940-E2943 WeakPolarHBondContact CD-OE1 3.4Å; K2940-E2943 VanDerWaalsContact CD-OE2 3.27Å; K2940-E2943 WeakPolarHBondContact CD-OE2 3.21Å; K2940-E2943 WeakPolarHBondContact CE-OE1 3.44Å; K2940-E2943 WeakPolarHBondContact CE-OE2 3.43Å; K2940-E2943 IonicContact NZ-OE1 3.4Å; K2940-E2943 PolarHBondContact NZ-OE1 3.07Å; K2940-E2943 IonicContact NZ-OE2 3.12Å; K2940-E2943 PolarHBondContact NZ-OE2 3.17Å; K2940-T2987 WeakPolarHBondContact O-CA 3.42Å; K2940-G2988 PolarHBondContact N-O 3Å; K2940-G2988 PolarHBondContact O-N 3.16Å; K2940-G2988 VanDerWaalsContact O-N 3.11Å; K2940-I2990 HydrophobicContact CD-CD1 3.81Å; K2940-I2990 HydrophobicContact CG-CD1 4.24Å; K2940-D3110 IonicContact NZ-OD2 3.68Å; K2940-D3110 PolarHBondContact NZ-OD2 2.83Å
2941G84.5Confident89.5Confident3 Ų334.7 Ų34.73%0.03118%0.181CC..EExtended strand (participates in β ladder)trans-110.9167161.100000109.9E2943 Y2986G2941-E2943 PolarHBondContact O-N 3.13Å; G2941-Y2986 CarbonylContact C-O 3.37Å; G2941-Y2986 VanDerWaalsContact C-O 3.31Å; G2941-Y2986 WeakPolarHBondContact CA-O 3.28Å
2942H79.6Confident89.4Confident51.6667 Ų51.666732 Ų3224%0.23917%0.167CC..SBendtrans59.624.7-177.6-57.8-98.6000114.7I2773 E2781 Y2986 W3322I2773-H2942 VanDerWaalsContact CD1-CD2 3.49Å; I2773-H2942 WeakPolarHBondContact CD1-CD2 3.42Å; I2773-H2942 WeakPolarHBondContact CD1-CE1 3.44Å; I2773-H2942 WeakPolarHBondContact CD1-NE2 3.34Å; I2773-H2942 WeakPolarHBondContact CG1-NE2 3.46Å; I2773-H2942 WeakPolarHBondContact CG2-NE2 3.42Å; E2781-H2942 VanDerWaalsContact CD-ND1 3.26Å; E2781-H2942 IonicContact OE1-CE1 3.35Å; E2781-H2942 PolarHBondContact OE1-CE1 3.3Å; E2781-H2942 IonicContact OE1-CG 3.6Å; E2781-H2942 IonicContact OE1-ND1 3.46Å; E2781-H2942 PolarHBondContact OE1-ND1 2.91Å; E2781-H2942 IonicContact OE2-CD2 2.74Å; E2781-H2942 IonicContact OE2-CE1 3.27Å; E2781-H2942 PolarHBondContact OE2-CE1 3.2Å; E2781-H2942 IonicContact OE2-CG 3.1Å; E2781-H2942 IonicContact OE2-ND1 3.08Å; E2781-H2942 PolarHBondContact OE2-ND1 2.9Å; E2781-H2942 VanDerWaalsContact OE2-ND1 3.11Å; E2781-H2942 IonicContact OE2-NE2 3.26Å; E2781-H2942 PolarHBondContact OE2-NE2 3.42Å; H2942-Y2986 CarbonylContact C-O 3.51Å; H2942-Y2986 WeakPolarHBondContact CA-O 3.36Å; H2942-Y2986 PolarHBondContact N-O 3.25Å; H2942-W3322 AromaticContact CE1-CH2 3.24Å; H2942-W3322 WeakPolarHBondContact CE1-CH2 3.25Å; H2942-W3322 AromaticContact CE1-CZ3 3.2Å; H2942-W3322 WeakPolarHBondContact CE1-CZ3 3.49Å; H2942-W3322 AromaticContact NE2-CH2 3.66Å; H2942-W3322 AromaticContact NE2-CZ3 3.28Å; H2942-W3322 VanDerWaalsContact NE2-CZ3 3.28Å; H2942-W3322 WeakPolarHBondContact NE2-CZ3 3.4Å
2943E81.5Confident89Confident33.6667 Ų33.666731 Ų3116%0.15715%0.146CC..SBendtrans-145.6132.7-175.9-156178.2114.500112.5K2940 G2941 T2945 Y2986 T2987K2940-E2943 HydrophobicContact CB-CB 4.49Å; K2940-E2943 HydrophobicContact CD-CB 4.38Å; K2940-E2943 HydrophobicContact CD-CG 4.48Å; K2940-E2943 WeakPolarHBondContact CD-OE1 3.4Å; K2940-E2943 VanDerWaalsContact CD-OE2 3.27Å; K2940-E2943 WeakPolarHBondContact CD-OE2 3.21Å; K2940-E2943 WeakPolarHBondContact CE-OE1 3.44Å; K2940-E2943 WeakPolarHBondContact CE-OE2 3.43Å; K2940-E2943 IonicContact NZ-OE1 3.4Å; K2940-E2943 PolarHBondContact NZ-OE1 3.07Å; K2940-E2943 IonicContact NZ-OE2 3.12Å; K2940-E2943 PolarHBondContact NZ-OE2 3.17Å; G2941-E2943 PolarHBondContact O-N 3.13Å; E2943-T2945 PolarHBondContact O-N 3.12Å; E2943-T2945 VanDerWaalsContact O-N 3.09Å; E2943-Y2986 PolarHBondContact N-O 3.13Å; E2943-Y2986 VanDerWaalsContact N-O 3.12Å; E2943-Y2986 CarbonylContact O-C 3.59Å; E2943-Y2986 WeakPolarHBondContact O-CA 3.44Å; E2943-T2987 PolarHBondContact O-N 3.01Å
2944D82.6Confident88.8Confident23 Ų2325.1 Ų25.112%0.12312%0.119CC..  trans-8587.2177.6-175.75000111.6R2946 Q2947 T2985 Q3181 W3182D2944-R2946 VanDerWaalsContact CG-NE 3.33Å; D2944-R2946 VanDerWaalsContact CG-NH2 3.3Å; D2944-R2946 PolarHBondContact O-N 3.13Å; D2944-R2946 VanDerWaalsContact O-N 3.14Å; D2944-R2946 VanDerWaalsContact OD1-CB 3.25Å; D2944-R2946 WeakPolarHBondContact OD1-CB 3.42Å; D2944-R2946 VanDerWaalsContact OD1-CG 3.27Å; D2944-R2946 WeakPolarHBondContact OD1-CG 3.31Å; D2944-R2946 IonicContact OD1-CZ 2.9Å; D2944-R2946 PolarHBondContact OD1-N 3.08Å; D2944-R2946 VanDerWaalsContact OD1-N 3.11Å; D2944-R2946 IonicContact OD1-NE 3.14Å; D2944-R2946 PolarHBondContact OD1-NE 3.07Å; D2944-R2946 IonicContact OD1-NH2 3.35Å; D2944-R2946 PolarHBondContact OD1-NH2 2.88Å; D2944-R2946 IonicContact OD2-CZ 3.03Å; D2944-R2946 VanDerWaalsContact OD2-CZ 3.31Å; D2944-R2946 IonicContact OD2-NE 3.05Å; D2944-R2946 PolarHBondContact OD2-NE 3.06Å; D2944-R2946 VanDerWaalsContact OD2-NE 3.12Å; D2944-R2946 IonicContact OD2-NH2 3.18Å; D2944-R2946 PolarHBondContact OD2-NH2 3.18Å; D2944-Q2947 PolarHBondContact O-N 3.3Å; D2944-T2985 VanDerWaalsContact CB-O 3.31Å; D2944-T2985 WeakPolarHBondContact CB-O 3.39Å; D2944-Q3181 WeakPolarHBondContact OD2-CB 3.35Å; D2944-Q3181 PolarHBondContact OD2-N 3.14Å; D2944-W3182 HydrophobicContact CB-CZ2 3.68Å; D2944-W3182 PolarHBondContact OD2-NE1 3.03Å; D2944-W3182 VanDerWaalsContact OD2-NE1 3.12Å
2945T87.6Confident88.7Confident0 Ų018.4 Ų18.40%09%0.087CC..THydrogen-bonded Turntrans-69.92.5-179.767.80000114.5E2943 Q2947 D2948 E2949 V2980 P2982 G2988 I2990E2943-T2945 PolarHBondContact O-N 3.12Å; E2943-T2945 VanDerWaalsContact O-N 3.09Å; T2945-Q2947 VanDerWaalsContact C-N 3.27Å; T2945-Q2947 PolarHBondContact O-N 3.18Å; T2945-D2948 PolarHBondContact O-N 3.3Å; T2945-E2949 PolarHBondContact O-N 3.36Å; T2945-E2949 VanDerWaalsContact O-N 3.11Å; T2945-V2980 VanDerWaalsContact O-CG1 3.29Å; T2945-V2980 WeakPolarHBondContact O-CG1 3.39Å; T2945-P2982 WeakPolarHBondContact OG1-CA 3.41Å; T2945-P2982 WeakPolarHBondContact OG1-CB 3.42Å; T2945-G2988 WeakPolarHBondContact OG1-CA 3.4Å; T2945-I2990 HydrophobicContact CG2-CD1 4.24Å; T2945-I2990 HydrophobicContact CG2-CG1 4.35Å
2946R83.9Confident88.4Confident9.66667 Ų9.6666715.8 Ų15.84%0.0368%0.08CC..Hα-helixtrans-65-33174.9-67.2173.2-66.3-163.23.1111.3L2729 D2944 E2949 R2950 P2982 T2985 L3179 L3180L2729-R2946 HydrophobicContact CD2-CG 4.4Å; D2944-R2946 VanDerWaalsContact CG-NE 3.33Å; D2944-R2946 VanDerWaalsContact CG-NH2 3.3Å; D2944-R2946 PolarHBondContact O-N 3.13Å; D2944-R2946 VanDerWaalsContact O-N 3.14Å; D2944-R2946 VanDerWaalsContact OD1-CB 3.25Å; D2944-R2946 WeakPolarHBondContact OD1-CB 3.42Å; D2944-R2946 VanDerWaalsContact OD1-CG 3.27Å; D2944-R2946 WeakPolarHBondContact OD1-CG 3.31Å; D2944-R2946 IonicContact OD1-CZ 2.9Å; D2944-R2946 PolarHBondContact OD1-N 3.08Å; D2944-R2946 VanDerWaalsContact OD1-N 3.11Å; D2944-R2946 IonicContact OD1-NE 3.14Å; D2944-R2946 PolarHBondContact OD1-NE 3.07Å; D2944-R2946 IonicContact OD1-NH2 3.35Å; D2944-R2946 PolarHBondContact OD1-NH2 2.88Å; D2944-R2946 IonicContact OD2-CZ 3.03Å; D2944-R2946 VanDerWaalsContact OD2-CZ 3.31Å; D2944-R2946 IonicContact OD2-NE 3.05Å; D2944-R2946 PolarHBondContact OD2-NE 3.06Å; D2944-R2946 VanDerWaalsContact OD2-NE 3.12Å; D2944-R2946 IonicContact OD2-NH2 3.18Å; D2944-R2946 PolarHBondContact OD2-NH2 3.18Å; R2946-E2949 WeakPolarHBondContact O-CB 3.48Å; R2946-E2949 PolarHBondContact O-N 3.12Å; R2946-R2950 VanDerWaalsContact O-CG 3.32Å; R2946-R2950 WeakPolarHBondContact O-CG 3.38Å; R2946-R2950 PolarHBondContact O-N 3.16Å; R2946-R2950 VanDerWaalsContact O-N 3.08Å; R2946-P2982 HydrophobicContact CB-CG 4.38Å; R2946-P2982 HydrophobicContact CG-CB 3.7Å; R2946-P2982 HydrophobicContact CG-CG 3.72Å; R2946-T2985 VanDerWaalsContact NH1-CG2 3.35Å; R2946-L3179 PolarHBondContact NH1-O 3.23Å; R2946-L3179 PolarHBondContact NH2-O 3.42Å; R2946-L3180 HydrophobicContact CB-CD2 3.79Å; R2946-L3180 HydrophobicContact CB-CG 4.45Å
2947Q84.2Confident88Confident16.6667 Ų16.666714.2 Ų14.28%0.0787%0.071CC..Hα-helixtrans-61.1-50.5175.9-177.4162.3-4300110.8D2944 T2945 E2949 R2950 I2951 F3111 G3112 L3180D2944-Q2947 PolarHBondContact O-N 3.3Å; T2945-Q2947 VanDerWaalsContact C-N 3.27Å; T2945-Q2947 PolarHBondContact O-N 3.18Å; Q2947-E2949 VanDerWaalsContact C-N 3.33Å; Q2947-E2949 PolarHBondContact O-N 3.04Å; Q2947-R2950 PolarHBondContact O-N 3.25Å; Q2947-I2951 HydrophobicContact CG-CD1 3.82Å; Q2947-I2951 WeakPolarHBondContact O-CD1 3.28Å; Q2947-I2951 VanDerWaalsContact O-CG1 3.27Å; Q2947-I2951 WeakPolarHBondContact O-CG1 3.28Å; Q2947-I2951 PolarHBondContact O-N 3.24Å; Q2947-F3111 PolarHBondContact NE2-O 3.11Å; Q2947-G3112 PolarHBondContact NE2-O 3.1Å; Q2947-L3180 HydrophobicContact CB-CD2 4.02Å
2948D89.3Confident87.8Confident5 Ų514.1 Ų14.13%0.0277%0.07CC..Hα-helixtrans-58.5-40.9174.8-58.5-113.7000112.1T2945 R2950 I2951 M2952 V2980 F3111T2945-D2948 PolarHBondContact O-N 3.3Å; D2948-R2950 PolarHBondContact O-N 3.37Å; D2948-I2951 PolarHBondContact O-N 3.25Å; D2948-M2952 VanDerWaalsContact O-CG 3.31Å; D2948-M2952 WeakPolarHBondContact O-CG 3.21Å; D2948-M2952 PolarHBondContact O-N 2.84Å; D2948-V2980 HydrophobicContact CB-CG1 4.1Å; D2948-V2980 HydrophobicContact CB-CG2 4.1Å; D2948-F3111 WeakPolarHBondContact OD1-CB 3.36Å; D2948-F3111 WeakPolarHBondContact OD1-CD2 3.41Å; D2948-F3111 PolarHBondContact OD1-N 3.11Å; D2948-F3111 VanDerWaalsContact OD1-N 3.13Å
2949E87.7Confident87.7Confident33.6667 Ų33.666713.5 Ų13.516%0.1577%0.067CC..Hα-helixtrans-58.6-50.3175.7-171.1-164.2-17400111.8Q2691 T2945 R2946 Q2947 I2951 M2952 Q2953 V2980 P2982Q2691-E2949 PolarHBondContact NE2-OE1 3.07Å; Q2691-E2949 PolarHBondContact NE2-OE2 3.06Å; T2945-E2949 PolarHBondContact O-N 3.36Å; T2945-E2949 VanDerWaalsContact O-N 3.11Å; R2946-E2949 WeakPolarHBondContact O-CB 3.48Å; R2946-E2949 PolarHBondContact O-N 3.12Å; Q2947-E2949 VanDerWaalsContact C-N 3.33Å; Q2947-E2949 PolarHBondContact O-N 3.04Å; E2949-I2951 VanDerWaalsContact C-N 3.32Å; E2949-I2951 PolarHBondContact O-N 3.02Å; E2949-M2952 PolarHBondContact O-N 3.24Å; E2949-M2952 VanDerWaalsContact O-N 3.14Å; E2949-Q2953 PolarHBondContact O-N 3.05Å; E2949-V2980 HydrophobicContact CB-CB 4.21Å; E2949-V2980 HydrophobicContact CB-CG1 4.04Å; E2949-P2982 HydrophobicContact CB-CG 4.11Å; E2949-P2982 HydrophobicContact CG-CG 4.45Å; E2949-P2982 WeakPolarHBondContact OE2-CG 3.39Å
2950R83.7Confident87.2Confident8.33333 Ų8.3333316.6 Ų16.63%0.0319%0.086CC..Hα-helixtrans-64.6-33.4179.4-59.5-45.3-176.1139.4-2.4111.9Q2691 R2946 Q2947 D2948 M2952 Q2953 F2954 F3174 D3177 L3180Q2691-R2950 VanDerWaalsContact CB-NH1 3.29Å; Q2691-R2950 PolarHBondContact O-NH1 3.08Å; Q2691-R2950 PolarHBondContact O-NH2 3.25Å; Q2691-R2950 VanDerWaalsContact O-NH2 3.12Å; R2946-R2950 VanDerWaalsContact O-CG 3.32Å; R2946-R2950 WeakPolarHBondContact O-CG 3.38Å; R2946-R2950 PolarHBondContact O-N 3.16Å; R2946-R2950 VanDerWaalsContact O-N 3.08Å; Q2947-R2950 PolarHBondContact O-N 3.25Å; D2948-R2950 PolarHBondContact O-N 3.37Å; R2950-M2952 VanDerWaalsContact C-N 3.34Å; R2950-Q2953 WeakPolarHBondContact O-CB 3.3Å; R2950-Q2953 PolarHBondContact O-N 3.13Å; R2950-F2954 PolarHBondContact O-N 3Å; R2950-F3174 HydrophobicContact CB-CD1 4.28Å; R2950-F3174 HydrophobicContact CB-CD2 4.33Å; R2950-F3174 HydrophobicContact CB-CE1 3.48Å; R2950-F3174 HydrophobicContact CB-CE2 3.56Å; R2950-F3174 VanDerWaalsContact CB-CE2 3.43Å; R2950-F3174 HydrophobicContact CB-CZ 3.1Å; R2950-F3174 HydrophobicContact CG-CD1 4.35Å; R2950-F3174 HydrophobicContact CG-CD2 4.48Å; R2950-F3174 HydrophobicContact CG-CE1 4.09Å; R2950-F3174 HydrophobicContact CG-CE2 4.16Å; R2950-F3174 HydrophobicContact CG-CZ 4.07Å; R2950-D3177 IonicContact CZ-OD2 3.73Å; R2950-D3177 IonicContact NH2-OD2 3.54Å; R2950-D3177 PolarHBondContact NH2-OD2 3.36Å; R2950-L3180 HydrophobicContact CG-CD1 3.99Å
2951I89.5Confident87.1Confident0 Ų016.4 Ų16.40%09%0.086CC..Hα-helixtrans-69.5-37.8175.5-68.7166.3000111.1Q2947 D2948 E2949 Q2953 F2954 F2955 L3087 F3111 C3114 F3174Q2947-I2951 HydrophobicContact CG-CD1 3.82Å; Q2947-I2951 WeakPolarHBondContact O-CD1 3.28Å; Q2947-I2951 VanDerWaalsContact O-CG1 3.27Å; Q2947-I2951 WeakPolarHBondContact O-CG1 3.28Å; Q2947-I2951 PolarHBondContact O-N 3.24Å; D2948-I2951 PolarHBondContact O-N 3.25Å; E2949-I2951 VanDerWaalsContact C-N 3.32Å; E2949-I2951 PolarHBondContact O-N 3.02Å; I2951-Q2953 VanDerWaalsContact C-N 3.29Å; I2951-Q2953 PolarHBondContact O-N 3.19Å; I2951-F2954 WeakPolarHBondContact O-CB 3.43Å; I2951-F2954 PolarHBondContact O-N 3.12Å; I2951-F2955 HydrophobicContact CG2-CD1 4.43Å; I2951-F2955 HydrophobicContact CG2-CD2 4.17Å; I2951-F2955 HydrophobicContact CG2-CE1 3.88Å; I2951-F2955 HydrophobicContact CG2-CE2 3.59Å; I2951-F2955 HydrophobicContact CG2-CZ 3.42Å; I2951-F2955 VanDerWaalsContact CG2-CZ 3.44Å; I2951-F2955 VanDerWaalsContact O-CG 3.3Å; I2951-F2955 WeakPolarHBondContact O-CG 3.46Å; I2951-F2955 PolarHBondContact O-N 3.06Å; I2951-L3087 HydrophobicContact CD1-CD2 4.14Å; I2951-L3087 HydrophobicContact CG1-CD1 4.45Å; I2951-L3087 HydrophobicContact CG1-CD2 4.07Å; I2951-L3087 HydrophobicContact CG2-CD2 3.93Å; I2951-F3111 HydrophobicContact CD1-CB 3.59Å; I2951-F3111 VanDerWaalsContact CD1-CB 3.47Å; I2951-F3111 HydrophobicContact CD1-CD1 4.27Å; I2951-F3111 HydrophobicContact CD1-CG 4.24Å; I2951-F3111 HydrophobicContact CG2-CD1 3.86Å; I2951-F3111 HydrophobicContact CG2-CE1 4.19Å; I2951-F3111 HydrophobicContact CG2-CG 4.15Å; I2951-C3114 HydrophobicContact CD1-CB 4.24Å; I2951-C3114 WeakPolarHBondContact CD1-SG 3.46Å; I2951-F3174 HydrophobicContact CG1-CZ 4.29Å
2952M91.2Very high87.5Confident12 Ų1216.3 Ų16.36%0.0599%0.085CC..Hα-helixtrans-66.6-29.3171.9-67.3-61.3146.900112.9D2948 E2949 R2950 F2955 G2956 R2977 M2978 V2980 F3111D2948-M2952 VanDerWaalsContact O-CG 3.31Å; D2948-M2952 WeakPolarHBondContact O-CG 3.21Å; D2948-M2952 PolarHBondContact O-N 2.84Å; E2949-M2952 PolarHBondContact O-N 3.24Å; E2949-M2952 VanDerWaalsContact O-N 3.14Å; R2950-M2952 VanDerWaalsContact C-N 3.34Å; M2952-F2955 HydrophobicContact CE-CD2 4.2Å; M2952-F2955 HydrophobicContact CE-CE2 4.16Å; M2952-F2955 HydrophobicContact SD-CD2 4.06Å; M2952-G2956 PolarHBondContact O-N 3.17Å; M2952-G2956 VanDerWaalsContact O-N 3.16Å; M2952-R2977 WeakPolarHBondContact O-CD 3.4Å; M2952-R2977 PolarHBondContact O-NH1 3.3Å; M2952-R2977 VanDerWaalsContact O-NH1 3.15Å; M2952-R2977 HydrophobicContact SD-CB 3.97Å; M2952-R2977 HydrophobicContact SD-CG 4.32Å; M2952-M2978 HydrophobicContact CE-CE 3.83Å; M2952-M2978 HydrophobicContact CE-CG 3.86Å; M2952-M2978 HydrophobicContact CE-SD 4.12Å; M2952-M2978 HydrophobicContact CG-CG 4.47Å; M2952-M2978 WeakPolarHBondContact CG-O 3.39Å; M2952-M2978 HydrophobicContact SD-CG 4.03Å; M2952-M2978 PolarHBondContact SD-N 2.85Å; M2952-V2980 HydrophobicContact CG-CG2 3.95Å; M2952-F3111 HydrophobicContact CE-CD2 3.96Å; M2952-F3111 HydrophobicContact CE-CE2 3.3Å; M2952-F3111 HydrophobicContact CE-CZ 3.84Å
2953Q85.6Confident88Confident37 Ų3717.9 Ų17.917%0.1739%0.094CC..Hα-helixtrans-69.2-45.1169.1-135.6-176.81900111.5L2688 Q2691 E2949 R2950 I2951 F2955 G2956 L2957L2688-Q2953 PolarHBondContact O-NE2 3.18Å; Q2691-Q2953 VanDerWaalsContact CB-NE2 3.28Å; Q2691-Q2953 VanDerWaalsContact CG-NE2 3.28Å; E2949-Q2953 PolarHBondContact O-N 3.05Å; R2950-Q2953 WeakPolarHBondContact O-CB 3.3Å; R2950-Q2953 PolarHBondContact O-N 3.13Å; I2951-Q2953 VanDerWaalsContact C-N 3.29Å; I2951-Q2953 PolarHBondContact O-N 3.19Å; Q2953-F2955 VanDerWaalsContact C-N 3.34Å; Q2953-F2955 PolarHBondContact O-N 3.46Å; Q2953-G2956 CarbonylContact O-C 3.55Å; Q2953-G2956 VanDerWaalsContact O-CA 3.29Å; Q2953-G2956 WeakPolarHBondContact O-CA 3.35Å; Q2953-G2956 PolarHBondContact O-N 3.08Å; Q2953-L2957 PolarHBondContact O-N 3.21Å; Q2953-L2957 VanDerWaalsContact O-N 3.1Å
2954F89Confident88.2Confident0.666667 Ų0.66666721.9 Ų21.90%0.00312%0.117CC..Hα-helixtrans-58.9-45.9175.1177.9-103.5000111.9R2950 I2951 G2956 L2957 V2958 V3083 I3086 L3167 V3170 L3171R2950-F2954 PolarHBondContact O-N 3Å; I2951-F2954 WeakPolarHBondContact O-CB 3.43Å; I2951-F2954 PolarHBondContact O-N 3.12Å; F2954-G2956 VanDerWaalsContact C-N 3.26Å; F2954-G2956 PolarHBondContact O-N 2.96Å; F2954-L2957 WeakPolarHBondContact O-CB 3.29Å; F2954-L2957 PolarHBondContact O-N 3.13Å; F2954-L2957 VanDerWaalsContact O-N 3.14Å; F2954-V2958 HydrophobicContact CD1-CG2 4.44Å; F2954-V2958 HydrophobicContact CE1-CG2 4.14Å; F2954-V2958 HydrophobicContact CZ-CG2 4.25Å; F2954-V2958 WeakPolarHBondContact O-CG2 3.37Å; F2954-V2958 PolarHBondContact O-N 3.27Å; F2954-V3083 HydrophobicContact CD1-CG1 4.48Å; F2954-V3083 HydrophobicContact CE1-CG1 3.84Å; F2954-I3086 HydrophobicContact CZ-CG2 4.35Å; F2954-L3167 HydrophobicContact CD2-CD2 4.39Å; F2954-L3167 HydrophobicContact CE2-CB 4.05Å; F2954-L3167 HydrophobicContact CE2-CD2 3.65Å; F2954-L3167 HydrophobicContact CE2-CG 4.4Å; F2954-L3167 HydrophobicContact CZ-CD2 4.07Å; F2954-V3170 HydrophobicContact CB-CG1 4.29Å; F2954-V3170 HydrophobicContact CD2-CG1 4.44Å; F2954-L3171 HydrophobicContact CD2-CD1 4.26Å; F2954-L3171 HydrophobicContact CD2-CD2 3.85Å; F2954-L3171 HydrophobicContact CD2-CG 3.92Å; F2954-L3171 HydrophobicContact CE2-CD1 3.77Å; F2954-L3171 HydrophobicContact CE2-CD2 4.17Å; F2954-L3171 HydrophobicContact CE2-CG 3.94Å; F2954-L3171 HydrophobicContact CG-CD2 4.31Å; F2954-L3171 HydrophobicContact CZ-CD1 4.38Å
2955F92.6Very high88.4Confident1.66667 Ų1.6666723 Ų231%0.00712%0.123CC..Hα-helixtrans-63.3-28.5172-63.4-16000112.7I2951 M2952 Q2953 V2958 N2959 I2975 R2977 M3080 V3083 L3087 F3111I2951-F2955 HydrophobicContact CG2-CD1 4.43Å; I2951-F2955 HydrophobicContact CG2-CD2 4.17Å; I2951-F2955 HydrophobicContact CG2-CE1 3.88Å; I2951-F2955 HydrophobicContact CG2-CE2 3.59Å; I2951-F2955 HydrophobicContact CG2-CZ 3.42Å; I2951-F2955 VanDerWaalsContact CG2-CZ 3.44Å; I2951-F2955 VanDerWaalsContact O-CG 3.3Å; I2951-F2955 WeakPolarHBondContact O-CG 3.46Å; I2951-F2955 PolarHBondContact O-N 3.06Å; M2952-F2955 HydrophobicContact CE-CD2 4.2Å; M2952-F2955 HydrophobicContact CE-CE2 4.16Å; M2952-F2955 HydrophobicContact SD-CD2 4.06Å; Q2953-F2955 VanDerWaalsContact C-N 3.34Å; Q2953-F2955 PolarHBondContact O-N 3.46Å; F2955-V2958 PolarHBondContact O-N 3.11Å; F2955-N2959 VanDerWaalsContact O-CB 3.3Å; F2955-N2959 WeakPolarHBondContact O-CB 3.38Å; F2955-N2959 VanDerWaalsContact O-CG 3.29Å; F2955-N2959 PolarHBondContact O-N 3.29Å; F2955-N2959 PolarHBondContact O-ND2 3.39Å; F2955-I2975 HydrophobicContact CB-CB 4.37Å; F2955-I2975 HydrophobicContact CB-CD1 4.13Å; F2955-I2975 HydrophobicContact CB-CG2 4Å; F2955-I2975 HydrophobicContact CD1-CD1 3.74Å; F2955-I2975 HydrophobicContact CD1-CG2 4.37Å; F2955-I2975 HydrophobicContact CD2-CG2 3.65Å; F2955-I2975 HydrophobicContact CE1-CD1 4.35Å; F2955-I2975 HydrophobicContact CE2-CG2 4.18Å; F2955-I2975 HydrophobicContact CG-CB 4.48Å; F2955-I2975 HydrophobicContact CG-CD1 4Å; F2955-I2975 HydrophobicContact CG-CG2 3.76Å; F2955-R2977 HydrophobicContact CB-CG 4Å; F2955-M3080 HydrophobicContact CE1-CE 4.4Å; F2955-M3080 HydrophobicContact CE2-CE 4.21Å; F2955-M3080 HydrophobicContact CZ-CE 3.78Å; F2955-M3080 HydrophobicContact CZ-SD 4.3Å; F2955-V3083 HydrophobicContact CD1-CG1 3.99Å; F2955-V3083 HydrophobicContact CE1-CG1 3.71Å; F2955-L3087 HydrophobicContact CE1-CD2 4.32Å; F2955-L3087 HydrophobicContact CZ-CD2 4.44Å; F2955-F3111 AromaticContact CE2-CE1 3.74Å; F2955-F3111 HydrophobicContact CE2-CE1 3.74Å; F2955-F3111 AromaticContact CE2-CZ 3.73Å; F2955-F3111 HydrophobicContact CE2-CZ 3.73Å; F2955-F3111 HydrophobicContact CZ-CD1 4.43Å; F2955-F3111 AromaticContact CZ-CE1 3.75Å; F2955-F3111 HydrophobicContact CZ-CE1 3.75Å; F2955-F3111 HydrophobicContact CZ-CZ 4.23Å
2956G89.2Confident88.2Confident10 Ų1027.9 Ų27.910%0.10315%0.154CC..Hα-helixtrans-62.6-46.4170.700000112.4M2952 Q2953 F2954 N2959 T2960 R2977M2952-G2956 PolarHBondContact O-N 3.17Å; M2952-G2956 VanDerWaalsContact O-N 3.16Å; Q2953-G2956 CarbonylContact O-C 3.55Å; Q2953-G2956 VanDerWaalsContact O-CA 3.29Å; Q2953-G2956 WeakPolarHBondContact O-CA 3.35Å; Q2953-G2956 PolarHBondContact O-N 3.08Å; F2954-G2956 VanDerWaalsContact C-N 3.26Å; F2954-G2956 PolarHBondContact O-N 2.96Å; G2956-N2959 PolarHBondContact O-N 3.36Å; G2956-T2960 PolarHBondContact O-N 3.08Å; G2956-T2960 PolarHBondContact O-OG1 3.08Å; G2956-R2977 VanDerWaalsContact CA-NH1 3.34Å
2957L87.1Confident88.4Confident2.66667 Ų2.6666732.6 Ų32.61%0.01418%0.176CC..Hα-helixtrans-61-49.8172.8174.958.6000110.9L2651 Q2652 Q2953 F2954 N2959 T2960 L2961 S3166 L3167 V3170L2651-L2957 HydrophobicContact CB-CD1 4.4Å; L2651-L2957 HydrophobicContact CD2-CB 3.82Å; L2651-L2957 HydrophobicContact CD2-CD1 3.95Å; L2651-L2957 HydrophobicContact CD2-CG 4.33Å; L2651-L2957 HydrophobicContact CG-CD1 4.25Å; Q2652-L2957 HydrophobicContact CG-CD1 4.41Å; Q2953-L2957 PolarHBondContact O-N 3.21Å; Q2953-L2957 VanDerWaalsContact O-N 3.1Å; F2954-L2957 WeakPolarHBondContact O-CB 3.29Å; F2954-L2957 PolarHBondContact O-N 3.13Å; F2954-L2957 VanDerWaalsContact O-N 3.14Å; L2957-N2959 VanDerWaalsContact C-N 3.32Å; L2957-N2959 PolarHBondContact O-N 2.82Å; L2957-T2960 CarbonylContact O-C 3.49Å; L2957-T2960 WeakPolarHBondContact O-CA 3.23Å; L2957-T2960 VanDerWaalsContact O-CB 3.25Å; L2957-T2960 WeakPolarHBondContact O-CB 3.4Å; L2957-T2960 PolarHBondContact O-N 3Å; L2957-T2960 VanDerWaalsContact O-N 3.08Å; L2957-L2961 HydrophobicContact CD1-CD1 4.42Å; L2957-L2961 HydrophobicContact CD1-CD2 4.28Å; L2957-L2961 HydrophobicContact CD1-CG 4.23Å; L2957-L2961 HydrophobicContact CG-CD1 4.39Å; L2957-L2961 HydrophobicContact CG-CG 4.46Å; L2957-L2961 WeakPolarHBondContact O-CG 3.38Å; L2957-L2961 PolarHBondContact O-N 3.35Å; L2957-S3166 VanDerWaalsContact CD2-O 3.23Å; L2957-S3166 WeakPolarHBondContact CD2-O 3.4Å; L2957-L3167 HydrophobicContact CD2-CD2 3.92Å; L2957-L3167 HydrophobicContact CG-CD2 4.27Å; L2957-V3170 HydrophobicContact CB-CG2 4.46Å; L2957-V3170 HydrophobicContact CD2-CB 4.43Å; L2957-V3170 HydrophobicContact CD2-CG2 3.55Å
2958V92.6Very high88.7Confident0.666667 Ų0.66666731.8 Ų31.80%0.00417%0.173CC..Hα-helixtrans-59-42.7-179.7175.50000111.5F2954 F2955 T2960 L2961 L2962 I2975 V3083 L3160 L3167F2954-V2958 HydrophobicContact CD1-CG2 4.44Å; F2954-V2958 HydrophobicContact CE1-CG2 4.14Å; F2954-V2958 HydrophobicContact CZ-CG2 4.25Å; F2954-V2958 WeakPolarHBondContact O-CG2 3.37Å; F2954-V2958 PolarHBondContact O-N 3.27Å; F2955-V2958 PolarHBondContact O-N 3.11Å; V2958-T2960 VanDerWaalsContact C-N 3.32Å; V2958-T2960 PolarHBondContact O-N 3.15Å; V2958-L2961 WeakPolarHBondContact O-CB 3.44Å; V2958-L2961 PolarHBondContact O-N 3.36Å; V2958-L2961 VanDerWaalsContact O-N 3.15Å; V2958-L2962 HydrophobicContact CG1-CD1 3.85Å; V2958-L2962 HydrophobicContact CG1-CG 4.28Å; V2958-L2962 VanDerWaalsContact O-CG 3.3Å; V2958-L2962 WeakPolarHBondContact O-CG 3.32Å; V2958-L2962 PolarHBondContact O-N 3.21Å; V2958-I2975 HydrophobicContact CB-CD1 4.04Å; V2958-I2975 HydrophobicContact CG1-CD1 3.72Å; V2958-V3083 HydrophobicContact CG1-CG2 3.99Å; V2958-L3160 HydrophobicContact CG1-CD2 4.23Å; V2958-L3160 HydrophobicContact CG2-CD2 4Å; V2958-L3167 HydrophobicContact CG2-CD2 3.85Å
2959N92.4Very high88.7Confident18.6667 Ų18.666735.9 Ų35.910%0.119%0.194CC..Hα-helixtrans-60.8-39.8173.6-79.6-17.7000112.5F2955 G2956 L2957 L2961 L2962 I2963 T2974 I2975F2955-N2959 VanDerWaalsContact O-CB 3.3Å; F2955-N2959 WeakPolarHBondContact O-CB 3.38Å; F2955-N2959 VanDerWaalsContact O-CG 3.29Å; F2955-N2959 PolarHBondContact O-N 3.29Å; F2955-N2959 PolarHBondContact O-ND2 3.39Å; G2956-N2959 PolarHBondContact O-N 3.36Å; L2957-N2959 VanDerWaalsContact C-N 3.32Å; L2957-N2959 PolarHBondContact O-N 2.82Å; N2959-L2961 VanDerWaalsContact C-N 3.31Å; N2959-L2961 PolarHBondContact O-N 2.89Å; N2959-L2962 PolarHBondContact O-N 3.08Å; N2959-I2963 WeakPolarHBondContact O-CB 3.28Å; N2959-I2963 WeakPolarHBondContact O-CD1 3.42Å; N2959-I2963 VanDerWaalsContact O-CG1 3.26Å; N2959-I2963 WeakPolarHBondContact O-CG1 3.42Å; N2959-I2963 PolarHBondContact O-N 3.37Å; N2959-T2974 WeakPolarHBondContact OD1-CA 3.42Å; N2959-I2975 PolarHBondContact ND2-O 3.04Å; N2959-I2975 WeakPolarHBondContact OD1-CB 3.27Å; N2959-I2975 PolarHBondContact OD1-N 3.02Å
2960T86.9Confident88.6Confident64.6667 Ų64.666743.7 Ų43.740%0.39722%0.222SC..Hα-helixtrans-62.4-40.7175.1-56.50000111.3G2956 L2957 V2958 I2963 N2964G2956-T2960 PolarHBondContact O-N 3.08Å; G2956-T2960 PolarHBondContact O-OG1 3.08Å; L2957-T2960 CarbonylContact O-C 3.49Å; L2957-T2960 WeakPolarHBondContact O-CA 3.23Å; L2957-T2960 VanDerWaalsContact O-CB 3.25Å; L2957-T2960 WeakPolarHBondContact O-CB 3.4Å; L2957-T2960 PolarHBondContact O-N 3Å; L2957-T2960 VanDerWaalsContact O-N 3.08Å; V2958-T2960 VanDerWaalsContact C-N 3.32Å; V2958-T2960 PolarHBondContact O-N 3.15Å; T2960-I2963 PolarHBondContact O-N 3.06Å; T2960-N2964 VanDerWaalsContact O-CB 3.3Å; T2960-N2964 WeakPolarHBondContact O-CB 3.36Å; T2960-N2964 PolarHBondContact O-N 2.99Å; T2960-N2964 VanDerWaalsContact O-N 3.08Å; T2960-N2964 PolarHBondContact O-ND2 2.99Å; T2960-N2964 VanDerWaalsContact O-ND2 3.17Å
2961L89.2Confident88.9Confident12 Ų1245.3 Ų45.36%0.06323%0.228CC..Hα-helixtrans-65.2-43.8175-60.3177.6000111.9Q2652 L2957 V2958 N2959 I2963 N2964 N2965 L3159 N3163 L3167Q2652-L2961 VanDerWaalsContact NE2-CD2 3.34Å; L2957-L2961 HydrophobicContact CD1-CD1 4.42Å; L2957-L2961 HydrophobicContact CD1-CD2 4.28Å; L2957-L2961 HydrophobicContact CD1-CG 4.23Å; L2957-L2961 HydrophobicContact CG-CD1 4.39Å; L2957-L2961 HydrophobicContact CG-CG 4.46Å; L2957-L2961 WeakPolarHBondContact O-CG 3.38Å; L2957-L2961 PolarHBondContact O-N 3.35Å; V2958-L2961 WeakPolarHBondContact O-CB 3.44Å; V2958-L2961 PolarHBondContact O-N 3.36Å; V2958-L2961 VanDerWaalsContact O-N 3.15Å; N2959-L2961 VanDerWaalsContact C-N 3.31Å; N2959-L2961 PolarHBondContact O-N 2.89Å; L2961-I2963 VanDerWaalsContact C-N 3.32Å; L2961-I2963 PolarHBondContact O-N 3.38Å; L2961-N2964 PolarHBondContact O-N 3.02Å; L2961-N2965 PolarHBondContact O-N 3.1Å; L2961-L3159 HydrophobicContact CB-CD1 4.37Å; L2961-L3159 HydrophobicContact CB-CD2 4.04Å; L2961-L3159 HydrophobicContact CB-CG 4.29Å; L2961-N3163 HydrophobicContact CD1-CB 3.67Å; L2961-N3163 HydrophobicContact CD2-CB 4.25Å; L2961-L3167 HydrophobicContact CD1-CD2 4.1Å; L2961-L3167 HydrophobicContact CD1-CG 4.49Å
2962L92Very high89Confident1.33333 Ų1.3333349.9 Ų49.91%0.00725%0.253CS..Hα-helixtrans-66.4-31.3179.1-69.8167000112.9V2958 N2959 T2968 L2969 L2973 T3079 V3156 L3159V2958-L2962 HydrophobicContact CG1-CD1 3.85Å; V2958-L2962 HydrophobicContact CG1-CG 4.28Å; V2958-L2962 VanDerWaalsContact O-CG 3.3Å; V2958-L2962 WeakPolarHBondContact O-CG 3.32Å; V2958-L2962 PolarHBondContact O-N 3.21Å; N2959-L2962 PolarHBondContact O-N 3.08Å; L2962-T2968 HydrophobicContact CD2-CG2 3.96Å; L2962-T2968 WeakPolarHBondContact O-CB 3.38Å; L2962-T2968 PolarHBondContact O-OG1 3.2Å; L2962-L2969 PolarHBondContact O-N 3.25Å; L2962-L2973 WeakPolarHBondContact CB-O 3.34Å; L2962-L2973 HydrophobicContact CD1-CB 4.45Å; L2962-L2973 HydrophobicContact CD2-CB 4.08Å; L2962-L2973 HydrophobicContact CD2-CD1 4.4Å; L2962-T3079 HydrophobicContact CD1-CG2 4Å; L2962-V3156 HydrophobicContact CD2-CG2 4.21Å; L2962-L3159 HydrophobicContact CB-CD2 4.49Å; L2962-L3159 HydrophobicContact CD2-CD2 3.56Å; L2962-L3159 HydrophobicContact CG-CD2 4.01Å
2963I89.9Confident89.1Confident85 Ų8549.5 Ų49.544%0.43625%0.251SS..Hα-helixtrans-78.5-36.9176-70.1165.4000111N2959 T2960 L2961 N2965 L2969N2959-I2963 WeakPolarHBondContact O-CB 3.28Å; N2959-I2963 WeakPolarHBondContact O-CD1 3.42Å; N2959-I2963 VanDerWaalsContact O-CG1 3.26Å; N2959-I2963 WeakPolarHBondContact O-CG1 3.42Å; N2959-I2963 PolarHBondContact O-N 3.37Å; T2960-I2963 PolarHBondContact O-N 3.06Å; L2961-I2963 VanDerWaalsContact C-N 3.32Å; L2961-I2963 PolarHBondContact O-N 3.38Å; I2963-N2965 VanDerWaalsContact C-N 3.31Å; I2963-N2965 PolarHBondContact O-N 3.25Å; I2963-L2969 HydrophobicContact CG2-CD1 4.31Å
2964N85.1Confident89.6Confident117.667 Ų117.66749.4 Ų49.463%0.62925%0.253SS*.Hα-helixtrans-73.6-21-179.4-72.8-18.4000113.7T2960 L2961 P2966T2960-N2964 VanDerWaalsContact O-CB 3.3Å; T2960-N2964 WeakPolarHBondContact O-CB 3.36Å; T2960-N2964 PolarHBondContact O-N 2.99Å; T2960-N2964 VanDerWaalsContact O-N 3.08Å; T2960-N2964 PolarHBondContact O-ND2 2.99Å; T2960-N2964 VanDerWaalsContact O-ND2 3.17Å; L2961-N2964 PolarHBondContact O-N 3.02Å; N2964-P2966 WeakPolarHBondContact O-CD 3.31Å
2965N87.3Confident89.9Confident46.6667 Ų46.666749.8 Ų49.825%0.2526%0.255CS..SBendtrans-88121.9172.7175-41.4000110.2L2961 I2963 E2967 T2968 L2969 L3159L2961-N2965 PolarHBondContact O-N 3.1Å; I2963-N2965 VanDerWaalsContact C-N 3.31Å; I2963-N2965 PolarHBondContact O-N 3.25Å; N2965-E2967 VanDerWaalsContact C-N 3.31Å; N2965-E2967 PolarHBondContact O-N 3.24Å; N2965-E2967 WeakPolarHBondContact OD1-CB 3.2Å; N2965-E2967 PolarHBondContact OD1-N 3.15Å; N2965-T2968 VanDerWaalsContact CB-OG1 3.28Å; N2965-T2968 WeakPolarHBondContact CB-OG1 3.31Å; N2965-T2968 PolarHBondContact O-N 3.28Å; N2965-T2968 PolarHBondContact O-OG1 3.06Å; N2965-T2968 PolarHBondContact OD1-N 3.12Å; N2965-L2969 VanDerWaalsContact O-CB 3.29Å; N2965-L2969 WeakPolarHBondContact O-CB 3.32Å; N2965-L2969 PolarHBondContact O-N 3.09Å; N2965-L3159 HydrophobicContact CB-CD1 3.92Å
2966P84.4Confident89.9Confident101 Ų10153.6 Ų53.666%0.65627%0.272SS*.Hα-helixtrans-61.7-31.6-176.5-25.134.7000115N2964 R2970N2964-P2966 WeakPolarHBondContact O-CD 3.31Å; P2966-R2970 WeakPolarHBondContact O-CB 3.42Å; P2966-R2970 PolarHBondContact O-N 2.96Å
2967E87.2Confident90.1Very high109.333 Ų109.33359.2 Ų59.251%0.51129%0.29SS..Hα-helixtrans-75.2-36.5-176.6-93.2-174166.500112.2N2965 R2971 M3155N2965-E2967 VanDerWaalsContact C-N 3.31Å; N2965-E2967 PolarHBondContact O-N 3.24Å; N2965-E2967 WeakPolarHBondContact OD1-CB 3.2Å; N2965-E2967 PolarHBondContact OD1-N 3.15Å; E2967-R2971 WeakPolarHBondContact O-CD 3.34Å; E2967-R2971 WeakPolarHBondContact O-CG 3.37Å; E2967-R2971 PolarHBondContact O-NH1 3.19Å; E2967-R2971 IonicContact OE1-CZ 3.05Å; E2967-R2971 VanDerWaalsContact OE1-CZ 3.22Å; E2967-R2971 IonicContact OE1-NH1 3.74Å; E2967-R2971 PolarHBondContact OE1-NH1 3.09Å; E2967-R2971 IonicContact OE1-NH2 3.08Å; E2967-R2971 PolarHBondContact OE1-NH2 3.32Å; E2967-M3155 HydrophobicContact CB-SD 4.32Å; E2967-M3155 HydrophobicContact CG-CE 3.69Å; E2967-M3155 HydrophobicContact CG-SD 3.9Å; E2967-M3155 VanDerWaalsContact OE1-CE 3.25Å; E2967-M3155 WeakPolarHBondContact OE1-CE 3.19Å
2968T90.9Very high90.4Very high0 Ų060.3 Ų60.30%030%0.296CS..Hα-helixtrans-77.7-35.2174.650.30000111.4L2962 N2965 R2971 N2972 L2973 M3155 L3159L2962-T2968 HydrophobicContact CD2-CG2 3.96Å; L2962-T2968 WeakPolarHBondContact O-CB 3.38Å; L2962-T2968 PolarHBondContact O-OG1 3.2Å; N2965-T2968 VanDerWaalsContact CB-OG1 3.28Å; N2965-T2968 WeakPolarHBondContact CB-OG1 3.31Å; N2965-T2968 PolarHBondContact O-N 3.28Å; N2965-T2968 PolarHBondContact O-OG1 3.06Å; N2965-T2968 PolarHBondContact OD1-N 3.12Å; T2968-R2971 CarbonylContact O-C 3.58Å; T2968-R2971 PolarHBondContact O-N 3.03Å; T2968-R2971 VanDerWaalsContact O-N 3.15Å; T2968-N2972 PolarHBondContact O-N 3.01Å; T2968-L2973 HydrophobicContact CG2-CD1 3.87Å; T2968-L2973 PolarHBondContact O-N 3.22Å; T2968-M3155 HydrophobicContact CG2-CG 3.64Å; T2968-M3155 HydrophobicContact CG2-SD 3.57Å; T2968-M3155 VanDerWaalsContact CG2-SD 3.57Å; T2968-L3159 HydrophobicContact CG2-CD2 4.4Å
2969L89.2Confident90.4Very high91 Ų9162.1 Ų62.148%0.47631%0.309SS..Hα-helixtrans-61.6-47.9173.118063.4000111.7L2962 I2963 N2965 R2971 N2972L2962-L2969 PolarHBondContact O-N 3.25Å; I2963-L2969 HydrophobicContact CG2-CD1 4.31Å; N2965-L2969 VanDerWaalsContact O-CB 3.29Å; N2965-L2969 WeakPolarHBondContact O-CB 3.32Å; N2965-L2969 PolarHBondContact O-N 3.09Å; L2969-R2971 PolarHBondContact O-N 3.23Å; L2969-R2971 VanDerWaalsContact O-N 3.11Å; L2969-N2972 PolarHBondContact O-N 3.15Å; L2969-N2972 PolarHBondContact O-OD1 3.2Å
2970R86.1Confident90.5Very high197.667 Ų197.66761.9 Ų61.975%0.74631%0.308SS*.Hα-helixtrans-56.4-25.2176.3-174.1175.8152.2179-1.2112.8P2966P2966-R2970 WeakPolarHBondContact O-CB 3.42Å; P2966-R2970 PolarHBondContact O-N 2.96Å
2971R89.2Confident90.8Very high41 Ų4159.5 Ų59.516%0.15529%0.293CS..THydrogen-bonded Turntrans-97.82.1-180-69172.9175.693.6-9.8113.9E2018 E2967 T2968 L2969 L2973 R3075 H3151E2018-R2971 IonicContact OE1-CZ 2.78Å; E2018-R2971 VanDerWaalsContact OE1-CZ 3.22Å; E2018-R2971 IonicContact OE1-NE 3.37Å; E2018-R2971 PolarHBondContact OE1-NE 3.47Å; E2018-R2971 IonicContact OE1-NH2 2.74Å; E2018-R2971 PolarHBondContact OE1-NH2 3.02Å; E2967-R2971 WeakPolarHBondContact O-CD 3.34Å; E2967-R2971 WeakPolarHBondContact O-CG 3.37Å; E2967-R2971 PolarHBondContact O-NH1 3.19Å; E2967-R2971 IonicContact OE1-CZ 3.05Å; E2967-R2971 VanDerWaalsContact OE1-CZ 3.22Å; E2967-R2971 IonicContact OE1-NH1 3.74Å; E2967-R2971 PolarHBondContact OE1-NH1 3.09Å; E2967-R2971 IonicContact OE1-NH2 3.08Å; E2967-R2971 PolarHBondContact OE1-NH2 3.32Å; T2968-R2971 CarbonylContact O-C 3.58Å; T2968-R2971 PolarHBondContact O-N 3.03Å; T2968-R2971 VanDerWaalsContact O-N 3.15Å; L2969-R2971 PolarHBondContact O-N 3.23Å; L2969-R2971 VanDerWaalsContact O-N 3.11Å; R2971-L2973 VanDerWaalsContact C-N 3.27Å; R2971-L2973 HydrophobicContact CB-CD2 4.14Å; R2971-L2973 HydrophobicContact CB-CG 4Å; R2971-L2973 PolarHBondContact O-N 3.19Å; R2971-R3075 WeakPolarHBondContact O-CD 3.29Å; R2971-R3075 PolarHBondContact O-NH1 2.83Å; R2971-H3151 PolarHBondContact NH2-NE2 3.19Å; R2971-H3151 VanDerWaalsContact NH2-NE2 3.2Å
2972N91.1Very high90.9Very high96.6667 Ų96.666759.2 Ų59.252%0.51729%0.291SS..THydrogen-bonded Turntrans53.638.8-178.4-139.4-8.2000113.4T2968 L2969 T2974 K3105T2968-N2972 PolarHBondContact O-N 3.01Å; L2969-N2972 PolarHBondContact O-N 3.15Å; L2969-N2972 PolarHBondContact O-OD1 3.2Å; N2972-T2974 PolarHBondContact O-N 3.15Å; N2972-T2974 PolarHBondContact O-OG1 3.33Å; N2972-K3105 PolarHBondContact O-NZ 3.32Å; N2972-K3105 PolarHBondContact OD1-NZ 2.71Å
2973L94.4Very high90.8Very high4.66667 Ų4.6666759.2 Ų59.22%0.02429%0.291CS..  trans-72.6114.4177.8-58-171000110.1L2962 T2968 R2971 R3075 T3152 M3155 V3156L2962-L2973 WeakPolarHBondContact CB-O 3.34Å; L2962-L2973 HydrophobicContact CD1-CB 4.45Å; L2962-L2973 HydrophobicContact CD2-CB 4.08Å; L2962-L2973 HydrophobicContact CD2-CD1 4.4Å; T2968-L2973 HydrophobicContact CG2-CD1 3.87Å; T2968-L2973 PolarHBondContact O-N 3.22Å; R2971-L2973 VanDerWaalsContact C-N 3.27Å; R2971-L2973 HydrophobicContact CB-CD2 4.14Å; R2971-L2973 HydrophobicContact CB-CG 4Å; R2971-L2973 PolarHBondContact O-N 3.19Å; L2973-R3075 HydrophobicContact CD2-CB 3.74Å; L2973-R3075 HydrophobicContact CD2-CG 4Å; L2973-T3152 HydrophobicContact CD1-CG2 3.88Å; L2973-T3152 HydrophobicContact CD2-CG2 3.88Å; L2973-M3155 HydrophobicContact CD1-CE 3.92Å; L2973-M3155 HydrophobicContact CD1-SD 4.42Å; L2973-V3156 HydrophobicContact CD1-CG2 3.97Å
2974T94.7Very high90.6Very high35 Ų3555.4 Ų55.422%0.21527%0.272CS..  trans-149.6141.4178.658.20000110.1N2959 N2972 K3105N2959-T2974 WeakPolarHBondContact OD1-CA 3.42Å; N2972-T2974 PolarHBondContact O-N 3.15Å; N2972-T2974 PolarHBondContact O-OG1 3.33Å; T2974-K3105 PolarHBondContact OG1-NZ 3.29Å
2975I95.9Very high90.5Very high7.66667 Ų7.6666750.8 Ų50.84%0.03925%0.249CC..  trans-82.3128.5167-57.7171.5000108.4F2955 V2958 N2959 R2977 T3079 M3080 V3083F2955-I2975 HydrophobicContact CB-CB 4.37Å; F2955-I2975 HydrophobicContact CB-CD1 4.13Å; F2955-I2975 HydrophobicContact CB-CG2 4Å; F2955-I2975 HydrophobicContact CD1-CD1 3.74Å; F2955-I2975 HydrophobicContact CD1-CG2 4.37Å; F2955-I2975 HydrophobicContact CD2-CG2 3.65Å; F2955-I2975 HydrophobicContact CE1-CD1 4.35Å; F2955-I2975 HydrophobicContact CE2-CG2 4.18Å; F2955-I2975 HydrophobicContact CG-CB 4.48Å; F2955-I2975 HydrophobicContact CG-CD1 4Å; F2955-I2975 HydrophobicContact CG-CG2 3.76Å; V2958-I2975 HydrophobicContact CB-CD1 4.04Å; V2958-I2975 HydrophobicContact CG1-CD1 3.72Å; N2959-I2975 PolarHBondContact ND2-O 3.04Å; N2959-I2975 WeakPolarHBondContact OD1-CB 3.27Å; N2959-I2975 PolarHBondContact OD1-N 3.02Å; I2975-R2977 PolarHBondContact O-N 3.28Å; I2975-T3079 HydrophobicContact CG1-CG2 4.02Å; I2975-M3080 HydrophobicContact CB-SD 4.27Å; I2975-M3080 HydrophobicContact CD1-SD 4.17Å; I2975-M3080 HydrophobicContact CG1-SD 3.91Å; I2975-M3080 HydrophobicContact CG2-SD 3.52Å; I2975-M3080 VanDerWaalsContact CG2-SD 3.56Å; I2975-M3080 WeakPolarHBondContact CG2-SD 3.45Å; I2975-V3083 HydrophobicContact CD1-CB 4.34Å; I2975-V3083 HydrophobicContact CD1-CG1 3.93Å; I2975-V3083 HydrophobicContact CD1-CG2 4.05Å
2976Q93.3Very high90.2Very high81.3333 Ų81.333352.1 Ų52.138%0.3825%0.251SS..  trans-71125.9170.9-144.534.528.400109.5K3105 V3107Q2976-K3105 HydrophobicContact CG-CB 4.21Å; Q2976-V3107 HydrophobicContact CB-CB 4.43Å; Q2976-V3107 HydrophobicContact CB-CG1 4.13Å; Q2976-V3107 HydrophobicContact CB-CG2 3.76Å; Q2976-V3107 HydrophobicContact CG-CG1 4.21Å; Q2976-V3107 HydrophobicContact CG-CG2 3.82Å
2977R93.1Very high90.5Very high127.667 Ų127.66747.3 Ų47.348%0.48222%0.219SC..  trans-110156.8179.1-57.2-170-59.9154.60.8110.8M2952 F2955 G2956 I2975M2952-R2977 WeakPolarHBondContact O-CD 3.4Å; M2952-R2977 PolarHBondContact O-NH1 3.3Å; M2952-R2977 VanDerWaalsContact O-NH1 3.15Å; M2952-R2977 HydrophobicContact SD-CB 3.97Å; M2952-R2977 HydrophobicContact SD-CG 4.32Å; F2955-R2977 HydrophobicContact CB-CG 4Å; G2956-R2977 VanDerWaalsContact CA-NH1 3.34Å; I2975-R2977 PolarHBondContact O-N 3.28Å
2978M93Very high90.7Very high26 Ų2642.1 Ų42.113%0.12820%0.195CC..  trans-123.3156.117062.4-153.143.400109.8M2952 V2980 I2990 G2991 V2993 V3107 I3109M2952-M2978 HydrophobicContact CE-CE 3.83Å; M2952-M2978 HydrophobicContact CE-CG 3.86Å; M2952-M2978 HydrophobicContact CE-SD 4.12Å; M2952-M2978 HydrophobicContact CG-CG 4.47Å; M2952-M2978 WeakPolarHBondContact CG-O 3.39Å; M2952-M2978 HydrophobicContact SD-CG 4.03Å; M2952-M2978 PolarHBondContact SD-N 2.85Å; M2978-V2980 HydrophobicContact CG-CG2 4.19Å; M2978-I2990 HydrophobicContact CE-CG2 3.44Å; M2978-I2990 VanDerWaalsContact CE-CG2 3.44Å; M2978-I2990 HydrophobicContact CG-CG2 4.21Å; M2978-I2990 HydrophobicContact SD-CG2 3.75Å; M2978-I2990 VanDerWaalsContact SD-CG2 3.55Å; M2978-G2991 VanDerWaalsContact CE-O 3.27Å; M2978-G2991 WeakPolarHBondContact CE-O 3.44Å; M2978-V2993 HydrophobicContact CB-CG2 4.34Å; M2978-V2993 HydrophobicContact CE-CG2 3.89Å; M2978-V3107 HydrophobicContact CE-CG1 3.88Å; M2978-I3109 HydrophobicContact CE-CG2 3.86Å; M2978-I3109 HydrophobicContact SD-CG2 4.44Å
2979S92.9Very high90.9Very high39.3333 Ų39.333342.1 Ų42.128%0.27520%0.195SC..  trans-71.6133.7170.252.40000109.3I2990 G2991S2979-I2990 CarbonylContact O-C 3.52Å; S2979-I2990 WeakPolarHBondContact O-CA 3.32Å; S2979-G2991 PolarHBondContact O-N 3.1Å; S2979-G2991 WeakPolarHBondContact OG-CA 3.38Å
2980V94.1Very high91.2Very high15 Ų1538.5 Ų38.59%0.09118%0.176CC..EExtended strand (participates in β ladder)trans-127.4127.5171.4-179.10000107.2T2945 D2948 E2949 M2952 M2978 L2989 I2990T2945-V2980 VanDerWaalsContact O-CG1 3.29Å; T2945-V2980 WeakPolarHBondContact O-CG1 3.39Å; D2948-V2980 HydrophobicContact CB-CG1 4.1Å; D2948-V2980 HydrophobicContact CB-CG2 4.1Å; E2949-V2980 HydrophobicContact CB-CB 4.21Å; E2949-V2980 HydrophobicContact CB-CG1 4.04Å; M2952-V2980 HydrophobicContact CG-CG2 3.95Å; M2978-V2980 HydrophobicContact CG-CG2 4.19Å; V2980-L2989 CarbonylContact C-O 3.49Å; V2980-L2989 WeakPolarHBondContact CA-O 3.46Å; V2980-I2990 HydrophobicContact CG1-CG1 4.43Å; V2980-I2990 HydrophobicContact CG2-CG1 4.46Å
2981I93.5Very high91.6Very high12.6667 Ų12.666729.4 Ų29.47%0.06515%0.145CC..EExtended strand (participates in β ladder)trans-129.696.8-178.7-50.590.9000107.5Y2725 P2894 F2937 L2983 G2988 L2989Y2725-I2981 HydrophobicContact CD1-CG2 3.99Å; Y2725-I2981 HydrophobicContact CG-CG2 3.97Å; P2894-I2981 HydrophobicContact CB-CD1 3.7Å; P2894-I2981 HydrophobicContact CB-CG1 3.88Å; F2937-I2981 HydrophobicContact CE1-CD1 4.11Å; I2981-L2983 HydrophobicContact CG2-CD2 4.42Å; I2981-L2983 PolarHBondContact O-N 3.23Å; I2981-G2988 WeakPolarHBondContact O-CA 3.35Å; I2981-L2989 HydrophobicContact CB-CB 4.32Å; I2981-L2989 HydrophobicContact CD1-CB 4.22Å; I2981-L2989 PolarHBondContact N-O 3.24Å; I2981-L2989 PolarHBondContact O-N 3.08Å
2982P90.9Very high91.8Very high5.66667 Ų5.6666732.4 Ų32.44%0.03716%0.156CC..EExtended strand (participates in β ladder)trans-65.1134.9173.8-14.928.7000110.1L2729 T2945 R2946 E2949L2729-P2982 HydrophobicContact CD1-CB 4.28Å; L2729-P2982 HydrophobicContact CD2-CB 3.87Å; L2729-P2982 HydrophobicContact CD2-CG 4.35Å; T2945-P2982 WeakPolarHBondContact OG1-CA 3.41Å; T2945-P2982 WeakPolarHBondContact OG1-CB 3.42Å; R2946-P2982 HydrophobicContact CB-CG 4.38Å; R2946-P2982 HydrophobicContact CG-CB 3.7Å; R2946-P2982 HydrophobicContact CG-CG 3.72Å; E2949-P2982 HydrophobicContact CB-CG 4.11Å; E2949-P2982 HydrophobicContact CG-CG 4.45Å; E2949-P2982 WeakPolarHBondContact OE2-CG 3.39Å
2983L90.7Very high91.9Very high1.66667 Ų1.6666728.8 Ų28.81%0.00914%0.137CC..  trans-104.4-33.7-179.4-62.9176.8000111.8N2765 L2768 I2769 L2939 I2981 T2987 L2989N2765-L2983 WeakPolarHBondContact ND2-CA 3.42Å; N2765-L2983 PolarHBondContact ND2-O 3.31Å; L2768-L2983 HydrophobicContact CB-CD1 3.59Å; L2768-L2983 HydrophobicContact CD1-CD1 4.09Å; I2769-L2983 HydrophobicContact CD1-CB 4.48Å; I2769-L2983 HydrophobicContact CG1-CB 4.13Å; L2939-L2983 HydrophobicContact CD1-CD1 3.97Å; I2981-L2983 HydrophobicContact CG2-CD2 4.42Å; I2981-L2983 PolarHBondContact O-N 3.23Å; L2983-T2987 WeakPolarHBondContact CB-OG1 3.3Å; L2983-T2987 PolarHBondContact N-O 3.09Å; L2983-L2989 HydrophobicContact CD1-CG 4.16Å; L2983-L2989 HydrophobicContact CG-CG 4.47Å
2984S86.5Confident91.7Very high5.33333 Ų5.3333332.6 Ų32.64%0.03716%0.162CC..SBendtrans-145.9-166.117379.50000110.1Y2986 T2987S2984-Y2986 VanDerWaalsContact C-N 3.27Å; S2984-Y2986 PolarHBondContact O-N 3.25Å; S2984-Y2986 WeakPolarHBondContact OG-CD2 3.35Å; S2984-Y2986 WeakPolarHBondContact OG-CE2 3.31Å; S2984-Y2986 PolarHBondContact OG-N 2.96Å; S2984-Y2986 VanDerWaalsContact OG-N 3.12Å; S2984-T2987 VanDerWaalsContact CB-OG1 3.32Å; S2984-T2987 WeakPolarHBondContact CB-OG1 3.31Å; S2984-T2987 PolarHBondContact N-O 3.37Å; S2984-T2987 PolarHBondContact N-OG1 3.04Å; S2984-T2987 VanDerWaalsContact N-OG1 3.14Å; S2984-T2987 PolarHBondContact OG-N 3.23Å; S2984-T2987 VanDerWaalsContact OG-N 3.14Å; S2984-T2987 PolarHBondContact OG-OG1 2.79Å
2985T81.2Confident91.6Very high22 Ų2235.6 Ų35.614%0.13518%0.177CC..SBendtrans-76.2-6.217262.30000113.6D2944 R2946 H3324D2944-T2985 VanDerWaalsContact CB-O 3.31Å; D2944-T2985 WeakPolarHBondContact CB-O 3.39Å; R2946-T2985 VanDerWaalsContact NH1-CG2 3.35Å; T2985-H3324 PolarHBondContact OG1-NE2 2.89Å
2986Y82.9Confident91.5Very high72.6667 Ų72.666735.9 Ų35.929%0.28518%0.18SC..SBendtrans-139.27.5-175.4-24.9-76.4000113.3I2773 G2941 H2942 E2943 S2984 Q3181 Q3321 H3324I2773-Y2986 HydrophobicContact CD1-CD2 4.38Å; G2941-Y2986 CarbonylContact C-O 3.37Å; G2941-Y2986 VanDerWaalsContact C-O 3.31Å; G2941-Y2986 WeakPolarHBondContact CA-O 3.28Å; H2942-Y2986 CarbonylContact C-O 3.51Å; H2942-Y2986 WeakPolarHBondContact CA-O 3.36Å; H2942-Y2986 PolarHBondContact N-O 3.25Å; E2943-Y2986 PolarHBondContact N-O 3.13Å; E2943-Y2986 VanDerWaalsContact N-O 3.12Å; E2943-Y2986 CarbonylContact O-C 3.59Å; E2943-Y2986 WeakPolarHBondContact O-CA 3.44Å; S2984-Y2986 VanDerWaalsContact C-N 3.27Å; S2984-Y2986 PolarHBondContact O-N 3.25Å; S2984-Y2986 WeakPolarHBondContact OG-CD2 3.35Å; S2984-Y2986 WeakPolarHBondContact OG-CE2 3.31Å; S2984-Y2986 PolarHBondContact OG-N 2.96Å; S2984-Y2986 VanDerWaalsContact OG-N 3.12Å; Y2986-Q3181 PolarHBondContact OH-NE2 3.47Å; Y2986-Q3321 WeakPolarHBondContact CD2-O 3.24Å; Y2986-Q3321 WeakPolarHBondContact CE2-O 3.33Å; Y2986-H3324 AromaticContact CD2-CD2 3.66Å; Y2986-H3324 AromaticContact CE2-CD2 3.93Å
2987T89.1Confident91.6Very high0.333333 Ų0.33333332.7 Ų32.70%0.00217%0.165CC..EExtended strand (participates in β ladder)trans-143.5145.4-176.363.30000110.9I2769 S2772 K2940 E2943 L2983 S2984I2769-T2987 HydrophobicContact CG2-CG2 4.47Å; S2772-T2987 WeakPolarHBondContact OG-CG2 3.29Å; K2940-T2987 WeakPolarHBondContact O-CA 3.42Å; E2943-T2987 PolarHBondContact O-N 3.01Å; L2983-T2987 WeakPolarHBondContact CB-OG1 3.3Å; L2983-T2987 PolarHBondContact N-O 3.09Å; S2984-T2987 VanDerWaalsContact CB-OG1 3.32Å; S2984-T2987 WeakPolarHBondContact CB-OG1 3.31Å; S2984-T2987 PolarHBondContact N-O 3.37Å; S2984-T2987 PolarHBondContact N-OG1 3.04Å; S2984-T2987 VanDerWaalsContact N-OG1 3.14Å; S2984-T2987 PolarHBondContact OG-N 3.23Å; S2984-T2987 VanDerWaalsContact OG-N 3.14Å; S2984-T2987 PolarHBondContact OG-OG1 2.79Å
2988G92.7Very high91.7Very high0 Ų027.6 Ų27.60%015%0.148CC..EExtended strand (participates in β ladder)trans-166.4161177.500000114.5K2940 T2945 I2981K2940-G2988 PolarHBondContact N-O 3Å; K2940-G2988 PolarHBondContact O-N 3.16Å; K2940-G2988 VanDerWaalsContact O-N 3.11Å; T2945-G2988 WeakPolarHBondContact OG1-CA 3.4Å; I2981-G2988 WeakPolarHBondContact O-CA 3.35Å
2989L95.2Very high91.8Very high0.666667 Ų0.66666726.7 Ų26.70%0.00314%0.144CC..EExtended strand (participates in β ladder)trans-97.7129.8170-66.1174.3000110.1L2768 P2894 L2925 F2937 L2939 V2980 I2981 L2983L2768-L2989 HydrophobicContact CD1-CD1 3.85Å; L2768-L2989 HydrophobicContact CD1-CD2 4.3Å; L2768-L2989 HydrophobicContact CD1-CG 4.33Å; P2894-L2989 HydrophobicContact CB-CD1 4.13Å; P2894-L2989 HydrophobicContact CG-CD1 3.89Å; L2925-L2989 HydrophobicContact CD2-CD2 3.76Å; F2937-L2989 HydrophobicContact CB-CD2 4.05Å; F2937-L2989 HydrophobicContact CD1-CB 4.16Å; L2939-L2989 HydrophobicContact CB-CD2 4.05Å; L2939-L2989 HydrophobicContact CD1-CD2 3.79Å; L2939-L2989 HydrophobicContact CD1-CG 4.46Å; L2939-L2989 HydrophobicContact CG-CD2 4.44Å; V2980-L2989 CarbonylContact C-O 3.49Å; V2980-L2989 WeakPolarHBondContact CA-O 3.46Å; I2981-L2989 HydrophobicContact CB-CB 4.32Å; I2981-L2989 HydrophobicContact CD1-CB 4.22Å; I2981-L2989 PolarHBondContact N-O 3.24Å; I2981-L2989 PolarHBondContact O-N 3.08Å; L2983-L2989 HydrophobicContact CD1-CG 4.16Å; L2983-L2989 HydrophobicContact CG-CG 4.47Å
2990I95.2Very high91.9Very high15 Ų1527.8 Ų27.88%0.07714%0.144CC..EExtended strand (participates in β ladder)trans-114.9125.8170.9-61.4175.5000108.2F2937 L2938 K2940 T2945 M2978 S2979 V2980 W2992F2937-I2990 CarbonylContact C-O 3.57Å; F2937-I2990 WeakPolarHBondContact CA-O 3.35Å; L2938-I2990 HydrophobicContact CB-CB 4.36Å; L2938-I2990 PolarHBondContact N-O 3.38Å; L2938-I2990 PolarHBondContact O-N 3.08Å; K2940-I2990 HydrophobicContact CD-CD1 3.81Å; K2940-I2990 HydrophobicContact CG-CD1 4.24Å; T2945-I2990 HydrophobicContact CG2-CD1 4.24Å; T2945-I2990 HydrophobicContact CG2-CG1 4.35Å; M2978-I2990 HydrophobicContact CE-CG2 3.44Å; M2978-I2990 VanDerWaalsContact CE-CG2 3.44Å; M2978-I2990 HydrophobicContact CG-CG2 4.21Å; M2978-I2990 HydrophobicContact SD-CG2 3.75Å; M2978-I2990 VanDerWaalsContact SD-CG2 3.55Å; S2979-I2990 CarbonylContact O-C 3.52Å; S2979-I2990 WeakPolarHBondContact O-CA 3.32Å; V2980-I2990 HydrophobicContact CG1-CG1 4.43Å; V2980-I2990 HydrophobicContact CG2-CG1 4.46Å; I2990-W2992 PolarHBondContact O-N 3.27Å
2991G95Very high91.9Very high7.66667 Ų7.6666729.6 Ų29.68%0.07915%0.154CC..EExtended strand (participates in β ladder)trans-64.4128.2-179.800000111.4M2978 S2979 V2993M2978-G2991 VanDerWaalsContact CE-O 3.27Å; M2978-G2991 WeakPolarHBondContact CE-O 3.44Å; S2979-G2991 PolarHBondContact O-N 3.1Å; S2979-G2991 WeakPolarHBondContact OG-CA 3.38Å; G2991-V2993 PolarHBondContact O-N 3.35Å
2992W93.2Very high92Very high104 Ų10429.2 Ų29.239%0.39415%0.152SC..  trans-70.8130.3-179.6-174.9-84.1000111I2916 V2936 L2938 I2990 P2994I2916-W2992 HydrophobicContact CD1-CH2 4.3Å; I2916-W2992 HydrophobicContact CD1-CZ3 3.9Å; V2936-W2992 HydrophobicContact CB-CB 3.7Å; V2936-W2992 HydrophobicContact CB-CG 4.11Å; V2936-W2992 HydrophobicContact CG1-CB 3.61Å; V2936-W2992 HydrophobicContact CG1-CD2 4.15Å; V2936-W2992 HydrophobicContact CG1-CE3 4.47Å; V2936-W2992 HydrophobicContact CG1-CG 3.74Å; V2936-W2992 WeakPolarHBondContact O-CB 3.33Å; V2936-W2992 PolarHBondContact O-N 3.12Å; L2938-W2992 HydrophobicContact CD1-CZ3 4.45Å; I2990-W2992 PolarHBondContact O-N 3.27Å; W2992-P2994 VanDerWaalsContact O-CD 3.25Å; W2992-P2994 WeakPolarHBondContact O-CD 3.32Å
2993V92.3Very high92.3Very high19.6667 Ų19.666729.5 Ų29.512%0.11915%0.153CC..  trans-82.7109.9175.3-170.90000109.1M2978 G2991 S2996 M3098 V3107M2978-V2993 HydrophobicContact CB-CG2 4.34Å; M2978-V2993 HydrophobicContact CE-CG2 3.89Å; G2991-V2993 PolarHBondContact O-N 3.35Å; V2993-S2996 WeakPolarHBondContact CG1-OG 3.13Å; V2993-M3098 HydrophobicContact CB-SD 4.49Å; V2993-V3107 HydrophobicContact CG1-CG1 4.45Å; V2993-V3107 HydrophobicContact CG1-CG2 4.37Å; V2993-V3107 HydrophobicContact CG2-CG1 4.27Å
2994P91.2Very high92.5Very high86 Ų8632.6 Ų32.656%0.55816%0.164SC*.THydrogen-bonded Turntrans-70.3162-177.731-35.9000111.5W2992 S2996W2992-P2994 VanDerWaalsContact O-CD 3.25Å; W2992-P2994 WeakPolarHBondContact O-CD 3.32Å; P2994-S2996 PolarHBondContact O-N 3.25Å; P2994-S2996 VanDerWaalsContact O-N 3.09Å; P2994-S2996 PolarHBondContact O-OG 2.99Å
2995N92.3Very high92.8Very high97.3333 Ų97.333334.5 Ų34.552%0.5217%0.174SC..THydrogen-bonded Turntrans49.239.2170.7-58.6-29.4000114.2R3101 V3102N2995-R3101 VanDerWaalsContact O-CB 3.27Å; N2995-R3101 WeakPolarHBondContact O-CB 3.33Å; N2995-R3101 VanDerWaalsContact O-CG 3.31Å; N2995-R3101 WeakPolarHBondContact O-CG 3.36Å; N2995-R3101 PolarHBondContact O-N 2.97Å; N2995-V3102 HydrophobicContact CB-CG2 4.15Å
2996S93.8Very high93.5Very high14 Ų1435.3 Ų35.310%0.09818%0.175CC..EExtended strand (participates in β ladder)trans-135.7140.7-174.2-59.20000111.1V2993 P2994 M3098 L3099V2993-S2996 WeakPolarHBondContact CG1-OG 3.13Å; P2994-S2996 PolarHBondContact O-N 3.25Å; P2994-S2996 VanDerWaalsContact O-N 3.09Å; P2994-S2996 PolarHBondContact O-OG 2.99Å; S2996-M3098 WeakPolarHBondContact O-CE 3.13Å; S2996-L3099 VanDerWaalsContact CA-O 3.29Å; S2996-L3099 WeakPolarHBondContact CA-O 3.43Å; S2996-L3099 WeakPolarHBondContact CB-O 3.17Å
2997D94.2Very high94.1Very high14.6667 Ų14.666732 Ų328%0.07816%0.162CC..EExtended strand (participates in β ladder)trans-119.1144.5-179.1-65.1-35.9000110.3L3002 K3059 M3098 L3099 R3101D2997-L3002 HydrophobicContact CB-CD1 4.27Å; D2997-L3002 HydrophobicContact CB-CD2 3.75Å; D2997-L3002 HydrophobicContact CB-CG 3.77Å; D2997-K3059 IonicContact OD2-NZ 3.67Å; D2997-K3059 PolarHBondContact OD2-NZ 3.11Å; D2997-M3098 CarbonylContact O-C 3.51Å; D2997-M3098 WeakPolarHBondContact O-CA 3.25Å; D2997-L3099 PolarHBondContact N-O 3.05Å; D2997-L3099 PolarHBondContact O-N 2.7Å; D2997-R3101 VanDerWaalsContact CG-NE 3.29Å; D2997-R3101 IonicContact OD1-CZ 3.04Å; D2997-R3101 IonicContact OD1-NE 3.13Å; D2997-R3101 PolarHBondContact OD1-NE 3.11Å; D2997-R3101 IonicContact OD1-NH2 3.3Å; D2997-R3101 PolarHBondContact OD1-NH2 3.38Å; D2997-R3101 IonicContact OD2-CZ 2.8Å; D2997-R3101 IonicContact OD2-NE 3.2Å; D2997-R3101 PolarHBondContact OD2-NE 3.31Å; D2997-R3101 VanDerWaalsContact OD2-NE 3.14Å; D2997-R3101 IonicContact OD2-NH2 3.66Å
2998T95.5Very high94.4Very high20.6667 Ų20.666738.1 Ų38.113%0.12719%0.19CC..EExtended strand (participates in β ladder)trans-68.7151.317061.60000110.9H3000 N3001 L3002 S3095 I3097 M3098T2998-H3000 PolarHBondContact O-N 3.12Å; T2998-N3001 PolarHBondContact O-N 2.99Å; T2998-N3001 VanDerWaalsContact O-N 3.13Å; T2998-N3001 WeakPolarHBondContact OG1-CB 3.21Å; T2998-N3001 PolarHBondContact OG1-N 3.26Å; T2998-N3001 VanDerWaalsContact OG1-N 3.14Å; T2998-N3001 PolarHBondContact OG1-ND2 3.16Å; T2998-L3002 WeakPolarHBondContact O-CG 3.29Å; T2998-L3002 PolarHBondContact O-N 2.94Å; T2998-S3095 VanDerWaalsContact CG2-O 3.25Å; T2998-S3095 WeakPolarHBondContact CG2-O 3.25Å; T2998-I3097 CarbonylContact C-O 3.58Å; T2998-I3097 WeakPolarHBondContact CA-O 3.3Å; T2998-M3098 HydrophobicContact CG2-CG 4Å
2999F95.9Very high94.5Very high6.33333 Ų6.3333346.7 Ų46.73%0.02823%0.228CC..Hα-helixtrans-59.8-37.1175-76.422000110.9N3001 L3002 I3003 L3052 F3073 P3094 I3097 L3099 V3106 I3136F2999-N3001 PolarHBondContact O-N 3.14Å; F2999-L3002 PolarHBondContact O-N 3.45Å; F2999-I3003 WeakPolarHBondContact O-CB 3.28Å; F2999-I3003 WeakPolarHBondContact O-CD1 3.14Å; F2999-I3003 VanDerWaalsContact O-CG1 3.27Å; F2999-I3003 WeakPolarHBondContact O-CG1 3.16Å; F2999-I3003 PolarHBondContact O-N 2.64Å; F2999-L3052 HydrophobicContact CD2-CD2 4.13Å; F2999-L3052 HydrophobicContact CE2-CD2 3.97Å; F2999-L3052 HydrophobicContact CZ-CD2 4.42Å; F2999-F3073 HydrophobicContact CE1-CE2 4.46Å; F2999-F3073 HydrophobicContact CE2-CE2 4.39Å; F2999-F3073 AromaticContact CZ-CE2 3.78Å; F2999-F3073 HydrophobicContact CZ-CE2 3.78Å; F2999-F3073 HydrophobicContact CZ-CZ 4.5Å; F2999-P3094 HydrophobicContact CB-CB 4.08Å; F2999-P3094 WeakPolarHBondContact CB-O 3.35Å; F2999-P3094 PolarHBondContact N-O 3.34Å; F2999-P3094 VanDerWaalsContact N-O 3.15Å; F2999-I3097 HydrophobicContact CD1-CB 4.38Å; F2999-I3097 HydrophobicContact CD1-CG2 4.03Å; F2999-I3097 WeakPolarHBondContact CD1-O 3.48Å; F2999-I3097 HydrophobicContact CD2-CB 4.41Å; F2999-I3097 HydrophobicContact CD2-CG2 4.21Å; F2999-I3097 HydrophobicContact CE1-CB 4.46Å; F2999-I3097 HydrophobicContact CE1-CG2 3.62Å; F2999-I3097 HydrophobicContact CE2-CB 4.48Å; F2999-I3097 HydrophobicContact CE2-CG2 3.83Å; F2999-I3097 HydrophobicContact CG-CB 4.35Å; F2999-I3097 HydrophobicContact CG-CG2 4.3Å; F2999-I3097 HydrophobicContact CZ-CB 4.47Å; F2999-I3097 HydrophobicContact CZ-CG2 3.49Å; F2999-I3097 VanDerWaalsContact CZ-CG2 3.47Å; F2999-I3097 PolarHBondContact N-O 3.4Å; F2999-L3099 HydrophobicContact CD1-CB 4.39Å; F2999-L3099 HydrophobicContact CE1-CB 4.03Å; F2999-L3099 HydrophobicContact CE1-CD1 4.45Å; F2999-V3106 HydrophobicContact CZ-CG1 4.35Å; F2999-V3106 HydrophobicContact CZ-CG2 4.25Å; F2999-I3136 HydrophobicContact CE2-CD1 4.1Å; F2999-I3136 HydrophobicContact CE2-CG1 4.11Å
3000H95.1Very high94.5Very high62.6667 Ų62.666748.9 Ų48.929%0.2925%0.246SC..Hα-helixtrans-56.2-48.9173.2177.683.5000112.1T2998 I3003 R3004 P3094 W3438T2998-H3000 PolarHBondContact O-N 3.12Å; H3000-I3003 PolarHBondContact O-N 2.77Å; H3000-R3004 VanDerWaalsContact O-CB 3.31Å; H3000-R3004 WeakPolarHBondContact O-CB 3.4Å; H3000-R3004 PolarHBondContact O-N 3.2Å; H3000-P3094 HydrophobicContact CB-CB 4.19Å; H3000-P3094 PolarHBondContact N-O 3.11Å; H3000-P3094 VanDerWaalsContact N-O 3.15Å; H3000-W3438 HydrophobicContact CB-CZ3 4.31Å; H3000-W3438 AromaticContact ND1-CH2 3.86Å; H3000-W3438 AromaticContact ND1-CZ3 3.57Å
3001N94.5Very high94.4Very high53 Ų5355.6 Ų55.628%0.28328%0.282SS..Hα-helixtrans-64.1-44.4177.2-72.9-11.6000111.2T2998 F2999 I3003 R3004 D3005T2998-N3001 PolarHBondContact O-N 2.99Å; T2998-N3001 VanDerWaalsContact O-N 3.13Å; T2998-N3001 WeakPolarHBondContact OG1-CB 3.21Å; T2998-N3001 PolarHBondContact OG1-N 3.26Å; T2998-N3001 VanDerWaalsContact OG1-N 3.14Å; T2998-N3001 PolarHBondContact OG1-ND2 3.16Å; F2999-N3001 PolarHBondContact O-N 3.14Å; N3001-I3003 VanDerWaalsContact C-N 3.34Å; N3001-I3003 PolarHBondContact O-N 2.84Å; N3001-R3004 PolarHBondContact O-N 3.33Å; N3001-R3004 PolarHBondContact OD1-NH1 3.21Å; N3001-R3004 PolarHBondContact OD1-NH2 2.91Å; N3001-D3005 VanDerWaalsContact O-CB 3.28Å; N3001-D3005 WeakPolarHBondContact O-CB 3.43Å; N3001-D3005 PolarHBondContact O-N 2.89Å; N3001-D3005 VanDerWaalsContact O-OD1 3.1Å
3002L95.5Very high94.3Very high4.5 Ų4.557.7 Ų57.72%0.02429%0.293CS..Hα-helixtrans-60.1-41.7178.7-69.4174.9000113.2D2997 T2998 F2999 Y3006 I3055 K3059 L3099D2997-L3002 HydrophobicContact CB-CD1 4.27Å; D2997-L3002 HydrophobicContact CB-CD2 3.75Å; D2997-L3002 HydrophobicContact CB-CG 3.77Å; T2998-L3002 WeakPolarHBondContact O-CG 3.29Å; T2998-L3002 PolarHBondContact O-N 2.94Å; F2999-L3002 PolarHBondContact O-N 3.45Å; L3002-Y3006 WeakPolarHBondContact O-CB 3.16Å; L3002-Y3006 PolarHBondContact O-N 3.39Å; L3002-Y3006 VanDerWaalsContact O-N 3.1Å; L3002-I3055 HydrophobicContact CB-CG2 4.3Å; L3002-I3055 HydrophobicContact CD2-CG1 4.45Å; L3002-K3059 HydrophobicContact CD2-CD 3.98Å; L3002-K3059 VanDerWaalsContact CD2-NZ 3.26Å; L3002-L3099 HydrophobicContact CD1-CB 3.82Å; L3002-L3099 HydrophobicContact CD1-CD2 3.78Å; L3002-L3099 HydrophobicContact CD1-CG 4.46Å
3003I95.5Very high94.4Very high11 Ų1156.2 Ų56.26%0.05630%0.295CS..Hα-helixtrans-70.1-42.4178.2-66.7164.1000110.3F2999 H3000 N3001 Y3006 R3007 M3135 W3438F2999-I3003 WeakPolarHBondContact O-CB 3.28Å; F2999-I3003 WeakPolarHBondContact O-CD1 3.14Å; F2999-I3003 VanDerWaalsContact O-CG1 3.27Å; F2999-I3003 WeakPolarHBondContact O-CG1 3.16Å; F2999-I3003 PolarHBondContact O-N 2.64Å; H3000-I3003 PolarHBondContact O-N 2.77Å; N3001-I3003 VanDerWaalsContact C-N 3.34Å; N3001-I3003 PolarHBondContact O-N 2.84Å; I3003-Y3006 PolarHBondContact O-N 3.11Å; I3003-R3007 HydrophobicContact CG2-CG 4.33Å; I3003-R3007 WeakPolarHBondContact O-CB 3.37Å; I3003-R3007 WeakPolarHBondContact O-CG 3.26Å; I3003-R3007 PolarHBondContact O-N 3.24Å; I3003-M3135 HydrophobicContact CD1-CE 4.08Å; I3003-M3135 HydrophobicContact CD1-SD 4.05Å; I3003-M3135 HydrophobicContact CG1-SD 4.39Å; I3003-W3438 HydrophobicContact CB-CE3 4.39Å; I3003-W3438 HydrophobicContact CB-CZ3 4.37Å; I3003-W3438 HydrophobicContact CD1-CB 4.06Å; I3003-W3438 HydrophobicContact CD1-CD2 3.82Å; I3003-W3438 HydrophobicContact CD1-CE3 3.6Å; I3003-W3438 HydrophobicContact CD1-CG 4.03Å; I3003-W3438 HydrophobicContact CD1-CZ3 4.35Å; I3003-W3438 HydrophobicContact CG2-CD2 4.06Å; I3003-W3438 HydrophobicContact CG2-CE3 4.22Å; I3003-W3438 HydrophobicContact CG2-CH2 4.13Å; I3003-W3438 HydrophobicContact CG2-CZ2 3.93Å; I3003-W3438 HydrophobicContact CG2-CZ3 4.26Å
3004R95Very high94.4Very high67.5 Ų67.558.1 Ų58.126%0.25531%0.305SS..Hα-helixtrans-61.7-52.8176.2-175.4-172.865.7-126.3-14.3111.6H3000 N3001 Y3006 R3007 E3008 L3014H3000-R3004 VanDerWaalsContact O-CB 3.31Å; H3000-R3004 WeakPolarHBondContact O-CB 3.4Å; H3000-R3004 PolarHBondContact O-N 3.2Å; N3001-R3004 PolarHBondContact O-N 3.33Å; N3001-R3004 PolarHBondContact OD1-NH1 3.21Å; N3001-R3004 PolarHBondContact OD1-NH2 2.91Å; R3004-Y3006 VanDerWaalsContact C-N 3.25Å; R3004-Y3006 PolarHBondContact O-N 3.43Å; R3004-Y3006 VanDerWaalsContact O-N 3.11Å; R3004-R3007 PolarHBondContact O-N 3.31Å; R3004-R3007 VanDerWaalsContact O-N 3.12Å; R3004-E3008 WeakPolarHBondContact CD-OE1 3.32Å; R3004-E3008 HydrophobicContact CG-CG 4.17Å; R3004-E3008 WeakPolarHBondContact CG-OE1 3.47Å; R3004-E3008 IonicContact NE-OE1 2.67Å; R3004-E3008 IonicContact NE-OE2 3.27Å; R3004-E3008 WeakPolarHBondContact O-CB 3.23Å; R3004-E3008 WeakPolarHBondContact O-CG 3.34Å; R3004-E3008 PolarHBondContact O-N 3.31Å; R3004-L3014 HydrophobicContact CB-CD1 3.87Å; R3004-L3014 HydrophobicContact CG-CD1 4.05Å; R3004-L3014 HydrophobicContact CG-CD2 4.28Å
3005D93.8Very high94.5Very high45.5 Ų45.558.1 Ų58.124%0.24330%0.3CS..Hα-helixtrans-56.5-34.8179.1-64.8-0.6000112N3001 K3009 K3059N3001-D3005 VanDerWaalsContact O-CB 3.28Å; N3001-D3005 WeakPolarHBondContact O-CB 3.43Å; N3001-D3005 PolarHBondContact O-N 2.89Å; N3001-D3005 VanDerWaalsContact O-OD1 3.1Å; D3005-K3009 WeakPolarHBondContact O-CB 3.42Å; D3005-K3009 WeakPolarHBondContact O-CD 3.45Å; D3005-K3009 VanDerWaalsContact O-CG 3.29Å; D3005-K3009 WeakPolarHBondContact O-CG 3.47Å; D3005-K3009 PolarHBondContact O-N 3.18Å; D3005-K3059 IonicContact OD2-NZ 3.35Å; D3005-K3059 PolarHBondContact OD2-NZ 3.34Å
3006Y95.8Very high94.5Very high38 Ų3857.1 Ų57.115%0.14929%0.291CS..Hα-helixtrans-73.1-49.7175.3172.7-96.8000111.9L3002 I3003 R3004 E3008 K3009 A3010 D3051 N3054 I3055 L3058L3002-Y3006 WeakPolarHBondContact O-CB 3.16Å; L3002-Y3006 PolarHBondContact O-N 3.39Å; L3002-Y3006 VanDerWaalsContact O-N 3.1Å; I3003-Y3006 PolarHBondContact O-N 3.11Å; R3004-Y3006 VanDerWaalsContact C-N 3.25Å; R3004-Y3006 PolarHBondContact O-N 3.43Å; R3004-Y3006 VanDerWaalsContact O-N 3.11Å; Y3006-E3008 PolarHBondContact O-N 3.37Å; Y3006-K3009 PolarHBondContact O-N 2.99Å; Y3006-K3009 VanDerWaalsContact O-N 3.12Å; Y3006-A3010 HydrophobicContact CE1-CB 4.37Å; Y3006-A3010 WeakPolarHBondContact O-CB 3.31Å; Y3006-A3010 PolarHBondContact O-N 3.34Å; Y3006-D3051 HydrophobicContact CD1-CB 3.65Å; Y3006-D3051 HydrophobicContact CE1-CB 3.75Å; Y3006-N3054 HydrophobicContact CD2-CB 4.37Å; Y3006-N3054 HydrophobicContact CE2-CB 3.58Å; Y3006-N3054 PolarHBondContact OH-ND2 3.07Å; Y3006-I3055 HydrophobicContact CD2-CB 4.24Å; Y3006-I3055 HydrophobicContact CD2-CD1 4.39Å; Y3006-I3055 HydrophobicContact CG-CB 4.42Å; Y3006-L3058 HydrophobicContact CD2-CD1 4.32Å; Y3006-L3058 HydrophobicContact CE2-CD1 4.14Å
3007R95.8Very high94.5Very high4.5 Ų4.557.2 Ų57.22%0.01729%0.29CS..Hα-helixtrans-64.3-40.8-177.2-78.3-170178.1-158.5-8.4112.4I3003 R3004 K3009 A3010 D3011 V3012 L3014 E3017 D3051I3003-R3007 HydrophobicContact CG2-CG 4.33Å; I3003-R3007 WeakPolarHBondContact O-CB 3.37Å; I3003-R3007 WeakPolarHBondContact O-CG 3.26Å; I3003-R3007 PolarHBondContact O-N 3.24Å; R3004-R3007 PolarHBondContact O-N 3.31Å; R3004-R3007 VanDerWaalsContact O-N 3.12Å; R3007-K3009 VanDerWaalsContact C-N 3.3Å; R3007-K3009 PolarHBondContact O-N 3.19Å; R3007-A3010 CarbonylContact O-C 3.41Å; R3007-A3010 PolarHBondContact O-N 3.25Å; R3007-D3011 PolarHBondContact O-N 2.97Å; R3007-D3011 VanDerWaalsContact O-N 3.14Å; R3007-V3012 HydrophobicContact CB-CB 4.15Å; R3007-V3012 WeakPolarHBondContact CB-O 3.42Å; R3007-V3012 HydrophobicContact CG-CB 4.07Å; R3007-V3012 HydrophobicContact CG-CG1 4.12Å; R3007-V3012 PolarHBondContact O-N 3.05Å; R3007-L3014 PolarHBondContact NH1-O 3.24Å; R3007-E3017 IonicContact CZ-OE1 3.09Å; R3007-E3017 IonicContact CZ-OE2 3.09Å; R3007-E3017 IonicContact NH1-OE1 3.07Å; R3007-E3017 IonicContact NH1-OE2 3.06Å; R3007-E3017 PolarHBondContact NH1-OE2 3.3Å; R3007-E3017 IonicContact NH2-OE1 3.43Å; R3007-E3017 PolarHBondContact NH2-OE1 3.11Å; R3007-E3017 IonicContact NH2-OE2 2.75Å; R3007-E3017 PolarHBondContact NH2-OE2 3.12Å; R3007-D3051 IonicContact CZ-OD2 3.08Å; R3007-D3051 VanDerWaalsContact CZ-OD2 3.23Å; R3007-D3051 IonicContact NE-OD2 2.8Å; R3007-D3051 PolarHBondContact NE-OD2 3.04Å; R3007-D3051 IonicContact NH2-OD2 3.41Å; R3007-D3051 PolarHBondContact NH2-OD2 3.09Å
3008E95.3Very high94.5Very high127 Ų12758.9 Ų58.959%0.59330%0.299SS*.Hα-helixtrans-60.3-38.7173.6-72.6172.3176.800111.9R3004 Y3006 D3011R3004-E3008 WeakPolarHBondContact CD-OE1 3.32Å; R3004-E3008 HydrophobicContact CG-CG 4.17Å; R3004-E3008 WeakPolarHBondContact CG-OE1 3.47Å; R3004-E3008 IonicContact NE-OE1 2.67Å; R3004-E3008 IonicContact NE-OE2 3.27Å; R3004-E3008 WeakPolarHBondContact O-CB 3.23Å; R3004-E3008 WeakPolarHBondContact O-CG 3.34Å; R3004-E3008 PolarHBondContact O-N 3.31Å; Y3006-E3008 PolarHBondContact O-N 3.37Å; E3008-D3011 PolarHBondContact O-N 3.12Å
3009K94.9Very high94.4Very high180.5 Ų180.565.9 Ų65.979%0.78532%0.323SS*.Hα-helixtrans-76.6-25.5177.1-73179.4-179.6-174.50114.1D3005 Y3006 R3007 D3011D3005-K3009 WeakPolarHBondContact O-CB 3.42Å; D3005-K3009 WeakPolarHBondContact O-CD 3.45Å; D3005-K3009 VanDerWaalsContact O-CG 3.29Å; D3005-K3009 WeakPolarHBondContact O-CG 3.47Å; D3005-K3009 PolarHBondContact O-N 3.18Å; Y3006-K3009 PolarHBondContact O-N 2.99Å; Y3006-K3009 VanDerWaalsContact O-N 3.12Å; R3007-K3009 VanDerWaalsContact C-N 3.3Å; R3007-K3009 PolarHBondContact O-N 3.19Å; K3009-D3011 VanDerWaalsContact C-N 3.31Å
3010A93.7Very high94.3Very high47.5 Ų47.567.2 Ų67.239%0.39333%0.329SS..THydrogen-bonded Turntrans-93.9517900000113.1Y3006 R3007 V3012Y3006-A3010 HydrophobicContact CE1-CB 4.37Å; Y3006-A3010 WeakPolarHBondContact O-CB 3.31Å; Y3006-A3010 PolarHBondContact O-N 3.34Å; R3007-A3010 CarbonylContact O-C 3.41Å; R3007-A3010 PolarHBondContact O-N 3.25Å; A3010-V3012 HydrophobicContact CB-CG2 4.01Å; A3010-V3012 PolarHBondContact O-N 3.16Å
3011D94.3Very high94.2Very high156 Ų15664.8 Ų64.883%0.83432%0.318SS*.THydrogen-bonded Turntrans51.639.2-172.7-160.329.7000113.7R3007 E3008 K3009R3007-D3011 PolarHBondContact O-N 2.97Å; R3007-D3011 VanDerWaalsContact O-N 3.14Å; E3008-D3011 PolarHBondContact O-N 3.12Å; K3009-D3011 VanDerWaalsContact C-N 3.31Å
3012V93.5Very high94.2Very high50.5 Ų50.565.9 Ų65.931%0.30632%0.324SS..  trans-101.7127.2176.6179.10000109.3R3007 A3010 L3014R3007-V3012 HydrophobicContact CB-CB 4.15Å; R3007-V3012 WeakPolarHBondContact CB-O 3.42Å; R3007-V3012 HydrophobicContact CG-CB 4.07Å; R3007-V3012 HydrophobicContact CG-CG1 4.12Å; R3007-V3012 PolarHBondContact O-N 3.05Å; A3010-V3012 HydrophobicContact CB-CG2 4.01Å; A3010-V3012 PolarHBondContact O-N 3.16Å; V3012-L3014 PolarHBondContact O-N 3.17Å; V3012-L3014 VanDerWaalsContact O-N 3.17Å
3013V94Very high94.2Very high73.5 Ų73.573.5 Ų73.545%0.44535%0.352SS..  trans-57.6124.1175177.70000110.5N3015 K3016V3013-N3015 VanDerWaalsContact C-N 3.29Å; V3013-N3015 WeakPolarHBondContact CG1-OD1 3.46Å; V3013-N3015 PolarHBondContact O-N 2.75Å; V3013-N3015 VanDerWaalsContact O-N 3.07Å; V3013-K3016 HydrophobicContact CB-CB 4.45Å; V3013-K3016 WeakPolarHBondContact O-CB 3.43Å; V3013-K3016 PolarHBondContact O-N 3.26Å; V3013-K3016 VanDerWaalsContact O-N 3.14Å
3014L92.6Very high94.1Very high60 Ų6076.5 Ų76.531%0.31437%0.368SS..THydrogen-bonded Turntrans-51.6-42.3-173.2-176.563000113.5R3004 R3007 V3012 W3438R3004-L3014 HydrophobicContact CB-CD1 3.87Å; R3004-L3014 HydrophobicContact CG-CD1 4.05Å; R3004-L3014 HydrophobicContact CG-CD2 4.28Å; R3007-L3014 PolarHBondContact NH1-O 3.24Å; V3012-L3014 PolarHBondContact O-N 3.17Å; V3012-L3014 VanDerWaalsContact O-N 3.17Å; L3014-W3438 HydrophobicContact CD1-CH2 3.83Å; L3014-W3438 HydrophobicContact CD1-CZ2 3.91Å; L3014-W3438 HydrophobicContact CG-CH2 4.38Å; L3014-W3438 HydrophobicContact CG-CZ2 4.38Å
3015N92.9Very high94.1Very high85.5 Ų85.573.7 Ų73.746%0.45736%0.359SS..THydrogen-bonded Turntrans-106.831.4-176.72-19.1000113.2V3013 E3017 N3018 R3019V3013-N3015 VanDerWaalsContact C-N 3.29Å; V3013-N3015 WeakPolarHBondContact CG1-OD1 3.46Å; V3013-N3015 PolarHBondContact O-N 2.75Å; V3013-N3015 VanDerWaalsContact O-N 3.07Å; N3015-E3017 VanDerWaalsContact C-N 3.33Å; N3015-E3017 PolarHBondContact O-N 3.24Å; N3015-N3018 HydrophobicContact CB-CB 4.43Å; N3015-N3018 PolarHBondContact O-N 3.07Å; N3015-N3018 VanDerWaalsContact O-N 3.15Å; N3015-R3019 WeakPolarHBondContact O-CB 3.15Å; N3015-R3019 PolarHBondContact O-N 3.14Å; N3015-R3019 WeakPolarHBondContact OD1-CD 3.34Å
3016K92.9Very high94Very high77 Ų7776.5 Ų76.534%0.33538%0.38SS..Hα-helixtrans-48.6-49.8-175.3-166.7-171.1-174.8-148.70113.2V3013 N3018 R3019 E3020 E3046V3013-K3016 HydrophobicContact CB-CB 4.45Å; V3013-K3016 WeakPolarHBondContact O-CB 3.43Å; V3013-K3016 PolarHBondContact O-N 3.26Å; V3013-K3016 VanDerWaalsContact O-N 3.14Å; K3016-N3018 PolarHBondContact O-N 3.38Å; K3016-R3019 PolarHBondContact O-N 2.95Å; K3016-E3020 PolarHBondContact O-N 3.02Å; K3016-E3020 VanDerWaalsContact O-N 3.14Å; K3016-E3046 HydrophobicContact CD-CB 4.32Å; K3016-E3046 WeakPolarHBondContact CD-O 3.42Å; K3016-E3046 VanDerWaalsContact CE-OE2 3.28Å; K3016-E3046 WeakPolarHBondContact CE-OE2 3.43Å; K3016-E3046 PolarHBondContact NZ-O 3.07Å; K3016-E3046 IonicContact NZ-OE2 3.58Å; K3016-E3046 PolarHBondContact NZ-OE2 2.9Å
3017E94.4Very high93.8Very high14.5 Ų14.579.1 Ų79.17%0.06840%0.397CS..Hα-helixtrans-63.2-45.1-178.1-60.492153.200112.1R3007 N3015 R3019 E3020 M3021 G3043 S3047 R3134 F3437R3007-E3017 IonicContact CZ-OE1 3.09Å; R3007-E3017 IonicContact CZ-OE2 3.09Å; R3007-E3017 IonicContact NH1-OE1 3.07Å; R3007-E3017 IonicContact NH1-OE2 3.06Å; R3007-E3017 PolarHBondContact NH1-OE2 3.3Å; R3007-E3017 IonicContact NH2-OE1 3.43Å; R3007-E3017 PolarHBondContact NH2-OE1 3.11Å; R3007-E3017 IonicContact NH2-OE2 2.75Å; R3007-E3017 PolarHBondContact NH2-OE2 3.12Å; N3015-E3017 VanDerWaalsContact C-N 3.33Å; N3015-E3017 PolarHBondContact O-N 3.24Å; E3017-R3019 VanDerWaalsContact C-N 3.32Å; E3017-R3019 PolarHBondContact O-N 3.47Å; E3017-E3020 PolarHBondContact O-N 3.15Å; E3017-M3021 WeakPolarHBondContact O-CG 3.3Å; E3017-M3021 PolarHBondContact O-N 3.2Å; E3017-G3043 VanDerWaalsContact CB-O 3.28Å; E3017-G3043 WeakPolarHBondContact CB-O 3.38Å; E3017-G3043 WeakPolarHBondContact CG-O 3.44Å; E3017-S3047 VanDerWaalsContact OE1-CB 3.28Å; E3017-S3047 WeakPolarHBondContact OE1-CB 3.31Å; E3017-S3047 PolarHBondContact OE1-OG 3.18Å; E3017-R3134 IonicContact OE1-NH2 3.29Å; E3017-R3134 PolarHBondContact OE1-NH2 2.84Å; E3017-F3437 HydrophobicContact CB-CB 4.22Å; E3017-F3437 HydrophobicContact CB-CD1 4.26Å; E3017-F3437 HydrophobicContact CB-CD2 3.54Å; E3017-F3437 HydrophobicContact CB-CE2 3.95Å; E3017-F3437 HydrophobicContact CB-CG 3.74Å; E3017-F3437 HydrophobicContact CB-CZ 4.48Å; E3017-F3437 HydrophobicContact CG-CB 4.33Å; E3017-F3437 HydrophobicContact CG-CD2 3.79Å; E3017-F3437 HydrophobicContact CG-CE2 4.45Å; E3017-F3437 HydrophobicContact CG-CG 4.2Å
3018N93.4Very high93.6Very high50.5 Ų50.580 Ų8027%0.2740%0.401SS..Hα-helixtrans-66-37.5178.5-17214.6000111.5N3015 K3016 E3020 M3021 L3022 I3432 F3437N3015-N3018 HydrophobicContact CB-CB 4.43Å; N3015-N3018 PolarHBondContact O-N 3.07Å; N3015-N3018 VanDerWaalsContact O-N 3.15Å; K3016-N3018 PolarHBondContact O-N 3.38Å; N3018-E3020 VanDerWaalsContact C-N 3.29Å; N3018-E3020 PolarHBondContact O-N 3.18Å; N3018-M3021 PolarHBondContact O-N 3.17Å; N3018-L3022 WeakPolarHBondContact O-CB 3.32Å; N3018-L3022 WeakPolarHBondContact O-CG 3.37Å; N3018-L3022 PolarHBondContact O-N 2.95Å; N3018-L3022 VanDerWaalsContact OD1-CD1 3.28Å; N3018-L3022 WeakPolarHBondContact OD1-CD1 3.37Å; N3018-I3432 WeakPolarHBondContact OD1-CD1 3.35Å; N3018-F3437 HydrophobicContact CB-CE1 4.01Å; N3018-F3437 HydrophobicContact CB-CZ 3.84Å
3019R94.2Very high93.2Very high167.5 Ų167.578.4 Ų78.463%0.63240%0.396SS*.Hα-helixtrans-62-38.1175.5-124.1177.9119.1178.4-3111.8N3015 K3016 E3017 R3023N3015-R3019 WeakPolarHBondContact O-CB 3.15Å; N3015-R3019 PolarHBondContact O-N 3.14Å; N3015-R3019 WeakPolarHBondContact OD1-CD 3.34Å; K3016-R3019 PolarHBondContact O-N 2.95Å; E3017-R3019 VanDerWaalsContact C-N 3.32Å; E3017-R3019 PolarHBondContact O-N 3.47Å; R3019-R3023 WeakPolarHBondContact O-CB 3.34Å; R3019-R3023 PolarHBondContact O-N 2.96Å
3020E93.7Very high93Very high34.5 Ų34.580 Ų8016%0.16140%0.397CS..Hα-helixtrans-71.8-42.8175.7-176.861.5-168.600112.2K3016 E3017 N3018 L3022 R3023 L3024 E3046K3016-E3020 PolarHBondContact O-N 3.02Å; K3016-E3020 VanDerWaalsContact O-N 3.14Å; E3017-E3020 PolarHBondContact O-N 3.15Å; N3018-E3020 VanDerWaalsContact C-N 3.29Å; N3018-E3020 PolarHBondContact O-N 3.18Å; E3020-L3022 VanDerWaalsContact C-N 3.31Å; E3020-L3022 PolarHBondContact O-N 3.07Å; E3020-R3023 VanDerWaalsContact CD-NE 3.35Å; E3020-R3023 WeakPolarHBondContact O-CB 3.45Å; E3020-R3023 PolarHBondContact O-N 2.85Å; E3020-R3023 VanDerWaalsContact O-N 3.15Å; E3020-R3023 IonicContact OE1-CZ 2.95Å; E3020-R3023 IonicContact OE1-NE 3.15Å; E3020-R3023 PolarHBondContact OE1-NE 3.24Å; E3020-R3023 IonicContact OE1-NH2 2.74Å; E3020-R3023 PolarHBondContact OE1-NH2 3.33Å; E3020-R3023 IonicContact OE2-CZ 2.92Å; E3020-R3023 IonicContact OE2-NE 2.78Å; E3020-R3023 PolarHBondContact OE2-NE 3.13Å; E3020-R3023 IonicContact OE2-NH2 2.99Å; E3020-L3024 HydrophobicContact CG-CD1 4.2Å; E3020-L3024 HydrophobicContact CG-CG 4.5Å; E3020-L3024 WeakPolarHBondContact O-CG 3.3Å; E3020-L3024 PolarHBondContact O-N 2.84Å; E3020-E3046 HydrophobicContact CB-CG 3.75Å; E3020-E3046 HydrophobicContact CG-CG 3.65Å
3021M93.7Very high92.9Very high12.5 Ų12.579.5 Ų79.56%0.06239%0.388CS..Hα-helixtrans-55-47.6174.3-70.6171.44000111.7E3017 N3018 R3023 L3024 A3025 F3028 I3039 F3040 I3432 F3437E3017-M3021 WeakPolarHBondContact O-CG 3.3Å; E3017-M3021 PolarHBondContact O-N 3.2Å; N3018-M3021 PolarHBondContact O-N 3.17Å; M3021-R3023 VanDerWaalsContact C-N 3.29Å; M3021-R3023 PolarHBondContact O-N 3.01Å; M3021-L3024 PolarHBondContact O-N 3.15Å; M3021-A3025 PolarHBondContact O-N 3.01Å; M3021-F3028 HydrophobicContact CE-CD1 4.38Å; M3021-F3028 HydrophobicContact CE-CD2 3.91Å; M3021-F3028 HydrophobicContact CE-CE1 3.95Å; M3021-F3028 HydrophobicContact CE-CE2 3.41Å; M3021-F3028 VanDerWaalsContact CE-CE2 3.41Å; M3021-F3028 HydrophobicContact CE-CG 4.37Å; M3021-F3028 HydrophobicContact CE-CZ 3.95Å; M3021-F3028 VanDerWaalsContact CE-CZ 3.43Å; M3021-I3039 HydrophobicContact CB-CG2 3.91Å; M3021-I3039 HydrophobicContact CG-CG2 4.12Å; M3021-I3039 WeakPolarHBondContact O-CG2 3.46Å; M3021-F3040 HydrophobicContact CE-CB 4.32Å; M3021-F3040 HydrophobicContact CE-CD2 3.94Å; M3021-F3040 HydrophobicContact SD-CD2 4.06Å; M3021-I3432 HydrophobicContact CE-CD1 3.75Å; M3021-I3432 HydrophobicContact CE-CG1 4.33Å; M3021-I3432 HydrophobicContact SD-CD1 4.31Å; M3021-F3437 HydrophobicContact SD-CD1 4.24Å
3022L93.7Very high92.9Very high76 Ų7676.1 Ų76.140%0.39837%0.369SS..Hα-helixtrans-72.8-22.9178.8-67.1174000113.3N3018 E3020 A3025 P3026 F3028N3018-L3022 WeakPolarHBondContact O-CB 3.32Å; N3018-L3022 WeakPolarHBondContact O-CG 3.37Å; N3018-L3022 PolarHBondContact O-N 2.95Å; N3018-L3022 VanDerWaalsContact OD1-CD1 3.28Å; N3018-L3022 WeakPolarHBondContact OD1-CD1 3.37Å; E3020-L3022 VanDerWaalsContact C-N 3.31Å; E3020-L3022 PolarHBondContact O-N 3.07Å; L3022-A3025 CarbonylContact O-C 3.55Å; L3022-P3026 WeakPolarHBondContact O-CA 3.41Å; L3022-F3028 HydrophobicContact CD2-CB 4.44Å
3023R94.8Very high92.9Very high163 Ų16377.7 Ų77.762%0.61538%0.379SS*.Hα-helixtrans-70-39.8171.2-170.4-17073.781.1-1.3111.2R3019 E3020 M3021R3019-R3023 WeakPolarHBondContact O-CB 3.34Å; R3019-R3023 PolarHBondContact O-N 2.96Å; E3020-R3023 VanDerWaalsContact CD-NE 3.35Å; E3020-R3023 WeakPolarHBondContact O-CB 3.45Å; E3020-R3023 PolarHBondContact O-N 2.85Å; E3020-R3023 VanDerWaalsContact O-N 3.15Å; E3020-R3023 IonicContact OE1-CZ 2.95Å; E3020-R3023 IonicContact OE1-NE 3.15Å; E3020-R3023 PolarHBondContact OE1-NE 3.24Å; E3020-R3023 IonicContact OE1-NH2 2.74Å; E3020-R3023 PolarHBondContact OE1-NH2 3.33Å; E3020-R3023 IonicContact OE2-CZ 2.92Å; E3020-R3023 IonicContact OE2-NE 2.78Å; E3020-R3023 PolarHBondContact OE2-NE 3.13Å; E3020-R3023 IonicContact OE2-NH2 2.99Å; M3021-R3023 VanDerWaalsContact C-N 3.29Å; M3021-R3023 PolarHBondContact O-N 3.01Å
3024L94Very high93Very high74.5 Ų74.580.5 Ų80.539%0.3939%0.39SS..Hα-helixtrans-77.8-39.2178.9-65.7170.9000112E3020 M3021 I3039 A3042E3020-L3024 HydrophobicContact CG-CD1 4.2Å; E3020-L3024 HydrophobicContact CG-CG 4.5Å; E3020-L3024 WeakPolarHBondContact O-CG 3.3Å; E3020-L3024 PolarHBondContact O-N 2.84Å; M3021-L3024 PolarHBondContact O-N 3.15Å; L3024-I3039 HydrophobicContact CB-CD1 3.72Å; L3024-I3039 HydrophobicContact CB-CG2 4.48Å; L3024-A3042 HydrophobicContact CD1-CB 3.45Å; L3024-A3042 VanDerWaalsContact CD1-CB 3.45Å
3025A94.5Very high93.1Very high9.5 Ų9.581.6 Ų81.68%0.07939%0.394CS..  trans-14398.6176.600000111.9M3021 L3022 D3027 F3028 L3031 I3039M3021-A3025 PolarHBondContact O-N 3.01Å; L3022-A3025 CarbonylContact O-C 3.55Å; A3025-D3027 PolarHBondContact O-N 2.88Å; A3025-F3028 PolarHBondContact O-N 3.41Å; A3025-L3031 HydrophobicContact CB-CD1 3.76Å; A3025-I3039 HydrophobicContact CB-CD1 3.7Å; A3025-I3039 HydrophobicContact CB-CG1 4.1Å; A3025-I3039 HydrophobicContact CB-CG2 4.26Å
3026P93Very high93.2Very high104.5 Ų104.579.8 Ų79.868%0.67938%0.382SS*.THydrogen-bonded Turntrans-60.3-30.1178.5-24.434000113.6L3022 F3028L3022-P3026 WeakPolarHBondContact O-CA 3.41Å; P3026-F3028 VanDerWaalsContact C-N 3.34Å; P3026-F3028 PolarHBondContact O-N 3.35Å
3027D91.3Very high93.4Very high92.5 Ų92.578 Ų7850%0.49538%0.377SS..THydrogen-bonded Turntrans-100.932.9-1790.3-36.9000113.1A3025 D3029 R3030A3025-D3027 PolarHBondContact O-N 2.88Å; D3027-D3029 PolarHBondContact O-N 3.14Å; D3027-R3030 WeakPolarHBondContact O-CB 3.35Å; D3027-R3030 PolarHBondContact O-N 2.88Å
3028F90.8Very high93.4Very high23 Ų2383.6 Ų83.610%0.10140%0.403CS..G310 helixtrans-40.6-43.6-177.2178.9-96.7000114.3M3021 L3022 A3025 P3026 R3030 L3031 K3036 I3039 I3432M3021-F3028 HydrophobicContact CE-CD1 4.38Å; M3021-F3028 HydrophobicContact CE-CD2 3.91Å; M3021-F3028 HydrophobicContact CE-CE1 3.95Å; M3021-F3028 HydrophobicContact CE-CE2 3.41Å; M3021-F3028 VanDerWaalsContact CE-CE2 3.41Å; M3021-F3028 HydrophobicContact CE-CG 4.37Å; M3021-F3028 HydrophobicContact CE-CZ 3.95Å; M3021-F3028 VanDerWaalsContact CE-CZ 3.43Å; L3022-F3028 HydrophobicContact CD2-CB 4.44Å; A3025-F3028 PolarHBondContact O-N 3.41Å; P3026-F3028 VanDerWaalsContact C-N 3.34Å; P3026-F3028 PolarHBondContact O-N 3.35Å; F3028-R3030 VanDerWaalsContact C-N 3.26Å; F3028-R3030 PolarHBondContact O-N 3.4Å; F3028-R3030 VanDerWaalsContact O-N 3.1Å; F3028-L3031 HydrophobicContact CD2-CD1 4.34Å; F3028-L3031 WeakPolarHBondContact O-CB 3.27Å; F3028-L3031 WeakPolarHBondContact O-CG 3.21Å; F3028-L3031 PolarHBondContact O-N 3.14Å; F3028-L3031 VanDerWaalsContact O-N 3.08Å; F3028-K3036 HydrophobicContact CD2-CG 4.4Å; F3028-K3036 HydrophobicContact CE1-CD 4.33Å; F3028-K3036 HydrophobicContact CE1-CG 4.36Å; F3028-K3036 HydrophobicContact CE2-CB 3.99Å; F3028-K3036 HydrophobicContact CE2-CG 3.92Å; F3028-K3036 HydrophobicContact CZ-CB 3.97Å; F3028-K3036 HydrophobicContact CZ-CD 4.35Å; F3028-K3036 HydrophobicContact CZ-CG 3.89Å; F3028-K3036 WeakPolarHBondContact O-CE 3.29Å; F3028-I3039 HydrophobicContact CD2-CB 4.2Å; F3028-I3039 HydrophobicContact CD2-CD1 4.47Å; F3028-I3039 HydrophobicContact CD2-CG2 3.81Å; F3028-I3039 HydrophobicContact CE2-CB 4.17Å; F3028-I3039 HydrophobicContact CE2-CG2 4.06Å; F3028-I3432 HydrophobicContact CD1-CD1 4.14Å; F3028-I3432 HydrophobicContact CE1-CD1 4.48Å
3029D87.1Confident93.5Very high94 Ų9482.3 Ų82.350%0.50340%0.396SS..G310 helixtrans-60.6-27-177.9-72.3-24.1000114.1D3027 K3036 F3124D3027-D3029 PolarHBondContact O-N 3.14Å; D3029-K3036 WeakPolarHBondContact O-CE 3.29Å; D3029-K3036 PolarHBondContact O-NZ 2.77Å; D3029-F3124 WeakPolarHBondContact OD1-CE1 3.41Å
3030R90.3Very high93.6Very high214.5 Ų214.576.8 Ų76.881%0.80938%0.377SS*.G310 helixtrans-87.2-11.9-178.9-63.2-177.5176.7-179.2-1.3113.9D3027 F3028D3027-R3030 WeakPolarHBondContact O-CB 3.35Å; D3027-R3030 PolarHBondContact O-N 2.88Å; F3028-R3030 VanDerWaalsContact C-N 3.26Å; F3028-R3030 PolarHBondContact O-N 3.4Å; F3028-R3030 VanDerWaalsContact O-N 3.1Å
3031L92.6Very high93.6Very high35.5 Ų35.579.4 Ų79.419%0.18639%0.389CS..SBendtrans-70.5154.2-176.9-60.9-179000112.5A3025 F3028 Q3035 K3036 I3039A3025-L3031 HydrophobicContact CB-CD1 3.76Å; F3028-L3031 HydrophobicContact CD2-CD1 4.34Å; F3028-L3031 WeakPolarHBondContact O-CB 3.27Å; F3028-L3031 WeakPolarHBondContact O-CG 3.21Å; F3028-L3031 PolarHBondContact O-N 3.14Å; F3028-L3031 VanDerWaalsContact O-N 3.08Å; L3031-Q3035 HydrophobicContact CB-CB 3.99Å; L3031-Q3035 HydrophobicContact CD1-CB 4.23Å; L3031-Q3035 HydrophobicContact CD2-CB 4.4Å; L3031-Q3035 HydrophobicContact CG-CB 4.4Å; L3031-K3036 HydrophobicContact CB-CG 3.78Å; L3031-K3036 WeakPolarHBondContact O-CE 3.43Å; L3031-K3036 PolarHBondContact O-NZ 3.19Å; L3031-I3039 HydrophobicContact CD1-CD1 3.1Å; L3031-I3039 HydrophobicContact CD1-CG1 4.06Å
3032N94Very high93.7Very high84.5 Ų84.579.6 Ų79.645%0.45239%0.393SS..  trans-72167.5171.574.344.1000111.3I3034 Q3035 K3036N3032-I3034 VanDerWaalsContact C-N 3.33Å; N3032-I3034 PolarHBondContact O-N 3.16Å; N3032-I3034 WeakPolarHBondContact OD1-CB 3.39Å; N3032-I3034 PolarHBondContact OD1-N 3.14Å; N3032-I3034 VanDerWaalsContact OD1-N 3.17Å; N3032-Q3035 VanDerWaalsContact CG-OE1 3.28Å; N3032-Q3035 VanDerWaalsContact N-OE1 3.11Å; N3032-Q3035 PolarHBondContact ND2-OE1 2.86Å; N3032-Q3035 VanDerWaalsContact ND2-OE1 3.1Å; N3032-Q3035 PolarHBondContact O-N 3.13Å; N3032-Q3035 WeakPolarHBondContact OD1-CB 3.33Å; N3032-Q3035 WeakPolarHBondContact OD1-CG 3.39Å; N3032-Q3035 PolarHBondContact OD1-N 3.25Å; N3032-K3036 WeakPolarHBondContact O-CB 3.24Å; N3032-K3036 WeakPolarHBondContact O-CG 3.42Å; N3032-K3036 PolarHBondContact O-N 3.16Å
3033V93.6Very high93.7Very high84 Ų8476 Ų7651%0.50937%0.374SS..Hα-helixtrans-61-38.6-173.6-179.80000112.6K3036 T3037 Q3425 Q3429V3033-K3036 PolarHBondContact O-N 2.96Å; V3033-T3037 WeakPolarHBondContact O-CB 3.24Å; V3033-T3037 PolarHBondContact O-N 3.37Å; V3033-T3037 PolarHBondContact O-OG1 3.36Å; V3033-Q3425 HydrophobicContact CG1-CB 4.22Å; V3033-Q3429 HydrophobicContact CG1-CG 4.39Å; V3033-Q3429 HydrophobicContact CG2-CG 4.22Å
3034I95.4Very high93.6Very high133 Ų13370 Ų7068%0.68235%0.354SS*.Hα-helixtrans-66.6-48.3-179-62.7170.3000110.1N3032 K3036 T3037 E3038N3032-I3034 VanDerWaalsContact C-N 3.33Å; N3032-I3034 PolarHBondContact O-N 3.16Å; N3032-I3034 WeakPolarHBondContact OD1-CB 3.39Å; N3032-I3034 PolarHBondContact OD1-N 3.14Å; N3032-I3034 VanDerWaalsContact OD1-N 3.17Å; I3034-K3036 VanDerWaalsContact C-N 3.34Å; I3034-K3036 PolarHBondContact O-N 3.15Å; I3034-T3037 WeakPolarHBondContact O-CB 3.36Å; I3034-T3037 PolarHBondContact O-N 3.05Å; I3034-T3037 VanDerWaalsContact O-N 3.1Å; I3034-E3038 PolarHBondContact O-N 3.48Å
3035Q95.8Very high93.6Very high84 Ų8475.2 Ų75.239%0.39337%0.369SS..Hα-helixtrans-60.6-43.3175.7-69.9171.8-35.900111.5L3031 N3032 T3037 E3038 I3039L3031-Q3035 HydrophobicContact CB-CB 3.99Å; L3031-Q3035 HydrophobicContact CD1-CB 4.23Å; L3031-Q3035 HydrophobicContact CD2-CB 4.4Å; L3031-Q3035 HydrophobicContact CG-CB 4.4Å; N3032-Q3035 VanDerWaalsContact CG-OE1 3.28Å; N3032-Q3035 VanDerWaalsContact N-OE1 3.11Å; N3032-Q3035 PolarHBondContact ND2-OE1 2.86Å; N3032-Q3035 VanDerWaalsContact ND2-OE1 3.1Å; N3032-Q3035 PolarHBondContact O-N 3.13Å; N3032-Q3035 WeakPolarHBondContact OD1-CB 3.33Å; N3032-Q3035 WeakPolarHBondContact OD1-CG 3.39Å; N3032-Q3035 PolarHBondContact OD1-N 3.25Å; Q3035-T3037 VanDerWaalsContact C-N 3.29Å; Q3035-T3037 PolarHBondContact O-N 3.16Å; Q3035-E3038 PolarHBondContact O-N 2.88Å; Q3035-I3039 WeakPolarHBondContact O-CD1 3.3Å; Q3035-I3039 WeakPolarHBondContact O-CG1 3.47Å; Q3035-I3039 PolarHBondContact O-N 3.33Å; Q3035-I3039 VanDerWaalsContact O-N 3.09Å
3036K95Very high93.5Very high47.5 Ų47.578.3 Ų78.321%0.20738%0.381CS..Hα-helixtrans-59.4-40.1174.4-75.8-179.7171160.40111.9F3028 D3029 L3031 N3032 V3033 I3034 F3040 C3428F3028-K3036 HydrophobicContact CD2-CG 4.4Å; F3028-K3036 HydrophobicContact CE1-CD 4.33Å; F3028-K3036 HydrophobicContact CE1-CG 4.36Å; F3028-K3036 HydrophobicContact CE2-CB 3.99Å; F3028-K3036 HydrophobicContact CE2-CG 3.92Å; F3028-K3036 HydrophobicContact CZ-CB 3.97Å; F3028-K3036 HydrophobicContact CZ-CD 4.35Å; F3028-K3036 HydrophobicContact CZ-CG 3.89Å; F3028-K3036 WeakPolarHBondContact O-CE 3.29Å; D3029-K3036 WeakPolarHBondContact O-CE 3.29Å; D3029-K3036 PolarHBondContact O-NZ 2.77Å; L3031-K3036 HydrophobicContact CB-CG 3.78Å; L3031-K3036 WeakPolarHBondContact O-CE 3.43Å; L3031-K3036 PolarHBondContact O-NZ 3.19Å; N3032-K3036 WeakPolarHBondContact O-CB 3.24Å; N3032-K3036 WeakPolarHBondContact O-CG 3.42Å; N3032-K3036 PolarHBondContact O-N 3.16Å; V3033-K3036 PolarHBondContact O-N 2.96Å; I3034-K3036 VanDerWaalsContact C-N 3.34Å; I3034-K3036 PolarHBondContact O-N 3.15Å; K3036-F3040 WeakPolarHBondContact O-CB 3.36Å; K3036-F3040 PolarHBondContact O-N 3.01Å; K3036-C3428 HydrophobicContact CB-CB 4.1Å
3037T95.3Very high93.5Very high38.5 Ų38.574.2 Ų74.224%0.23636%0.356CS..Hα-helixtrans-63.8-47178.1-56.20000111.1V3033 I3034 Q3035 I3039 F3040 E3041 N3424 Q3425 C3428V3033-T3037 WeakPolarHBondContact O-CB 3.24Å; V3033-T3037 PolarHBondContact O-N 3.37Å; V3033-T3037 PolarHBondContact O-OG1 3.36Å; I3034-T3037 WeakPolarHBondContact O-CB 3.36Å; I3034-T3037 PolarHBondContact O-N 3.05Å; I3034-T3037 VanDerWaalsContact O-N 3.1Å; Q3035-T3037 VanDerWaalsContact C-N 3.29Å; Q3035-T3037 PolarHBondContact O-N 3.16Å; T3037-I3039 PolarHBondContact O-N 3.01Å; T3037-F3040 PolarHBondContact O-N 3.37Å; T3037-E3041 HydrophobicContact CG2-CG 4.45Å; T3037-E3041 WeakPolarHBondContact O-CB 3.4Å; T3037-E3041 WeakPolarHBondContact O-CG 3.4Å; T3037-E3041 PolarHBondContact O-N 3.04Å; T3037-N3424 HydrophobicContact CG2-CB 4.04Å; T3037-Q3425 HydrophobicContact CG2-CG 4.04Å; T3037-C3428 PolarHBondContact OG1-SG 3.42Å
3038E95.6Very high93.4Very high131.5 Ų131.573.7 Ų73.761%0.61436%0.359SS*.Hα-helixtrans-60.5-47.9179-178.2176.3-161.700112.3I3034 Q3035 F3040 E3041 A3042I3034-E3038 PolarHBondContact O-N 3.48Å; Q3035-E3038 PolarHBondContact O-N 2.88Å; E3038-F3040 VanDerWaalsContact C-N 3.34Å; E3038-F3040 PolarHBondContact O-N 3.43Å; E3038-E3041 PolarHBondContact O-N 3.21Å; E3038-A3042 PolarHBondContact O-N 3.33Å
3039I95.6Very high93.5Very high23 Ų2372.6 Ų72.612%0.11835%0.354CS..Hα-helixtrans-66.4-39178.2-63.9-134.9000111.1M3021 L3024 A3025 F3028 L3031 Q3035 T3037 A3042 G3043M3021-I3039 HydrophobicContact CB-CG2 3.91Å; M3021-I3039 HydrophobicContact CG-CG2 4.12Å; M3021-I3039 WeakPolarHBondContact O-CG2 3.46Å; L3024-I3039 HydrophobicContact CB-CD1 3.72Å; L3024-I3039 HydrophobicContact CB-CG2 4.48Å; A3025-I3039 HydrophobicContact CB-CD1 3.7Å; A3025-I3039 HydrophobicContact CB-CG1 4.1Å; A3025-I3039 HydrophobicContact CB-CG2 4.26Å; F3028-I3039 HydrophobicContact CD2-CB 4.2Å; F3028-I3039 HydrophobicContact CD2-CD1 4.47Å; F3028-I3039 HydrophobicContact CD2-CG2 3.81Å; F3028-I3039 HydrophobicContact CE2-CB 4.17Å; F3028-I3039 HydrophobicContact CE2-CG2 4.06Å; L3031-I3039 HydrophobicContact CD1-CD1 3.1Å; L3031-I3039 HydrophobicContact CD1-CG1 4.06Å; Q3035-I3039 WeakPolarHBondContact O-CD1 3.3Å; Q3035-I3039 WeakPolarHBondContact O-CG1 3.47Å; Q3035-I3039 PolarHBondContact O-N 3.33Å; Q3035-I3039 VanDerWaalsContact O-N 3.09Å; T3037-I3039 PolarHBondContact O-N 3.01Å; I3039-A3042 PolarHBondContact O-N 3.07Å; I3039-G3043 PolarHBondContact O-N 3.16Å
3040F95.2Very high93.8Very high53.5 Ų53.575.5 Ų75.524%0.23536%0.358CS..Hα-helixtrans-62.8-46.9175.6-176.9-109.7000111M3021 K3036 T3037 E3038 A3042 G3043 L3044 N3424 L3427 C3428 A3436 F3437M3021-F3040 HydrophobicContact CE-CB 4.32Å; M3021-F3040 HydrophobicContact CE-CD2 3.94Å; M3021-F3040 HydrophobicContact SD-CD2 4.06Å; K3036-F3040 WeakPolarHBondContact O-CB 3.36Å; K3036-F3040 PolarHBondContact O-N 3.01Å; T3037-F3040 PolarHBondContact O-N 3.37Å; E3038-F3040 VanDerWaalsContact C-N 3.34Å; E3038-F3040 PolarHBondContact O-N 3.43Å; F3040-A3042 VanDerWaalsContact C-N 3.32Å; F3040-A3042 PolarHBondContact O-N 2.94Å; F3040-G3043 CarbonylContact O-C 3.54Å; F3040-G3043 WeakPolarHBondContact O-CA 3.49Å; F3040-G3043 PolarHBondContact O-N 3.03Å; F3040-G3043 VanDerWaalsContact O-N 3.16Å; F3040-L3044 HydrophobicContact CD1-CD1 3.99Å; F3040-L3044 HydrophobicContact CD1-CG 4.23Å; F3040-L3044 HydrophobicContact CE1-CD1 3.74Å; F3040-L3044 HydrophobicContact CE1-CD2 4.08Å; F3040-L3044 HydrophobicContact CE1-CG 4.08Å; F3040-L3044 HydrophobicContact CE2-CD2 4.32Å; F3040-L3044 HydrophobicContact CZ-CD1 4.26Å; F3040-L3044 HydrophobicContact CZ-CD2 3.91Å; F3040-L3044 HydrophobicContact CZ-CG 4.36Å; F3040-L3044 VanDerWaalsContact O-CG 3.3Å; F3040-L3044 WeakPolarHBondContact O-CG 3.34Å; F3040-L3044 PolarHBondContact O-N 3.16Å; F3040-N3424 HydrophobicContact CD1-CB 4.36Å; F3040-L3427 HydrophobicContact CE1-CB 3.78Å; F3040-L3427 HydrophobicContact CZ-CB 3.8Å; F3040-C3428 HydrophobicContact CB-CB 3.59Å; F3040-C3428 HydrophobicContact CD1-CB 3.99Å; F3040-C3428 HydrophobicContact CD2-CB 4.31Å; F3040-C3428 HydrophobicContact CG-CB 3.73Å; F3040-A3436 HydrophobicContact CE2-CB 3.94Å; F3040-A3436 HydrophobicContact CZ-CB 4.13Å; F3040-F3437 HydrophobicContact CE2-CB 4.14Å; F3040-F3437 HydrophobicContact CE2-CD1 4.47Å
3041E95.4Very high94.1Very high88.5 Ų88.565.8 Ų65.841%0.41432%0.322SS..Hα-helixtrans-62.3-36.2176.1-74.9-177.2-178.800113T3037 E3038 L3044 R3045 N3424T3037-E3041 HydrophobicContact CG2-CG 4.45Å; T3037-E3041 WeakPolarHBondContact O-CB 3.4Å; T3037-E3041 WeakPolarHBondContact O-CG 3.4Å; T3037-E3041 PolarHBondContact O-N 3.04Å; E3038-E3041 PolarHBondContact O-N 3.21Å; E3041-L3044 PolarHBondContact O-N 3.12Å; E3041-R3045 WeakPolarHBondContact O-CG 3.06Å; E3041-R3045 PolarHBondContact O-N 3.04Å; E3041-R3045 VanDerWaalsContact O-N 3.16Å; E3041-N3424 HydrophobicContact CG-CB 4.37Å; E3041-N3424 WeakPolarHBondContact CG-ND2 3.43Å; E3041-N3424 PolarHBondContact OE1-ND2 3.18Å
3042A94.1Very high94.2Very high17 Ų1764.2 Ų64.214%0.1431%0.314CS..Hα-helixtrans-61.7-47.7170.100000111.5L3024 E3038 I3039 F3040 L3044 R3045L3024-A3042 HydrophobicContact CD1-CB 3.45Å; L3024-A3042 VanDerWaalsContact CD1-CB 3.45Å; E3038-A3042 PolarHBondContact O-N 3.33Å; I3039-A3042 PolarHBondContact O-N 3.07Å; F3040-A3042 VanDerWaalsContact C-N 3.32Å; F3040-A3042 PolarHBondContact O-N 2.94Å; A3042-L3044 VanDerWaalsContact C-N 3.29Å; A3042-L3044 PolarHBondContact O-N 3.02Å; A3042-R3045 PolarHBondContact O-N 3.03Å; A3042-R3045 VanDerWaalsContact O-N 3.15Å
3043G93.7Very high94.3Very high0.5 Ų0.561.2 Ų61.21%0.00530%0.3CS..Hα-helixtrans-61.1-33.5174.300000113.8E3017 I3039 F3040 E3046E3017-G3043 VanDerWaalsContact CB-O 3.28Å; E3017-G3043 WeakPolarHBondContact CB-O 3.38Å; E3017-G3043 WeakPolarHBondContact CG-O 3.44Å; I3039-G3043 PolarHBondContact O-N 3.16Å; F3040-G3043 CarbonylContact O-C 3.54Å; F3040-G3043 WeakPolarHBondContact O-CA 3.49Å; F3040-G3043 PolarHBondContact O-N 3.03Å; F3040-G3043 VanDerWaalsContact O-N 3.16Å; G3043-E3046 PolarHBondContact O-N 3.33Å
3044L93.6Very high94.4Very high37 Ų3759.9 Ų59.919%0.19429%0.291CS..Hα-helixtrans-64.8-41.6174.4-65.8-178.4000111.3F3040 E3041 A3042 E3046 S3047 R3134 F3437F3040-L3044 HydrophobicContact CD1-CD1 3.99Å; F3040-L3044 HydrophobicContact CD1-CG 4.23Å; F3040-L3044 HydrophobicContact CE1-CD1 3.74Å; F3040-L3044 HydrophobicContact CE1-CD2 4.08Å; F3040-L3044 HydrophobicContact CE1-CG 4.08Å; F3040-L3044 HydrophobicContact CE2-CD2 4.32Å; F3040-L3044 HydrophobicContact CZ-CD1 4.26Å; F3040-L3044 HydrophobicContact CZ-CD2 3.91Å; F3040-L3044 HydrophobicContact CZ-CG 4.36Å; F3040-L3044 VanDerWaalsContact O-CG 3.3Å; F3040-L3044 WeakPolarHBondContact O-CG 3.34Å; F3040-L3044 PolarHBondContact O-N 3.16Å; E3041-L3044 PolarHBondContact O-N 3.12Å; A3042-L3044 VanDerWaalsContact C-N 3.29Å; A3042-L3044 PolarHBondContact O-N 3.02Å; L3044-E3046 PolarHBondContact O-N 3.06Å; L3044-E3046 VanDerWaalsContact O-N 3.1Å; L3044-S3047 PolarHBondContact O-N 2.96Å; L3044-S3047 VanDerWaalsContact O-O 3.07Å; L3044-R3134 VanDerWaalsContact CD2-CZ 3.47Å; L3044-R3134 VanDerWaalsContact O-CZ 3.3Å; L3044-R3134 PolarHBondContact O-NH1 2.86Å; L3044-R3134 PolarHBondContact O-NH2 3.13Å; L3044-R3134 VanDerWaalsContact O-NH2 3.14Å; L3044-F3437 HydrophobicContact CD2-CB 3.59Å
3045R93.9Very high94.3Very high184 Ų18454.1 Ų54.169%0.69426%0.261SS*.Hα-helixtrans-60.2-21.7-178-74.8-177.9-76-134.41.4113.8E3041 A3042 S3047E3041-R3045 WeakPolarHBondContact O-CG 3.06Å; E3041-R3045 PolarHBondContact O-N 3.04Å; E3041-R3045 VanDerWaalsContact O-N 3.16Å; A3042-R3045 PolarHBondContact O-N 3.03Å; A3042-R3045 VanDerWaalsContact O-N 3.15Å; R3045-S3047 VanDerWaalsContact C-N 3.28Å; R3045-S3047 PolarHBondContact O-N 3.16Å
3046E92.9Very high94.2Very high73.5 Ų73.550.5 Ų50.534%0.34324%0.244SC..THydrogen-bonded Turntrans-69.4-15.8178.7-77.7-58.4118.200115.7K3016 E3020 G3043 L3044K3016-E3046 HydrophobicContact CD-CB 4.32Å; K3016-E3046 WeakPolarHBondContact CD-O 3.42Å; K3016-E3046 VanDerWaalsContact CE-OE2 3.28Å; K3016-E3046 WeakPolarHBondContact CE-OE2 3.43Å; K3016-E3046 PolarHBondContact NZ-O 3.07Å; K3016-E3046 IonicContact NZ-OE2 3.58Å; K3016-E3046 PolarHBondContact NZ-OE2 2.9Å; E3020-E3046 HydrophobicContact CB-CG 3.75Å; E3020-E3046 HydrophobicContact CG-CG 3.65Å; G3043-E3046 PolarHBondContact O-N 3.33Å; L3044-E3046 PolarHBondContact O-N 3.06Å; L3044-E3046 VanDerWaalsContact O-N 3.1Å
3047S91.4Very high94.2Very high19.5 Ų19.554.5 Ų54.514%0.13626%0.259CS..SBendtrans-139.5152.6176.484.70000112.2E3017 L3044 R3045 G3049 R3134E3017-S3047 VanDerWaalsContact OE1-CB 3.28Å; E3017-S3047 WeakPolarHBondContact OE1-CB 3.31Å; E3017-S3047 PolarHBondContact OE1-OG 3.18Å; L3044-S3047 PolarHBondContact O-N 2.96Å; L3044-S3047 VanDerWaalsContact O-O 3.07Å; R3045-S3047 VanDerWaalsContact C-N 3.28Å; R3045-S3047 PolarHBondContact O-N 3.16Å; S3047-G3049 PolarHBondContact O-N 2.89Å; S3047-R3134 PolarHBondContact O-NH1 3Å; S3047-R3134 PolarHBondContact OG-NH2 2.91Å
3048S90.9Very high94.2Very high80.5 Ų80.558.2 Ų58.256%0.56328%0.276SS*.  trans-70-17.4-178.567.30000113.7R3050S3048-R3050 PolarHBondContact O-N 3.13Å; S3048-R3050 PolarHBondContact OG-N 3.26Å
3049G92.2Very high94.1Very high0 Ų055.6 Ų55.60%026%0.263CS..SBendtrans67.411.4-171.100000114.6S3047 M3135 S3138S3047-G3049 PolarHBondContact O-N 2.89Å; G3049-M3135 VanDerWaalsContact O-CA 3.3Å; G3049-M3135 WeakPolarHBondContact O-CA 3.35Å; G3049-M3135 WeakPolarHBondContact O-CG 3.45Å; G3049-S3138 WeakPolarHBondContact O-CB 3.36Å
3050R94.3Very high94Very high156.5 Ų156.555.5 Ų55.559%0.59126%0.264SS*.  trans-92.50.4-176.5-68.1-175.2174.3165.2-0.5114.9S3048 L3052 A3053 N3054S3048-R3050 PolarHBondContact O-N 3.13Å; S3048-R3050 PolarHBondContact OG-N 3.26Å; R3050-L3052 VanDerWaalsContact C-N 3.31Å; R3050-L3052 PolarHBondContact O-N 3.32Å; R3050-A3053 WeakPolarHBondContact O-CA 3.27Å; R3050-A3053 WeakPolarHBondContact O-CB 3.44Å; R3050-A3053 PolarHBondContact O-N 3.28Å; R3050-N3054 VanDerWaalsContact O-CG 3.32Å; R3050-N3054 PolarHBondContact O-N 3.19Å; R3050-N3054 PolarHBondContact O-OD1 2.62Å
3051D95.5Very high93.8Very high9 Ų961 Ų615%0.04829%0.29CS..Hα-helixtrans-51.2-47.3-175.2-55.5-3.9000112.8Y3006 R3007 A3053 N3054 I3055 M3135Y3006-D3051 HydrophobicContact CD1-CB 3.65Å; Y3006-D3051 HydrophobicContact CE1-CB 3.75Å; R3007-D3051 IonicContact CZ-OD2 3.08Å; R3007-D3051 VanDerWaalsContact CZ-OD2 3.23Å; R3007-D3051 IonicContact NE-OD2 2.8Å; R3007-D3051 PolarHBondContact NE-OD2 3.04Å; R3007-D3051 IonicContact NH2-OD2 3.41Å; R3007-D3051 PolarHBondContact NH2-OD2 3.09Å; D3051-A3053 PolarHBondContact O-N 2.97Å; D3051-N3054 PolarHBondContact O-N 3.04Å; D3051-I3055 WeakPolarHBondContact O-CG2 3.49Å; D3051-I3055 PolarHBondContact O-N 2.76Å; D3051-M3135 HydrophobicContact CB-CE 4.5Å; D3051-M3135 HydrophobicContact CB-SD 4.21Å
3052L95Very high93.8Very high2.5 Ų2.559.1 Ų59.11%0.01329%0.287CS..Hα-helixtrans-67.2-36.2179-172.662000112.6F2999 R3050 I3055 L3056 F3073 M3135 I3136 A3139F2999-L3052 HydrophobicContact CD2-CD2 4.13Å; F2999-L3052 HydrophobicContact CE2-CD2 3.97Å; F2999-L3052 HydrophobicContact CZ-CD2 4.42Å; R3050-L3052 VanDerWaalsContact C-N 3.31Å; R3050-L3052 PolarHBondContact O-N 3.32Å; L3052-I3055 HydrophobicContact CD1-CG2 4.24Å; L3052-I3055 WeakPolarHBondContact O-CG2 3.39Å; L3052-L3056 HydrophobicContact CG-CD1 4.44Å; L3052-L3056 VanDerWaalsContact O-CB 3.3Å; L3052-L3056 WeakPolarHBondContact O-CB 3.41Å; L3052-L3056 WeakPolarHBondContact O-CD1 3.37Å; L3052-L3056 WeakPolarHBondContact O-CG 3.48Å; L3052-L3056 PolarHBondContact O-N 3.04Å; L3052-L3056 VanDerWaalsContact O-N 3.13Å; L3052-F3073 HydrophobicContact CD2-CE2 4.32Å; L3052-F3073 HydrophobicContact CD2-CZ 4.02Å; L3052-M3135 HydrophobicContact CB-CB 4.3Å; L3052-I3136 HydrophobicContact CD2-CG1 4.35Å; L3052-A3139 HydrophobicContact CB-CB 4.26Å; L3052-A3139 HydrophobicContact CD2-CB 4.02Å; L3052-A3139 HydrophobicContact CG-CB 3.95Å
3053A95.2Very high93.7Very high21 Ų2161.7 Ų61.717%0.17430%0.304CS..Hα-helixtrans-67.3-43.5175.900000111.1R3050 D3051 L3056 W3057 S3138 A3139R3050-A3053 WeakPolarHBondContact O-CA 3.27Å; R3050-A3053 WeakPolarHBondContact O-CB 3.44Å; R3050-A3053 PolarHBondContact O-N 3.28Å; D3051-A3053 PolarHBondContact O-N 2.97Å; A3053-L3056 WeakPolarHBondContact O-CB 3.47Å; A3053-L3056 PolarHBondContact O-N 3.25Å; A3053-W3057 PolarHBondContact O-N 2.87Å; A3053-W3057 VanDerWaalsContact O-N 3.09Å; A3053-S3138 WeakPolarHBondContact CB-O 3.46Å; A3053-A3139 HydrophobicContact CB-CB 4.32Å
3054N95.5Very high93.6Very high58 Ų5867.5 Ų67.531%0.3133%0.331SS..Hα-helixtrans-66.8-44.3-179.5-67.3-6.6000111.3Y3006 R3050 D3051 L3056 W3057 L3058Y3006-N3054 HydrophobicContact CD2-CB 4.37Å; Y3006-N3054 HydrophobicContact CE2-CB 3.58Å; Y3006-N3054 PolarHBondContact OH-ND2 3.07Å; R3050-N3054 VanDerWaalsContact O-CG 3.32Å; R3050-N3054 PolarHBondContact O-N 3.19Å; R3050-N3054 PolarHBondContact O-OD1 2.62Å; D3051-N3054 PolarHBondContact O-N 3.04Å; N3054-L3056 VanDerWaalsContact C-N 3.33Å; N3054-L3056 PolarHBondContact O-N 3.37Å; N3054-W3057 WeakPolarHBondContact O-CB 3.49Å; N3054-W3057 PolarHBondContact O-N 3.44Å; N3054-L3058 WeakPolarHBondContact O-CB 3.44Å; N3054-L3058 VanDerWaalsContact O-CG 3.24Å; N3054-L3058 WeakPolarHBondContact O-CG 3.23Å; N3054-L3058 PolarHBondContact O-N 2.93Å
3055I94.5Very high93.6Very high11 Ų1166.8 Ų66.86%0.05633%0.33CS..Hα-helixtrans-69.3-31.5177.7-163.860000112.5L3002 Y3006 D3051 L3052 W3057 L3058 K3059L3002-I3055 HydrophobicContact CB-CG2 4.3Å; L3002-I3055 HydrophobicContact CD2-CG1 4.45Å; Y3006-I3055 HydrophobicContact CD2-CB 4.24Å; Y3006-I3055 HydrophobicContact CD2-CD1 4.39Å; Y3006-I3055 HydrophobicContact CG-CB 4.42Å; D3051-I3055 WeakPolarHBondContact O-CG2 3.49Å; D3051-I3055 PolarHBondContact O-N 2.76Å; L3052-I3055 HydrophobicContact CD1-CG2 4.24Å; L3052-I3055 WeakPolarHBondContact O-CG2 3.39Å; I3055-W3057 VanDerWaalsContact C-N 3.32Å; I3055-W3057 PolarHBondContact O-N 3.16Å; I3055-L3058 PolarHBondContact O-N 3.42Å; I3055-K3059 HydrophobicContact CD1-CD 4.33Å; I3055-K3059 HydrophobicContact CD1-CG 3.93Å; I3055-K3059 HydrophobicContact CG1-CD 4.22Å; I3055-K3059 HydrophobicContact CG1-CG 4.13Å; I3055-K3059 WeakPolarHBondContact O-CB 3.25Å; I3055-K3059 WeakPolarHBondContact O-CG 3.15Å; I3055-K3059 PolarHBondContact O-N 2.97Å
3056L94.1Very high93.6Very high8 Ų860.7 Ų60.74%0.04231%0.307CS..Hα-helixtrans-63.9-40.5172.7-129118.4000111.7L3052 A3053 N3054 S3060 R3070 F3073 L3099 A3139L3052-L3056 HydrophobicContact CG-CD1 4.44Å; L3052-L3056 VanDerWaalsContact O-CB 3.3Å; L3052-L3056 WeakPolarHBondContact O-CB 3.41Å; L3052-L3056 WeakPolarHBondContact O-CD1 3.37Å; L3052-L3056 WeakPolarHBondContact O-CG 3.48Å; L3052-L3056 PolarHBondContact O-N 3.04Å; L3052-L3056 VanDerWaalsContact O-N 3.13Å; A3053-L3056 WeakPolarHBondContact O-CB 3.47Å; A3053-L3056 PolarHBondContact O-N 3.25Å; N3054-L3056 VanDerWaalsContact C-N 3.33Å; N3054-L3056 PolarHBondContact O-N 3.37Å; L3056-S3060 PolarHBondContact O-OG 3.17Å; L3056-R3070 HydrophobicContact CD2-CB 4.11Å; L3056-R3070 HydrophobicContact CD2-CG 4.26Å; L3056-F3073 HydrophobicContact CD1-CG 4.48Å; L3056-L3099 HydrophobicContact CD1-CD2 3.73Å; L3056-L3099 HydrophobicContact CD2-CD1 4.47Å; L3056-L3099 HydrophobicContact CD2-CD2 3.53Å; L3056-L3099 HydrophobicContact CG-CD2 4.38Å; L3056-A3139 HydrophobicContact CD1-CB 3.83Å
3057W95Very high93.7Very high132.5 Ų132.560.6 Ų60.650%0.50231%0.306SS..Hα-helixtrans-64.7-56.3171.5174.9-103.6000111.4A3053 N3054 I3055 K3059 S3060 W3066A3053-W3057 PolarHBondContact O-N 2.87Å; A3053-W3057 VanDerWaalsContact O-N 3.09Å; N3054-W3057 WeakPolarHBondContact O-CB 3.49Å; N3054-W3057 PolarHBondContact O-N 3.44Å; I3055-W3057 VanDerWaalsContact C-N 3.32Å; I3055-W3057 PolarHBondContact O-N 3.16Å; W3057-K3059 VanDerWaalsContact C-N 3.29Å; W3057-K3059 PolarHBondContact O-N 3.23Å; W3057-S3060 WeakPolarHBondContact O-CB 3.32Å; W3057-S3060 PolarHBondContact O-N 3.31Å; W3057-W3066 HydrophobicContact CE3-CB 4.08Å; W3057-W3066 AromaticContact CE3-CD1 3.8Å; W3057-W3066 AromaticContact CE3-CD2 3.59Å; W3057-W3066 HydrophobicContact CE3-CD2 3.59Å; W3057-W3066 AromaticContact CE3-CE2 3.83Å; W3057-W3066 HydrophobicContact CE3-CE3 4.14Å; W3057-W3066 AromaticContact CE3-CG 3.55Å; W3057-W3066 HydrophobicContact CE3-CG 3.55Å; W3057-W3066 HydrophobicContact CE3-CZ2 4.5Å; W3057-W3066 AromaticContact CE3-NE1 3.93Å; W3057-W3066 HydrophobicContact CZ3-CB 4.23Å; W3057-W3066 AromaticContact CZ3-CD2 3.85Å; W3057-W3066 HydrophobicContact CZ3-CD2 3.85Å; W3057-W3066 AromaticContact CZ3-CE3 3.93Å; W3057-W3066 HydrophobicContact CZ3-CE3 3.93Å; W3057-W3066 AromaticContact CZ3-CG 3.97Å; W3057-W3066 HydrophobicContact CZ3-CG 4Å
3058L94.6Very high93.8Very high116 Ų11665.5 Ų65.561%0.60733%0.327SS*.Hα-helixtrans-64.2-26.9-174.7-67.9169.7000114.3Y3006 N3054 I3055 S3060Y3006-L3058 HydrophobicContact CD2-CD1 4.32Å; Y3006-L3058 HydrophobicContact CE2-CD1 4.14Å; N3054-L3058 WeakPolarHBondContact O-CB 3.44Å; N3054-L3058 VanDerWaalsContact O-CG 3.24Å; N3054-L3058 WeakPolarHBondContact O-CG 3.23Å; N3054-L3058 PolarHBondContact O-N 2.93Å; I3055-L3058 PolarHBondContact O-N 3.42Å; L3058-S3060 VanDerWaalsContact C-N 3.34Å
3059K93.2Very high94Very high75.5 Ų75.563 Ų6333%0.32830%0.304SS..THydrogen-bonded Turntrans-88.26.9173.4-69.9-163.8178.7-167.40113.4D2997 L3002 D3005 I3055 W3057 R3069D2997-K3059 IonicContact OD2-NZ 3.67Å; D2997-K3059 PolarHBondContact OD2-NZ 3.11Å; L3002-K3059 HydrophobicContact CD2-CD 3.98Å; L3002-K3059 VanDerWaalsContact CD2-NZ 3.26Å; D3005-K3059 IonicContact OD2-NZ 3.35Å; D3005-K3059 PolarHBondContact OD2-NZ 3.34Å; I3055-K3059 HydrophobicContact CD1-CD 4.33Å; I3055-K3059 HydrophobicContact CD1-CG 3.93Å; I3055-K3059 HydrophobicContact CG1-CD 4.22Å; I3055-K3059 HydrophobicContact CG1-CG 4.13Å; I3055-K3059 WeakPolarHBondContact O-CB 3.25Å; I3055-K3059 WeakPolarHBondContact O-CG 3.15Å; I3055-K3059 PolarHBondContact O-N 2.97Å; W3057-K3059 VanDerWaalsContact C-N 3.29Å; W3057-K3059 PolarHBondContact O-N 3.23Å; K3059-R3069 PolarHBondContact O-NH1 3.35Å
3060S93.9Very high94.2Very high20.5 Ų20.564.4 Ų64.414%0.14331%0.31CS..  trans-102.9138.7177.5-63.90000111.5L3056 W3057 L3058 R3069L3056-S3060 PolarHBondContact O-OG 3.17Å; W3057-S3060 WeakPolarHBondContact O-CB 3.32Å; W3057-S3060 PolarHBondContact O-N 3.31Å; L3058-S3060 VanDerWaalsContact C-N 3.34Å; S3060-R3069 PolarHBondContact OG-NH1 3.35Å
3061H91.9Very high94.2Very high170.5 Ų170.557.5 Ų57.579%0.78929%0.285SS*.SBendtrans-82.5-21.2-1740.694.7000114A3065H3061-A3065 WeakPolarHBondContact CE1-CB 3.34Å; H3061-A3065 WeakPolarHBondContact NE2-CB 3.44Å
3062S93.7Very high94.2Very high49 Ų4958.5 Ų58.534%0.34329%0.291SS..SBendtrans-149.3166.617576.20000110.9E3064 A3065 W3066S3062-E3064 VanDerWaalsContact C-N 3.32Å; S3062-E3064 WeakPolarHBondContact CB-OE2 3.38Å; S3062-E3064 PolarHBondContact O-N 3.3Å; S3062-E3064 PolarHBondContact OG-N 3.04Å; S3062-E3064 PolarHBondContact OG-OE2 3.39Å; S3062-A3065 PolarHBondContact O-N 3Å; S3062-A3065 WeakPolarHBondContact OG-CB 3.45Å; S3062-A3065 PolarHBondContact OG-N 3.05Å; S3062-W3066 WeakPolarHBondContact O-CB 3.41Å; S3062-W3066 PolarHBondContact O-N 3.28Å
3063S93.3Very high94.3Very high71 Ų7158.4 Ų58.450%0.49729%0.29SS..Hα-helixtrans-61.7-37175.136.90000112.9F3067S3063-F3067 WeakPolarHBondContact O-CB 3.33Å; S3063-F3067 PolarHBondContact O-N 3.34Å
3064E91.8Very high94.4Very high122.5 Ų122.557.5 Ų57.557%0.57228%0.282SS*.Hα-helixtrans-70.4-47178.6-113.7120.4-143.700110.5S3062 W3066 F3067 E3068S3062-E3064 VanDerWaalsContact C-N 3.32Å; S3062-E3064 WeakPolarHBondContact CB-OE2 3.38Å; S3062-E3064 PolarHBondContact O-N 3.3Å; S3062-E3064 PolarHBondContact OG-N 3.04Å; S3062-E3064 PolarHBondContact OG-OE2 3.39Å; E3064-W3066 VanDerWaalsContact C-N 3.3Å; E3064-W3066 PolarHBondContact O-N 3.22Å; E3064-F3067 WeakPolarHBondContact O-CA 3.46Å; E3064-F3067 WeakPolarHBondContact O-CB 3.29Å; E3064-F3067 PolarHBondContact O-N 3.18Å; E3064-F3067 VanDerWaalsContact O-N 3.14Å; E3064-E3068 PolarHBondContact O-N 2.93Å
3065A92.5Very high94.5Very high21 Ų2157.2 Ų57.217%0.17428%0.277CS..Hα-helixtrans-62.7-37.6175.800000112H3061 S3062 F3067 R3069H3061-A3065 WeakPolarHBondContact CE1-CB 3.34Å; H3061-A3065 WeakPolarHBondContact NE2-CB 3.44Å; S3062-A3065 PolarHBondContact O-N 3Å; S3062-A3065 WeakPolarHBondContact OG-CB 3.45Å; S3062-A3065 PolarHBondContact OG-N 3.05Å; A3065-F3067 VanDerWaalsContact C-N 3.34Å; A3065-R3069 VanDerWaalsContact O-CB 3.26Å; A3065-R3069 WeakPolarHBondContact O-CB 3.2Å; A3065-R3069 WeakPolarHBondContact O-CD 3.38Å; A3065-R3069 WeakPolarHBondContact O-CG 3.45Å; A3065-R3069 PolarHBondContact O-N 3.41Å
3066W95.2Very high94.6Very high56 Ų5657 Ų5721%0.21228%0.276CS..Hα-helixtrans-61.8-46170.6168.277.1000111.8W3057 S3062 E3064 R3069 R3070W3057-W3066 HydrophobicContact CE3-CB 4.08Å; W3057-W3066 AromaticContact CE3-CD1 3.8Å; W3057-W3066 AromaticContact CE3-CD2 3.59Å; W3057-W3066 HydrophobicContact CE3-CD2 3.59Å; W3057-W3066 AromaticContact CE3-CE2 3.83Å; W3057-W3066 HydrophobicContact CE3-CE3 4.14Å; W3057-W3066 AromaticContact CE3-CG 3.55Å; W3057-W3066 HydrophobicContact CE3-CG 3.55Å; W3057-W3066 HydrophobicContact CE3-CZ2 4.5Å; W3057-W3066 AromaticContact CE3-NE1 3.93Å; W3057-W3066 HydrophobicContact CZ3-CB 4.23Å; W3057-W3066 AromaticContact CZ3-CD2 3.85Å; W3057-W3066 HydrophobicContact CZ3-CD2 3.85Å; W3057-W3066 AromaticContact CZ3-CE3 3.93Å; W3057-W3066 HydrophobicContact CZ3-CE3 3.93Å; W3057-W3066 AromaticContact CZ3-CG 3.97Å; W3057-W3066 HydrophobicContact CZ3-CG 4Å; S3062-W3066 WeakPolarHBondContact O-CB 3.41Å; S3062-W3066 PolarHBondContact O-N 3.28Å; E3064-W3066 VanDerWaalsContact C-N 3.3Å; E3064-W3066 PolarHBondContact O-N 3.22Å; W3066-R3069 PolarHBondContact O-N 2.99Å; W3066-R3070 VanDerWaalsContact O-CB 3.27Å; W3066-R3070 WeakPolarHBondContact O-CB 3.35Å; W3066-R3070 PolarHBondContact O-N 3.06Å
3067F94.3Very high94.8Very high72.5 Ų72.556.7 Ų56.732%0.31828%0.275SS..Hα-helixtrans-61.9-47-178.8-178.6-99.5000111.7S3063 E3064 A3065 R3069 R3070 T3071S3063-F3067 WeakPolarHBondContact O-CB 3.33Å; S3063-F3067 PolarHBondContact O-N 3.34Å; E3064-F3067 WeakPolarHBondContact O-CA 3.46Å; E3064-F3067 WeakPolarHBondContact O-CB 3.29Å; E3064-F3067 PolarHBondContact O-N 3.18Å; E3064-F3067 VanDerWaalsContact O-N 3.14Å; A3065-F3067 VanDerWaalsContact C-N 3.34Å; F3067-R3069 PolarHBondContact O-N 2.92Å; F3067-R3070 PolarHBondContact O-N 3.13Å; F3067-T3071 WeakPolarHBondContact O-CB 3.37Å; F3067-T3071 PolarHBondContact O-N 3.09Å; F3067-T3071 PolarHBondContact O-OG1 3.39Å; F3067-T3071 VanDerWaalsContact O-OG1 3.05Å
3068E93.3Very high94.9Very high123 Ų12350.4 Ų50.458%0.57525%0.251SS*.Hα-helixtrans-61-47.7174.3-70.7-163.2152.900112.1E3064 R3070 T3071 N3072E3064-E3068 PolarHBondContact O-N 2.93Å; E3068-R3070 VanDerWaalsContact C-N 3.33Å; E3068-R3070 PolarHBondContact O-N 3.18Å; E3068-T3071 PolarHBondContact O-N 3.17Å; E3068-N3072 WeakPolarHBondContact O-CB 3.38Å; E3068-N3072 PolarHBondContact O-N 3.08Å; E3068-N3072 PolarHBondContact O-ND2 3.17Å
3069R94.9Very high95.1Very high26 Ų2644.9 Ų44.910%0.09822%0.222CC..Hα-helixtrans-61.5-41.2178.8-75.4174.9123.4-168.68.1112K3059 S3060 A3065 W3066 F3067 N3072 F3073 R3101 V3102K3059-R3069 PolarHBondContact O-NH1 3.35Å; S3060-R3069 PolarHBondContact OG-NH1 3.35Å; A3065-R3069 VanDerWaalsContact O-CB 3.26Å; A3065-R3069 WeakPolarHBondContact O-CB 3.2Å; A3065-R3069 WeakPolarHBondContact O-CD 3.38Å; A3065-R3069 WeakPolarHBondContact O-CG 3.45Å; A3065-R3069 PolarHBondContact O-N 3.41Å; W3066-R3069 PolarHBondContact O-N 2.99Å; F3067-R3069 PolarHBondContact O-N 2.92Å; R3069-N3072 PolarHBondContact O-N 3.2Å; R3069-F3073 VanDerWaalsContact O-CB 3.27Å; R3069-F3073 WeakPolarHBondContact O-CB 3.2Å; R3069-F3073 PolarHBondContact O-N 2.94Å; R3069-R3101 PolarHBondContact NE-O 3.01Å; R3069-R3101 PolarHBondContact NH1-O 3.19Å; R3069-R3101 PolarHBondContact NH2-O 3.26Å; R3069-V3102 PolarHBondContact NE-O 2.91Å
3070R96Very high95.3Very high30 Ų3041.7 Ų41.711%0.11321%0.209CC..Hα-helixtrans-66.1-42.9176.2-170.917967.9160.6-4.3111.4L3056 W3066 F3067 E3068 N3072 F3073 T3074 A3139 M3140L3056-R3070 HydrophobicContact CD2-CB 4.11Å; L3056-R3070 HydrophobicContact CD2-CG 4.26Å; W3066-R3070 VanDerWaalsContact O-CB 3.27Å; W3066-R3070 WeakPolarHBondContact O-CB 3.35Å; W3066-R3070 PolarHBondContact O-N 3.06Å; F3067-R3070 PolarHBondContact O-N 3.13Å; E3068-R3070 VanDerWaalsContact C-N 3.33Å; E3068-R3070 PolarHBondContact O-N 3.18Å; R3070-N3072 VanDerWaalsContact C-N 3.34Å; R3070-N3072 PolarHBondContact O-N 3.49Å; R3070-F3073 WeakPolarHBondContact O-CB 3.22Å; R3070-F3073 PolarHBondContact O-N 3.31Å; R3070-T3074 PolarHBondContact O-N 3.4Å; R3070-T3074 PolarHBondContact O-OG1 3.05Å; R3070-T3074 VanDerWaalsContact O-OG1 3.12Å; R3070-A3139 WeakPolarHBondContact CG-O 3.44Å; R3070-M3140 WeakPolarHBondContact CD-O 3.41Å; R3070-M3140 PolarHBondContact NH1-O 2.95Å
3071T95.1Very high95.4Very high13 Ų1340.8 Ų40.88%0.0820%0.202CC..Hα-helixtrans-62.4-43.1175.3-59.40000111.4F3067 E3068 T3074 R3075F3067-T3071 WeakPolarHBondContact O-CB 3.37Å; F3067-T3071 PolarHBondContact O-N 3.09Å; F3067-T3071 PolarHBondContact O-OG1 3.39Å; F3067-T3071 VanDerWaalsContact O-OG1 3.05Å; E3068-T3071 PolarHBondContact O-N 3.17Å; T3071-T3074 PolarHBondContact O-N 3.15Å; T3071-R3075 VanDerWaalsContact CG2-NH2 3.31Å; T3071-R3075 WeakPolarHBondContact O-CB 3.27Å; T3071-R3075 VanDerWaalsContact O-CG 3.3Å; T3071-R3075 WeakPolarHBondContact O-CG 3.33Å; T3071-R3075 PolarHBondContact O-N 3.2Å
3072N96Very high95.7Very high29.5 Ų29.533.2 Ų33.216%0.15817%0.167CC..Hα-helixtrans-65.6-39.2175.2-75-25.4000112.3E3068 R3069 R3070 S3076 T3103 K3105E3068-N3072 WeakPolarHBondContact O-CB 3.38Å; E3068-N3072 PolarHBondContact O-N 3.08Å; E3068-N3072 PolarHBondContact O-ND2 3.17Å; R3069-N3072 PolarHBondContact O-N 3.2Å; R3070-N3072 VanDerWaalsContact C-N 3.34Å; R3070-N3072 PolarHBondContact O-N 3.49Å; N3072-S3076 VanDerWaalsContact O-CB 3.26Å; N3072-S3076 WeakPolarHBondContact O-CB 3.41Å; N3072-S3076 PolarHBondContact O-N 2.95Å; N3072-S3076 PolarHBondContact O-OG 3.41Å; N3072-T3103 VanDerWaalsContact CB-O 3.24Å; N3072-T3103 WeakPolarHBondContact CB-O 3.38Å; N3072-T3103 PolarHBondContact ND2-O 3.37Å; N3072-K3105 HydrophobicContact CB-CG 4.09Å
3073F96.8Very high95.8Very high0.5 Ų0.530.9 Ų30.90%0.00215%0.151CC..Hα-helixtrans-58-56.3173167.1-98.8000110.7F2999 L3052 L3056 R3069 R3070 R3075 S3076 M3077 L3099 G3104 V3106 I3136 A3139 M3140F2999-F3073 HydrophobicContact CE1-CE2 4.46Å; F2999-F3073 HydrophobicContact CE2-CE2 4.39Å; F2999-F3073 AromaticContact CZ-CE2 3.78Å; F2999-F3073 HydrophobicContact CZ-CE2 3.78Å; F2999-F3073 HydrophobicContact CZ-CZ 4.5Å; L3052-F3073 HydrophobicContact CD2-CE2 4.32Å; L3052-F3073 HydrophobicContact CD2-CZ 4.02Å; L3056-F3073 HydrophobicContact CD1-CG 4.48Å; R3069-F3073 VanDerWaalsContact O-CB 3.27Å; R3069-F3073 WeakPolarHBondContact O-CB 3.2Å; R3069-F3073 PolarHBondContact O-N 2.94Å; R3070-F3073 WeakPolarHBondContact O-CB 3.22Å; R3070-F3073 PolarHBondContact O-N 3.31Å; F3073-R3075 PolarHBondContact O-N 3.35Å; F3073-S3076 PolarHBondContact O-N 2.93Å; F3073-S3076 PolarHBondContact O-OG 3.36Å; F3073-S3076 VanDerWaalsContact O-OG 3.13Å; F3073-M3077 VanDerWaalsContact O-CB 3.31Å; F3073-M3077 WeakPolarHBondContact O-CB 3.46Å; F3073-M3077 PolarHBondContact O-N 3.21Å; F3073-L3099 HydrophobicContact CD2-CD1 3.7Å; F3073-L3099 HydrophobicContact CE2-CD1 4.24Å; F3073-G3104 VanDerWaalsContact CA-O 3.23Å; F3073-G3104 WeakPolarHBondContact CA-O 3.44Å; F3073-G3104 WeakPolarHBondContact CB-O 3.26Å; F3073-G3104 PolarHBondContact N-O 3.04Å; F3073-V3106 HydrophobicContact CD2-CG2 3.61Å; F3073-V3106 HydrophobicContact CE2-CG2 3.95Å; F3073-I3136 HydrophobicContact CZ-CG2 4.13Å; F3073-A3139 HydrophobicContact CD1-CB 4.47Å; F3073-A3139 HydrophobicContact CE1-CB 3.61Å; F3073-A3139 HydrophobicContact CZ-CB 3.86Å; F3073-M3140 HydrophobicContact CE1-CG 4.27Å
3074T97.1Very high95.9Very high1.5 Ų1.527.7 Ų27.71%0.00913%0.129CC..Hα-helixtrans-58.9-45.9-179.6-57.10000111.9R3070 T3071 A3078 M3140 E3141 V3148 Y3149R3070-T3074 PolarHBondContact O-N 3.4Å; R3070-T3074 PolarHBondContact O-OG1 3.05Å; R3070-T3074 VanDerWaalsContact O-OG1 3.12Å; T3071-T3074 PolarHBondContact O-N 3.15Å; T3074-A3078 WeakPolarHBondContact O-CB 3.41Å; T3074-A3078 PolarHBondContact O-N 3.12Å; T3074-M3140 HydrophobicContact CG2-CB 4.4Å; T3074-M3140 HydrophobicContact CG2-CG 4.18Å; T3074-M3140 HydrophobicContact CG2-SD 4.13Å; T3074-E3141 PolarHBondContact OG1-OE1 3.11Å; T3074-V3148 HydrophobicContact CG2-CB 4.09Å; T3074-V3148 HydrophobicContact CG2-CG1 4.17Å; T3074-Y3149 HydrophobicContact CG2-CD2 4.4Å
3075R97Very high96.1Very high51.5 Ų51.524 Ų2419%0.19411%0.111CC..Hα-helixtrans-65.4-46.4179.5-74.4178.4-174.6159.57.6112.8R2971 L2973 T3071 F3073 M3077 A3078 T3079 V3148R2971-R3075 WeakPolarHBondContact O-CD 3.29Å; R2971-R3075 PolarHBondContact O-NH1 2.83Å; L2973-R3075 HydrophobicContact CD2-CB 3.74Å; L2973-R3075 HydrophobicContact CD2-CG 4Å; T3071-R3075 VanDerWaalsContact CG2-NH2 3.31Å; T3071-R3075 WeakPolarHBondContact O-CB 3.27Å; T3071-R3075 VanDerWaalsContact O-CG 3.3Å; T3071-R3075 WeakPolarHBondContact O-CG 3.33Å; T3071-R3075 PolarHBondContact O-N 3.2Å; F3073-R3075 PolarHBondContact O-N 3.35Å; R3075-M3077 VanDerWaalsContact C-N 3.34Å; R3075-M3077 PolarHBondContact O-N 2.79Å; R3075-A3078 PolarHBondContact O-N 3.16Å; R3075-T3079 WeakPolarHBondContact O-CB 3.3Å; R3075-T3079 PolarHBondContact O-N 3.17Å; R3075-T3079 PolarHBondContact O-OG1 3.09Å; R3075-V3148 HydrophobicContact CG-CG1 3.6Å
3076S97.3Very high96.2Very high7 Ų723 Ų235%0.04910%0.102CC..Hα-helixtrans-68.3-37.7179.558.20000112.2N3072 F3073 T3079 M3080 K3105 V3106N3072-S3076 VanDerWaalsContact O-CB 3.26Å; N3072-S3076 WeakPolarHBondContact O-CB 3.41Å; N3072-S3076 PolarHBondContact O-N 2.95Å; N3072-S3076 PolarHBondContact O-OG 3.41Å; F3073-S3076 PolarHBondContact O-N 2.93Å; F3073-S3076 PolarHBondContact O-OG 3.36Å; F3073-S3076 VanDerWaalsContact O-OG 3.13Å; S3076-T3079 PolarHBondContact O-N 3.09Å; S3076-M3080 WeakPolarHBondContact O-CB 3.32Å; S3076-M3080 PolarHBondContact O-N 3.41Å; S3076-K3105 WeakPolarHBondContact OG-CA 3.39Å; S3076-V3106 PolarHBondContact OG-N 3.12Å
3077M97.6Very high95.9Very high2 Ų220.4 Ų20.41%0.019%0.093CC..Hα-helixtrans-61.9-46.9172.5-167.769.5-159.400111.2F3073 R3075 T3079 M3080 S3081 V3106 R3131 I3136 M3140 Y3149F3073-M3077 VanDerWaalsContact O-CB 3.31Å; F3073-M3077 WeakPolarHBondContact O-CB 3.46Å; F3073-M3077 PolarHBondContact O-N 3.21Å; R3075-M3077 VanDerWaalsContact C-N 3.34Å; R3075-M3077 PolarHBondContact O-N 2.79Å; M3077-T3079 VanDerWaalsContact C-N 3.33Å; M3077-T3079 PolarHBondContact O-N 3.05Å; M3077-M3080 PolarHBondContact O-N 2.93Å; M3077-S3081 VanDerWaalsContact O-CB 3.31Å; M3077-S3081 WeakPolarHBondContact O-CB 3.43Å; M3077-S3081 PolarHBondContact O-N 3.31Å; M3077-S3081 PolarHBondContact O-OG 3.45Å; M3077-S3081 VanDerWaalsContact O-OG 3.08Å; M3077-V3106 HydrophobicContact CB-CG2 4.29Å; M3077-V3106 HydrophobicContact SD-CG1 4.24Å; M3077-V3106 HydrophobicContact SD-CG2 4.31Å; M3077-R3131 WeakPolarHBondContact CE-O 3.43Å; M3077-I3136 HydrophobicContact CE-CD1 3.93Å; M3077-I3136 HydrophobicContact CE-CG2 4.31Å; M3077-I3136 HydrophobicContact CG-CG2 4.03Å; M3077-I3136 HydrophobicContact SD-CG2 4.17Å; M3077-M3140 HydrophobicContact CG-CE 4.27Å; M3077-Y3149 HydrophobicContact CB-CE2 4.39Å; M3077-Y3149 HydrophobicContact CG-CE2 4.19Å
3078A97.8Very high95.7Very high0 Ų017.4 Ų17.40%08%0.081CC..Hα-helixtrans-60.5-45.4176.500000112.4T3074 R3075 M3080 S3081 M3082 Y3149 T3152T3074-A3078 WeakPolarHBondContact O-CB 3.41Å; T3074-A3078 PolarHBondContact O-N 3.12Å; R3075-A3078 PolarHBondContact O-N 3.16Å; A3078-M3080 PolarHBondContact O-N 3.5Å; A3078-S3081 PolarHBondContact O-N 3.49Å; A3078-M3082 PolarHBondContact O-N 3.42Å; A3078-M3082 VanDerWaalsContact O-N 3.13Å; A3078-Y3149 VanDerWaalsContact CA-CE2 3.48Å; A3078-Y3149 HydrophobicContact CB-CD2 3.6Å; A3078-Y3149 HydrophobicContact CB-CE2 3.81Å; A3078-Y3149 HydrophobicContact CB-CG 4.23Å; A3078-T3152 HydrophobicContact CB-CG2 3.69Å
3079T97.8Very high95.7Very high1 Ų112 Ų121%0.0066%0.057CC..Hα-helixtrans-60.1-47.9177-55.40000111.1L2962 I2975 R3075 S3076 M3077 S3081 M3082 V3083 V3156L2962-T3079 HydrophobicContact CD1-CG2 4Å; I2975-T3079 HydrophobicContact CG1-CG2 4.02Å; R3075-T3079 WeakPolarHBondContact O-CB 3.3Å; R3075-T3079 PolarHBondContact O-N 3.17Å; R3075-T3079 PolarHBondContact O-OG1 3.09Å; S3076-T3079 PolarHBondContact O-N 3.09Å; M3077-T3079 VanDerWaalsContact C-N 3.33Å; M3077-T3079 PolarHBondContact O-N 3.05Å; T3079-S3081 VanDerWaalsContact C-N 3.33Å; T3079-S3081 PolarHBondContact O-N 3.5Å; T3079-M3082 PolarHBondContact O-N 3.06Å; T3079-V3083 HydrophobicContact CG2-CG2 4.37Å; T3079-V3083 WeakPolarHBondContact O-CB 3.38Å; T3079-V3083 WeakPolarHBondContact O-CG2 3.38Å; T3079-V3083 PolarHBondContact O-N 2.91Å; T3079-V3083 VanDerWaalsContact O-N 3.12Å; T3079-V3156 HydrophobicContact CG2-CG1 4.45Å; T3079-V3156 HydrophobicContact CG2-CG2 4.26Å
3080M97.2Very high95.5Very high8 Ų811 Ų114%0.0395%0.054CC..Hα-helixtrans-70.6-29.9179.3-78.5-56-59.700113.8F2955 I2975 S3076 M3077 A3078 G3084 L3089 H3108F2955-M3080 HydrophobicContact CE1-CE 4.4Å; F2955-M3080 HydrophobicContact CE2-CE 4.21Å; F2955-M3080 HydrophobicContact CZ-CE 3.78Å; F2955-M3080 HydrophobicContact CZ-SD 4.3Å; I2975-M3080 HydrophobicContact CB-SD 4.27Å; I2975-M3080 HydrophobicContact CD1-SD 4.17Å; I2975-M3080 HydrophobicContact CG1-SD 3.91Å; I2975-M3080 HydrophobicContact CG2-SD 3.52Å; I2975-M3080 VanDerWaalsContact CG2-SD 3.56Å; I2975-M3080 WeakPolarHBondContact CG2-SD 3.45Å; S3076-M3080 WeakPolarHBondContact O-CB 3.32Å; S3076-M3080 PolarHBondContact O-N 3.41Å; M3077-M3080 PolarHBondContact O-N 2.93Å; A3078-M3080 PolarHBondContact O-N 3.5Å; M3080-G3084 WeakPolarHBondContact O-CA 3.37Å; M3080-G3084 PolarHBondContact O-N 3.13Å; M3080-L3089 HydrophobicContact CE-CD2 4.49Å; M3080-H3108 HydrophobicContact CE-CB 4Å
3081S97.5Very high95.3Very high2 Ų211.2 Ų11.21%0.0146%0.058CC..Hα-helixtrans-62.7-48.2174-64.80000111.4M3077 A3078 T3079 Y3085 F3130 Y3149M3077-S3081 VanDerWaalsContact O-CB 3.31Å; M3077-S3081 WeakPolarHBondContact O-CB 3.43Å; M3077-S3081 PolarHBondContact O-N 3.31Å; M3077-S3081 PolarHBondContact O-OG 3.45Å; M3077-S3081 VanDerWaalsContact O-OG 3.08Å; A3078-S3081 PolarHBondContact O-N 3.49Å; T3079-S3081 VanDerWaalsContact C-N 3.33Å; T3079-S3081 PolarHBondContact O-N 3.5Å; S3081-Y3085 VanDerWaalsContact O-CB 3.31Å; S3081-Y3085 WeakPolarHBondContact O-CB 3.35Å; S3081-Y3085 PolarHBondContact O-N 3.19Å; S3081-F3130 VanDerWaalsContact O-CD1 3.29Å; S3081-F3130 WeakPolarHBondContact O-CD1 3.46Å; S3081-Y3149 VanDerWaalsContact CB-OH 3.27Å; S3081-Y3149 WeakPolarHBondContact CB-OH 3.42Å; S3081-Y3149 PolarHBondContact OG-OH 3.09Å
3082M97.5Very high95.3Very high11 Ų1111.1 Ų11.15%0.0546%0.056CC..Hα-helixtrans-68.7-44.5179.2-65.2-59.596.100112.3A3078 T3079 G3084 Y3085 I3086 F3130 C3153 V3156 M3157 V3414 L3417A3078-M3082 PolarHBondContact O-N 3.42Å; A3078-M3082 VanDerWaalsContact O-N 3.13Å; T3079-M3082 PolarHBondContact O-N 3.06Å; M3082-G3084 VanDerWaalsContact C-N 3.34Å; M3082-Y3085 WeakPolarHBondContact O-CB 3.25Å; M3082-Y3085 PolarHBondContact O-N 3.36Å; M3082-I3086 WeakPolarHBondContact O-CG1 3.35Å; M3082-I3086 PolarHBondContact O-N 3Å; M3082-I3086 VanDerWaalsContact O-N 3.12Å; M3082-F3130 HydrophobicContact CE-CD1 4.34Å; M3082-F3130 HydrophobicContact CE-CE1 3.49Å; M3082-F3130 VanDerWaalsContact CE-CE1 3.41Å; M3082-F3130 HydrophobicContact CE-CZ 3.74Å; M3082-C3153 HydrophobicContact CE-CB 4.16Å; M3082-C3153 HydrophobicContact CG-CB 3.77Å; M3082-C3153 HydrophobicContact SD-CB 3.81Å; M3082-V3156 HydrophobicContact CB-CB 4.44Å; M3082-V3156 HydrophobicContact CB-CG1 3.9Å; M3082-V3156 HydrophobicContact CG-CG1 4.5Å; M3082-M3157 HydrophobicContact SD-CB 4.32Å; M3082-V3414 HydrophobicContact SD-CG2 3.89Å; M3082-L3417 HydrophobicContact CE-CD1 4.45Å
3083V96.6Very high95.2Very high0 Ų012.3 Ų12.30%06%0.06CC..Hα-helixtrans-67.5-39.7179.8176.50000111F2954 F2955 V2958 I2975 T3079 Y3085 I3086 L3087 V3156 L3160F2954-V3083 HydrophobicContact CD1-CG1 4.48Å; F2954-V3083 HydrophobicContact CE1-CG1 3.84Å; F2955-V3083 HydrophobicContact CD1-CG1 3.99Å; F2955-V3083 HydrophobicContact CE1-CG1 3.71Å; V2958-V3083 HydrophobicContact CG1-CG2 3.99Å; I2975-V3083 HydrophobicContact CD1-CB 4.34Å; I2975-V3083 HydrophobicContact CD1-CG1 3.93Å; I2975-V3083 HydrophobicContact CD1-CG2 4.05Å; T3079-V3083 HydrophobicContact CG2-CG2 4.37Å; T3079-V3083 WeakPolarHBondContact O-CB 3.38Å; T3079-V3083 WeakPolarHBondContact O-CG2 3.38Å; T3079-V3083 PolarHBondContact O-N 2.91Å; T3079-V3083 VanDerWaalsContact O-N 3.12Å; V3083-Y3085 VanDerWaalsContact C-N 3.34Å; V3083-Y3085 PolarHBondContact O-N 3.11Å; V3083-I3086 PolarHBondContact O-N 3.09Å; V3083-L3087 WeakPolarHBondContact O-CB 3.41Å; V3083-L3087 PolarHBondContact O-N 2.94Å; V3083-V3156 HydrophobicContact CG2-CG1 4.21Å; V3083-L3160 HydrophobicContact CG2-CD1 3.99Å; V3083-L3160 HydrophobicContact CG2-CD2 4.49Å
3084G95.2Very high95.1Very high4 Ų413.3 Ų13.34%0.0417%0.067CC..Hα-helixtrans-64.4-40.3174.600000112.8M3080 M3082 L3087 G3088 L3089M3080-G3084 WeakPolarHBondContact O-CA 3.37Å; M3080-G3084 PolarHBondContact O-N 3.13Å; M3082-G3084 VanDerWaalsContact C-N 3.34Å; G3084-L3087 CarbonylContact O-C 3.58Å; G3084-L3087 PolarHBondContact O-N 3.33Å; G3084-G3088 PolarHBondContact O-N 2.93Å; G3084-L3089 PolarHBondContact O-N 3.07Å
3085Y95.8Very high94.9Very high45.5 Ų45.515.4 Ų15.418%0.1788%0.081CC..Hα-helixtrans-61-46.1174165.3-111.4000112.4S3081 M3082 V3083 L3087 G3088 P3129 M3157 K3398 E3403 Q3413 L3417S3081-Y3085 VanDerWaalsContact O-CB 3.31Å; S3081-Y3085 WeakPolarHBondContact O-CB 3.35Å; S3081-Y3085 PolarHBondContact O-N 3.19Å; M3082-Y3085 WeakPolarHBondContact O-CB 3.25Å; M3082-Y3085 PolarHBondContact O-N 3.36Å; V3083-Y3085 VanDerWaalsContact C-N 3.34Å; V3083-Y3085 PolarHBondContact O-N 3.11Å; Y3085-L3087 VanDerWaalsContact C-N 3.28Å; Y3085-L3087 PolarHBondContact O-N 2.8Å; Y3085-G3088 PolarHBondContact O-N 2.94Å; Y3085-G3088 VanDerWaalsContact O-N 3.15Å; Y3085-P3129 HydrophobicContact CD2-CB 3.77Å; Y3085-P3129 HydrophobicContact CE2-CB 4.1Å; Y3085-M3157 HydrophobicContact CD1-CE 4.19Å; Y3085-M3157 HydrophobicContact CE1-CE 4.06Å; Y3085-K3398 HydrophobicContact CD2-CD 4.2Å; Y3085-K3398 HydrophobicContact CE1-CB 4.09Å; Y3085-K3398 HydrophobicContact CE1-CD 4.12Å; Y3085-K3398 HydrophobicContact CE1-CG 4.14Å; Y3085-K3398 HydrophobicContact CE2-CD 3.75Å; Y3085-K3398 HydrophobicContact CE2-CG 4.07Å; Y3085-K3398 WeakPolarHBondContact O-CD 3.24Å; Y3085-K3398 PolarHBondContact O-NZ 3.18Å; Y3085-E3403 WeakPolarHBondContact CE2-OE2 3.3Å; Y3085-E3403 PolarHBondContact OH-OE2 3.48Å; Y3085-Q3413 PolarHBondContact OH-NE2 3.32Å; Y3085-L3417 HydrophobicContact CD1-CD1 3.56Å; Y3085-L3417 HydrophobicContact CD1-CD2 4.27Å; Y3085-L3417 HydrophobicContact CD2-CD1 4.42Å; Y3085-L3417 HydrophobicContact CD2-CD2 3.62Å; Y3085-L3417 HydrophobicContact CE1-CD1 3.46Å; Y3085-L3417 VanDerWaalsContact CE1-CD1 3.46Å; Y3085-L3417 HydrophobicContact CE1-CD2 4.09Å; Y3085-L3417 HydrophobicContact CE1-CG 4.39Å; Y3085-L3417 HydrophobicContact CE2-CD1 4.35Å; Y3085-L3417 HydrophobicContact CE2-CD2 3.42Å; Y3085-L3417 VanDerWaalsContact CE2-CD2 3.42Å; Y3085-L3417 HydrophobicContact CG-CD1 4.03Å; Y3085-L3417 HydrophobicContact CG-CD2 4.03Å
3086I93.5Very high94.8Very high0 Ų013.5 Ų13.50%08%0.075CC..Hα-helixtrans-59.6-44.2175.8-68.5-54.7000110.9F2954 M3082 V3083 G3088 M3157 L3160 I3395 K3398 L3399F2954-I3086 HydrophobicContact CZ-CG2 4.35Å; M3082-I3086 WeakPolarHBondContact O-CG1 3.35Å; M3082-I3086 PolarHBondContact O-N 3Å; M3082-I3086 VanDerWaalsContact O-N 3.12Å; V3083-I3086 PolarHBondContact O-N 3.09Å; I3086-G3088 PolarHBondContact O-N 2.92Å; I3086-M3157 HydrophobicContact CD1-CE 3.74Å; I3086-M3157 HydrophobicContact CD1-SD 4.05Å; I3086-M3157 HydrophobicContact CG1-SD 4.33Å; I3086-L3160 HydrophobicContact CG1-CD1 3.99Å; I3086-I3395 HydrophobicContact CG2-CG2 4.15Å; I3086-K3398 HydrophobicContact CD1-CB 3.65Å; I3086-L3399 HydrophobicContact CD1-CD2 3.76Å; I3086-L3399 HydrophobicContact CD1-CG 4.07Å; I3086-L3399 HydrophobicContact CG1-CD2 4.11Å; I3086-L3399 HydrophobicContact CG2-CD1 4.33Å; I3086-L3399 HydrophobicContact CG2-CD2 4.01Å; I3086-L3399 HydrophobicContact CG2-CG 4.15Å
3087L90.1Very high94.8Very high1 Ų113.2 Ų13.21%0.0057%0.073CC..Hα-helixtrans-72.2-21.5179.1-172.962.6000113.4I2951 F2955 V3083 G3084 Y3085 C3114 F3115 L3171I2951-L3087 HydrophobicContact CD1-CD2 4.14Å; I2951-L3087 HydrophobicContact CG1-CD1 4.45Å; I2951-L3087 HydrophobicContact CG1-CD2 4.07Å; I2951-L3087 HydrophobicContact CG2-CD2 3.93Å; F2955-L3087 HydrophobicContact CE1-CD2 4.32Å; F2955-L3087 HydrophobicContact CZ-CD2 4.44Å; V3083-L3087 WeakPolarHBondContact O-CB 3.41Å; V3083-L3087 PolarHBondContact O-N 2.94Å; G3084-L3087 CarbonylContact O-C 3.58Å; G3084-L3087 PolarHBondContact O-N 3.33Å; Y3085-L3087 VanDerWaalsContact C-N 3.28Å; Y3085-L3087 PolarHBondContact O-N 2.8Å; L3087-C3114 HydrophobicContact CG-CB 4.38Å; L3087-F3115 HydrophobicContact CD1-CD1 4.42Å; L3087-F3115 HydrophobicContact CD1-CE1 3.7Å; L3087-F3115 HydrophobicContact CD1-CZ 4.02Å; L3087-F3115 WeakPolarHBondContact O-CA 3.35Å; L3087-F3115 WeakPolarHBondContact O-CD1 3.47Å; L3087-F3115 PolarHBondContact O-N 3.39Å; L3087-L3171 HydrophobicContact CD1-CD2 4.16Å
3088G90.3Very high94.7Very high8 Ų814 Ų148%0.0828%0.077CC..THydrogen-bonded Turntrans73.139.9-171.300000112.8G3084 Y3085 I3086 G3090 C3114 F3115 E3116G3084-G3088 PolarHBondContact O-N 2.93Å; Y3085-G3088 PolarHBondContact O-N 2.94Å; Y3085-G3088 VanDerWaalsContact O-N 3.15Å; I3086-G3088 PolarHBondContact O-N 2.92Å; G3088-G3090 PolarHBondContact O-N 3.1Å; G3088-C3114 CarbonylContact O-C 3.51Å; G3088-C3114 VanDerWaalsContact O-C 3.26Å; G3088-F3115 PolarHBondContact O-N 3.12Å; G3088-F3115 VanDerWaalsContact O-N 3.09Å; G3088-E3116 PolarHBondContact O-N 3.17Å
3089L92.5Very high94.6Very high10 Ų1014.5 Ų14.55%0.0528%0.08CC..  trans-76.7110.1-177.4-177.464.2000111.9M3080 G3084 R3092 F3111 C3114M3080-L3089 HydrophobicContact CE-CD2 4.49Å; G3084-L3089 PolarHBondContact O-N 3.07Å; L3089-R3092 HydrophobicContact CG-CG 4.38Å; L3089-F3111 HydrophobicContact CD1-CD1 3.68Å; L3089-F3111 HydrophobicContact CD1-CE1 4.29Å; L3089-F3111 HydrophobicContact CD2-CD1 4.19Å; L3089-F3111 HydrophobicContact CD2-CE1 3.97Å; L3089-C3114 VanDerWaalsContact CD1-SG 3.57Å; L3089-C3114 WeakPolarHBondContact CD1-SG 3.21Å
3090G90.9Very high94.5Very high4.5 Ų4.515.2 Ų15.25%0.0469%0.085CC..  trans-108.1-171.6177.100000113.6G3088 R3092 D3113G3088-G3090 PolarHBondContact O-N 3.1Å; G3090-R3092 VanDerWaalsContact C-N 3.28Å; G3090-R3092 PolarHBondContact O-N 3.18Å; G3090-R3092 PolarHBondContact O-NE 3.47Å; G3090-R3092 PolarHBondContact O-NH2 3.18Å; G3090-D3113 PolarHBondContact N-O 3.06Å
3091D92.3Very high94.3Very high35.5 Ų35.521 Ų2119%0.1911%0.106CC..  trans5439.9-175.3-164.445.4000113.9H3093 N3096 D3113 E3126 W3434D3091-H3093 PolarHBondContact O-N 2.94Å; D3091-H3093 IonicContact OD1-CD2 3.24Å; D3091-H3093 PolarHBondContact OD1-CD2 3.22Å; D3091-H3093 VanDerWaalsContact OD1-CD2 3.25Å; D3091-H3093 IonicContact OD2-CD2 2.95Å; D3091-H3093 PolarHBondContact OD2-CD2 3.22Å; D3091-H3093 IonicContact OD2-NE2 3.29Å; D3091-N3096 PolarHBondContact O-ND2 3.38Å; D3091-N3096 PolarHBondContact OD2-ND2 3.41Å; D3091-D3113 HydrophobicContact CB-CB 3.91Å; D3091-D3113 WeakPolarHBondContact CB-OD2 3.41Å; D3091-E3126 WeakPolarHBondContact CA-OE1 3.25Å; D3091-E3126 PolarHBondContact N-OE1 3.18Å; D3091-E3126 PolarHBondContact N-OE2 3.37Å; D3091-W3434 WeakPolarHBondContact OD1-CZ2 3.48Å; D3091-W3434 PolarHBondContact OD1-NE1 3.01Å
3092R94.8Very high94Very high11 Ų1125.4 Ų25.44%0.04213%0.133CC..  trans-83.354.1179.9-62.7-53.593.8173.510.3111.7L3089 G3090 I3097 H3108 I3109 D3110 R3131L3089-R3092 HydrophobicContact CG-CG 4.38Å; G3090-R3092 VanDerWaalsContact C-N 3.28Å; G3090-R3092 PolarHBondContact O-N 3.18Å; G3090-R3092 PolarHBondContact O-NE 3.47Å; G3090-R3092 PolarHBondContact O-NH2 3.18Å; R3092-I3097 HydrophobicContact CB-CD1 4.36Å; R3092-H3108 WeakPolarHBondContact CD-ND1 3.24Å; R3092-I3109 PolarHBondContact NH1-O 3.16Å; R3092-D3110 VanDerWaalsContact CZ-O 3.25Å; R3092-D3110 PolarHBondContact NH1-O 2.99Å; R3092-D3110 PolarHBondContact NH2-O 3.1Å; R3092-R3131 HydrophobicContact CB-CB 4.22Å; R3092-R3131 WeakPolarHBondContact O-CD 3.3Å; R3092-R3131 PolarHBondContact O-NE 3.24Å
3093H93.5Very high93.8Very high54.5 Ų54.527.2 Ų27.225%0.25215%0.145SC..  trans-73.3161.1174.766.574.6000112.1D3091 S3095 N3096 W3434D3091-H3093 PolarHBondContact O-N 2.94Å; D3091-H3093 IonicContact OD1-CD2 3.24Å; D3091-H3093 PolarHBondContact OD1-CD2 3.22Å; D3091-H3093 VanDerWaalsContact OD1-CD2 3.25Å; D3091-H3093 IonicContact OD2-CD2 2.95Å; D3091-H3093 PolarHBondContact OD2-CD2 3.22Å; D3091-H3093 IonicContact OD2-NE2 3.29Å; H3093-S3095 VanDerWaalsContact CE1-CB 3.48Å; H3093-S3095 WeakPolarHBondContact CE1-CB 3.49Å; H3093-S3095 PolarHBondContact ND1-N 3.44Å; H3093-S3095 PolarHBondContact ND1-OG 3.45Å; H3093-S3095 PolarHBondContact O-N 3.34Å; H3093-N3096 PolarHBondContact CD2-ND2 3.5Å; H3093-N3096 PolarHBondContact CE1-ND2 3.17Å; H3093-N3096 PolarHBondContact CE1-OD1 3.12Å; H3093-N3096 PolarHBondContact ND1-N 3.11Å; H3093-N3096 PolarHBondContact NE2-ND2 3.14Å; H3093-N3096 VanDerWaalsContact NE2-ND2 3.15Å; H3093-N3096 PolarHBondContact NE2-OD1 3.33Å; H3093-N3096 PolarHBondContact O-N 2.98Å; H3093-W3434 HydrophobicContact CB-CB 3.89Å; H3093-W3434 VanDerWaalsContact CB-CD1 3.5Å; H3093-W3434 HydrophobicContact CB-CG 3.85Å; H3093-W3434 AromaticContact CD2-CD1 3.94Å; H3093-W3434 AromaticContact CD2-NE1 3.97Å; H3093-W3434 AromaticContact CG-CD1 3.86Å
3094P94.9Very high93.7Very high21 Ų2127.3 Ų27.314%0.13615%0.145CC..THydrogen-bonded Turntrans-60.7-11.4-171.8-27.337.2000116.6F2999 H3000 W3434 W3438F2999-P3094 HydrophobicContact CB-CB 4.08Å; F2999-P3094 WeakPolarHBondContact CB-O 3.35Å; F2999-P3094 PolarHBondContact N-O 3.34Å; F2999-P3094 VanDerWaalsContact N-O 3.15Å; H3000-P3094 HydrophobicContact CB-CB 4.19Å; H3000-P3094 PolarHBondContact N-O 3.11Å; H3000-P3094 VanDerWaalsContact N-O 3.15Å; P3094-W3434 WeakPolarHBondContact CD-O 3.35Å; P3094-W3438 HydrophobicContact CB-CE3 3.98Å; P3094-W3438 HydrophobicContact CB-CZ3 4.44Å; P3094-W3438 HydrophobicContact CG-CB 4.43Å; P3094-W3438 HydrophobicContact CG-CE3 3.87Å
3095S93.2Very high93.7Very high45 Ų4527.9 Ų27.932%0.31515%0.147SC..THydrogen-bonded Turntrans-85.3-23.6172.3-46.10000113.2T2998 H3093 I3097T2998-S3095 VanDerWaalsContact CG2-O 3.25Å; T2998-S3095 WeakPolarHBondContact CG2-O 3.25Å; H3093-S3095 VanDerWaalsContact CE1-CB 3.48Å; H3093-S3095 WeakPolarHBondContact CE1-CB 3.49Å; H3093-S3095 PolarHBondContact ND1-N 3.44Å; H3093-S3095 PolarHBondContact ND1-OG 3.45Å; H3093-S3095 PolarHBondContact O-N 3.34Å; S3095-I3097 VanDerWaalsContact C-N 3.25Å; S3095-I3097 PolarHBondContact O-N 2.94Å
3096N94.3Very high93.8Very high13 Ų1325.9 Ų25.97%0.0714%0.139CC..SBendtrans-90.64.5180-67.6-6.1000112.6D3091 H3093 I3109D3091-N3096 PolarHBondContact O-ND2 3.38Å; D3091-N3096 PolarHBondContact OD2-ND2 3.41Å; H3093-N3096 PolarHBondContact CD2-ND2 3.5Å; H3093-N3096 PolarHBondContact CE1-ND2 3.17Å; H3093-N3096 PolarHBondContact CE1-OD1 3.12Å; H3093-N3096 PolarHBondContact ND1-N 3.11Å; H3093-N3096 PolarHBondContact NE2-ND2 3.14Å; H3093-N3096 VanDerWaalsContact NE2-ND2 3.15Å; H3093-N3096 PolarHBondContact NE2-OD1 3.33Å; H3093-N3096 PolarHBondContact O-N 2.98Å; N3096-I3109 HydrophobicContact CB-CG1 4.47Å; N3096-I3109 PolarHBondContact O-N 3.08Å
3097I96.7Very high93.9Very high0.5 Ų0.526.1 Ų26.10%0.00314%0.14CC..EExtended strand (participates in β ladder)trans-123.5121.4175.7-49.4-179.6000108.1T2998 F2999 R3092 S3095 V3106 R3131T2998-I3097 CarbonylContact C-O 3.58Å; T2998-I3097 WeakPolarHBondContact CA-O 3.3Å; F2999-I3097 HydrophobicContact CD1-CB 4.38Å; F2999-I3097 HydrophobicContact CD1-CG2 4.03Å; F2999-I3097 WeakPolarHBondContact CD1-O 3.48Å; F2999-I3097 HydrophobicContact CD2-CB 4.41Å; F2999-I3097 HydrophobicContact CD2-CG2 4.21Å; F2999-I3097 HydrophobicContact CE1-CB 4.46Å; F2999-I3097 HydrophobicContact CE1-CG2 3.62Å; F2999-I3097 HydrophobicContact CE2-CB 4.48Å; F2999-I3097 HydrophobicContact CE2-CG2 3.83Å; F2999-I3097 HydrophobicContact CG-CB 4.35Å; F2999-I3097 HydrophobicContact CG-CG2 4.3Å; F2999-I3097 HydrophobicContact CZ-CB 4.47Å; F2999-I3097 HydrophobicContact CZ-CG2 3.49Å; F2999-I3097 VanDerWaalsContact CZ-CG2 3.47Å; F2999-I3097 PolarHBondContact N-O 3.4Å; R3092-I3097 HydrophobicContact CB-CD1 4.36Å; S3095-I3097 VanDerWaalsContact C-N 3.25Å; S3095-I3097 PolarHBondContact O-N 2.94Å; I3097-V3106 HydrophobicContact CG2-CG1 3.47Å; I3097-V3106 VanDerWaalsContact CG2-CG1 3.42Å; I3097-R3131 HydrophobicContact CD1-CB 4.33Å; I3097-R3131 HydrophobicContact CD1-CG 4.42Å
3098M96.2Very high94.2Very high19 Ų1926.7 Ų26.79%0.09414%0.143CC..EExtended strand (participates in β ladder)trans-110.9156.7177.2-58.5-178.979.100111.5V2993 S2996 D2997 T2998 V3106 V3107 I3109V2993-M3098 HydrophobicContact CB-SD 4.49Å; S2996-M3098 WeakPolarHBondContact O-CE 3.13Å; D2997-M3098 CarbonylContact O-C 3.51Å; D2997-M3098 WeakPolarHBondContact O-CA 3.25Å; T2998-M3098 HydrophobicContact CG2-CG 4Å; M3098-V3106 CarbonylContact O-C 3.54Å; M3098-V3106 WeakPolarHBondContact O-CA 3.32Å; M3098-V3107 HydrophobicContact CB-CB 4.28Å; M3098-V3107 PolarHBondContact N-O 3.04Å; M3098-V3107 PolarHBondContact O-N 2.98Å; M3098-I3109 HydrophobicContact CG-CD1 4.24Å; M3098-I3109 HydrophobicContact CG-CG2 4.48Å; M3098-I3109 HydrophobicContact SD-CD1 4.03Å; M3098-I3109 HydrophobicContact SD-CG2 3.9Å
3099L96Very high94.3Very high10.5 Ų10.528.2 Ų28.26%0.05515%0.149CC..EExtended strand (participates in β ladder)trans-120128.6173.1-172.275.4000109.9S2996 D2997 F2999 L3002 L3056 F3073 R3101 G3104 V3106S2996-L3099 VanDerWaalsContact CA-O 3.29Å; S2996-L3099 WeakPolarHBondContact CA-O 3.43Å; S2996-L3099 WeakPolarHBondContact CB-O 3.17Å; D2997-L3099 PolarHBondContact N-O 3.05Å; D2997-L3099 PolarHBondContact O-N 2.7Å; F2999-L3099 HydrophobicContact CD1-CB 4.39Å; F2999-L3099 HydrophobicContact CE1-CB 4.03Å; F2999-L3099 HydrophobicContact CE1-CD1 4.45Å; L3002-L3099 HydrophobicContact CD1-CB 3.82Å; L3002-L3099 HydrophobicContact CD1-CD2 3.78Å; L3002-L3099 HydrophobicContact CD1-CG 4.46Å; L3056-L3099 HydrophobicContact CD1-CD2 3.73Å; L3056-L3099 HydrophobicContact CD2-CD1 4.47Å; L3056-L3099 HydrophobicContact CD2-CD2 3.53Å; L3056-L3099 HydrophobicContact CG-CD2 4.38Å; F3073-L3099 HydrophobicContact CD2-CD1 3.7Å; F3073-L3099 HydrophobicContact CE2-CD1 4.24Å; L3099-R3101 PolarHBondContact O-N 3.16Å; L3099-G3104 VanDerWaalsContact CD1-O 3.27Å; L3099-G3104 WeakPolarHBondContact CD1-O 3.37Å; L3099-V3106 HydrophobicContact CD1-CG2 4.37Å
3100S95.4Very high94.2Very high16 Ų1630.3 Ų30.311%0.11216%0.16CC..EExtended strand (participates in β ladder)trans-67.8121.1169.8-178.70000110.6V3102 T3103 G3104 K3105S3100-V3102 PolarHBondContact O-N 3.46Å; S3100-T3103 VanDerWaalsContact CB-OG1 3.29Å; S3100-T3103 WeakPolarHBondContact CB-OG1 3.22Å; S3100-T3103 PolarHBondContact OG-N 3.07Å; S3100-T3103 PolarHBondContact OG-OG1 3.38Å; S3100-G3104 WeakPolarHBondContact O-CA 3.39Å; S3100-G3104 PolarHBondContact O-N 3.01Å; S3100-K3105 WeakPolarHBondContact CB-O 3.22Å; S3100-K3105 PolarHBondContact N-O 2.86Å
3101R92.3Very high94.1Very high128 Ų12830.1 Ų30.148%0.48316%0.158SC..THydrogen-bonded Turntrans-61.9-30.9176.7-62.2178.4-169.2166.44.1112.3N2995 D2997 R3069 L3099N2995-R3101 VanDerWaalsContact O-CB 3.27Å; N2995-R3101 WeakPolarHBondContact O-CB 3.33Å; N2995-R3101 VanDerWaalsContact O-CG 3.31Å; N2995-R3101 WeakPolarHBondContact O-CG 3.36Å; N2995-R3101 PolarHBondContact O-N 2.97Å; D2997-R3101 VanDerWaalsContact CG-NE 3.29Å; D2997-R3101 IonicContact OD1-CZ 3.04Å; D2997-R3101 IonicContact OD1-NE 3.13Å; D2997-R3101 PolarHBondContact OD1-NE 3.11Å; D2997-R3101 IonicContact OD1-NH2 3.3Å; D2997-R3101 PolarHBondContact OD1-NH2 3.38Å; D2997-R3101 IonicContact OD2-CZ 2.8Å; D2997-R3101 IonicContact OD2-NE 3.2Å; D2997-R3101 PolarHBondContact OD2-NE 3.31Å; D2997-R3101 VanDerWaalsContact OD2-NE 3.14Å; D2997-R3101 IonicContact OD2-NH2 3.66Å; R3069-R3101 PolarHBondContact NE-O 3.01Å; R3069-R3101 PolarHBondContact NH1-O 3.19Å; R3069-R3101 PolarHBondContact NH2-O 3.26Å; L3099-R3101 PolarHBondContact O-N 3.16Å
3102V91.7Very high93.7Very high95 Ų9530 Ų3058%0.57617%0.165SC*.THydrogen-bonded Turntrans-85.5-55.9-176.9-177.50000110.7N2995 R3069 S3100N2995-V3102 HydrophobicContact CB-CG2 4.15Å; R3069-V3102 PolarHBondContact NE-O 2.91Å; S3100-V3102 PolarHBondContact O-N 3.46Å
3103T93.6Very high93.2Very high50 Ų5031 Ų3131%0.30717%0.171SC..THydrogen-bonded Turntrans-93.6-18.1-168.864.30000114.2N3072 S3100 K3105N3072-T3103 VanDerWaalsContact CB-O 3.24Å; N3072-T3103 WeakPolarHBondContact CB-O 3.38Å; N3072-T3103 PolarHBondContact ND2-O 3.37Å; S3100-T3103 VanDerWaalsContact CB-OG1 3.29Å; S3100-T3103 WeakPolarHBondContact CB-OG1 3.22Å; S3100-T3103 PolarHBondContact OG-N 3.07Å; S3100-T3103 PolarHBondContact OG-OG1 3.38Å; T3103-K3105 PolarHBondContact O-N 3.1Å; T3103-K3105 PolarHBondContact OG1-N 3.18Å
3104G93.9Very high92.9Very high0.5 Ų0.528.4 Ų28.41%0.00516%0.159CC..  trans73.10-170.300000114.6F3073 L3099 S3100F3073-G3104 VanDerWaalsContact CA-O 3.23Å; F3073-G3104 WeakPolarHBondContact CA-O 3.44Å; F3073-G3104 WeakPolarHBondContact CB-O 3.26Å; F3073-G3104 PolarHBondContact N-O 3.04Å; L3099-G3104 VanDerWaalsContact CD1-O 3.27Å; L3099-G3104 WeakPolarHBondContact CD1-O 3.37Å; S3100-G3104 WeakPolarHBondContact O-CA 3.39Å; S3100-G3104 PolarHBondContact O-N 3.01Å
3105K96.2Very high92.4Very high18 Ų1828.1 Ų28.18%0.07816%0.155CC..  trans-68.7138.7175.8-69.7-173.5173.1-179.30111.1N2972 T2974 Q2976 N3072 S3076 S3100 T3103N2972-K3105 PolarHBondContact O-NZ 3.32Å; N2972-K3105 PolarHBondContact OD1-NZ 2.71Å; T2974-K3105 PolarHBondContact OG1-NZ 3.29Å; Q2976-K3105 HydrophobicContact CG-CB 4.21Å; N3072-K3105 HydrophobicContact CB-CG 4.09Å; S3076-K3105 WeakPolarHBondContact OG-CA 3.39Å; S3100-K3105 WeakPolarHBondContact CB-O 3.22Å; S3100-K3105 PolarHBondContact N-O 2.86Å; T3103-K3105 PolarHBondContact O-N 3.1Å; T3103-K3105 PolarHBondContact OG1-N 3.18Å
3106V96.9Very high92Very high2.5 Ų2.527.2 Ų27.22%0.01515%0.147CC..EExtended strand (participates in β ladder)trans-76.4140.5173179.90000109.8F2999 F3073 S3076 M3077 I3097 M3098 L3099F2999-V3106 HydrophobicContact CZ-CG1 4.35Å; F2999-V3106 HydrophobicContact CZ-CG2 4.25Å; F3073-V3106 HydrophobicContact CD2-CG2 3.61Å; F3073-V3106 HydrophobicContact CE2-CG2 3.95Å; S3076-V3106 PolarHBondContact OG-N 3.12Å; M3077-V3106 HydrophobicContact CB-CG2 4.29Å; M3077-V3106 HydrophobicContact SD-CG1 4.24Å; M3077-V3106 HydrophobicContact SD-CG2 4.31Å; I3097-V3106 HydrophobicContact CG2-CG1 3.47Å; I3097-V3106 VanDerWaalsContact CG2-CG1 3.42Å; M3098-V3106 CarbonylContact O-C 3.54Å; M3098-V3106 WeakPolarHBondContact O-CA 3.32Å; L3099-V3106 HydrophobicContact CD1-CG2 4.37Å
3107V96.3Very high91.5Very high4 Ų428.2 Ų28.22%0.02415%0.153CC..EExtended strand (participates in β ladder)trans-128.2120.5175.8-168.10000108.3Q2976 M2978 V2993 M3098Q2976-V3107 HydrophobicContact CB-CB 4.43Å; Q2976-V3107 HydrophobicContact CB-CG1 4.13Å; Q2976-V3107 HydrophobicContact CB-CG2 3.76Å; Q2976-V3107 HydrophobicContact CG-CG1 4.21Å; Q2976-V3107 HydrophobicContact CG-CG2 3.82Å; M2978-V3107 HydrophobicContact CE-CG1 3.88Å; V2993-V3107 HydrophobicContact CG1-CG1 4.45Å; V2993-V3107 HydrophobicContact CG1-CG2 4.37Å; V2993-V3107 HydrophobicContact CG2-CG1 4.27Å; M3098-V3107 HydrophobicContact CB-CB 4.28Å; M3098-V3107 PolarHBondContact N-O 3.04Å; M3098-V3107 PolarHBondContact O-N 2.98Å
3108H96.1Very high91Very high13.5 Ų13.528.2 Ų28.26%0.06315%0.153CC..EExtended strand (participates in β ladder)trans-86.6142.4171.5-70.2-118.6000109M3080 R3092 F3111M3080-H3108 HydrophobicContact CE-CB 4Å; R3092-H3108 WeakPolarHBondContact CD-ND1 3.24Å; H3108-F3111 HydrophobicContact CB-CE1 4.15Å; H3108-F3111 HydrophobicContact CB-CZ 3.93Å; H3108-F3111 WeakPolarHBondContact O-CE2 3.46Å; H3108-F3111 VanDerWaalsContact O-CZ 3.3Å; H3108-F3111 WeakPolarHBondContact O-CZ 3.34Å
3109I93.4Very high90.4Very high40.5 Ų40.530.1 Ų30.121%0.20817%0.166CC..  trans-128.4167.2173.961.6171.8000109.4M2978 R3092 N3096 M3098M2978-I3109 HydrophobicContact CE-CG2 3.86Å; M2978-I3109 HydrophobicContact SD-CG2 4.44Å; R3092-I3109 PolarHBondContact NH1-O 3.16Å; N3096-I3109 HydrophobicContact CB-CG1 4.47Å; N3096-I3109 PolarHBondContact O-N 3.08Å; M3098-I3109 HydrophobicContact CG-CD1 4.24Å; M3098-I3109 HydrophobicContact CG-CG2 4.48Å; M3098-I3109 HydrophobicContact SD-CD1 4.03Å; M3098-I3109 HydrophobicContact SD-CG2 3.9Å
3110D89.2Confident89.8Confident53.5 Ų53.533.8 Ų33.829%0.28618%0.184SC..  trans6098179.4-153.2-44.4000112.7K2940 R3092K2940-D3110 IonicContact NZ-OD2 3.68Å; K2940-D3110 PolarHBondContact NZ-OD2 2.83Å; R3092-D3110 VanDerWaalsContact CZ-O 3.25Å; R3092-D3110 PolarHBondContact NH1-O 2.99Å; R3092-D3110 PolarHBondContact NH2-O 3.1Å
3111F89.4Confident89.2Confident1.5 Ų1.536.6 Ų36.61%0.00719%0.192CC..  trans-108.220.2-173-62.5-86.8000113.8Q2947 D2948 I2951 M2952 F2955 L3089 H3108 D3113 C3114Q2947-F3111 PolarHBondContact NE2-O 3.11Å; D2948-F3111 WeakPolarHBondContact OD1-CB 3.36Å; D2948-F3111 WeakPolarHBondContact OD1-CD2 3.41Å; D2948-F3111 PolarHBondContact OD1-N 3.11Å; D2948-F3111 VanDerWaalsContact OD1-N 3.13Å; I2951-F3111 HydrophobicContact CD1-CB 3.59Å; I2951-F3111 VanDerWaalsContact CD1-CB 3.47Å; I2951-F3111 HydrophobicContact CD1-CD1 4.27Å; I2951-F3111 HydrophobicContact CD1-CG 4.24Å; I2951-F3111 HydrophobicContact CG2-CD1 3.86Å; I2951-F3111 HydrophobicContact CG2-CE1 4.19Å; I2951-F3111 HydrophobicContact CG2-CG 4.15Å; M2952-F3111 HydrophobicContact CE-CD2 3.96Å; M2952-F3111 HydrophobicContact CE-CE2 3.3Å; M2952-F3111 HydrophobicContact CE-CZ 3.84Å; F2955-F3111 AromaticContact CE2-CE1 3.74Å; F2955-F3111 HydrophobicContact CE2-CE1 3.74Å; F2955-F3111 AromaticContact CE2-CZ 3.73Å; F2955-F3111 HydrophobicContact CE2-CZ 3.73Å; F2955-F3111 HydrophobicContact CZ-CD1 4.43Å; F2955-F3111 AromaticContact CZ-CE1 3.75Å; F2955-F3111 HydrophobicContact CZ-CE1 3.75Å; F2955-F3111 HydrophobicContact CZ-CZ 4.23Å; L3089-F3111 HydrophobicContact CD1-CD1 3.68Å; L3089-F3111 HydrophobicContact CD1-CE1 4.29Å; L3089-F3111 HydrophobicContact CD2-CD1 4.19Å; L3089-F3111 HydrophobicContact CD2-CE1 3.97Å; H3108-F3111 HydrophobicContact CB-CE1 4.15Å; H3108-F3111 HydrophobicContact CB-CZ 3.93Å; H3108-F3111 WeakPolarHBondContact O-CE2 3.46Å; H3108-F3111 VanDerWaalsContact O-CZ 3.3Å; H3108-F3111 WeakPolarHBondContact O-CZ 3.34Å; F3111-D3113 PolarHBondContact O-N 3.32Å; F3111-C3114 PolarHBondContact O-SG 3.08Å
3112G82.9Confident88.7Confident32.5 Ų32.536.3 Ų36.334%0.33520%0.196SC..SBendtrans-57.8-43.5177.600000113.8Q2947 C3114Q2947-G3112 PolarHBondContact NE2-O 3.1Å; G3112-C3114 PolarHBondContact O-N 3.05Å; G3112-C3114 VanDerWaalsContact O-N 3.11Å
3113D85.8Confident88.4Confident31 Ų3139.6 Ų39.617%0.16620%0.203CC..SBendtrans-87.969.5177.9-80-6.5000112.3G3090 D3091 F3111 V3117 A3118 R3121G3090-D3113 PolarHBondContact N-O 3.06Å; D3091-D3113 HydrophobicContact CB-CB 3.91Å; D3091-D3113 WeakPolarHBondContact CB-OD2 3.41Å; F3111-D3113 PolarHBondContact O-N 3.32Å; D3113-V3117 VanDerWaalsContact OD1-CG1 3.31Å; D3113-V3117 WeakPolarHBondContact OD1-CG1 3.25Å; D3113-A3118 HydrophobicContact CB-CB 4.34Å; D3113-R3121 IonicContact OD1-CZ 2.69Å; D3113-R3121 IonicContact OD1-NH1 3.49Å; D3113-R3121 IonicContact OD1-NH2 2.79Å; D3113-R3121 PolarHBondContact OD1-NH2 3.18Å; D3113-R3121 IonicContact OD2-CZ 3.58Å; D3113-R3121 IonicContact OD2-NH1 3.69Å; D3113-R3121 PolarHBondContact OD2-NH1 3.1Å; D3113-R3121 IonicContact OD2-NH2 3.27Å; D3113-R3121 PolarHBondContact OD2-NH2 3.05Å; D3113-R3121 VanDerWaalsContact OD2-NH2 3.09Å
3114C86.1Confident88Confident0 Ų042.5 Ų42.50%021%0.211CC..  trans-101.7177.5167.6-69.60000111.9I2951 L3087 G3088 L3089 F3111 G3112 E3116 V3117I2951-C3114 HydrophobicContact CD1-CB 4.24Å; I2951-C3114 WeakPolarHBondContact CD1-SG 3.46Å; L3087-C3114 HydrophobicContact CG-CB 4.38Å; G3088-C3114 CarbonylContact O-C 3.51Å; G3088-C3114 VanDerWaalsContact O-C 3.26Å; L3089-C3114 VanDerWaalsContact CD1-SG 3.57Å; L3089-C3114 WeakPolarHBondContact CD1-SG 3.21Å; F3111-C3114 PolarHBondContact O-SG 3.08Å; G3112-C3114 PolarHBondContact O-N 3.05Å; G3112-C3114 VanDerWaalsContact O-N 3.11Å; C3114-E3116 PolarHBondContact O-N 2.95Å; C3114-E3116 VanDerWaalsContact O-N 3.12Å; C3114-V3117 WeakPolarHBondContact O-CB 3.14Å; C3114-V3117 VanDerWaalsContact O-CG2 3.27Å; C3114-V3117 WeakPolarHBondContact O-CG2 3.4Å; C3114-V3117 PolarHBondContact O-N 3.22Å
3115F85.2Confident87.9Confident15 Ų1544.5 Ų44.57%0.06622%0.224CC..THydrogen-bonded Turntrans57.134.2172.5-51.1-58.8000114.2L3087 G3088 V3117 L3171 F3174 V3391 I3395L3087-F3115 HydrophobicContact CD1-CD1 4.42Å; L3087-F3115 HydrophobicContact CD1-CE1 3.7Å; L3087-F3115 HydrophobicContact CD1-CZ 4.02Å; L3087-F3115 WeakPolarHBondContact O-CA 3.35Å; L3087-F3115 WeakPolarHBondContact O-CD1 3.47Å; L3087-F3115 PolarHBondContact O-N 3.39Å; G3088-F3115 PolarHBondContact O-N 3.12Å; G3088-F3115 VanDerWaalsContact O-N 3.09Å; F3115-V3117 PolarHBondContact O-N 3.2Å; F3115-L3171 HydrophobicContact CE1-CD2 4.37Å; F3115-L3171 HydrophobicContact CZ-CD2 4.42Å; F3115-F3174 AromaticContact CE2-CD1 3.89Å; F3115-F3174 HydrophobicContact CE2-CD1 4Å; F3115-F3174 AromaticContact CE2-CE1 3.73Å; F3115-F3174 HydrophobicContact CE2-CE1 3.94Å; F3115-F3174 AromaticContact CZ-CD1 3.89Å; F3115-F3174 HydrophobicContact CZ-CD1 3.89Å; F3115-F3174 AromaticContact CZ-CE1 3.74Å; F3115-F3174 HydrophobicContact CZ-CE1 3.74Å; F3115-F3174 HydrophobicContact CZ-CG 4.39Å; F3115-F3174 AromaticContact CZ-CZ 3.95Å; F3115-F3174 HydrophobicContact CZ-CZ 4.1Å; F3115-V3391 HydrophobicContact CB-CG1 3.76Å; F3115-V3391 HydrophobicContact CB-CG2 4.05Å; F3115-V3391 HydrophobicContact CD1-CG1 3.5Å; F3115-V3391 VanDerWaalsContact CD1-CG1 3.5Å; F3115-V3391 HydrophobicContact CE1-CG1 4.31Å; F3115-V3391 HydrophobicContact CG-CG1 3.8Å; F3115-I3395 HydrophobicContact CD1-CD1 3.91Å; F3115-I3395 HydrophobicContact CE1-CD1 3.92Å
3116E84.1Confident87.6Confident27 Ų2744.8 Ų44.813%0.12623%0.226CC..THydrogen-bonded Turntrans64.518177.3-56.9167.7-172.300114.6G3088 C3114 A3118 T3119 M3120 R3394 K3398G3088-E3116 PolarHBondContact O-N 3.17Å; C3114-E3116 PolarHBondContact O-N 2.95Å; C3114-E3116 VanDerWaalsContact O-N 3.12Å; E3116-A3118 PolarHBondContact O-N 3.31Å; E3116-T3119 WeakPolarHBondContact O-CB 3.41Å; E3116-T3119 PolarHBondContact O-N 3.13Å; E3116-M3120 WeakPolarHBondContact O-CG 3.36Å; E3116-M3120 PolarHBondContact O-N 3.14Å; E3116-M3120 VanDerWaalsContact O-N 3.11Å; E3116-R3394 VanDerWaalsContact CD-CD 3.41Å; E3116-R3394 WeakPolarHBondContact OE1-CD 3.25Å; E3116-R3394 WeakPolarHBondContact OE2-CD 3.19Å; E3116-R3394 IonicContact OE2-CZ 3.72Å; E3116-R3394 IonicContact OE2-NE 2.62Å; E3116-R3394 IonicContact OE2-NH1 2.7Å; E3116-R3394 PolarHBondContact OE2-NH1 3.15Å; E3116-K3398 VanDerWaalsContact OE1-CE 3.26Å; E3116-K3398 WeakPolarHBondContact OE1-CE 3.38Å; E3116-K3398 IonicContact OE1-NZ 3.78Å; E3116-K3398 PolarHBondContact OE1-NZ 3.31Å
3117V84Confident87.4Confident34.5 Ų34.550.5 Ų50.521%0.20925%0.25CS..THydrogen-bonded Turntrans-51.7-43.9173.2169.30000110.7D3113 C3114 F3115 T3119 M3120 R3121 V3183D3113-V3117 VanDerWaalsContact OD1-CG1 3.31Å; D3113-V3117 WeakPolarHBondContact OD1-CG1 3.25Å; C3114-V3117 WeakPolarHBondContact O-CB 3.14Å; C3114-V3117 VanDerWaalsContact O-CG2 3.27Å; C3114-V3117 WeakPolarHBondContact O-CG2 3.4Å; C3114-V3117 PolarHBondContact O-N 3.22Å; F3115-V3117 PolarHBondContact O-N 3.2Å; V3117-T3119 VanDerWaalsContact C-N 3.28Å; V3117-T3119 PolarHBondContact O-N 3.02Å; V3117-M3120 PolarHBondContact O-N 2.82Å; V3117-M3120 VanDerWaalsContact O-N 3.15Å; V3117-R3121 WeakPolarHBondContact O-CG 3.36Å; V3117-R3121 PolarHBondContact O-N 3.06Å; V3117-R3121 VanDerWaalsContact O-N 3.15Å; V3117-V3183 HydrophobicContact CG2-CG1 4.37Å
3118A85.7Confident87.2Confident0 Ų052.6 Ų52.60%026%0.263CS..THydrogen-bonded Turntrans-63.2-33.517700000114.6D3113 E3116 M3120 R3121 P3125 E3126D3113-A3118 HydrophobicContact CB-CB 4.34Å; E3116-A3118 PolarHBondContact O-N 3.31Å; A3118-M3120 VanDerWaalsContact C-N 3.29Å; A3118-M3120 PolarHBondContact O-N 2.81Å; A3118-R3121 WeakPolarHBondContact O-CG 3.41Å; A3118-R3121 PolarHBondContact O-NE 2.58Å; A3118-P3125 WeakPolarHBondContact O-CA 3.27Å; A3118-E3126 HydrophobicContact CB-CB 4.37Å; A3118-E3126 HydrophobicContact CB-CG 4.33Å; A3118-E3126 VanDerWaalsContact CB-OE1 3.23Å; A3118-E3126 WeakPolarHBondContact CB-OE1 3.36Å; A3118-E3126 PolarHBondContact O-N 3.17Å; A3118-E3126 VanDerWaalsContact O-N 3.1Å
3119T84.9Confident87.1Confident58 Ų5854.3 Ų54.336%0.35628%0.275SS..THydrogen-bonded Turntrans-73.7-28.3178.1-50.70000111.7E3116 V3117 P3125 E3126E3116-T3119 WeakPolarHBondContact O-CB 3.41Å; E3116-T3119 PolarHBondContact O-N 3.13Å; V3117-T3119 VanDerWaalsContact C-N 3.28Å; V3117-T3119 PolarHBondContact O-N 3.02Å; T3119-P3125 VanDerWaalsContact O-CB 3.27Å; T3119-P3125 WeakPolarHBondContact O-CB 3.43Å; T3119-E3126 WeakPolarHBondContact CA-O 3.5Å; T3119-E3126 WeakPolarHBondContact CG2-O 3.45Å
3120M81.7Confident87.2Confident88 Ų8853.8 Ų53.843%0.43327%0.272SS..THydrogen-bonded Turntrans-96.80.6-175.9-64-171.6175.300114.3E3116 V3117 A3118 E3122 R3394E3116-M3120 WeakPolarHBondContact O-CG 3.36Å; E3116-M3120 PolarHBondContact O-N 3.14Å; E3116-M3120 VanDerWaalsContact O-N 3.11Å; V3117-M3120 PolarHBondContact O-N 2.82Å; V3117-M3120 VanDerWaalsContact O-N 3.15Å; A3118-M3120 VanDerWaalsContact C-N 3.29Å; A3118-M3120 PolarHBondContact O-N 2.81Å; M3120-E3122 PolarHBondContact O-N 3.42Å; M3120-R3394 VanDerWaalsContact CE-NH1 3.32Å
3121R83Confident87.5Confident75 Ų7553.2 Ų53.228%0.28327%0.265SS..  trans-64.6138.6178.1-2.7178.6129.3157.3-4.4111.8D3113 V3117 A3118 K3123 F3124 P3125 E3126D3113-R3121 IonicContact OD1-CZ 2.69Å; D3113-R3121 IonicContact OD1-NH1 3.49Å; D3113-R3121 IonicContact OD1-NH2 2.79Å; D3113-R3121 PolarHBondContact OD1-NH2 3.18Å; D3113-R3121 IonicContact OD2-CZ 3.58Å; D3113-R3121 IonicContact OD2-NH1 3.69Å; D3113-R3121 PolarHBondContact OD2-NH1 3.1Å; D3113-R3121 IonicContact OD2-NH2 3.27Å; D3113-R3121 PolarHBondContact OD2-NH2 3.05Å; D3113-R3121 VanDerWaalsContact OD2-NH2 3.09Å; V3117-R3121 WeakPolarHBondContact O-CG 3.36Å; V3117-R3121 PolarHBondContact O-N 3.06Å; V3117-R3121 VanDerWaalsContact O-N 3.15Å; A3118-R3121 WeakPolarHBondContact O-CG 3.41Å; A3118-R3121 PolarHBondContact O-NE 2.58Å; R3121-K3123 WeakPolarHBondContact CB-O 3.39Å; R3121-K3123 WeakPolarHBondContact CD-O 3.36Å; R3121-K3123 VanDerWaalsContact CG-O 3.26Å; R3121-K3123 WeakPolarHBondContact CG-O 3.49Å; R3121-K3123 PolarHBondContact O-N 3.39Å; R3121-F3124 WeakPolarHBondContact CD-O 3.21Å; R3121-P3125 HydrophobicContact CG-CB 4.46Å; R3121-P3125 VanDerWaalsContact O-CB 3.22Å; R3121-P3125 WeakPolarHBondContact O-CB 3.41Å; R3121-P3125 VanDerWaalsContact O-CD 3.3Å; R3121-P3125 WeakPolarHBondContact O-CD 3.28Å; R3121-P3125 WeakPolarHBondContact O-CG 3.27Å; R3121-E3126 IonicContact CZ-OE1 2.7Å; R3121-E3126 IonicContact NH1-OE1 3.31Å; R3121-E3126 IonicContact NH2-OE1 3.18Å; R3121-E3126 PolarHBondContact NH2-OE1 3.09Å
3122E82.7Confident87.9Confident123 Ų12354.4 Ų54.458%0.57527%0.272SS*.SBendtrans-61.8-37.1175-68.7175.2-151.100113.1M3120 K3189M3120-E3122 PolarHBondContact O-N 3.42Å; E3122-K3189 WeakPolarHBondContact OE1-CD 3.26Å; E3122-K3189 IonicContact OE1-NZ 3.6Å; E3122-K3189 PolarHBondContact OE1-NZ 3.11Å; E3122-K3189 IonicContact OE2-NZ 2.73Å; E3122-K3189 PolarHBondContact OE2-NZ 3.03Å
3123K84.5Confident88.5Confident164 Ų16453.9 Ų53.971%0.71326%0.262SS*.SBendtrans-107.2121.5-178.5-65.9-177.6-179.81770109.8R3121R3121-K3123 WeakPolarHBondContact CB-O 3.39Å; R3121-K3123 WeakPolarHBondContact CD-O 3.36Å; R3121-K3123 VanDerWaalsContact CG-O 3.26Å; R3121-K3123 WeakPolarHBondContact CG-O 3.49Å; R3121-K3123 PolarHBondContact O-N 3.39Å
3124F86.7Confident88.9Confident110 Ų11055.3 Ų55.348%0.48227%0.265SS..SBendtrans5455.4-178.7-51.5-78.8000114.3D3029 R3121 E3126 Y3431D3029-F3124 WeakPolarHBondContact OD1-CE1 3.41Å; R3121-F3124 WeakPolarHBondContact CD-O 3.21Å; F3124-E3126 PolarHBondContact O-N 3.17Å; F3124-Y3431 HydrophobicContact CD1-CD2 4.23Å; F3124-Y3431 AromaticContact CD2-CD2 3.98Å; F3124-Y3431 HydrophobicContact CD2-CD2 3.98Å; F3124-Y3431 HydrophobicContact CD2-CG 4.44Å; F3124-Y3431 HydrophobicContact CE1-CD2 4.07Å; F3124-Y3431 AromaticContact CE2-CD2 3.81Å; F3124-Y3431 HydrophobicContact CE2-CD2 3.81Å; F3124-Y3431 HydrophobicContact CE2-CE2 4.33Å; F3124-Y3431 HydrophobicContact CG-CD2 4.19Å; F3124-Y3431 HydrophobicContact CG-CG 4.46Å; F3124-Y3431 AromaticContact CZ-CD2 3.85Å; F3124-Y3431 HydrophobicContact CZ-CD2 3.85Å; F3124-Y3431 HydrophobicContact CZ-CE2 4.38Å
3125P91Very high89.3Confident42.5 Ų42.556.3 Ų56.328%0.27627%0.27SS..  trans-61126.7176.523.8-31.8000111.5A3118 T3119 R3121 K3127A3118-P3125 WeakPolarHBondContact O-CA 3.27Å; T3119-P3125 VanDerWaalsContact O-CB 3.27Å; T3119-P3125 WeakPolarHBondContact O-CB 3.43Å; R3121-P3125 HydrophobicContact CG-CB 4.46Å; R3121-P3125 VanDerWaalsContact O-CB 3.22Å; R3121-P3125 WeakPolarHBondContact O-CB 3.41Å; R3121-P3125 VanDerWaalsContact O-CD 3.3Å; R3121-P3125 WeakPolarHBondContact O-CD 3.28Å; R3121-P3125 WeakPolarHBondContact O-CG 3.27Å; P3125-K3127 WeakPolarHBondContact O-CE 3.36Å
3126E90.7Very high89.9Confident24.5 Ų24.555.7 Ų55.711%0.11427%0.267CS..  trans-64.5138.3177.4-76.4180-136.300111.5D3091 A3118 T3119 R3121 F3124 M3430 W3434D3091-E3126 WeakPolarHBondContact CA-OE1 3.25Å; D3091-E3126 PolarHBondContact N-OE1 3.18Å; D3091-E3126 PolarHBondContact N-OE2 3.37Å; A3118-E3126 HydrophobicContact CB-CB 4.37Å; A3118-E3126 HydrophobicContact CB-CG 4.33Å; A3118-E3126 VanDerWaalsContact CB-OE1 3.23Å; A3118-E3126 WeakPolarHBondContact CB-OE1 3.36Å; A3118-E3126 PolarHBondContact O-N 3.17Å; A3118-E3126 VanDerWaalsContact O-N 3.1Å; T3119-E3126 WeakPolarHBondContact CA-O 3.5Å; T3119-E3126 WeakPolarHBondContact CG2-O 3.45Å; R3121-E3126 IonicContact CZ-OE1 2.7Å; R3121-E3126 IonicContact NH1-OE1 3.31Å; R3121-E3126 IonicContact NH2-OE1 3.18Å; R3121-E3126 PolarHBondContact NH2-OE1 3.09Å; F3124-E3126 PolarHBondContact O-N 3.17Å; E3126-M3430 HydrophobicContact CG-CE 4.18Å; E3126-W3434 HydrophobicContact CG-CH2 3.93Å; E3126-W3434 HydrophobicContact CG-CZ3 3.61Å; E3126-W3434 WeakPolarHBondContact OE1-CH2 3.41Å
3127K91.7Very high90.5Very high123.5 Ų123.556.7 Ų56.754%0.53727%0.273SS..  trans-115.47.7178.7-55.2-58.4174.4-167.20113.1P3125 N3426 Q3429P3125-K3127 WeakPolarHBondContact O-CE 3.36Å; K3127-N3426 HydrophobicContact CB-CB 3.91Å; K3127-N3426 PolarHBondContact O-ND2 3.02Å; K3127-Q3429 HydrophobicContact CG-CB 4.22Å
3128V92.9Very high91Very high48 Ų4857.4 Ų57.429%0.29128%0.279SS..  trans-109.7141-179.8-65.30000110.4F3130 N3426 L3427 M3430V3128-F3130 VanDerWaalsContact C-N 3.3Å; V3128-N3426 HydrophobicContact CG1-CB 3.76Å; V3128-L3427 HydrophobicContact CG1-CD2 3.92Å; V3128-L3427 HydrophobicContact CG1-CG 4.33Å; V3128-M3430 HydrophobicContact CG2-CE 4.13Å; V3128-M3430 HydrophobicContact CG2-SD 3.97Å
3129P93.7Very high91.5Very high48.5 Ų48.557.5 Ų57.532%0.31528%0.28SS..SBendtrans-76.2-25179.229.7-34.8000113.2Y3085 L3417 E3420 A3421Y3085-P3129 HydrophobicContact CD2-CB 3.77Å; Y3085-P3129 HydrophobicContact CE2-CB 4.1Å; P3129-L3417 HydrophobicContact CB-CD2 3.72Å; P3129-L3417 HydrophobicContact CG-CB 4.32Å; P3129-L3417 HydrophobicContact CG-CD2 3.91Å; P3129-L3417 WeakPolarHBondContact CG-O 3.44Å; P3129-E3420 HydrophobicContact CG-CB 4.28Å; P3129-A3421 HydrophobicContact CG-CB 4.06Å
3130F96Very high92Very high30 Ų3054.9 Ų54.913%0.13226%0.264CS..SBendtrans-164.2162174.944.6-98.2000108.6S3081 M3082 V3128 L3132 Y3149 L3417 A3421S3081-F3130 VanDerWaalsContact O-CD1 3.29Å; S3081-F3130 WeakPolarHBondContact O-CD1 3.46Å; M3082-F3130 HydrophobicContact CE-CD1 4.34Å; M3082-F3130 HydrophobicContact CE-CE1 3.49Å; M3082-F3130 VanDerWaalsContact CE-CE1 3.41Å; M3082-F3130 HydrophobicContact CE-CZ 3.74Å; V3128-F3130 VanDerWaalsContact C-N 3.3Å; F3130-L3132 HydrophobicContact CD2-CB 4.04Å; F3130-L3132 HydrophobicContact CE2-CB 3.96Å; F3130-L3132 HydrophobicContact CE2-CD2 4.13Å; F3130-L3132 PolarHBondContact O-N 3.14Å; F3130-L3132 VanDerWaalsContact O-N 3.17Å; F3130-Y3149 WeakPolarHBondContact CE2-OH 3.47Å; F3130-L3417 HydrophobicContact CE1-CB 3.96Å; F3130-L3417 HydrophobicContact CZ-CB 4.17Å; F3130-A3421 HydrophobicContact CD2-CB 3.68Å; F3130-A3421 HydrophobicContact CE2-CB 3.35Å; F3130-A3421 HydrophobicContact CG-CB 4.49Å; F3130-A3421 HydrophobicContact CZ-CB 3.94Å; F3130-A3421 WeakPolarHBondContact O-CB 3.14Å
3131R95.4Very high92.5Very high40 Ų4052.1 Ų52.115%0.15125%0.25CS..  trans-74.4109.4176179.8174.7-79-101.8-4.8110.7M3077 R3092 I3097 T3133 I3136 W3434 C3435 W3438M3077-R3131 WeakPolarHBondContact CE-O 3.43Å; R3092-R3131 HydrophobicContact CB-CB 4.22Å; R3092-R3131 WeakPolarHBondContact O-CD 3.3Å; R3092-R3131 PolarHBondContact O-NE 3.24Å; I3097-R3131 HydrophobicContact CD1-CB 4.33Å; I3097-R3131 HydrophobicContact CD1-CG 4.42Å; R3131-T3133 HydrophobicContact CG-CG2 3.94Å; R3131-T3133 WeakPolarHBondContact CG-OG1 3.41Å; R3131-I3136 HydrophobicContact CG-CD1 3.79Å; R3131-W3434 PolarHBondContact NH2-O 2.7Å; R3131-C3435 PolarHBondContact NH1-O 3.28Å; R3131-W3438 PolarHBondContact NH1-O 3Å
3132L96.6Very high92.8Very high27 Ų2754.7 Ų54.714%0.14127%0.274CS..  trans-130.683.3167.6-174.161.1000109.4F3130 I3136 I3137 M3140 I3145 Y3149 I3418 A3421 T3422F3130-L3132 HydrophobicContact CD2-CB 4.04Å; F3130-L3132 HydrophobicContact CE2-CB 3.96Å; F3130-L3132 HydrophobicContact CE2-CD2 4.13Å; F3130-L3132 PolarHBondContact O-N 3.14Å; F3130-L3132 VanDerWaalsContact O-N 3.17Å; L3132-I3136 HydrophobicContact CD1-CG2 4.19Å; L3132-I3137 HydrophobicContact CD1-CG1 3.85Å; L3132-I3137 HydrophobicContact CG-CD1 4.21Å; L3132-I3137 HydrophobicContact CG-CG1 4.05Å; L3132-M3140 HydrophobicContact CD1-CE 3.85Å; L3132-I3145 HydrophobicContact CD2-CG2 4.2Å; L3132-Y3149 HydrophobicContact CD1-CE1 4.29Å; L3132-Y3149 HydrophobicContact CD1-CE2 4.26Å; L3132-Y3149 HydrophobicContact CD2-CD1 4.49Å; L3132-Y3149 HydrophobicContact CD2-CE1 3.76Å; L3132-I3418 HydrophobicContact CD2-CG2 4.38Å; L3132-A3421 HydrophobicContact CB-CB 3.86Å; L3132-T3422 HydrophobicContact CB-CG2 4.36Å; L3132-T3422 HydrophobicContact CD2-CG2 3.86Å; L3132-T3422 HydrophobicContact CG-CG2 3.94Å
3133T95.6Very high93.1Very high22.5 Ų22.551.1 Ų51.114%0.13826%0.261CS..  trans-102.3164.3-174.551.80000111.9R3131 M3135 I3136 I3137 L3427 A3436 W3438R3131-T3133 HydrophobicContact CG-CG2 3.94Å; R3131-T3133 WeakPolarHBondContact CG-OG1 3.41Å; T3133-M3135 VanDerWaalsContact C-N 3.31Å; T3133-M3135 PolarHBondContact O-N 3.16Å; T3133-I3136 WeakPolarHBondContact O-CB 3.47Å; T3133-I3136 PolarHBondContact O-N 3.28Å; T3133-I3137 WeakPolarHBondContact O-CG1 3.44Å; T3133-I3137 PolarHBondContact O-N 3.2Å; T3133-L3427 HydrophobicContact CG2-CD1 4.34Å; T3133-L3427 HydrophobicContact CG2-CD2 3.72Å; T3133-A3436 VanDerWaalsContact CG2-O 3.24Å; T3133-A3436 WeakPolarHBondContact CG2-O 3.29Å; T3133-W3438 VanDerWaalsContact CB-C 3.45Å; T3133-W3438 WeakPolarHBondContact CB-O 3.48Å; T3133-W3438 WeakPolarHBondContact CB-OXT 3.28Å; T3133-W3438 PolarHBondContact OG1-O 3.22Å; T3133-W3438 PolarHBondContact OG1-OXT 3.23Å
3134R94.7Very high93.4Very high61 Ų6144 Ų4423%0.2323%0.234CC..Hα-helixtrans-55.4-32.5-174.866.2171.6-175.5163.4-6.8114.9E3017 L3044 S3047 S3138 F3437E3017-R3134 IonicContact OE1-NH2 3.29Å; E3017-R3134 PolarHBondContact OE1-NH2 2.84Å; L3044-R3134 VanDerWaalsContact CD2-CZ 3.47Å; L3044-R3134 VanDerWaalsContact O-CZ 3.3Å; L3044-R3134 PolarHBondContact O-NH1 2.86Å; L3044-R3134 PolarHBondContact O-NH2 3.13Å; L3044-R3134 VanDerWaalsContact O-NH2 3.14Å; S3047-R3134 PolarHBondContact O-NH1 3Å; S3047-R3134 PolarHBondContact OG-NH2 2.91Å; R3134-S3138 VanDerWaalsContact O-CB 3.24Å; R3134-S3138 WeakPolarHBondContact O-CB 3.36Å; R3134-S3138 PolarHBondContact O-N 3.38Å; R3134-S3138 PolarHBondContact O-OG 3.11Å; R3134-F3437 PolarHBondContact NE-O 3.25Å
3135M95.3Very high93.7Very high20 Ų2040.9 Ų40.910%0.09922%0.222CC..Hα-helixtrans-72.8-36177.4-63.9-171.3-124.600111.9I3003 G3049 D3051 L3052 T3133 S3138 A3139 W3438I3003-M3135 HydrophobicContact CD1-CE 4.08Å; I3003-M3135 HydrophobicContact CD1-SD 4.05Å; I3003-M3135 HydrophobicContact CG1-SD 4.39Å; G3049-M3135 VanDerWaalsContact O-CA 3.3Å; G3049-M3135 WeakPolarHBondContact O-CA 3.35Å; G3049-M3135 WeakPolarHBondContact O-CG 3.45Å; D3051-M3135 HydrophobicContact CB-CE 4.5Å; D3051-M3135 HydrophobicContact CB-SD 4.21Å; L3052-M3135 HydrophobicContact CB-CB 4.3Å; T3133-M3135 VanDerWaalsContact C-N 3.31Å; T3133-M3135 PolarHBondContact O-N 3.16Å; M3135-S3138 PolarHBondContact O-N 3.47Å; M3135-A3139 VanDerWaalsContact O-CB 3.29Å; M3135-A3139 WeakPolarHBondContact O-CB 3.5Å; M3135-A3139 PolarHBondContact O-N 3.16Å; M3135-W3438 WeakPolarHBondContact CB-OXT 3.38Å; M3135-W3438 HydrophobicContact CE-CB 4.38Å; M3135-W3438 HydrophobicContact CE-CG 4.04Å; M3135-W3438 VanDerWaalsContact CG-OXT 3.28Å; M3135-W3438 WeakPolarHBondContact CG-OXT 3.31Å; M3135-W3438 PolarHBondContact N-OXT 2.96Å; M3135-W3438 HydrophobicContact SD-CB 3.93Å; M3135-W3438 HydrophobicContact SD-CG 4.02Å
3136I96.6Very high93.8Very high2.5 Ų2.541.6 Ų41.61%0.01322%0.223CC..Hα-helixtrans-67.5-44.9175.2-61.5-179.2000109.8F2999 L3052 F3073 M3077 R3131 L3132 T3133 S3138 A3139 M3140F2999-I3136 HydrophobicContact CE2-CD1 4.1Å; F2999-I3136 HydrophobicContact CE2-CG1 4.11Å; L3052-I3136 HydrophobicContact CD2-CG1 4.35Å; F3073-I3136 HydrophobicContact CZ-CG2 4.13Å; M3077-I3136 HydrophobicContact CE-CD1 3.93Å; M3077-I3136 HydrophobicContact CE-CG2 4.31Å; M3077-I3136 HydrophobicContact CG-CG2 4.03Å; M3077-I3136 HydrophobicContact SD-CG2 4.17Å; R3131-I3136 HydrophobicContact CG-CD1 3.79Å; L3132-I3136 HydrophobicContact CD1-CG2 4.19Å; T3133-I3136 WeakPolarHBondContact O-CB 3.47Å; T3133-I3136 PolarHBondContact O-N 3.28Å; I3136-S3138 VanDerWaalsContact C-N 3.31Å; I3136-S3138 PolarHBondContact O-N 2.63Å; I3136-A3139 PolarHBondContact O-N 3.11Å; I3136-A3139 VanDerWaalsContact O-N 3.13Å; I3136-M3140 HydrophobicContact CG2-CE 3.87Å; I3136-M3140 WeakPolarHBondContact O-CG 3.4Å; I3136-M3140 PolarHBondContact O-N 2.79Å
3137I96.5Very high93.8Very high48 Ų4841 Ų4125%0.24622%0.223CC..Hα-helixtrans-62.5-45.1176.2-61.6169.2000110.7L3132 T3133 A3139 M3140 I3145 T3422L3132-I3137 HydrophobicContact CD1-CG1 3.85Å; L3132-I3137 HydrophobicContact CG-CD1 4.21Å; L3132-I3137 HydrophobicContact CG-CG1 4.05Å; T3133-I3137 WeakPolarHBondContact O-CG1 3.44Å; T3133-I3137 PolarHBondContact O-N 3.2Å; I3137-A3139 PolarHBondContact O-N 3.2Å; I3137-M3140 WeakPolarHBondContact O-CB 3.38Å; I3137-M3140 WeakPolarHBondContact O-CG 3.3Å; I3137-M3140 PolarHBondContact O-N 3.15Å; I3137-M3140 VanDerWaalsContact O-N 3.1Å; I3137-I3145 HydrophobicContact CD1-CG2 4.23Å; I3137-I3145 HydrophobicContact CG1-CG2 3.92Å; I3137-I3145 HydrophobicContact CG2-CG2 4.12Å; I3137-T3422 HydrophobicContact CD1-CG2 3.84Å
3138S95.5Very high94Very high49 Ų4936 Ų3634%0.34320%0.203SC..Hα-helixtrans-65-22.8179.8-60.70000113.5G3049 A3053 R3134 M3135 I3136 M3140G3049-S3138 WeakPolarHBondContact O-CB 3.36Å; A3053-S3138 WeakPolarHBondContact CB-O 3.46Å; R3134-S3138 VanDerWaalsContact O-CB 3.24Å; R3134-S3138 WeakPolarHBondContact O-CB 3.36Å; R3134-S3138 PolarHBondContact O-N 3.38Å; R3134-S3138 PolarHBondContact O-OG 3.11Å; M3135-S3138 PolarHBondContact O-N 3.47Å; I3136-S3138 VanDerWaalsContact C-N 3.31Å; I3136-S3138 PolarHBondContact O-N 2.63Å; S3138-M3140 VanDerWaalsContact C-N 3.32Å
3139A95.9Very high94.2Very high2 Ų234 Ų342%0.01719%0.19CC..THydrogen-bonded Turntrans-81.8-8.1175.300000114L3052 A3053 L3056 R3070 F3073 M3135 I3136 I3137L3052-A3139 HydrophobicContact CB-CB 4.26Å; L3052-A3139 HydrophobicContact CD2-CB 4.02Å; L3052-A3139 HydrophobicContact CG-CB 3.95Å; A3053-A3139 HydrophobicContact CB-CB 4.32Å; L3056-A3139 HydrophobicContact CD1-CB 3.83Å; R3070-A3139 WeakPolarHBondContact CG-O 3.44Å; F3073-A3139 HydrophobicContact CD1-CB 4.47Å; F3073-A3139 HydrophobicContact CE1-CB 3.61Å; F3073-A3139 HydrophobicContact CZ-CB 3.86Å; M3135-A3139 VanDerWaalsContact O-CB 3.29Å; M3135-A3139 WeakPolarHBondContact O-CB 3.5Å; M3135-A3139 PolarHBondContact O-N 3.16Å; I3136-A3139 PolarHBondContact O-N 3.11Å; I3136-A3139 VanDerWaalsContact O-N 3.13Å; I3137-A3139 PolarHBondContact O-N 3.2Å
3140M95.6Very high94.3Very high4.5 Ų4.534.4 Ų34.42%0.02219%0.185CC..SBendtrans-81.9-155.8175.9-57.6-177.4-179.400111.5R3070 F3073 T3074 M3077 L3132 I3136 I3137 S3138 I3145 Y3149R3070-M3140 WeakPolarHBondContact CD-O 3.41Å; R3070-M3140 PolarHBondContact NH1-O 2.95Å; F3073-M3140 HydrophobicContact CE1-CG 4.27Å; T3074-M3140 HydrophobicContact CG2-CB 4.4Å; T3074-M3140 HydrophobicContact CG2-CG 4.18Å; T3074-M3140 HydrophobicContact CG2-SD 4.13Å; M3077-M3140 HydrophobicContact CG-CE 4.27Å; L3132-M3140 HydrophobicContact CD1-CE 3.85Å; I3136-M3140 HydrophobicContact CG2-CE 3.87Å; I3136-M3140 WeakPolarHBondContact O-CG 3.4Å; I3136-M3140 PolarHBondContact O-N 2.79Å; I3137-M3140 WeakPolarHBondContact O-CB 3.38Å; I3137-M3140 WeakPolarHBondContact O-CG 3.3Å; I3137-M3140 PolarHBondContact O-N 3.15Å; I3137-M3140 VanDerWaalsContact O-N 3.1Å; S3138-M3140 VanDerWaalsContact C-N 3.32Å; M3140-I3145 HydrophobicContact SD-CG2 4.42Å; M3140-Y3149 HydrophobicContact CE-CD2 3.34Å; M3140-Y3149 VanDerWaalsContact CE-CD2 3.47Å; M3140-Y3149 HydrophobicContact CE-CE2 3.7Å; M3140-Y3149 HydrophobicContact CE-CG 3.92Å; M3140-Y3149 HydrophobicContact SD-CD2 3.91Å; M3140-Y3149 HydrophobicContact SD-CG 3.96Å
3141E92.3Very high94.3Very high28.5 Ų28.536.4 Ų36.413%0.13320%0.195CC..  trans-76.8161.5171.80.4140.4-16000111.8T3074 T3143 G3144 V3148T3074-E3141 PolarHBondContact OG1-OE1 3.11Å; E3141-T3143 PolarHBondContact O-N 3.11Å; E3141-T3143 VanDerWaalsContact O-N 3.11Å; E3141-G3144 WeakPolarHBondContact O-CA 3.24Å; E3141-G3144 PolarHBondContact O-N 3Å; E3141-V3148 HydrophobicContact CG-CG2 4.43Å; E3141-V3148 VanDerWaalsContact OE1-CB 3.23Å; E3141-V3148 WeakPolarHBondContact OE1-CB 3.37Å; E3141-V3148 VanDerWaalsContact OE1-CG2 3.23Å; E3141-V3148 WeakPolarHBondContact OE1-CG2 3.38Å; E3141-V3148 PolarHBondContact OE1-N 3.19Å; E3141-V3148 PolarHBondContact OE2-N 3.39Å; E3141-V3148 VanDerWaalsContact OE2-N 3.11Å
3142V89.2Confident94.4Very high130.5 Ų130.534.5 Ų34.579%0.79119%0.188SC*.THydrogen-bonded Turntrans-64.6-17.6-174.2-63.90000114.1G3144V3142-G3144 PolarHBondContact O-N 3.02Å
3143T89.1Confident94.4Very high47.5 Ų47.533.5 Ų33.529%0.29118%0.183SC..THydrogen-bonded Turntrans-79.1-1.7171.5500000113.1E3141 I3145 D3146E3141-T3143 PolarHBondContact O-N 3.11Å; E3141-T3143 VanDerWaalsContact O-N 3.11Å; T3143-I3145 PolarHBondContact O-N 2.97Å; T3143-D3146 PolarHBondContact O-N 3.33Å
3144G90.6Very high94.5Very high14.5 Ų14.536.3 Ų36.315%0.14920%0.195CC..G310 helixtrans68-127.7-177.800000112.3E3141 V3142E3141-G3144 WeakPolarHBondContact O-CA 3.24Å; E3141-G3144 PolarHBondContact O-N 3Å; V3142-G3144 PolarHBondContact O-N 3.02Å
3145I93.9Very high94.5Very high45 Ų4534.3 Ų34.323%0.23119%0.188CC..G310 helixtrans-83.1-20.7-170.762.4-177.3000114.1L3132 I3137 M3140 T3143 G3147 Y3149 R3150 I3418L3132-I3145 HydrophobicContact CD2-CG2 4.2Å; I3137-I3145 HydrophobicContact CD1-CG2 4.23Å; I3137-I3145 HydrophobicContact CG1-CG2 3.92Å; I3137-I3145 HydrophobicContact CG2-CG2 4.12Å; M3140-I3145 HydrophobicContact SD-CG2 4.42Å; T3143-I3145 PolarHBondContact O-N 2.97Å; I3145-G3147 VanDerWaalsContact C-N 3.28Å; I3145-G3147 PolarHBondContact O-N 3.18Å; I3145-Y3149 HydrophobicContact CB-CD1 4.22Å; I3145-Y3149 HydrophobicContact CG2-CD1 4.3Å; I3145-Y3149 WeakPolarHBondContact O-CB 3.39Å; I3145-R3150 VanDerWaalsContact O-CB 3.25Å; I3145-R3150 WeakPolarHBondContact O-CB 3.41Å; I3145-R3150 PolarHBondContact O-N 3.09Å; I3145-I3418 HydrophobicContact CD1-CG2 3.65Å; I3145-I3418 HydrophobicContact CG1-CG2 4.48Å
3146D91.3Very high94.6Very high57 Ų5733.4 Ų33.431%0.30518%0.184SC..G310 helixtrans-79.3-4.1-171.2-64.2-43.1000113.9T3143 R3150T3143-D3146 PolarHBondContact O-N 3.33Å; D3146-R3150 IonicContact OD1-CZ 3.25Å; D3146-R3150 IonicContact OD1-NE 3.06Å; D3146-R3150 PolarHBondContact OD1-NE 2.98Å; D3146-R3150 IonicContact OD1-NH1 3.94Å; D3146-R3150 PolarHBondContact OD1-NH1 3.23Å; D3146-R3150 IonicContact OD1-NH2 2.65Å; D3146-R3150 PolarHBondContact OD1-NH2 3.06Å
3147G91.7Very high94.6Very high10.5 Ų10.533.9 Ų33.911%0.10819%0.186CC..THydrogen-bonded Turntrans-89.8-126175.500000113.4I3145 Y3149 R3150 H3151I3145-G3147 VanDerWaalsContact C-N 3.28Å; I3145-G3147 PolarHBondContact O-N 3.18Å; G3147-Y3149 PolarHBondContact O-N 3.35Å; G3147-Y3149 VanDerWaalsContact O-N 3.11Å; G3147-R3150 PolarHBondContact O-N 3.19Å; G3147-H3151 PolarHBondContact O-N 3.18Å
3148V95.2Very high94.5Very high19 Ų1934.9 Ų34.912%0.11520%0.197CC..Hα-helixtrans-59.6-32.2-175.6175.70000111.8T3074 R3075 E3141 T3152T3074-V3148 HydrophobicContact CG2-CB 4.09Å; T3074-V3148 HydrophobicContact CG2-CG1 4.17Å; R3075-V3148 HydrophobicContact CG-CG1 3.6Å; E3141-V3148 HydrophobicContact CG-CG2 4.43Å; E3141-V3148 VanDerWaalsContact OE1-CB 3.23Å; E3141-V3148 WeakPolarHBondContact OE1-CB 3.37Å; E3141-V3148 VanDerWaalsContact OE1-CG2 3.23Å; E3141-V3148 WeakPolarHBondContact OE1-CG2 3.38Å; E3141-V3148 PolarHBondContact OE1-N 3.19Å; E3141-V3148 PolarHBondContact OE2-N 3.39Å; E3141-V3148 VanDerWaalsContact OE2-N 3.11Å; V3148-T3152 WeakPolarHBondContact O-CB 3.41Å; V3148-T3152 PolarHBondContact O-N 3.19Å; V3148-T3152 PolarHBondContact O-OG1 3.19Å
3149Y97Very high94.5Very high5.5 Ų5.533.1 Ų33.12%0.02218%0.184CC..Hα-helixtrans-62.4-59.4180-174.1-94.8000112.1T3074 M3077 A3078 S3081 F3130 L3132 M3140 I3145 G3147 H3151 T3152 C3153 I3418T3074-Y3149 HydrophobicContact CG2-CD2 4.4Å; M3077-Y3149 HydrophobicContact CB-CE2 4.39Å; M3077-Y3149 HydrophobicContact CG-CE2 4.19Å; A3078-Y3149 VanDerWaalsContact CA-CE2 3.48Å; A3078-Y3149 HydrophobicContact CB-CD2 3.6Å; A3078-Y3149 HydrophobicContact CB-CE2 3.81Å; A3078-Y3149 HydrophobicContact CB-CG 4.23Å; S3081-Y3149 VanDerWaalsContact CB-OH 3.27Å; S3081-Y3149 WeakPolarHBondContact CB-OH 3.42Å; S3081-Y3149 PolarHBondContact OG-OH 3.09Å; F3130-Y3149 WeakPolarHBondContact CE2-OH 3.47Å; L3132-Y3149 HydrophobicContact CD1-CE1 4.29Å; L3132-Y3149 HydrophobicContact CD1-CE2 4.26Å; L3132-Y3149 HydrophobicContact CD2-CD1 4.49Å; L3132-Y3149 HydrophobicContact CD2-CE1 3.76Å; M3140-Y3149 HydrophobicContact CE-CD2 3.34Å; M3140-Y3149 VanDerWaalsContact CE-CD2 3.47Å; M3140-Y3149 HydrophobicContact CE-CE2 3.7Å; M3140-Y3149 HydrophobicContact CE-CG 3.92Å; M3140-Y3149 HydrophobicContact SD-CD2 3.91Å; M3140-Y3149 HydrophobicContact SD-CG 3.96Å; I3145-Y3149 HydrophobicContact CB-CD1 4.22Å; I3145-Y3149 HydrophobicContact CG2-CD1 4.3Å; I3145-Y3149 WeakPolarHBondContact O-CB 3.39Å; G3147-Y3149 PolarHBondContact O-N 3.35Å; G3147-Y3149 VanDerWaalsContact O-N 3.11Å; Y3149-H3151 PolarHBondContact O-N 3.15Å; Y3149-T3152 PolarHBondContact O-N 3.09Å; Y3149-T3152 VanDerWaalsContact O-N 3.13Å; Y3149-C3153 PolarHBondContact O-N 3.16Å; Y3149-C3153 PolarHBondContact O-SG 3.22Å; Y3149-C3153 VanDerWaalsContact O-SG 3.35Å; Y3149-I3418 HydrophobicContact CD1-CD1 4.34Å; Y3149-I3418 HydrophobicContact CE1-CD1 4.18Å; Y3149-I3418 HydrophobicContact CE1-CG1 4.21Å
3150R96.7Very high94.4Very high58 Ų5833 Ų3322%0.21918%0.183CC..Hα-helixtrans-57-49.8178.6176.3179.9-68.2-139.46.6111.9I3145 D3146 G3147 T3152 C3153 E3154 D3415 I3418I3145-R3150 VanDerWaalsContact O-CB 3.25Å; I3145-R3150 WeakPolarHBondContact O-CB 3.41Å; I3145-R3150 PolarHBondContact O-N 3.09Å; D3146-R3150 IonicContact OD1-CZ 3.25Å; D3146-R3150 IonicContact OD1-NE 3.06Å; D3146-R3150 PolarHBondContact OD1-NE 2.98Å; D3146-R3150 IonicContact OD1-NH1 3.94Å; D3146-R3150 PolarHBondContact OD1-NH1 3.23Å; D3146-R3150 IonicContact OD1-NH2 2.65Å; D3146-R3150 PolarHBondContact OD1-NH2 3.06Å; G3147-R3150 PolarHBondContact O-N 3.19Å; R3150-T3152 VanDerWaalsContact C-N 3.28Å; R3150-T3152 PolarHBondContact O-N 3.1Å; R3150-C3153 WeakPolarHBondContact O-CA 3.48Å; R3150-C3153 WeakPolarHBondContact O-CB 3.36Å; R3150-C3153 PolarHBondContact O-N 3.26Å; R3150-C3153 VanDerWaalsContact O-N 3.09Å; R3150-E3154 WeakPolarHBondContact CD-OE1 3.46Å; R3150-E3154 HydrophobicContact CG-CG 4.31Å; R3150-E3154 VanDerWaalsContact CG-OE1 3.26Å; R3150-E3154 WeakPolarHBondContact CG-OE1 3.47Å; R3150-E3154 PolarHBondContact O-N 3.38Å; R3150-D3415 IonicContact CZ-OD1 3.26Å; R3150-D3415 VanDerWaalsContact CZ-OD1 3.22Å; R3150-D3415 IonicContact NH1-OD1 3.63Å; R3150-D3415 PolarHBondContact NH1-OD1 3.19Å; R3150-D3415 IonicContact NH2-OD1 2.62Å; R3150-D3415 PolarHBondContact NH2-OD1 3.36Å; R3150-I3418 HydrophobicContact CB-CD1 4.45Å
3151H95.3Very high94.2Very high71 Ų7136.5 Ų36.533%0.32920%0.196SC..Hα-helixtrans-60.1-39.2-179.2-174.179.3000112.1R2971 G3147 Y3149 C3153 E3154 M3155R2971-H3151 PolarHBondContact NH2-NE2 3.19Å; R2971-H3151 VanDerWaalsContact NH2-NE2 3.2Å; G3147-H3151 PolarHBondContact O-N 3.18Å; Y3149-H3151 PolarHBondContact O-N 3.15Å; H3151-C3153 VanDerWaalsContact C-N 3.34Å; H3151-C3153 PolarHBondContact O-N 3.03Å; H3151-E3154 PolarHBondContact O-N 3.23Å; H3151-M3155 WeakPolarHBondContact NE2-CE 3.13Å; H3151-M3155 VanDerWaalsContact O-CB 3.31Å; H3151-M3155 WeakPolarHBondContact O-CB 3.22Å; H3151-M3155 PolarHBondContact O-N 3.06Å; H3151-M3155 VanDerWaalsContact O-N 3.09Å
3152T97.1Very high94Very high1 Ų139.2 Ų39.21%0.00622%0.218CC..Hα-helixtrans-67.7-39.4175.1-56.30000111.4L2973 A3078 V3148 Y3149 R3150 M3155 V3156L2973-T3152 HydrophobicContact CD1-CG2 3.88Å; L2973-T3152 HydrophobicContact CD2-CG2 3.88Å; A3078-T3152 HydrophobicContact CB-CG2 3.69Å; V3148-T3152 WeakPolarHBondContact O-CB 3.41Å; V3148-T3152 PolarHBondContact O-N 3.19Å; V3148-T3152 PolarHBondContact O-OG1 3.19Å; Y3149-T3152 PolarHBondContact O-N 3.09Å; Y3149-T3152 VanDerWaalsContact O-N 3.13Å; R3150-T3152 VanDerWaalsContact C-N 3.28Å; R3150-T3152 PolarHBondContact O-N 3.1Å; T3152-M3155 PolarHBondContact O-N 3.4Å; T3152-V3156 HydrophobicContact CG2-CG2 4.18Å; T3152-V3156 WeakPolarHBondContact O-CB 3.4Å; T3152-V3156 VanDerWaalsContact O-CG2 3.26Å; T3152-V3156 WeakPolarHBondContact O-CG2 3.48Å; T3152-V3156 PolarHBondContact O-N 2.99Å
3153C97.8Very high93.8Very high6.5 Ų6.534.7 Ų34.74%0.04419%0.19CC..Hα-helixtrans-61-48.4175.9-69.70000112M3082 Y3149 R3150 H3151 M3155 V3156 M3157 V3414M3082-C3153 HydrophobicContact CE-CB 4.16Å; M3082-C3153 HydrophobicContact CG-CB 3.77Å; M3082-C3153 HydrophobicContact SD-CB 3.81Å; Y3149-C3153 PolarHBondContact O-N 3.16Å; Y3149-C3153 PolarHBondContact O-SG 3.22Å; Y3149-C3153 VanDerWaalsContact O-SG 3.35Å; R3150-C3153 WeakPolarHBondContact O-CA 3.48Å; R3150-C3153 WeakPolarHBondContact O-CB 3.36Å; R3150-C3153 PolarHBondContact O-N 3.26Å; R3150-C3153 VanDerWaalsContact O-N 3.09Å; H3151-C3153 VanDerWaalsContact C-N 3.34Å; H3151-C3153 PolarHBondContact O-N 3.03Å; C3153-M3155 PolarHBondContact O-N 2.88Å; C3153-V3156 PolarHBondContact O-N 3Å; C3153-M3157 VanDerWaalsContact O-CB 3.25Å; C3153-M3157 WeakPolarHBondContact O-CB 3.27Å; C3153-M3157 PolarHBondContact O-N 3.22Å; C3153-V3414 HydrophobicContact CB-CG1 3.6Å; C3153-V3414 HydrophobicContact CB-CG2 4.29Å
3154E96.6Very high93.6Very high80.5 Ų80.537 Ų3738%0.37619%0.193SC..Hα-helixtrans-61.1-44.5179.1-69.6175.2169.100112R3150 H3151 M3157 S3158 V3410 S3411 V3414R3150-E3154 WeakPolarHBondContact CD-OE1 3.46Å; R3150-E3154 HydrophobicContact CG-CG 4.31Å; R3150-E3154 VanDerWaalsContact CG-OE1 3.26Å; R3150-E3154 WeakPolarHBondContact CG-OE1 3.47Å; R3150-E3154 PolarHBondContact O-N 3.38Å; H3151-E3154 PolarHBondContact O-N 3.23Å; E3154-M3157 PolarHBondContact O-N 3.05Å; E3154-S3158 VanDerWaalsContact O-CB 3.28Å; E3154-S3158 WeakPolarHBondContact O-CB 3.32Å; E3154-S3158 PolarHBondContact O-N 3.29Å; E3154-V3410 HydrophobicContact CB-CG1 4.46Å; E3154-V3410 WeakPolarHBondContact O-CG1 3.47Å; E3154-S3411 WeakPolarHBondContact OE1-CA 3.39Å; E3154-S3411 WeakPolarHBondContact OE1-CB 3.25Å; E3154-S3411 PolarHBondContact OE1-OG 3.34Å; E3154-V3414 HydrophobicContact CG-CB 4.04Å; E3154-V3414 HydrophobicContact CG-CG1 3.99Å; E3154-V3414 HydrophobicContact CG-CG2 4.07Å
3155M95.7Very high93Very high19.5 Ų19.539.2 Ų39.210%0.09620%0.199CC..Hα-helixtrans-64-47177.9-178.5177.9-15.700112.4E2967 T2968 L2973 H3151 T3152 C3153 S3158 L3159E2967-M3155 HydrophobicContact CB-SD 4.32Å; E2967-M3155 HydrophobicContact CG-CE 3.69Å; E2967-M3155 HydrophobicContact CG-SD 3.9Å; E2967-M3155 VanDerWaalsContact OE1-CE 3.25Å; E2967-M3155 WeakPolarHBondContact OE1-CE 3.19Å; T2968-M3155 HydrophobicContact CG2-CG 3.64Å; T2968-M3155 HydrophobicContact CG2-SD 3.57Å; T2968-M3155 VanDerWaalsContact CG2-SD 3.57Å; L2973-M3155 HydrophobicContact CD1-CE 3.92Å; L2973-M3155 HydrophobicContact CD1-SD 4.42Å; H3151-M3155 WeakPolarHBondContact NE2-CE 3.13Å; H3151-M3155 VanDerWaalsContact O-CB 3.31Å; H3151-M3155 WeakPolarHBondContact O-CB 3.22Å; H3151-M3155 PolarHBondContact O-N 3.06Å; H3151-M3155 VanDerWaalsContact O-N 3.09Å; T3152-M3155 PolarHBondContact O-N 3.4Å; C3153-M3155 PolarHBondContact O-N 2.88Å; M3155-S3158 PolarHBondContact O-N 3.5Å; M3155-L3159 WeakPolarHBondContact O-CB 3.24Å; M3155-L3159 PolarHBondContact O-N 2.99Å
3156V97.1Very high92.3Very high0.5 Ų0.537.1 Ų37.10%0.00319%0.189CC..Hα-helixtrans-64.7-43.5177.4171.90000110.3L2962 L2973 T3079 M3082 V3083 T3152 C3153 S3158 L3159 L3160L2962-V3156 HydrophobicContact CD2-CG2 4.21Å; L2973-V3156 HydrophobicContact CD1-CG2 3.97Å; T3079-V3156 HydrophobicContact CG2-CG1 4.45Å; T3079-V3156 HydrophobicContact CG2-CG2 4.26Å; M3082-V3156 HydrophobicContact CB-CB 4.44Å; M3082-V3156 HydrophobicContact CB-CG1 3.9Å; M3082-V3156 HydrophobicContact CG-CG1 4.5Å; V3083-V3156 HydrophobicContact CG2-CG1 4.21Å; T3152-V3156 HydrophobicContact CG2-CG2 4.18Å; T3152-V3156 WeakPolarHBondContact O-CB 3.4Å; T3152-V3156 VanDerWaalsContact O-CG2 3.26Å; T3152-V3156 WeakPolarHBondContact O-CG2 3.48Å; T3152-V3156 PolarHBondContact O-N 2.99Å; C3153-V3156 PolarHBondContact O-N 3Å; V3156-S3158 PolarHBondContact O-N 3.37Å; V3156-L3159 WeakPolarHBondContact O-CB 3.49Å; V3156-L3159 PolarHBondContact O-N 3.1Å; V3156-L3160 HydrophobicContact CG1-CD1 3.96Å; V3156-L3160 HydrophobicContact CG1-CG 4.3Å; V3156-L3160 VanDerWaalsContact O-CG 3.3Å; V3156-L3160 WeakPolarHBondContact O-CG 3.3Å; V3156-L3160 PolarHBondContact O-N 3.22Å
3157M96.1Very high92Very high12.5 Ų12.534.4 Ų34.46%0.06217%0.174CC..Hα-helixtrans-65.8-40.6-179.9-167.562.1173.200112.1M3082 Y3085 I3086 C3153 E3154 L3159 L3160 R3161 V3410 Q3413 V3414M3082-M3157 HydrophobicContact SD-CB 4.32Å; Y3085-M3157 HydrophobicContact CD1-CE 4.19Å; Y3085-M3157 HydrophobicContact CE1-CE 4.06Å; I3086-M3157 HydrophobicContact CD1-CE 3.74Å; I3086-M3157 HydrophobicContact CD1-SD 4.05Å; I3086-M3157 HydrophobicContact CG1-SD 4.33Å; C3153-M3157 VanDerWaalsContact O-CB 3.25Å; C3153-M3157 WeakPolarHBondContact O-CB 3.27Å; C3153-M3157 PolarHBondContact O-N 3.22Å; E3154-M3157 PolarHBondContact O-N 3.05Å; M3157-L3159 VanDerWaalsContact C-N 3.33Å; M3157-L3159 PolarHBondContact O-N 2.88Å; M3157-L3160 PolarHBondContact O-N 2.84Å; M3157-R3161 HydrophobicContact CE-CG 4.36Å; M3157-R3161 HydrophobicContact CG-CG 4.49Å; M3157-R3161 WeakPolarHBondContact O-CB 3.35Å; M3157-R3161 VanDerWaalsContact O-CG 3.29Å; M3157-R3161 WeakPolarHBondContact O-CG 3.47Å; M3157-R3161 PolarHBondContact O-N 3.11Å; M3157-V3410 HydrophobicContact CB-CG1 3.95Å; M3157-V3410 HydrophobicContact CG-CG1 4.16Å; M3157-Q3413 HydrophobicContact CE-CG 4.23Å; M3157-Q3413 VanDerWaalsContact CE-OE1 3.28Å; M3157-V3414 HydrophobicContact CB-CG2 4.01Å; M3157-V3414 HydrophobicContact CG-CG2 4.25Å
3158S95.3Very high91.5Very high69 Ų6934 Ų3448%0.48317%0.17SC..Hα-helixtrans-59.7-43.6172.2-177.20000111.9E3154 M3155 V3156 R3161 S3162E3154-S3158 VanDerWaalsContact O-CB 3.28Å; E3154-S3158 WeakPolarHBondContact O-CB 3.32Å; E3154-S3158 PolarHBondContact O-N 3.29Å; M3155-S3158 PolarHBondContact O-N 3.5Å; V3156-S3158 PolarHBondContact O-N 3.37Å; S3158-R3161 PolarHBondContact O-N 2.98Å; S3158-S3162 VanDerWaalsContact O-CB 3.32Å; S3158-S3162 WeakPolarHBondContact O-CB 3.39Å; S3158-S3162 PolarHBondContact O-N 3.39Å; S3158-S3162 PolarHBondContact O-OG 3.21Å
3159L94.3Very high90.6Very high11.5 Ų11.533.8 Ų33.86%0.0617%0.17CC..Hα-helixtrans-63.3-42.3176.1-176.270.2000112.4L2961 L2962 N2965 T2968 M3155 V3156 M3157 S3162 N3163L2961-L3159 HydrophobicContact CB-CD1 4.37Å; L2961-L3159 HydrophobicContact CB-CD2 4.04Å; L2961-L3159 HydrophobicContact CB-CG 4.29Å; L2962-L3159 HydrophobicContact CB-CD2 4.49Å; L2962-L3159 HydrophobicContact CD2-CD2 3.56Å; L2962-L3159 HydrophobicContact CG-CD2 4.01Å; N2965-L3159 HydrophobicContact CB-CD1 3.92Å; T2968-L3159 HydrophobicContact CG2-CD2 4.4Å; M3155-L3159 WeakPolarHBondContact O-CB 3.24Å; M3155-L3159 PolarHBondContact O-N 2.99Å; V3156-L3159 WeakPolarHBondContact O-CB 3.49Å; V3156-L3159 PolarHBondContact O-N 3.1Å; M3157-L3159 VanDerWaalsContact C-N 3.33Å; M3157-L3159 PolarHBondContact O-N 2.88Å; L3159-S3162 WeakPolarHBondContact CA-OG 3.24Å; L3159-S3162 PolarHBondContact O-OG 3.1Å; L3159-S3162 VanDerWaalsContact O-OG 3.08Å; L3159-N3163 WeakPolarHBondContact O-CB 3.34Å; L3159-N3163 PolarHBondContact O-N 3.1Å; L3159-N3163 PolarHBondContact O-ND2 3.17Å
3160L93.7Very high89.7Confident1 Ų133.6 Ų33.61%0.00517%0.17CC..Hα-helixtrans-67.1-46.9178.2-65.9173.4000111.3V2958 V3083 I3086 V3156 M3157 S3162 N3163 R3164 L3167 L3399V2958-L3160 HydrophobicContact CG1-CD2 4.23Å; V2958-L3160 HydrophobicContact CG2-CD2 4Å; V3083-L3160 HydrophobicContact CG2-CD1 3.99Å; V3083-L3160 HydrophobicContact CG2-CD2 4.49Å; I3086-L3160 HydrophobicContact CG1-CD1 3.99Å; V3156-L3160 HydrophobicContact CG1-CD1 3.96Å; V3156-L3160 HydrophobicContact CG1-CG 4.3Å; V3156-L3160 VanDerWaalsContact O-CG 3.3Å; V3156-L3160 WeakPolarHBondContact O-CG 3.3Å; V3156-L3160 PolarHBondContact O-N 3.22Å; M3157-L3160 PolarHBondContact O-N 2.84Å; L3160-S3162 VanDerWaalsContact C-N 3.34Å; L3160-S3162 PolarHBondContact O-N 3.38Å; L3160-N3163 CarbonylContact O-C 3.29Å; L3160-N3163 PolarHBondContact O-N 3.18Å; L3160-N3163 VanDerWaalsContact O-N 3.08Å; L3160-R3164 PolarHBondContact O-N 2.75Å; L3160-R3164 VanDerWaalsContact O-N 3.09Å; L3160-L3167 HydrophobicContact CB-CD1 3.93Å; L3160-L3167 HydrophobicContact CD2-CD1 3.62Å; L3160-L3167 HydrophobicContact CD2-CD2 4.24Å; L3160-L3167 HydrophobicContact CG-CD1 4.37Å; L3160-L3167 WeakPolarHBondContact O-CD1 3.36Å; L3160-L3399 HydrophobicContact CB-CD2 3.99Å
3161R92.3Very high88.9Confident78 Ų7830.9 Ų30.929%0.29416%0.159SC..Hα-helixtrans-61.2-42.9178.5-70.9-178.8109.6179.2-11.1112.2M3157 S3158 N3163 R3164 L3399 T3400 M3408M3157-R3161 HydrophobicContact CE-CG 4.36Å; M3157-R3161 HydrophobicContact CG-CG 4.49Å; M3157-R3161 WeakPolarHBondContact O-CB 3.35Å; M3157-R3161 VanDerWaalsContact O-CG 3.29Å; M3157-R3161 WeakPolarHBondContact O-CG 3.47Å; M3157-R3161 PolarHBondContact O-N 3.11Å; S3158-R3161 PolarHBondContact O-N 2.98Å; R3161-N3163 VanDerWaalsContact C-N 3.27Å; R3161-N3163 PolarHBondContact O-N 3.33Å; R3161-R3164 WeakPolarHBondContact O-CB 3.46Å; R3161-R3164 PolarHBondContact O-N 3.15Å; R3161-L3399 WeakPolarHBondContact CB-O 3.37Å; R3161-L3399 VanDerWaalsContact CG-O 3.25Å; R3161-L3399 WeakPolarHBondContact CG-O 3.34Å; R3161-T3400 PolarHBondContact NH2-O 3.08Å; R3161-M3408 PolarHBondContact NH1-O 2.91Å; R3161-M3408 PolarHBondContact NH2-O 3.28Å
3162S87.3Confident87.8Confident85.5 Ų85.529.8 Ų29.860%0.59815%0.154SC*.Hα-helixtrans-66.6-19.5176.554.80000114.2S3158 L3159 L3160S3158-S3162 VanDerWaalsContact O-CB 3.32Å; S3158-S3162 WeakPolarHBondContact O-CB 3.39Å; S3158-S3162 PolarHBondContact O-N 3.39Å; S3158-S3162 PolarHBondContact O-OG 3.21Å; L3159-S3162 WeakPolarHBondContact CA-OG 3.24Å; L3159-S3162 PolarHBondContact O-OG 3.1Å; L3159-S3162 VanDerWaalsContact O-OG 3.08Å; L3160-S3162 VanDerWaalsContact C-N 3.34Å; L3160-S3162 PolarHBondContact O-N 3.38Å
3163N85.5Confident86.4Confident34.5 Ų34.530.3 Ų30.318%0.18416%0.159CC..THydrogen-bonded Turntrans-11419.4179.3-69.2-86.3000113.4Q2652 L2961 L3159 L3160 R3161 E3165 S3166 L3167Q2652-N3163 PolarHBondContact NE2-OD1 3.3Å; L2961-N3163 HydrophobicContact CD1-CB 3.67Å; L2961-N3163 HydrophobicContact CD2-CB 4.25Å; L3159-N3163 WeakPolarHBondContact O-CB 3.34Å; L3159-N3163 PolarHBondContact O-N 3.1Å; L3159-N3163 PolarHBondContact O-ND2 3.17Å; L3160-N3163 CarbonylContact O-C 3.29Å; L3160-N3163 PolarHBondContact O-N 3.18Å; L3160-N3163 VanDerWaalsContact O-N 3.08Å; R3161-N3163 VanDerWaalsContact C-N 3.27Å; R3161-N3163 PolarHBondContact O-N 3.33Å; N3163-E3165 VanDerWaalsContact C-N 3.27Å; N3163-E3165 PolarHBondContact O-N 3.17Å; N3163-E3165 VanDerWaalsContact O-N 3.13Å; N3163-S3166 PolarHBondContact O-N 3.1Å; N3163-S3166 VanDerWaalsContact O-N 3.13Å; N3163-L3167 PolarHBondContact O-N 3.39Å
3164R85.8Confident85Confident97.5 Ų97.530.6 Ų30.637%0.36816%0.16SC..Hα-helixtrans-51.3-40.8-171.870.4-177.3-167.2-157.7-3.7114.3L3160 R3161 S3166 L3167 L3168 L3399L3160-R3164 PolarHBondContact O-N 2.75Å; L3160-R3164 VanDerWaalsContact O-N 3.09Å; R3161-R3164 WeakPolarHBondContact O-CB 3.46Å; R3161-R3164 PolarHBondContact O-N 3.15Å; R3164-S3166 VanDerWaalsContact C-N 3.29Å; R3164-S3166 PolarHBondContact O-N 2.93Å; R3164-L3167 PolarHBondContact O-N 2.98Å; R3164-L3168 WeakPolarHBondContact O-CB 3.31Å; R3164-L3168 VanDerWaalsContact O-CG 3.31Å; R3164-L3168 WeakPolarHBondContact O-CG 3.41Å; R3164-L3168 PolarHBondContact O-N 3.18Å; R3164-L3399 HydrophobicContact CB-CB 3.72Å; R3164-L3399 HydrophobicContact CB-CD1 3.99Å; R3164-L3399 HydrophobicContact CB-CD2 4.42Å; R3164-L3399 HydrophobicContact CB-CG 4.27Å
3165E76.7Confident83.5Confident59 Ų5928.1 Ų28.128%0.27615%0.148SC..Hα-helixtrans-63.4-36.5-175.9-54.4-55.7150.800111.8N3163 A3169N3163-E3165 VanDerWaalsContact C-N 3.27Å; N3163-E3165 PolarHBondContact O-N 3.17Å; N3163-E3165 VanDerWaalsContact O-N 3.13Å; E3165-A3169 VanDerWaalsContact O-CB 3.29Å; E3165-A3169 WeakPolarHBondContact O-CB 3.47Å; E3165-A3169 PolarHBondContact O-N 3.29Å
3166S79.1Confident81.9Confident1 Ų130.3 Ų30.31%0.00716%0.158CC..Hα-helixtrans-76.7-34.6178.5-58.90000112.3Q2652 L2957 N3163 R3164 A3169 V3170Q2652-S3166 WeakPolarHBondContact CB-OG 3.29Å; Q2652-S3166 VanDerWaalsContact CG-OG 3.29Å; Q2652-S3166 WeakPolarHBondContact CG-OG 3.31Å; Q2652-S3166 PolarHBondContact NE2-OG 3.2Å; L2957-S3166 VanDerWaalsContact CD2-O 3.23Å; L2957-S3166 WeakPolarHBondContact CD2-O 3.4Å; N3163-S3166 PolarHBondContact O-N 3.1Å; N3163-S3166 VanDerWaalsContact O-N 3.13Å; R3164-S3166 VanDerWaalsContact C-N 3.29Å; R3164-S3166 PolarHBondContact O-N 2.93Å; S3166-A3169 PolarHBondContact O-N 3.2Å; S3166-V3170 PolarHBondContact O-N 2.91Å
3167L85.4Confident80.5Confident0 Ų030.7 Ų30.70%016%0.16CC..Hα-helixtrans-65.5-47.4173.5-63.8171.9000110.3F2954 L2957 V2958 L2961 L3160 N3163 R3164 A3169 V3170 L3171 L3399F2954-L3167 HydrophobicContact CD2-CD2 4.39Å; F2954-L3167 HydrophobicContact CE2-CB 4.05Å; F2954-L3167 HydrophobicContact CE2-CD2 3.65Å; F2954-L3167 HydrophobicContact CE2-CG 4.4Å; F2954-L3167 HydrophobicContact CZ-CD2 4.07Å; L2957-L3167 HydrophobicContact CD2-CD2 3.92Å; L2957-L3167 HydrophobicContact CG-CD2 4.27Å; V2958-L3167 HydrophobicContact CG2-CD2 3.85Å; L2961-L3167 HydrophobicContact CD1-CD2 4.1Å; L2961-L3167 HydrophobicContact CD1-CG 4.49Å; L3160-L3167 HydrophobicContact CB-CD1 3.93Å; L3160-L3167 HydrophobicContact CD2-CD1 3.62Å; L3160-L3167 HydrophobicContact CD2-CD2 4.24Å; L3160-L3167 HydrophobicContact CG-CD1 4.37Å; L3160-L3167 WeakPolarHBondContact O-CD1 3.36Å; N3163-L3167 PolarHBondContact O-N 3.39Å; R3164-L3167 PolarHBondContact O-N 2.98Å; L3167-A3169 VanDerWaalsContact C-N 3.33Å; L3167-A3169 PolarHBondContact O-N 3.1Å; L3167-V3170 PolarHBondContact O-N 3.14Å; L3167-L3171 VanDerWaalsContact O-CG 3.32Å; L3167-L3171 WeakPolarHBondContact O-CG 3.43Å; L3167-L3171 PolarHBondContact O-N 3.1Å; L3167-L3171 VanDerWaalsContact O-N 3.08Å; L3167-L3399 HydrophobicContact CB-CD1 4.3Å; L3167-L3399 HydrophobicContact CD1-CD1 4.42Å; L3167-L3399 HydrophobicContact CD1-CD2 3.98Å
3168L81.2Confident78.6Confident2.5 Ų2.533.6 Ų33.61%0.01318%0.18CC..Hα-helixtrans-60.2-42.7174.5-69.9171.9000111.2R3164 V3170 L3171 E3172 M3392 I3395 R3396 L3399R3164-L3168 WeakPolarHBondContact O-CB 3.31Å; R3164-L3168 VanDerWaalsContact O-CG 3.31Å; R3164-L3168 WeakPolarHBondContact O-CG 3.41Å; R3164-L3168 PolarHBondContact O-N 3.18Å; L3168-V3170 VanDerWaalsContact C-N 3.29Å; L3168-V3170 PolarHBondContact O-N 2.88Å; L3168-L3171 CarbonylContact O-C 3.53Å; L3168-L3171 PolarHBondContact O-N 3.18Å; L3168-L3171 VanDerWaalsContact O-N 3.13Å; L3168-E3172 WeakPolarHBondContact O-CB 3.46Å; L3168-E3172 VanDerWaalsContact O-CG 3.3Å; L3168-E3172 WeakPolarHBondContact O-CG 3.39Å; L3168-E3172 PolarHBondContact O-N 3.2Å; L3168-M3392 HydrophobicContact CB-CE 4.42Å; L3168-M3392 HydrophobicContact CD2-CE 3.81Å; L3168-I3395 HydrophobicContact CD2-CB 4.48Å; L3168-I3395 HydrophobicContact CD2-CG2 4.04Å; L3168-R3396 HydrophobicContact CD1-CB 4.15Å; L3168-R3396 HydrophobicContact CD1-CG 4.2Å; L3168-R3396 HydrophobicContact CD2-CB 4.19Å; L3168-L3399 HydrophobicContact CD2-CD1 4.28Å; L3168-L3399 HydrophobicContact CG-CD1 4.17Å
3169A76Confident76.7Confident15.5 Ų15.531.1 Ų31.113%0.12816%0.161CC..Hα-helixtrans-62.3-33.2178.900000114.1L2655 E3165 S3166 L3167L2655-A3169 HydrophobicContact CB-CB 4.04Å; L2655-A3169 HydrophobicContact CD1-CB 4.3Å; E3165-A3169 VanDerWaalsContact O-CB 3.29Å; E3165-A3169 WeakPolarHBondContact O-CB 3.47Å; E3165-A3169 PolarHBondContact O-N 3.29Å; S3166-A3169 PolarHBondContact O-N 3.2Å; L3167-A3169 VanDerWaalsContact C-N 3.33Å; L3167-A3169 PolarHBondContact O-N 3.1Å
3170V79.5Confident75.1Confident1.5 Ų1.530.9 Ų30.91%0.00916%0.16CC..Hα-helixtrans-69.4-42.8171.21740000110.7L2655 F2954 L2957 S3166 L3167 L3168 A3173L2655-V3170 HydrophobicContact CD1-CG2 3.45Å; F2954-V3170 HydrophobicContact CB-CG1 4.29Å; F2954-V3170 HydrophobicContact CD2-CG1 4.44Å; L2957-V3170 HydrophobicContact CB-CG2 4.46Å; L2957-V3170 HydrophobicContact CD2-CB 4.43Å; L2957-V3170 HydrophobicContact CD2-CG2 3.55Å; S3166-V3170 PolarHBondContact O-N 2.91Å; L3167-V3170 PolarHBondContact O-N 3.14Å; L3168-V3170 VanDerWaalsContact C-N 3.29Å; L3168-V3170 PolarHBondContact O-N 2.88Å; V3170-A3173 VanDerWaalsContact O-CB 3.27Å; V3170-A3173 WeakPolarHBondContact O-CB 3.37Å; V3170-A3173 PolarHBondContact O-N 3.38Å
3171L78.4Confident73.2Confident0 Ų032.9 Ų32.90%017%0.17CC..Hα-helixtrans-74-30-177.3-65172.6000112.9F2954 L3087 F3115 L3167 L3168 A3173 F3174 M3392 I3395F2954-L3171 HydrophobicContact CD2-CD1 4.26Å; F2954-L3171 HydrophobicContact CD2-CD2 3.85Å; F2954-L3171 HydrophobicContact CD2-CG 3.92Å; F2954-L3171 HydrophobicContact CE2-CD1 3.77Å; F2954-L3171 HydrophobicContact CE2-CD2 4.17Å; F2954-L3171 HydrophobicContact CE2-CG 3.94Å; F2954-L3171 HydrophobicContact CG-CD2 4.31Å; F2954-L3171 HydrophobicContact CZ-CD1 4.38Å; L3087-L3171 HydrophobicContact CD1-CD2 4.16Å; F3115-L3171 HydrophobicContact CE1-CD2 4.37Å; F3115-L3171 HydrophobicContact CZ-CD2 4.42Å; L3167-L3171 VanDerWaalsContact O-CG 3.32Å; L3167-L3171 WeakPolarHBondContact O-CG 3.43Å; L3167-L3171 PolarHBondContact O-N 3.1Å; L3167-L3171 VanDerWaalsContact O-N 3.08Å; L3168-L3171 CarbonylContact O-C 3.53Å; L3168-L3171 PolarHBondContact O-N 3.18Å; L3168-L3171 VanDerWaalsContact O-N 3.13Å; L3171-A3173 PolarHBondContact O-N 3.21Å; L3171-A3173 VanDerWaalsContact O-N 3.14Å; L3171-F3174 HydrophobicContact CD2-CD2 4.25Å; L3171-F3174 HydrophobicContact CD2-CE2 3.7Å; L3171-F3174 HydrophobicContact CD2-CZ 4.25Å; L3171-F3174 VanDerWaalsContact O-CB 3.28Å; L3171-F3174 WeakPolarHBondContact O-CB 3.23Å; L3171-F3174 VanDerWaalsContact O-CD2 3.3Å; L3171-F3174 WeakPolarHBondContact O-CD2 3.37Å; L3171-F3174 PolarHBondContact O-N 3.25Å; L3171-M3392 HydrophobicContact CB-CE 3.75Å; L3171-M3392 HydrophobicContact CB-SD 3.53Å; L3171-M3392 VanDerWaalsContact CB-SD 3.53Å; L3171-I3395 HydrophobicContact CD1-CD1 4.05Å; L3171-I3395 HydrophobicContact CD1-CG2 3.9Å
3172E73Confident71.4Confident48 Ų4832.5 Ų32.522%0.22417%0.168CC..Hα-helixtrans-61.3-28.1174.6-79.9-178177.100111.7L3168 F3174 I3175 H3176 M3392 R3396L3168-E3172 WeakPolarHBondContact O-CB 3.46Å; L3168-E3172 VanDerWaalsContact O-CG 3.3Å; L3168-E3172 WeakPolarHBondContact O-CG 3.39Å; L3168-E3172 PolarHBondContact O-N 3.2Å; E3172-F3174 PolarHBondContact O-N 3.04Å; E3172-I3175 HydrophobicContact CB-CD1 4.3Å; E3172-I3175 HydrophobicContact CG-CD1 4.07Å; E3172-I3175 WeakPolarHBondContact O-CB 3.4Å; E3172-I3175 WeakPolarHBondContact O-CG1 3.48Å; E3172-I3175 PolarHBondContact O-N 3.44Å; E3172-I3175 VanDerWaalsContact O-N 3.13Å; E3172-H3176 PolarHBondContact O-CD2 3.26Å; E3172-M3392 HydrophobicContact CB-CE 4.38Å; E3172-M3392 HydrophobicContact CG-CE 3.6Å; E3172-R3396 IonicContact OE1-NH2 3.79Å
3173A67.7Low69.7Low13 Ų1330.6 Ų30.611%0.10715%0.153CC..Hα-helixtrans-58.5-30.1172.800000112.6Q2692 V3170 L3171 I3175 H3176 D3177Q2692-A3173 HydrophobicContact CG-CB 3.96Å; V3170-A3173 VanDerWaalsContact O-CB 3.27Å; V3170-A3173 WeakPolarHBondContact O-CB 3.37Å; V3170-A3173 PolarHBondContact O-N 3.38Å; L3171-A3173 PolarHBondContact O-N 3.21Å; L3171-A3173 VanDerWaalsContact O-N 3.14Å; A3173-I3175 VanDerWaalsContact C-N 3.33Å; A3173-I3175 PolarHBondContact O-N 2.8Å; A3173-H3176 PolarHBondContact O-N 2.76Å; A3173-D3177 PolarHBondContact O-N 3.11Å; A3173-D3177 VanDerWaalsContact O-N 3.1Å
3174F68.2Low67.9Low13 Ų1330.6 Ų30.66%0.05715%0.152CC..Hα-helixtrans-67.7-33.3176.1-69.2-114.3000112.6R2950 I2951 F3115 L3171 E3172 H3176 L3180 W3182R2950-F3174 HydrophobicContact CB-CD1 4.28Å; R2950-F3174 HydrophobicContact CB-CD2 4.33Å; R2950-F3174 HydrophobicContact CB-CE1 3.48Å; R2950-F3174 HydrophobicContact CB-CE2 3.56Å; R2950-F3174 VanDerWaalsContact CB-CE2 3.43Å; R2950-F3174 HydrophobicContact CB-CZ 3.1Å; R2950-F3174 HydrophobicContact CG-CD1 4.35Å; R2950-F3174 HydrophobicContact CG-CD2 4.48Å; R2950-F3174 HydrophobicContact CG-CE1 4.09Å; R2950-F3174 HydrophobicContact CG-CE2 4.16Å; R2950-F3174 HydrophobicContact CG-CZ 4.07Å; I2951-F3174 HydrophobicContact CG1-CZ 4.29Å; F3115-F3174 AromaticContact CE2-CD1 3.89Å; F3115-F3174 HydrophobicContact CE2-CD1 4Å; F3115-F3174 AromaticContact CE2-CE1 3.73Å; F3115-F3174 HydrophobicContact CE2-CE1 3.94Å; F3115-F3174 AromaticContact CZ-CD1 3.89Å; F3115-F3174 HydrophobicContact CZ-CD1 3.89Å; F3115-F3174 AromaticContact CZ-CE1 3.74Å; F3115-F3174 HydrophobicContact CZ-CE1 3.74Å; F3115-F3174 HydrophobicContact CZ-CG 4.39Å; F3115-F3174 AromaticContact CZ-CZ 3.95Å; F3115-F3174 HydrophobicContact CZ-CZ 4.1Å; L3171-F3174 HydrophobicContact CD2-CD2 4.25Å; L3171-F3174 HydrophobicContact CD2-CE2 3.7Å; L3171-F3174 HydrophobicContact CD2-CZ 4.25Å; L3171-F3174 VanDerWaalsContact O-CB 3.28Å; L3171-F3174 WeakPolarHBondContact O-CB 3.23Å; L3171-F3174 VanDerWaalsContact O-CD2 3.3Å; L3171-F3174 WeakPolarHBondContact O-CD2 3.37Å; L3171-F3174 PolarHBondContact O-N 3.25Å; E3172-F3174 PolarHBondContact O-N 3.04Å; F3174-H3176 PolarHBondContact O-N 2.9Å; F3174-L3180 HydrophobicContact CB-CD1 4.1Å; F3174-L3180 HydrophobicContact CD1-CD1 4Å; F3174-L3180 HydrophobicContact CG-CD1 3.99Å; F3174-W3182 HydrophobicContact CB-CZ2 3.85Å
3175I64.7Low65.9Low27.5 Ų27.531.2 Ų31.214%0.14116%0.16CC..Hα-helixtrans-62.4-34178.3-49.7172.8000110.1E3172 A3173 Q3181 A3388 M3392E3172-I3175 HydrophobicContact CB-CD1 4.3Å; E3172-I3175 HydrophobicContact CG-CD1 4.07Å; E3172-I3175 WeakPolarHBondContact O-CB 3.4Å; E3172-I3175 WeakPolarHBondContact O-CG1 3.48Å; E3172-I3175 PolarHBondContact O-N 3.44Å; E3172-I3175 VanDerWaalsContact O-N 3.13Å; A3173-I3175 VanDerWaalsContact C-N 3.33Å; A3173-I3175 PolarHBondContact O-N 2.8Å; I3175-Q3181 PolarHBondContact O-NE2 3.18Å; I3175-A3388 HydrophobicContact CB-CB 4.33Å; I3175-A3388 HydrophobicContact CG1-CB 4.26Å; I3175-A3388 HydrophobicContact CG2-CB 3.98Å; I3175-M3392 HydrophobicContact CD1-CB 4.31Å; I3175-M3392 HydrophobicContact CD1-CG 3.8Å; I3175-M3392 HydrophobicContact CG1-CG 3.81Å
3176H63Low64.2Low65.5 Ų65.533.6 Ų33.630%0.30317%0.171SC..Hα-helixtrans-104.4-10.7-164.4-66.9-59.7000114.9R2696 E3172 A3173 F3174 P3178R2696-H3176 VanDerWaalsContact CZ-CD2 3.5Å; R2696-H3176 VanDerWaalsContact NE-CB 3.25Å; R2696-H3176 VanDerWaalsContact NE-CG 3.29Å; R2696-H3176 PolarHBondContact NH1-ND1 3.46Å; R2696-H3176 PolarHBondContact NH2-CD2 3.08Å; R2696-H3176 PolarHBondContact NH2-CE1 3.02Å; R2696-H3176 VanDerWaalsContact NH2-CE1 3.3Å; R2696-H3176 PolarHBondContact NH2-ND1 3.13Å; R2696-H3176 VanDerWaalsContact NH2-ND1 3.15Å; R2696-H3176 PolarHBondContact NH2-NE2 3.45Å; E3172-H3176 PolarHBondContact O-CD2 3.26Å; A3173-H3176 PolarHBondContact O-N 2.76Å; F3174-H3176 PolarHBondContact O-N 2.9Å; H3176-P3178 WeakPolarHBondContact O-CD 3.41Å
3177D66.9Low62.2Low8 Ų836.6 Ų36.64%0.04319%0.187CC..  trans-81.4103.9168.3-163.5-5.4000108.3A2695 R2739 R2950 A3173 L3179 L3180 Q3181A2695-D3177 HydrophobicContact CB-CB 4.1Å; R2739-D3177 IonicContact CZ-OD1 3.16Å; R2739-D3177 IonicContact NH1-OD1 3.01Å; R2739-D3177 PolarHBondContact NH1-OD1 3.3Å; R2739-D3177 IonicContact NH2-OD1 3.29Å; R2950-D3177 IonicContact CZ-OD2 3.73Å; R2950-D3177 IonicContact NH2-OD2 3.54Å; R2950-D3177 PolarHBondContact NH2-OD2 3.36Å; A3173-D3177 PolarHBondContact O-N 3.11Å; A3173-D3177 VanDerWaalsContact O-N 3.1Å; D3177-L3179 PolarHBondContact O-N 2.95Å; D3177-L3179 WeakPolarHBondContact OD1-CB 2.99Å; D3177-L3179 PolarHBondContact OD1-N 2.89Å; D3177-L3180 HydrophobicContact CB-CD1 4.06Å; D3177-L3180 HydrophobicContact CB-CG 4.41Å; D3177-L3180 PolarHBondContact O-N 3.07Å; D3177-L3180 VanDerWaalsContact O-N 3.11Å; D3177-Q3181 WeakPolarHBondContact O-CG 3.29Å
3178P55.8Low59.9Low74 Ų7444.9 Ų44.948%0.48122%0.218SC..THydrogen-bonded Turntrans-60.9-14.7-176.827.9-36000112.6R2739 H3176R2739-P3178 VanDerWaalsContact NH2-CD 3.3Å; H3176-P3178 WeakPolarHBondContact O-CD 3.41Å
3179L55.7Low57.7Low16 Ų1650.9 Ų50.98%0.08424%0.244CC..THydrogen-bonded Turntrans-82.1-22.1-179.1-67.6179.2000114.2S2733 G2734 R2739 R2946 D3177 Q3181 W3182S2733-L3179 VanDerWaalsContact OG-CD1 3.25Å; S2733-L3179 WeakPolarHBondContact OG-CD1 3.41Å; G2734-L3179 VanDerWaalsContact O-CD2 3.3Å; G2734-L3179 WeakPolarHBondContact O-CD2 3.42Å; R2739-L3179 VanDerWaalsContact NH1-CD1 3.31Å; R2946-L3179 PolarHBondContact NH1-O 3.23Å; R2946-L3179 PolarHBondContact NH2-O 3.42Å; D3177-L3179 PolarHBondContact O-N 2.95Å; D3177-L3179 WeakPolarHBondContact OD1-CB 2.99Å; D3177-L3179 PolarHBondContact OD1-N 2.89Å; L3179-Q3181 PolarHBondContact O-N 2.84Å; L3179-W3182 PolarHBondContact O-NE1 2.81Å
3180L60.3Low55.4Low8 Ų856.6 Ų56.64%0.04227%0.268CS..SBendtrans-83.955.5-179.8-83.2162.8000111.1R2946 Q2947 R2950 F3174 D3177 W3182R2946-L3180 HydrophobicContact CB-CD2 3.79Å; R2946-L3180 HydrophobicContact CB-CG 4.45Å; Q2947-L3180 HydrophobicContact CB-CD2 4.02Å; R2950-L3180 HydrophobicContact CG-CD1 3.99Å; F3174-L3180 HydrophobicContact CB-CD1 4.1Å; F3174-L3180 HydrophobicContact CD1-CD1 4Å; F3174-L3180 HydrophobicContact CG-CD1 3.99Å; D3177-L3180 HydrophobicContact CB-CD1 4.06Å; D3177-L3180 HydrophobicContact CB-CG 4.41Å; D3177-L3180 PolarHBondContact O-N 3.07Å; D3177-L3180 VanDerWaalsContact O-N 3.11Å; L3180-W3182 VanDerWaalsContact C-N 3.29Å; L3180-W3182 PolarHBondContact O-N 3.11Å
3181Q53.7Low53.1Low43 Ų4363 Ų6320%0.20130%0.296CS..THydrogen-bonded Turntrans-78.5-5-160.5-101.7176.6-500115D2944 Y2986 I3175 D3177 L3179 V3183 L3184 H3185D2944-Q3181 WeakPolarHBondContact OD2-CB 3.35Å; D2944-Q3181 PolarHBondContact OD2-N 3.14Å; Y2986-Q3181 PolarHBondContact OH-NE2 3.47Å; I3175-Q3181 PolarHBondContact O-NE2 3.18Å; D3177-Q3181 WeakPolarHBondContact O-CG 3.29Å; L3179-Q3181 PolarHBondContact O-N 2.84Å; Q3181-V3183 PolarHBondContact O-N 3.3Å; Q3181-L3184 HydrophobicContact CG-CB 4.2Å; Q3181-L3184 HydrophobicContact CG-CD1 3.77Å; Q3181-L3184 HydrophobicContact CG-CG 4.18Å; Q3181-L3184 PolarHBondContact O-N 3.08Å; Q3181-H3185 PolarHBondContact O-N 3.27Å; Q3181-H3185 PolarHBondContact O-ND1 3.44Å
3182W56.1Low50.8Low69.5 Ų69.566.7 Ų66.726%0.26332%0.316SS..THydrogen-bonded Turntrans-69.6-14.3-174.963.2-79.9000114.4D2944 F3174 L3179 L3180 L3184 H3185 E3186 A3388 V3391D2944-W3182 HydrophobicContact CB-CZ2 3.68Å; D2944-W3182 PolarHBondContact OD2-NE1 3.03Å; D2944-W3182 VanDerWaalsContact OD2-NE1 3.12Å; F3174-W3182 HydrophobicContact CB-CZ2 3.85Å; L3179-W3182 PolarHBondContact O-NE1 2.81Å; L3180-W3182 VanDerWaalsContact C-N 3.29Å; L3180-W3182 PolarHBondContact O-N 3.11Å; W3182-L3184 PolarHBondContact O-N 2.83Å; W3182-L3184 VanDerWaalsContact O-N 3.07Å; W3182-H3185 PolarHBondContact O-N 3.43Å; W3182-E3186 HydrophobicContact CE3-CG 4.46Å; W3182-E3186 PolarHBondContact O-N 2.9Å; W3182-A3388 HydrophobicContact CH2-CB 3.16Å; W3182-A3388 HydrophobicContact CZ2-CB 3.54Å; W3182-A3388 VanDerWaalsContact CZ3-CA 3.43Å; W3182-A3388 HydrophobicContact CZ3-CB 3.72Å; W3182-V3391 HydrophobicContact CH2-CB 4.32Å; W3182-V3391 HydrophobicContact CH2-CG1 4.28Å; W3182-V3391 HydrophobicContact CZ3-CB 4.02Å; W3182-V3391 HydrophobicContact CZ3-CG1 4.22Å; W3182-V3391 HydrophobicContact CZ3-CG2 3.97Å
3183V50.7Low48.8Very low46.5 Ų46.571.4 Ų71.428%0.28234%0.337SS..Hα-helixtrans-72.7-29.1170.9-177.50000111.6V3117 Q3181 N3385V3117-V3183 HydrophobicContact CG2-CG1 4.37Å; Q3181-V3183 PolarHBondContact O-N 3.3Å; V3183-N3385 HydrophobicContact CG2-CB 3.84Å; V3183-N3385 VanDerWaalsContact CG2-CG 3.41Å; V3183-N3385 WeakPolarHBondContact CG2-ND2 3.46Å
3184L48.4Very low47.1Very low33 Ų3377.1 Ų77.117%0.17337%0.365CS..Hα-helixtrans-91.7-6.2-171.6-62.3178.8000114.1Q3181 W3182 Q3317Q3181-L3184 HydrophobicContact CG-CB 4.2Å; Q3181-L3184 HydrophobicContact CG-CD1 3.77Å; Q3181-L3184 HydrophobicContact CG-CG 4.18Å; Q3181-L3184 PolarHBondContact O-N 3.08Å; W3182-L3184 PolarHBondContact O-N 2.83Å; W3182-L3184 VanDerWaalsContact O-N 3.07Å; L3184-Q3317 HydrophobicContact CD2-CG 3.82Å
3185H44Very low45.3Very low111.5 Ų111.582.9 Ų82.952%0.51639%0.392SS..Hα-helixtrans-97.6-14.1-175.6-83.467.2000115Q3181 W3182 N3187 R3188Q3181-H3185 PolarHBondContact O-N 3.27Å; Q3181-H3185 PolarHBondContact O-ND1 3.44Å; W3182-H3185 PolarHBondContact O-N 3.43Å; H3185-N3187 VanDerWaalsContact C-N 3.25Å; H3185-N3187 PolarHBondContact O-N 3.45Å; H3185-N3187 VanDerWaalsContact O-N 3.14Å; H3185-R3188 PolarHBondContact O-N 3.35Å
3186E40.7Very low43.7Very low109 Ų10987.6 Ų87.651%0.50942%0.418SS..G310 helixtrans-71.5-25.2178.6-98.8142.9-166.500113.6W3182 R3188 K3189 R3387W3182-E3186 HydrophobicContact CE3-CG 4.46Å; W3182-E3186 PolarHBondContact O-N 2.9Å; E3186-R3188 PolarHBondContact O-N 3.12Å; E3186-R3188 VanDerWaalsContact O-N 3.09Å; E3186-K3189 PolarHBondContact O-N 2.91Å; E3186-R3387 IonicContact OE1-CZ 2.97Å; E3186-R3387 IonicContact OE1-NH1 2.78Å; E3186-R3387 PolarHBondContact OE1-NH1 2.91Å; E3186-R3387 IonicContact OE2-CZ 3.44Å; E3186-R3387 IonicContact OE2-NH1 3.71Å; E3186-R3387 PolarHBondContact OE2-NH1 3.25Å
3187N37.2Very low42.2Very low64 Ų6493.1 Ų93.134%0.34244%0.441SS..G310 helixtrans-70.74.2-179.4-73.1-34.9000115H3185 Q3317H3185-N3187 VanDerWaalsContact C-N 3.25Å; H3185-N3187 PolarHBondContact O-N 3.45Å; H3185-N3187 VanDerWaalsContact O-N 3.14Å; N3187-Q3317 PolarHBondContact ND2-OE1 3.43Å
3188R36.7Very low40.4Very low173 Ų173100.1 Ų100.165%0.65348%0.477SS*.G310 helixtrans-88.4-10174.6-122.7-172.7-171.2-142.9-0.4114D2785 H3185 E3186 E3190D2785-R3188 VanDerWaalsContact CG-NH2 3.28Å; D2785-R3188 IonicContact OD1-CZ 2.75Å; D2785-R3188 IonicContact OD1-NH1 3.68Å; D2785-R3188 IonicContact OD1-NH2 2.68Å; D2785-R3188 PolarHBondContact OD1-NH2 2.97Å; D2785-R3188 IonicContact OD2-NH2 3.87Å; D2785-R3188 PolarHBondContact OD2-NH2 3.09Å; H3185-R3188 PolarHBondContact O-N 3.35Å; E3186-R3188 PolarHBondContact O-N 3.12Å; E3186-R3188 VanDerWaalsContact O-N 3.09Å; R3188-E3190 VanDerWaalsContact C-N 3.32Å; R3188-E3190 PolarHBondContact O-N 3.38Å
3189K34.1Very low39.2Very low130 Ų130103.8 Ų103.857%0.56549%0.493SS*.THydrogen-bonded Turntrans-106.1-30.5-175.7-72.4-174.3179.8172.80115.7E3122 E3186 F3191E3122-K3189 WeakPolarHBondContact OE1-CD 3.26Å; E3122-K3189 IonicContact OE1-NZ 3.6Å; E3122-K3189 PolarHBondContact OE1-NZ 3.11Å; E3122-K3189 IonicContact OE2-NZ 2.73Å; E3122-K3189 PolarHBondContact OE2-NZ 3.03Å; E3186-K3189 PolarHBondContact O-N 2.91Å; K3189-F3191 PolarHBondContact O-N 3.48Å
3190E29.3Very low37.9Very low134 Ų134111 Ų11163%0.62653%0.532SS*.THydrogen-bonded Turntrans-86-21.5-173.8-65.6-169.1142.300114.4R3188 N3192 H3193R3188-E3190 VanDerWaalsContact C-N 3.32Å; R3188-E3190 PolarHBondContact O-N 3.38Å; E3190-N3192 VanDerWaalsContact C-N 3.3Å; E3190-N3192 PolarHBondContact O-N 3.17Å; E3190-H3193 PolarHBondContact O-N 3.35Å
3191F30Very low36.3Very low135.5 Ų135.5114.2 Ų114.259%0.59457%0.567SS**THydrogen-bonded Turntrans-68.3-33.9179.3-107.5-90.8000114.1K3189 H3193 L3194K3189-F3191 PolarHBondContact O-N 3.48Å; F3191-H3193 PolarHBondContact O-N 3.27Å; F3191-H3193 VanDerWaalsContact O-N 3.1Å; F3191-L3194 PolarHBondContact O-N 3.11Å
3192N30.1Very low34.9Very low79 Ų79116.5 Ų116.542%0.42260%0.602SS.*Hα-helixtrans-71-9.9-178.4-71.59.5000113.6E3190 N3196E3190-N3192 VanDerWaalsContact C-N 3.3Å; E3190-N3192 PolarHBondContact O-N 3.17Å; N3192-N3196 WeakPolarHBondContact O-CB 3.18Å; N3192-N3196 PolarHBondContact O-N 3.33Å; N3192-N3196 PolarHBondContact O-ND2 3.19Å
3193H31.4Very low33.6Very low147 Ų147116.9 Ų116.968%0.68163%0.628SS**Hα-helixtrans-96-10.9179.5-83.1-55.9000114.9E3190 F3191E3190-H3193 PolarHBondContact O-N 3.35Å; F3191-H3193 PolarHBondContact O-N 3.27Å; F3191-H3193 VanDerWaalsContact O-N 3.1Å
3194L31.9Very low32.6Very low132.5 Ų132.5118.8 Ų118.869%0.69466%0.657SS**Hα-helixtrans-96.9-31.3170-91.690.3000113.1F3191 N3196 K3197F3191-L3194 PolarHBondContact O-N 3.11Å; L3194-N3196 VanDerWaalsContact C-N 3.33Å; L3194-N3196 PolarHBondContact O-N 3.46Å; L3194-K3197 PolarHBondContact O-N 3.17Å
3195E30.2Very low31.6Very low134 Ų134121.2 Ų121.263%0.62669%0.689SS**Hα-helixtrans-69.5-37.1178.7-139.6162.1-156.800111.5K3197 L3198E3195-K3197 PolarHBondContact O-N 3.09Å; E3195-L3198 PolarHBondContact O-N 3.21Å
3196N31.5Very low30.8Very low126 Ų126120 Ų12067%0.67471%0.707SS**THydrogen-bonded Turntrans-73.514.8173.4-72.7-44.7000114.8N3192 L3194N3192-N3196 WeakPolarHBondContact O-CB 3.18Å; N3192-N3196 PolarHBondContact O-N 3.33Å; N3192-N3196 PolarHBondContact O-ND2 3.19Å; L3194-N3196 VanDerWaalsContact C-N 3.33Å; L3194-N3196 PolarHBondContact O-N 3.46Å
3197K31.6Very low30Very low182.5 Ų182.5118.2 Ų118.279%0.79372%0.718SS**THydrogen-bonded Turntrans-120.35.8172.3-92-171.6175.4-177.70114.1L3194 E3195L3194-K3197 PolarHBondContact O-N 3.17Å; E3195-K3197 PolarHBondContact O-N 3.09Å
3198L29.8Very low29.6Very low153.5 Ų153.5123.8 Ų123.880%0.80475%0.746SS**SBendtrans-118.1-3.5177.8-72.2168.8000114.3E3195E3195-L3198 PolarHBondContact O-N 3.21Å
3199D29Very low29.2Very low152.5 Ų152.5119.9 Ų119.982%0.81675%0.75SS**SBendtrans-112.921.6-177.8-100-10.5000114.6
3200D28.5Very low29Very low167 Ų167119.8 Ų119.889%0.89376%0.763SS**  trans-12378.3172.5-128.2-8.4000110.2
3201G27Very low29Very low75 Ų75117.6 Ų117.677%0.77377%0.768SS**  trans171.920.4-173.100000117G3203G3201-G3203 PolarHBondContact O-N 3.44Å
3202G24.9Very low28.9Very low92 Ų92119.7 Ų119.795%0.94878%0.784SS**  trans-95.353-17100000116.1
3203G27.9Very low28.9Very low77 Ų77119.3 Ų119.379%0.79480%0.798SS**  trans-166.2134.8179.100000116.4G3201G3201-G3203 PolarHBondContact O-N 3.44Å
3204G29.6Very low28.9Very low87 Ų87118.3 Ų118.390%0.89780%0.802SS**  trans101.7105.4175.600000113.1
3205G28.4Very low28.7Very low83 Ų83119 Ų11986%0.85681%0.807SS**  trans-95.6158.3-176.100000114.8
3206G26.7Very low28.4Very low87 Ų87117.7 Ų117.790%0.89781%0.811SS**  trans94108.1145.700000118.6
3207G24.8Very low28.2Very low70 Ų70120 Ų12072%0.72282%0.822SS**  trans113.9113.3134.400000119.3
3208I28.7Very low27.8Very low183 Ų183115.3 Ų115.394%0.93882%0.818SS**  trans78.6154.9145.3-55.1177.2000116.9
3209A28.1Very low27.8Very low90 Ų90116.4 Ų116.474%0.74483%0.825SS**  trans-77.7167.9-161.100000115.7
3210P30.4Very low27.6Very low129 Ų129112.4 Ų112.484%0.83882%0.819SS**  trans-108.7169.3-157.741.1-35.7000116.1
3211A29.6Very low27.7Very low88 Ų88111.7 Ų111.773%0.72782%0.821SS**  trans-150.3120.9162.300000114.1
3212I28.2Very low27.7Very low179 Ų179111.8 Ų111.892%0.91882%0.822SS**  trans39.2126.6134.1-48.5173000119.7
3213G29.3Very low27.9Very low70 Ų70111.6 Ų111.672%0.72282%0.82SS**  trans169.954.8162.900000121.8
3214T30.3Very low27.9Very low126 Ų126111.5 Ų111.577%0.77382%0.819SS**  trans5.9132.6158.250.10000123.8
3215N29.2Very low28Very low147 Ų147113.8 Ų113.879%0.78682%0.815SS**  trans67.8108.3134.1-65.64.9000123.6
3216C23.2Very low28Very low107 Ų107118.6 Ų118.672%0.72382%0.815SS**  trans-5.8138.4139.656.90000121.4
3217L26.6Very low27.9Very low174 Ų174117.7 Ų117.791%0.91181%0.806SS**  -166172.4102-103.8168.2000111.8
3218A24.7Very low28Very low84 Ų84120.7 Ų120.769%0.69481%0.81SS**  trans-93.8155-167.900000114.6
3219N28.8Very low28Very low177 Ų177117.8 Ų117.895%0.94780%0.801SS**  trans-159.4156.1141.7-112.5-28000111
3220G24.7Very low28.1Very low68 Ų68119.5 Ų119.570%0.70180%0.802SS**  trans-143.1151.2179.100000112.5
3221T30.1Very low28Very low153 Ų153117.5 Ų117.594%0.93980%0.796SS**  trans-147.2144.7175.149.60000108.7
3222G28.1Very low28Very low76 Ų76120 Ų12078%0.78480%0.798SS**  cis-178.6157.4-8.900000112.4
3223G29.2Very low28Very low88 Ų88118.1 Ų118.191%0.90779%0.79SS**  trans82.5142.9-179.800000114.5
3224G27.9Very low28Very low75 Ų75123.5 Ų123.577%0.77380%0.796SS**  cis135.61442.700000110.2
3225V30.7Very low27.9Very low135 Ų135122.1 Ų122.182%0.81879%0.791SS**  cis-149.7169.62.2176.80000108.5
3226H28.3Very low27.8Very low184 Ų184120.8 Ų120.885%0.85279%0.788SS**  trans-50.3161.2168.3-47.6-86.8000114
3227G25.7Very low28Very low69 Ų69124.6 Ų124.671%0.71180%0.796SS**  cis151.6-168.8-1.700000112.7
3228V27.3Very low28Very low133 Ų133123.4 Ų123.481%0.80679%0.789SS**  trans91.4132.5157.3-1700000120.6
3229T28.9Very low28.2Very low121 Ų121129.2 Ų129.274%0.74280%0.799SS**  trans69.6102159.845.20000125.7
3230T30Very low28.4Very low127 Ų127127 Ų12778%0.77979%0.794SS**  34.8113.3120.842.30000125.2
3231A28.1Very low28.5Very low86 Ų86127.5 Ų127.571%0.71180%0.799SS**  76.6131.4107.700000125.6
3232N29.4Very low28.5Very low142 Ų142124.8 Ų124.876%0.75979%0.792SS**  trans89.7103.7142.2-73.4-0.9000124.6
3233N28.2Very low28.5Very low139 Ų139132 Ų13274%0.74380%0.796SS**  62.1114.5124.1-65.7-11.9000124.1
3234Q29.3Very low28.3Very low182 Ų182135.1 Ų135.185%0.8579%0.792SS**  169.5135.7112.3-87.6176.431.700108.7
3235S27.4Very low28.5Very low97 Ų97137 Ų13768%0.67879%0.793SS**  cis94.4132.136.183.80000113
3236V27Very low28.2Very low120 Ų120137.8 Ų137.873%0.72779%0.793SS**  cis-154.8143.511.9-178.30000111.9
3237Q28.3Very low28.1Very low187 Ų187140.2 Ų140.287%0.87480%0.796SS**  trans-153.4147.9152.1-90.5-177.129.400109.4
3238L25.9Very low28.5Very low148 Ų148142.7 Ų142.778%0.77580%0.799SS**  cis138.497.7-14.9-91.9174.8000110.8
3239K28.5Very low28.4Very low207 Ų207145.4 Ų145.490%0.980%0.803SS**  173.6163.5126.9-94.7-177.4178.5-177.30113.5
3240P33.4Very low28.3Very low130 Ų130151.5 Ų151.584%0.84481%0.812SS**  trans-131.8172.1-156.343.6-29.1000118
3241G26.2Very low28Very low78 Ų78154.2 Ų154.280%0.80482%0.816SS**  trans131.1145.8163.400000114.1
3242A30.3Very low27.9Very low96 Ų96156.4 Ų156.479%0.79382%0.82SS**  cis-162.5157.3-5.200000113.6
3243R28Very low27.8Very low228 Ų228159.9 Ų159.986%0.8682%0.824SS**  trans62.2117.6154.7-73.5-179.4175.3174.8-1.7122.5
3244N26.9Very low27.7Very low154 Ų154157.1 Ų157.182%0.82482%0.821SS**  trans69.1145.4135.6-58.717.7000118.6
3245S30.5Very low27.5Very low113 Ų113156.7 Ų156.779%0.7982%0.818SS**  cis-142.5150.516.949.90000114
3246D24.2Very low27.5Very low153 Ų153161.2 Ų161.282%0.81883%0.829SS**  trans-111.1160.7176.7-77.7-63.4000112.1
3247Y27.1Very low27.3Very low235 Ų235163.7 Ų163.792%0.92283%0.832SS**  trans-142.1122.2156.5-102.2-78000111.3
3248P33.8Very low27.3Very low121 Ų121162.5 Ų162.579%0.78683%0.827SS**  trans-112.3173.5-168.341.4-36.5000116
3249H25.7Very low27.5Very low190 Ų190163.5 Ų163.588%0.8883%0.827SS**  trans-87.3136165.8-78.3-63.5000112.9
3250R26Very low27.6Very low249 Ų249157.7 Ų157.794%0.9482%0.817SS**  -178.7169.5108.9-108.1-175.8173.9178.6-0.5113.9
3251Q24.9Very low27.4Very low183 Ų183157.2 Ų157.286%0.85581%0.812SS**  trans-91160.9177.3-57.5160.1-47.700111.6
3252V25.2Very low27.5Very low133 Ų133160.7 Ų160.781%0.80681%0.807SS**  -171.7140.5124.21420000112.7
3253Y27.4Very low27.3Very low215 Ų215162.2 Ų162.284%0.84380%0.802SS**  trans-12.4131.8171.7-71.9-88.3000125.2
3254A25.5Very low27.3Very low80 Ų80156.6 Ų156.666%0.66179%0.793SS**  100.5128.9112.900000124.5
3255H24.6Very low27.2Very low173 Ų173156.8 Ų156.880%0.80179%0.793SS**  trans69.3113.5140.5-81.558.5000121.9
3256Q27.5Very low27.1Very low193 Ų193163.1 Ų163.190%0.90280%0.8SS**  -161.2176.2103.2-104178.71100112
3257Q23.7Very low27.1Very low171 Ų171167.5 Ų167.580%0.79981%0.805SS**  trans-121.3-166.4-171-64.4-176.9-1400112.6
3258H28.5Very low27.7Very low163 Ų163161.3 Ų161.376%0.75579%0.794SS**  trans98.8126.6179.6-70-96.9000114.6
3259H30.3Very low27.5Very low169 Ų169161.3 Ų161.378%0.78279%0.791SS**  cis-130-172.1-11.3-82-91.2000108
3260A30.2Very low27.6Very low85 Ų85159 Ų15970%0.70279%0.785SS**  cis-150169.74.700000107.4
3261V29Very low27.8Very low119 Ų119157.2 Ų157.272%0.72178%0.784SS**  cis78.8116.924.4-177.30000113.8
3262Q27.4Very low27.8Very low152 Ų152153.2 Ų153.271%0.7178%0.777SS**  cis-168.5159.1-8.3-121.917916.100111.6
3263N26.7Very low27.9Very low127 Ų127153.2 Ų153.268%0.67977%0.772SS**  trans65.3154.8148.2-65-14000120
3264T28.2Very low27.9Very low110 Ų110149.5 Ų149.568%0.67577%0.767SS**  cis-161.2156.3-4.910.70000113.1
3265L25.3Very low27.9Very low158 Ų158152.4 Ų152.483%0.82777%0.771SS**  trans46.8122144.9-70.7159.8000122.4
3266R28.7Very low27.9Very low247 Ų247149.5 Ų149.593%0.93277%0.765SS**  -166.9167.4106.1-102.8174.9-171.9-147.21112.6
3267R24.2Very low27.9Very low244 Ų244146.2 Ų146.292%0.92176%0.763SS**  trans-143.8-179.3-176.4-118-157.1175.8-168.11.5110.1
3268P39Very low28Very low106 Ų106141.1 Ų141.169%0.68876%0.757SS**  trans-121.9174.4-132.245-32.8000116
3269T30Very low28Very low120 Ų120141.7 Ų141.774%0.73676%0.76SS**  trans-178.5154.5155.142.80000107
3270D27Very low27.9Very low141 Ų141140.2 Ų140.275%0.75475%0.754SS**  cis-168.8157-15.6-99.7-18.8000108.2
3271K30.6Very low27.7Very low212 Ų212142.6 Ų142.692%0.92276%0.755SS**  163.3152.3126.4-90.2173-177.5-178.40113.3
3272S25.3Very low27.7Very low99 Ų99141.5 Ų141.569%0.69275%0.752SS**  trans-140.4161.4-179.458.10000112.1
3273N27.4Very low27.8Very low133 Ų133143.8 Ų143.871%0.71176%0.763SS**  trans71.4111.1155.3-63.7-4.2000121
3274N26.2Very low27.7Very low137 Ų137141.1 Ų141.173%0.73377%0.765SS**  95.8144.5112.9-80.3-0.2000124.6
3275L26.3Very low27.8Very low142 Ų142144.6 Ų144.674%0.74377%0.773SS**  trans88.398.4143.1-74.9160.8000122.7
3276T24.8Very low27.9Very low111 Ų111145.8 Ų145.868%0.68177%0.772SS**  70.7110.4121.250.80000125.3
3277S26.1Very low28Very low124 Ų124141.7 Ų141.787%0.86776%0.764SS**  75.1135.3114.376.60000124.8
3278G27.5Very low28.1Very low65 Ų65137.7 Ų137.767%0.6776%0.755SS**  trans172.4107.8156.100000109.3
3279Q27.2Very low27.8Very low174 Ų174141.4 Ų141.481%0.81376%0.764SS**  71.4142.582.3-72.3-165.18.700114
3280Q28.1Very low27.6Very low138 Ų138142.6 Ų142.665%0.64577%0.766SS**  cis-161.8157.517.2-136.1178.172.700112.9
3281N26.5Very low27.8Very low136 Ų136142.8 Ų142.873%0.72777%0.766SS**  trans65158.1152.5-67.6-14.4000120.6
3282S29.9Very low27.7Very low96 Ų96140.1 Ų140.167%0.67176%0.761SS**  cis-162.3154.3-0.336.40000113
3283Q28.5Very low27.6Very low200 Ų200146.6 Ų146.694%0.93577%0.771SS**  trans47.3143.7150-60.8173.23.700120.8
3284G25.5Very low27.7Very low70 Ų70151.4 Ų151.472%0.72278%0.779SS**  cis172.4-176.8-2.100000113
3285H29.9Very low27.8Very low183 Ų183149.4 Ų149.485%0.84778%0.781SS**  trans84.5164.9170.9-73.9-48.1000122.7
3286F27Very low28Very low184 Ų184150.6 Ų150.681%0.80779%0.788SS**  trans-69.9172.8-159.3-65.2-88.9000116
3287Q31.2Very low28.1Very low161 Ų161150.1 Ų150.175%0.75279%0.79SS**  cis-152.4171.823.6-156.7164.6-11.100114.7
3288Q27.2Very low28.2Very low160 Ų160150.4 Ų150.475%0.74879%0.789SS**  trans-28.8148.9176.1-68.5155.7-35.800117.4
3289Q31.4Very low28.2Very low184 Ų184154.8 Ų154.886%0.8680%0.797SS**  -148.9143.257.5-66.8178.91.700116.5
3290N26.4Very low28.1Very low145 Ų145157.4 Ų157.478%0.77580%0.799SS**  trans13129140.5-73.9-8.9000119
3291L30.1Very low28Very low144 Ų144157.3 Ų157.375%0.75481%0.808SS**  cis-173.2134.448.3-116.7155.1000113.9
3292N29.5Very low28Very low156 Ų156155.9 Ų155.983%0.83480%0.795SS**  trans40.1137153.5-74.4-21.9000125.6
3293R23.7Very low28.1Very low236 Ų236156.2 Ų156.289%0.89179%0.793SS**  trans-93.8153175.2-54.5162.2171.2165.4-6.3113
3294R29.2Very low28Very low234 Ų234151.6 Ų151.688%0.88378%0.775SS**  175.5119.5124.4-94.3162.9-177.6-170.41.2108.6
3295A27Very low28.3Very low95 Ų95153.2 Ų153.279%0.78577%0.773SS**  72.77771.200000113.3
3296N30.6Very low28.3Very low166 Ų166150.8 Ų150.889%0.88877%0.766SS**PPolyproline II helixtrans-80.2129.8172.3-81.8-15.1000111.5
3297S26.5Very low28.6Very low102 Ų102149.4 Ų149.471%0.71376%0.762SS**PPolyproline II helixtrans-102.4150.5152.8-64.50000108.2N3299S3297-N3299 PolarHBondContact O-N 3.29Å
3298P29.4Very low28.6Very low130 Ų130145.1 Ų145.184%0.84475%0.748SS**PPolyproline II helixtrans-66.7128.8-175.526.1-33.9000111.8
3299N27.4Very low28.7Very low156 Ų156144 Ų14483%0.83475%0.747SS**PPolyproline II helixtrans-68130.5178.4-80.2-35.2000111.2S3297 V3301S3297-N3299 PolarHBondContact O-N 3.29Å; N3299-V3301 PolarHBondContact O-N 3.45Å
3300R25.2Very low28.6Very low229 Ų229138.1 Ų138.186%0.86473%0.727SS**  trans-77.2112.7168.9-68.4-177.6176.4-171.4-3.5109.1F3302R3300-F3302 PolarHBondContact O-N 2.92Å
3301V25.9Very low28.7Very low137 Ų137135.3 Ų135.383%0.8372%0.724SS**  trans-73.694-177.9-176.50000110.8N3299N3299-V3301 PolarHBondContact O-N 3.45Å
3302F27.1Very low28.7Very low106 Ų106131.4 Ų131.447%0.46571%0.708SS.*  trans-79.3162.9141.9-84.7-91.1000109.3R3300 N3304R3300-F3302 PolarHBondContact O-N 2.92Å; F3302-N3304 PolarHBondContact O-N 2.9Å
3303T30.7Very low28.8Very low103 Ų103128.5 Ų128.563%0.63269%0.692SS**  trans-44128.6-175.546.80000113.6P3305T3303-P3305 WeakPolarHBondContact O-CD 3.31Å
3304N27.9Very low29.4Very low103 Ų103125.7 Ų125.755%0.55168%0.681SS**  trans-50.8120.3176.9179.4-3.5000110.9F3302 N3306F3302-N3304 PolarHBondContact O-N 2.9Å; N3304-N3306 PolarHBondContact O-N 3.18Å; N3304-N3306 VanDerWaalsContact O-N 3.08Å; N3304-N3306 PolarHBondContact OD1-N 3.31Å
3305P30.6Very low29.8Very low104 Ų104116.5 Ų116.568%0.67565%0.65SS**THydrogen-bonded Turntrans-58.3-22.3-179.1-26.735.6000114.9T3303 H3307T3303-P3305 WeakPolarHBondContact O-CD 3.31Å; P3305-H3307 PolarHBondContact O-N 2.86Å
3306N31.3Very low30.4Very low132 Ų132115.6 Ų115.671%0.70664%0.636SS**THydrogen-bonded Turntrans-89.34.3-167.7-61-3.2000114.7N3304N3304-N3306 PolarHBondContact O-N 3.18Å; N3304-N3306 VanDerWaalsContact O-N 3.08Å; N3304-N3306 PolarHBondContact OD1-N 3.31Å
3307H32.2Very low30.6Very low154 Ų154112.8 Ų112.871%0.71362%0.618SS**  trans-143.682.3176-96.5-60.5000112.9P3305P3305-H3307 PolarHBondContact O-N 2.86Å
3308P31.2Very low31.3Very low72 Ų72115.2 Ų115.247%0.46862%0.615SS.*  trans-80-17.4176.730.5-32.2000114.4S3310P3308-S3310 PolarHBondContact O-N 3.3Å
3309D28.3Very low31.9Very low136 Ų136110.6 Ų110.673%0.72759%0.585SS**  trans-95.420.6-160.6-55.3-53.6000116A3311D3309-A3311 PolarHBondContact O-N 3.1Å
3310S30.4Very low32.8Very low61 Ų61104.3 Ų104.343%0.42755%0.551SS.*  trans-69.7101.7173.7-171.90000111P3308 S3312 L3313P3308-S3310 PolarHBondContact O-N 3.3Å; S3310-S3312 PolarHBondContact O-N 3.4Å; S3310-S3312 PolarHBondContact OG-OG 3.17Å; S3310-L3313 WeakPolarHBondContact O-CB 3.48Å; S3310-L3313 PolarHBondContact O-N 3Å
3311A28Very low34Very low86 Ų8696.9 Ų96.971%0.71153%0.526SS*.G310 helixtrans-55.2-20.1178.100000114D3309 L3313D3309-A3311 PolarHBondContact O-N 3.1Å; A3311-L3313 PolarHBondContact O-N 2.86Å
3312S31.3Very low35.1Very low61 Ų6190.9 Ų90.943%0.42749%0.488SS..G310 helixtrans-63.7-18.3173.872.80000114.5S3310S3310-S3312 PolarHBondContact O-N 3.4Å; S3310-S3312 PolarHBondContact OG-OG 3.17Å
3313L30.4Very low36.2Very low95 Ų9589.9 Ų89.950%0.49748%0.482SS..G310 helixtrans-84.7-22.3-170.3-67.2176.8000114.7S3310 A3311 R3323S3310-L3313 WeakPolarHBondContact O-CB 3.48Å; S3310-L3313 PolarHBondContact O-N 3Å; A3311-L3313 PolarHBondContact O-N 2.86Å; L3313-R3323 PolarHBondContact O-NH2 3.42Å
3314R35.9Very low37.1Very low177 Ų17785.7 Ų85.767%0.66846%0.455SS*.THydrogen-bonded Turntrans-100-15.7-170.7-60.6-174.7-176-131.4-3114.7Q3358R3314-Q3358 PolarHBondContact NH2-O 3.06Å
3315D38.2Very low38.1Very low41 Ų4181.2 Ų81.222%0.21943%0.431CS..  trans-102.2109.2-176.3-179.42.1000111.5Q3317 K3318D3315-Q3317 PolarHBondContact O-N 3.42Å; D3315-Q3317 VanDerWaalsContact O-N 3.16Å; D3315-Q3317 VanDerWaalsContact OD1-CB 3.22Å; D3315-Q3317 WeakPolarHBondContact OD1-CB 3.4Å; D3315-Q3317 VanDerWaalsContact OD1-CG 3.3Å; D3315-Q3317 WeakPolarHBondContact OD1-CG 3.16Å; D3315-Q3317 PolarHBondContact OD1-N 2.88Å; D3315-K3318 HydrophobicContact CB-CB 4.42Å; D3315-K3318 HydrophobicContact CB-CD 4.4Å; D3315-K3318 PolarHBondContact O-N 3.28Å; D3315-K3318 WeakPolarHBondContact OD2-CD 3.47Å; D3315-K3318 WeakPolarHBondContact OD2-CE 3.28Å; D3315-K3318 WeakPolarHBondContact OD2-CG 3.46Å; D3315-K3318 IonicContact OD2-NZ 2.75Å; D3315-K3318 PolarHBondContact OD2-NZ 3.43Å
3316P39.6Very low38.8Very low77 Ų7776.9 Ų76.950%0.540%0.402SS..THydrogen-bonded Turntrans-64.8-15.7178.628.3-34.8000113.5K3318P3316-K3318 VanDerWaalsContact C-N 3.26Å; P3316-K3318 PolarHBondContact O-N 3.45Å
3317Q35.9Very low39.7Very low107 Ų10772.9 Ų72.950%0.538%0.383SS..THydrogen-bonded Turntrans-74.6-16.3174.4-49.2-167.76.400112.9L3184 N3187 D3315L3184-Q3317 HydrophobicContact CD2-CG 3.82Å; N3187-Q3317 PolarHBondContact ND2-OE1 3.43Å; D3315-Q3317 PolarHBondContact O-N 3.42Å; D3315-Q3317 VanDerWaalsContact O-N 3.16Å; D3315-Q3317 VanDerWaalsContact OD1-CB 3.22Å; D3315-Q3317 WeakPolarHBondContact OD1-CB 3.4Å; D3315-Q3317 VanDerWaalsContact OD1-CG 3.3Å; D3315-Q3317 WeakPolarHBondContact OD1-CG 3.16Å; D3315-Q3317 PolarHBondContact OD1-N 2.88Å
3318K39.6Very low40.3Very low153 Ų15366.9 Ų66.967%0.66536%0.357SS*.SBendtrans-115.16.8-176.7-64.4174.1-169.7164.40113.3D3315 P3316 N3320D3315-K3318 HydrophobicContact CB-CB 4.42Å; D3315-K3318 HydrophobicContact CB-CD 4.4Å; D3315-K3318 PolarHBondContact O-N 3.28Å; D3315-K3318 WeakPolarHBondContact OD2-CD 3.47Å; D3315-K3318 WeakPolarHBondContact OD2-CE 3.28Å; D3315-K3318 WeakPolarHBondContact OD2-CG 3.46Å; D3315-K3318 IonicContact OD2-NZ 2.75Å; D3315-K3318 PolarHBondContact OD2-NZ 3.43Å; P3316-K3318 VanDerWaalsContact C-N 3.26Å; P3316-K3318 PolarHBondContact O-N 3.45Å; K3318-N3320 PolarHBondContact O-N 3.46Å
3319V43.9Very low41.2Very low33 Ų3364.9 Ų64.920%0.235%0.35CS..  trans-74.2122176.61660000110.4Q3321 R3323V3319-Q3321 PolarHBondContact O-N 2.84Å; V3319-R3323 HydrophobicContact CG1-CB 3.73Å; V3319-R3323 HydrophobicContact CG1-CG 3.84Å
3320N44.7Very low42.5Very low23 Ų2361 Ų6112%0.12333%0.332CS..  trans-56.3130.4169.1-179.5-48.4000109.9R2801 L2802 P2805 K3318 W3322 R3323R2801-N3320 PolarHBondContact O-ND2 3.35Å; L2802-N3320 PolarHBondContact O-ND2 3.12Å; P2805-N3320 HydrophobicContact CB-CB 4.42Å; P2805-N3320 HydrophobicContact CG-CB 4.22Å; P2805-N3320 WeakPolarHBondContact CG-ND2 3.35Å; K3318-N3320 PolarHBondContact O-N 3.46Å; N3320-W3322 PolarHBondContact O-N 3.17Å; N3320-W3322 VanDerWaalsContact O-N 3.1Å; N3320-W3322 VanDerWaalsContact OD1-CB 3.3Å; N3320-W3322 WeakPolarHBondContact OD1-CB 3.27Å; N3320-W3322 PolarHBondContact OD1-N 3.13Å; N3320-R3323 WeakPolarHBondContact O-CB 3.32Å; N3320-R3323 PolarHBondContact O-N 3.48Å
3321Q50.2Low43.9Very low74 Ų7459.8 Ų59.835%0.34632%0.318SS..G310 helixtrans-54.6-33.2-174.1-59.9-178.143.300112.8Y2986 V3319 R3323Y2986-Q3321 WeakPolarHBondContact CD2-O 3.24Å; Y2986-Q3321 WeakPolarHBondContact CE2-O 3.33Å; V3319-Q3321 PolarHBondContact O-N 2.84Å; Q3321-R3323 PolarHBondContact O-N 3.4Å
3322W50.8Low45.4Very low10 Ų1058.4 Ų58.44%0.03830%0.296CS..G310 helixtrans-65.5-7.3179.1-55.9124.2000114.7I2773 M2778 E2781 A2782 L2806 H2942 N3320 H3324 H3325 L3326I2773-W3322 HydrophobicContact CD1-CH2 3.83Å; I2773-W3322 HydrophobicContact CD1-CZ3 3.81Å; I2773-W3322 HydrophobicContact CG2-CZ3 4.24Å; M2778-W3322 VanDerWaalsContact CA-CH2 3.5Å; M2778-W3322 HydrophobicContact CB-CD2 4.46Å; M2778-W3322 HydrophobicContact CB-CE3 4.23Å; M2778-W3322 HydrophobicContact CB-CH2 3.97Å; M2778-W3322 HydrophobicContact CB-CZ2 4.21Å; M2778-W3322 HydrophobicContact CB-CZ3 3.97Å; M2778-W3322 HydrophobicContact CE-CB 4.1Å; M2778-W3322 HydrophobicContact CE-CD2 3.89Å; M2778-W3322 HydrophobicContact CE-CE3 3.58Å; M2778-W3322 HydrophobicContact CE-CG 4.12Å; M2778-W3322 HydrophobicContact CE-CZ3 4.3Å; M2778-W3322 HydrophobicContact CG-CE3 3.86Å; M2778-W3322 HydrophobicContact CG-CH2 4.05Å; M2778-W3322 HydrophobicContact CG-CZ3 3.58Å; M2778-W3322 VanDerWaalsContact O-CZ2 3.23Å; M2778-W3322 WeakPolarHBondContact O-CZ2 3.41Å; M2778-W3322 HydrophobicContact SD-CE3 4.48Å; E2781-W3322 HydrophobicContact CB-CH2 4.17Å; E2781-W3322 HydrophobicContact CB-CZ2 4.06Å; E2781-W3322 HydrophobicContact CG-CH2 4.35Å; E2781-W3322 HydrophobicContact CG-CZ2 4.21Å; A2782-W3322 HydrophobicContact CB-CZ2 4.21Å; L2806-W3322 HydrophobicContact CD2-CB 4.17Å; L2806-W3322 HydrophobicContact CD2-CD2 4.2Å; L2806-W3322 HydrophobicContact CD2-CG 3.71Å; L2806-W3322 HydrophobicContact CG-CG 4.37Å; H2942-W3322 AromaticContact CE1-CH2 3.24Å; H2942-W3322 WeakPolarHBondContact CE1-CH2 3.25Å; H2942-W3322 AromaticContact CE1-CZ3 3.2Å; H2942-W3322 WeakPolarHBondContact CE1-CZ3 3.49Å; H2942-W3322 AromaticContact NE2-CH2 3.66Å; H2942-W3322 AromaticContact NE2-CZ3 3.28Å; H2942-W3322 VanDerWaalsContact NE2-CZ3 3.28Å; H2942-W3322 WeakPolarHBondContact NE2-CZ3 3.4Å; N3320-W3322 PolarHBondContact O-N 3.17Å; N3320-W3322 VanDerWaalsContact O-N 3.1Å; N3320-W3322 VanDerWaalsContact OD1-CB 3.3Å; N3320-W3322 WeakPolarHBondContact OD1-CB 3.27Å; N3320-W3322 PolarHBondContact OD1-N 3.13Å; W3322-H3324 PolarHBondContact O-N 3.32Å; W3322-H3325 PolarHBondContact O-N 3.48Å; W3322-L3326 HydrophobicContact CB-CD1 3.69Å; W3322-L3326 HydrophobicContact CB-CD2 4.37Å; W3322-L3326 HydrophobicContact CB-CG 3.7Å; W3322-L3326 WeakPolarHBondContact O-CG 3.2Å; W3322-L3326 PolarHBondContact O-N 3.17Å
3323R48.4Very low46.9Very low85 Ų8556.6 Ų56.632%0.32129%0.287SS..G310 helixtrans-45.4-35.3-166.1-134.2-154.6-151.4-170.713115.5L3313 V3319 N3320 Q3321 L3326 C3327L3313-R3323 PolarHBondContact O-NH2 3.42Å; V3319-R3323 HydrophobicContact CG1-CB 3.73Å; V3319-R3323 HydrophobicContact CG1-CG 3.84Å; N3320-R3323 WeakPolarHBondContact O-CB 3.32Å; N3320-R3323 PolarHBondContact O-N 3.48Å; Q3321-R3323 PolarHBondContact O-N 3.4Å; R3323-L3326 CarbonylContact O-C 3.58Å; R3323-L3326 VanDerWaalsContact O-C 3.28Å; R3323-L3326 PolarHBondContact O-N 3.13Å; R3323-C3327 WeakPolarHBondContact O-CB 3.49Å; R3323-C3327 PolarHBondContact O-N 2.82Å; R3323-C3327 PolarHBondContact O-SG 3.08Å
3324H50.3Low48.6Very low16 Ų1653 Ų537%0.07427%0.269CS..G310 helixtrans-69.7-43-180-64.6-86.5000112.7T2985 Y2986 W3322 L3326 C3327T2985-H3324 PolarHBondContact OG1-NE2 2.89Å; Y2986-H3324 AromaticContact CD2-CD2 3.66Å; Y2986-H3324 AromaticContact CE2-CD2 3.93Å; W3322-H3324 PolarHBondContact O-N 3.32Å; H3324-L3326 VanDerWaalsContact C-N 3.33Å; H3324-C3327 CarbonylContact O-C 3.5Å; H3324-C3327 WeakPolarHBondContact O-CA 3.5Å; H3324-C3327 WeakPolarHBondContact O-CB 3.36Å; H3324-C3327 PolarHBondContact O-N 3.01Å
3325H48.2Very low50.3Low8 Ų844.6 Ų44.64%0.03724%0.237CC..G310 helixtrans-70.4-33.9172.4-50.4-80.7000110.6I2769 M2778 W3322 C3327 N3328I2769-H3325 PolarHBondContact O-CE1 3.26Å; I2769-H3325 VanDerWaalsContact O-CE1 3.23Å; M2778-H3325 HydrophobicContact CE-CB 3.48Å; M2778-H3325 VanDerWaalsContact CE-CB 3.48Å; M2778-H3325 HydrophobicContact SD-CB 4.11Å; W3322-H3325 PolarHBondContact O-N 3.48Å; H3325-C3327 PolarHBondContact O-N 3.43Å; H3325-N3328 WeakPolarHBondContact CA-OD1 3.27Å; H3325-N3328 WeakPolarHBondContact O-CB 3.49Å; H3325-N3328 PolarHBondContact O-N 3.34Å; H3325-N3328 VanDerWaalsContact O-N 3.09Å; H3325-N3328 PolarHBondContact O-OD1 3.16Å
3326L46.3Very low52Low14 Ų1444.3 Ų44.37%0.07324%0.235CC..G310 helixtrans-743168.8-52.7-177000113.7P2805 L2806 M2809 R2812 W3322 R3323 H3324P2805-L3326 HydrophobicContact CB-CD1 3.27Å; P2805-L3326 WeakPolarHBondContact O-CD1 3.16Å; P2805-L3326 WeakPolarHBondContact O-CD2 3.47Å; L2806-L3326 HydrophobicContact CD2-CD2 4.31Å; M2809-L3326 HydrophobicContact CB-CD2 3.57Å; M2809-L3326 HydrophobicContact CG-CD2 3.89Å; M2809-L3326 HydrophobicContact SD-CD2 3.86Å; R2812-L3326 PolarHBondContact NH1-O 3.38Å; R2812-L3326 PolarHBondContact NH2-O 3.45Å; W3322-L3326 HydrophobicContact CB-CD1 3.69Å; W3322-L3326 HydrophobicContact CB-CD2 4.37Å; W3322-L3326 HydrophobicContact CB-CG 3.7Å; W3322-L3326 WeakPolarHBondContact O-CG 3.2Å; W3322-L3326 PolarHBondContact O-N 3.17Å; R3323-L3326 CarbonylContact O-C 3.58Å; R3323-L3326 VanDerWaalsContact O-C 3.28Å; R3323-L3326 PolarHBondContact O-N 3.13Å; H3324-L3326 VanDerWaalsContact C-N 3.33Å
3327C49.2Very low53.6Low47 Ų4743.1 Ų43.132%0.31823%0.226SC..G310 helixtrans-114.923.8168.3-75.10000111.2R3323 H3324 H3325 G3329 W3331R3323-C3327 WeakPolarHBondContact O-CB 3.49Å; R3323-C3327 PolarHBondContact O-N 2.82Å; R3323-C3327 PolarHBondContact O-SG 3.08Å; H3324-C3327 CarbonylContact O-C 3.5Å; H3324-C3327 WeakPolarHBondContact O-CA 3.5Å; H3324-C3327 WeakPolarHBondContact O-CB 3.36Å; H3324-C3327 PolarHBondContact O-N 3.01Å; H3325-C3327 PolarHBondContact O-N 3.43Å; C3327-G3329 PolarHBondContact O-N 3.33Å; C3327-W3331 HydrophobicContact CB-CH2 4.15Å; C3327-W3331 HydrophobicContact CB-CZ2 3.38Å; C3327-W3331 PolarHBondContact O-NE1 3.09Å
3328N45.8Very low55.2Low28 Ų2838.2 Ų38.215%0.1520%0.204CC..  trans-601.8179.1-87.67.8000116.6H3325H3325-N3328 WeakPolarHBondContact CA-OD1 3.27Å; H3325-N3328 WeakPolarHBondContact O-CB 3.49Å; H3325-N3328 PolarHBondContact O-N 3.34Å; H3325-N3328 VanDerWaalsContact O-N 3.09Å; H3325-N3328 PolarHBondContact O-OD1 3.16Å
3329G50Low56.8Low31 Ų3132.1 Ų32.132%0.3218%0.178SC..SBendtrans-59.9137159.600000108.6C3327 W3331C3327-G3329 PolarHBondContact O-N 3.33Å; G3329-W3331 PolarHBondContact O-N 2.91Å
3330P55.2Low58.3Low54 Ų5437.8 Ų37.835%0.35120%0.195SC..  trans-55.6119.9-171.819.6-32.3000110.5F3332 G3333 C3334P3330-F3332 PolarHBondContact O-N 3.02Å; P3330-G3333 CarbonylContact O-C 3.26Å; P3330-G3333 WeakPolarHBondContact O-CA 3.48Å; P3330-G3333 PolarHBondContact O-N 3.32Å; P3330-C3334 PolarHBondContact O-N 3.26Å
3331W60.6Low59.5Low35 Ų3539.7 Ų39.713%0.13321%0.205CC..Hα-helixtrans-65.7-28.7178.3-73.288.5000111.4F2731 K2732 F2762 E2766 C3327 G3329 G3333 C3334 Y3335F2731-W3331 HydrophobicContact CE1-CE3 4.22Å; K2732-W3331 HydrophobicContact CB-CD2 4.47Å; K2732-W3331 HydrophobicContact CB-CE3 4.33Å; K2732-W3331 HydrophobicContact CB-CH2 4.48Å; K2732-W3331 HydrophobicContact CB-CZ3 4.35Å; K2732-W3331 HydrophobicContact CD-CB 4.21Å; K2732-W3331 HydrophobicContact CD-CD2 3.88Å; K2732-W3331 HydrophobicContact CD-CE3 4.42Å; K2732-W3331 HydrophobicContact CD-CG 3.79Å; K2732-W3331 VanDerWaalsContact CE-CB 3.41Å; K2732-W3331 VanDerWaalsContact CE-CG 3.47Å; K2732-W3331 HydrophobicContact CG-CB 4.45Å; K2732-W3331 HydrophobicContact CG-CD2 3.8Å; K2732-W3331 HydrophobicContact CG-CE3 3.82Å; K2732-W3331 HydrophobicContact CG-CG 4.11Å; K2732-W3331 HydrophobicContact CG-CZ3 4.33Å; F2762-W3331 HydrophobicContact CD1-CB 4.15Å; F2762-W3331 HydrophobicContact CE1-CB 4.25Å; E2766-W3331 HydrophobicContact CG-CB 4.38Å; E2766-W3331 WeakPolarHBondContact OE1-CA 3.36Å; E2766-W3331 PolarHBondContact OE1-N 3.25Å; C3327-W3331 HydrophobicContact CB-CH2 4.15Å; C3327-W3331 HydrophobicContact CB-CZ2 3.38Å; C3327-W3331 PolarHBondContact O-NE1 3.09Å; G3329-W3331 PolarHBondContact O-N 2.91Å; W3331-G3333 PolarHBondContact O-N 2.87Å; W3331-C3334 WeakPolarHBondContact O-CB 3.43Å; W3331-C3334 PolarHBondContact O-N 3.34Å; W3331-Y3335 WeakPolarHBondContact O-CB 3.38Å; W3331-Y3335 PolarHBondContact O-N 3.38Å
3332F58.1Low60.3Low58 Ų5838.6 Ų38.625%0.25420%0.198SC..Hα-helixtrans-59.4-34.9165.2-171.2-107.3000112F2762 E2766 P3330 Y3335 E3336F2762-F3332 HydrophobicContact CB-CB 4.05Å; F2762-F3332 HydrophobicContact CB-CD2 4Å; F2762-F3332 HydrophobicContact CB-CG 4.45Å; F2762-F3332 HydrophobicContact CD2-CD2 4.06Å; F2762-F3332 HydrophobicContact CG-CB 4.37Å; F2762-F3332 HydrophobicContact CG-CD2 4.14Å; E2766-F3332 PolarHBondContact OE1-N 3.36Å; P3330-F3332 PolarHBondContact O-N 3.02Å; F3332-Y3335 HydrophobicContact CD2-CD1 4.24Å; F3332-Y3335 HydrophobicContact CE2-CD1 4.16Å; F3332-Y3335 HydrophobicContact CE2-CE1 4.47Å; F3332-Y3335 PolarHBondContact O-N 3.23Å; F3332-E3336 HydrophobicContact CD1-CG 4.39Å; F3332-E3336 HydrophobicContact CE1-CG 3.98Å; F3332-E3336 HydrophobicContact CZ-CG 4.21Å; F3332-E3336 WeakPolarHBondContact O-CB 3.3Å; F3332-E3336 PolarHBondContact O-N 3.35Å
3333G64.2Low61.5Low23 Ų2343.4 Ų43.424%0.23722%0.219CC..Hα-helixtrans-69.4-38.6170.600000113.3P3330 W3331 Y3335 E3336 T3337P3330-G3333 CarbonylContact O-C 3.26Å; P3330-G3333 WeakPolarHBondContact O-CA 3.48Å; P3330-G3333 PolarHBondContact O-N 3.32Å; W3331-G3333 PolarHBondContact O-N 2.87Å; G3333-Y3335 VanDerWaalsContact C-N 3.35Å; G3333-E3336 PolarHBondContact O-N 2.88Å; G3333-T3337 WeakPolarHBondContact O-CB 3.38Å; G3333-T3337 PolarHBondContact O-N 3.43Å; G3333-T3337 PolarHBondContact O-OG1 3.49Å
3334C66.2Low62.8Low19 Ų1943.2 Ų43.213%0.12822%0.222CC..Hα-helixtrans-61.3-43.7170.6-58.90000111.6P3330 W3331 T3337 A3338 F3362P3330-C3334 PolarHBondContact O-N 3.26Å; W3331-C3334 WeakPolarHBondContact O-CB 3.43Å; W3331-C3334 PolarHBondContact O-N 3.34Å; C3334-T3337 PolarHBondContact O-N 3.19Å; C3334-A3338 PolarHBondContact O-N 3Å; C3334-F3362 HydrophobicContact CB-CZ 4.3Å
3335Y70.5Confident63.8Low0 Ų045.7 Ų45.70%023%0.234CC..Hα-helixtrans-64.3-47.6176171.3-99.4000111.7F2731 N2744 L2747 Y2748 E2751 F2762 W3331 F3332 G3333 T3337 A3338 K3339F2731-Y3335 HydrophobicContact CE2-CD2 4.34Å; F2731-Y3335 HydrophobicContact CZ-CD2 4.38Å; N2744-Y3335 VanDerWaalsContact OD1-CD2 3.24Å; N2744-Y3335 WeakPolarHBondContact OD1-CD2 3.37Å; N2744-Y3335 VanDerWaalsContact OD1-CE2 3.24Å; N2744-Y3335 WeakPolarHBondContact OD1-CE2 3.36Å; L2747-Y3335 HydrophobicContact CB-CE2 3.85Å; L2747-Y3335 HydrophobicContact CD1-CE2 4.44Å; Y2748-Y3335 WeakPolarHBondContact CA-OH 3.48Å; E2751-Y3335 WeakPolarHBondContact OE2-CE1 3.34Å; E2751-Y3335 PolarHBondContact OE2-OH 3.08Å; F2762-Y3335 HydrophobicContact CE2-CD1 4.34Å; F2762-Y3335 HydrophobicContact CE2-CD2 4.24Å; F2762-Y3335 HydrophobicContact CE2-CG 4.05Å; F2762-Y3335 HydrophobicContact CZ-CD2 4.23Å; F2762-Y3335 HydrophobicContact CZ-CG 4.12Å; W3331-Y3335 WeakPolarHBondContact O-CB 3.38Å; W3331-Y3335 PolarHBondContact O-N 3.38Å; F3332-Y3335 HydrophobicContact CD2-CD1 4.24Å; F3332-Y3335 HydrophobicContact CE2-CD1 4.16Å; F3332-Y3335 HydrophobicContact CE2-CE1 4.47Å; F3332-Y3335 PolarHBondContact O-N 3.23Å; G3333-Y3335 VanDerWaalsContact C-N 3.35Å; Y3335-T3337 VanDerWaalsContact C-N 3.33Å; Y3335-T3337 PolarHBondContact O-N 2.98Å; Y3335-A3338 WeakPolarHBondContact O-CB 3.34Å; Y3335-A3338 PolarHBondContact O-N 3.5Å; Y3335-K3339 HydrophobicContact CE1-CD 3.99Å; Y3335-K3339 WeakPolarHBondContact O-CB 3.46Å; Y3335-K3339 PolarHBondContact O-N 3.4Å
3336E74.4Confident64.8Low36 Ų3650.3 Ų50.317%0.16826%0.256CS..Hα-helixtrans-58.2-40.8173.1-91.2-70.8132.400112.6F3332 G3333 K3339 R3340F3332-E3336 HydrophobicContact CD1-CG 4.39Å; F3332-E3336 HydrophobicContact CE1-CG 3.98Å; F3332-E3336 HydrophobicContact CZ-CG 4.21Å; F3332-E3336 WeakPolarHBondContact O-CB 3.3Å; F3332-E3336 PolarHBondContact O-N 3.35Å; G3333-E3336 PolarHBondContact O-N 2.88Å; E3336-K3339 PolarHBondContact O-N 2.83Å; E3336-K3339 WeakPolarHBondContact OE1-CD 3.33Å; E3336-K3339 WeakPolarHBondContact OE1-CE 3.47Å; E3336-K3339 IonicContact OE1-NZ 2.92Å; E3336-K3339 PolarHBondContact OE1-NZ 3.36Å; E3336-R3340 WeakPolarHBondContact O-CB 3.47Å; E3336-R3340 WeakPolarHBondContact O-CD 3.45Å; E3336-R3340 WeakPolarHBondContact O-CG 3.49Å; E3336-R3340 PolarHBondContact O-N 3.24Å; E3336-R3340 IonicContact OE2-CZ 2.72Å; E3336-R3340 IonicContact OE2-NE 3.59Å; E3336-R3340 PolarHBondContact OE2-NE 2.88Å; E3336-R3340 IonicContact OE2-NH2 3.88Å; E3336-R3340 PolarHBondContact OE2-NH2 3.11Å
3337T73.3Confident66.3Low51 Ų5152.9 Ų52.931%0.31328%0.275SS..Hα-helixtrans-63.2-47.4173.9-65.20000111.3G3333 C3334 Y3335 K3339 R3340 L3341 F3362G3333-T3337 WeakPolarHBondContact O-CB 3.38Å; G3333-T3337 PolarHBondContact O-N 3.43Å; G3333-T3337 PolarHBondContact O-OG1 3.49Å; C3334-T3337 PolarHBondContact O-N 3.19Å; Y3335-T3337 VanDerWaalsContact C-N 3.33Å; Y3335-T3337 PolarHBondContact O-N 2.98Å; T3337-K3339 VanDerWaalsContact C-N 3.32Å; T3337-K3339 PolarHBondContact O-N 2.85Å; T3337-R3340 PolarHBondContact O-N 2.97Å; T3337-L3341 HydrophobicContact CG2-CD1 4.05Å; T3337-L3341 WeakPolarHBondContact O-CB 3.24Å; T3337-L3341 WeakPolarHBondContact O-CG 3.43Å; T3337-L3341 PolarHBondContact O-N 2.94Å; T3337-F3362 HydrophobicContact CG2-CD2 4.46Å; T3337-F3362 HydrophobicContact CG2-CE2 4.18Å
3338A68.9Low67.3Low4 Ų453.2 Ų53.23%0.03329%0.286CS..Hα-helixtrans-59.8-41.7176.300000112.4C3334 Y3335 R3342 F3362C3334-A3338 PolarHBondContact O-N 3Å; Y3335-A3338 WeakPolarHBondContact O-CB 3.34Å; Y3335-A3338 PolarHBondContact O-N 3.5Å; A3338-R3342 VanDerWaalsContact O-CB 3.29Å; A3338-R3342 WeakPolarHBondContact O-CB 3.44Å; A3338-R3342 PolarHBondContact O-N 3.41Å; A3338-F3362 HydrophobicContact CB-CB 4.48Å; A3338-F3362 HydrophobicContact CB-CD1 3.42Å; A3338-F3362 VanDerWaalsContact CB-CD1 3.42Å; A3338-F3362 HydrophobicContact CB-CE1 3.78Å; A3338-F3362 HydrophobicContact CB-CG 4.01Å
3339K72.5Confident68.5Low26 Ų2659.3 Ų59.311%0.11331%0.313CS..Hα-helixtrans-64.9-41.5177.1171.2177.6170.2-168.70112.5Y2748 E2751 Y3335 E3336 T3337 K3343Y2748-K3339 HydrophobicContact CD2-CG 3.98Å; Y2748-K3339 HydrophobicContact CE2-CG 3.95Å; E2751-K3339 IonicContact OE1-NZ 3.46Å; E2751-K3339 PolarHBondContact OE1-NZ 2.9Å; E2751-K3339 WeakPolarHBondContact OE2-CD 3.38Å; E2751-K3339 WeakPolarHBondContact OE2-CE 3.32Å; E2751-K3339 IonicContact OE2-NZ 3.62Å; E2751-K3339 PolarHBondContact OE2-NZ 2.89Å; Y3335-K3339 HydrophobicContact CE1-CD 3.99Å; Y3335-K3339 WeakPolarHBondContact O-CB 3.46Å; Y3335-K3339 PolarHBondContact O-N 3.4Å; E3336-K3339 PolarHBondContact O-N 2.83Å; E3336-K3339 WeakPolarHBondContact OE1-CD 3.33Å; E3336-K3339 WeakPolarHBondContact OE1-CE 3.47Å; E3336-K3339 IonicContact OE1-NZ 2.92Å; E3336-K3339 PolarHBondContact OE1-NZ 3.36Å; T3337-K3339 VanDerWaalsContact C-N 3.32Å; T3337-K3339 PolarHBondContact O-N 2.85Å; K3339-K3343 PolarHBondContact O-N 3.38Å
3340R75.7Confident68.8Low152 Ų15260.8 Ų60.857%0.57431%0.313SS*.Hα-helixtrans-66.2-50174.6-72.3164.5-165.6-148.30.5111.7E3336 T3337 R3342 K3343 Q3344E3336-R3340 WeakPolarHBondContact O-CB 3.47Å; E3336-R3340 WeakPolarHBondContact O-CD 3.45Å; E3336-R3340 WeakPolarHBondContact O-CG 3.49Å; E3336-R3340 PolarHBondContact O-N 3.24Å; E3336-R3340 IonicContact OE2-CZ 2.72Å; E3336-R3340 IonicContact OE2-NE 3.59Å; E3336-R3340 PolarHBondContact OE2-NE 2.88Å; E3336-R3340 IonicContact OE2-NH2 3.88Å; E3336-R3340 PolarHBondContact OE2-NH2 3.11Å; T3337-R3340 PolarHBondContact O-N 2.97Å; R3340-R3342 VanDerWaalsContact C-N 3.28Å; R3340-R3342 PolarHBondContact O-N 3.47Å; R3340-K3343 PolarHBondContact O-N 3.43Å; R3340-Q3344 WeakPolarHBondContact O-CG 3.06Å; R3340-Q3344 PolarHBondContact O-N 3.36Å; R3340-Q3344 PolarHBondContact O-OE1 3.42Å
3341L70.2Confident68.6Low63 Ų6364.3 Ų64.333%0.3333%0.333SS..Hα-helixtrans-56.4-43.6175.5-72.2169.7000111.3T3337 Q3344 M3345 I3350 F3362T3337-L3341 HydrophobicContact CG2-CD1 4.05Å; T3337-L3341 WeakPolarHBondContact O-CB 3.24Å; T3337-L3341 WeakPolarHBondContact O-CG 3.43Å; T3337-L3341 PolarHBondContact O-N 2.94Å; L3341-Q3344 PolarHBondContact O-N 2.86Å; L3341-M3345 PolarHBondContact O-N 3.05Å; L3341-I3350 HydrophobicContact CD2-CD1 4.35Å; L3341-F3362 HydrophobicContact CD1-CB 4.1Å; L3341-F3362 HydrophobicContact CD1-CD2 4.02Å; L3341-F3362 HydrophobicContact CD1-CG 4.38Å
3342R68Low68.1Low51 Ų5165.6 Ų65.619%0.19235%0.345CS..Hα-helixtrans-62.1-47.9175.9-176.1174.9175.3-152.1-13.3112.1A3338 R3340 Q3344 M3345 E3346A3338-R3342 VanDerWaalsContact O-CB 3.29Å; A3338-R3342 WeakPolarHBondContact O-CB 3.44Å; A3338-R3342 PolarHBondContact O-N 3.41Å; R3340-R3342 VanDerWaalsContact C-N 3.28Å; R3340-R3342 PolarHBondContact O-N 3.47Å; R3342-Q3344 VanDerWaalsContact C-N 3.31Å; R3342-Q3344 PolarHBondContact O-N 3.32Å; R3342-M3345 PolarHBondContact O-N 2.92Å; R3342-E3346 HydrophobicContact CG-CG 4.32Å; R3342-E3346 IonicContact CZ-OE1 2.74Å; R3342-E3346 IonicContact NE-OE1 2.72Å; R3342-E3346 PolarHBondContact NE-OE1 3.22Å; R3342-E3346 IonicContact NE-OE2 3.47Å; R3342-E3346 IonicContact NH2-OE1 3.8Å; R3342-E3346 PolarHBondContact NH2-OE1 3.39Å; R3342-E3346 IonicContact NH2-OE2 3.56Å; R3342-E3346 WeakPolarHBondContact O-CB 3.44Å; R3342-E3346 WeakPolarHBondContact O-CG 3.42Å; R3342-E3346 PolarHBondContact O-N 2.98Å
3343K75.3Confident67.3Low110 Ų11070.7 Ų70.748%0.47837%0.37SS..Hα-helixtrans-58.7-41.1175.6-79.3-169.7171.5-168.60112.4Y2748 K3339 R3340 E3346 S3347Y2748-K3343 HydrophobicContact CE2-CG 4.44Å; Y2748-K3343 WeakPolarHBondContact OH-CE 3.4Å; K3339-K3343 PolarHBondContact O-N 3.38Å; R3340-K3343 PolarHBondContact O-N 3.43Å; K3343-E3346 PolarHBondContact O-N 3.25Å; K3343-S3347 WeakPolarHBondContact O-CB 3.25Å; K3343-S3347 PolarHBondContact O-N 2.88Å; K3343-S3347 PolarHBondContact O-OG 3.08Å
3344Q76.3Confident66Low81 Ų8178.5 Ų78.538%0.37939%0.392SS..Hα-helixtrans-67.3-33.9177.4-69.7172.2-61.200112.9R3340 L3341 R3342 S3347 G3348 H3349 I3350R3340-Q3344 WeakPolarHBondContact O-CG 3.06Å; R3340-Q3344 PolarHBondContact O-N 3.36Å; R3340-Q3344 PolarHBondContact O-OE1 3.42Å; L3341-Q3344 PolarHBondContact O-N 2.86Å; R3342-Q3344 VanDerWaalsContact C-N 3.31Å; R3342-Q3344 PolarHBondContact O-N 3.32Å; Q3344-S3347 PolarHBondContact O-OG 3.09Å; Q3344-G3348 PolarHBondContact O-N 2.96Å; Q3344-H3349 HydrophobicContact CB-CB 4.4Å; Q3344-H3349 WeakPolarHBondContact O-CA 3.33Å; Q3344-H3349 PolarHBondContact O-N 3.13Å; Q3344-I3350 HydrophobicContact CB-CD1 3.72Å; Q3344-I3350 HydrophobicContact CB-CG1 3.97Å; Q3344-I3350 HydrophobicContact CG-CD1 4.37Å; Q3344-I3350 PolarHBondContact O-N 3.24Å; Q3344-I3350 VanDerWaalsContact O-N 3.13Å
3345M70Confident64.4Low68 Ų6886.5 Ų86.534%0.33543%0.427SS..Hα-helixtrans-73.2-40.6173.6-172.2-176.366.900111.8L3341 R3342 G3348L3341-M3345 PolarHBondContact O-N 3.05Å; R3342-M3345 PolarHBondContact O-N 2.92Å; M3345-G3348 PolarHBondContact O-N 3.33Å
3346E71.1Confident62.7Low106 Ų10689.9 Ų89.950%0.49546%0.462SS..Hα-helixtrans-72-27.4178.8-72.4174.1162.600112.7R3342 K3343 G3348R3342-E3346 HydrophobicContact CG-CG 4.32Å; R3342-E3346 IonicContact CZ-OE1 2.74Å; R3342-E3346 IonicContact NE-OE1 2.72Å; R3342-E3346 PolarHBondContact NE-OE1 3.22Å; R3342-E3346 IonicContact NE-OE2 3.47Å; R3342-E3346 IonicContact NH2-OE1 3.8Å; R3342-E3346 PolarHBondContact NH2-OE1 3.39Å; R3342-E3346 IonicContact NH2-OE2 3.56Å; R3342-E3346 WeakPolarHBondContact O-CB 3.44Å; R3342-E3346 WeakPolarHBondContact O-CG 3.42Å; R3342-E3346 PolarHBondContact O-N 2.98Å; K3343-E3346 PolarHBondContact O-N 3.25Å; E3346-G3348 VanDerWaalsContact C-N 3.34Å
3347S76Confident60.7Low68 Ų6892.4 Ų92.448%0.47648%0.476SS..THydrogen-bonded Turntrans-88.25.9171.880.20000114.1K3343 Q3344 H3349K3343-S3347 WeakPolarHBondContact O-CB 3.25Å; K3343-S3347 PolarHBondContact O-N 2.88Å; K3343-S3347 PolarHBondContact O-OG 3.08Å; Q3344-S3347 PolarHBondContact O-OG 3.09Å; S3347-H3349 PolarHBondContact O-N 3.43Å; S3347-H3349 VanDerWaalsContact O-N 3.16Å; S3347-H3349 PolarHBondContact OG-CD2 3.17Å
3348G71.1Confident58.8Low53 Ų5398.3 Ų98.355%0.54650%0.501SS..THydrogen-bonded Turntrans67.48.2-178.900000116Q3344 M3345 E3346 I3350Q3344-G3348 PolarHBondContact O-N 2.96Å; M3345-G3348 PolarHBondContact O-N 3.33Å; E3346-G3348 VanDerWaalsContact C-N 3.34Å; G3348-I3350 VanDerWaalsContact C-N 3.28Å; G3348-I3350 PolarHBondContact O-N 3.34Å
3349H70Confident57.1Low156 Ų156100.2 Ų100.272%0.72252%0.521SS*.SBendtrans-73.3-17.6177.9-80.6-44.6000113.6Q3344 S3347Q3344-H3349 HydrophobicContact CB-CB 4.4Å; Q3344-H3349 WeakPolarHBondContact O-CA 3.33Å; Q3344-H3349 PolarHBondContact O-N 3.13Å; S3347-H3349 PolarHBondContact O-N 3.43Å; S3347-H3349 VanDerWaalsContact O-N 3.16Å; S3347-H3349 PolarHBondContact OG-CD2 3.17Å
3350I57.3Low55.3Low62 Ų62104.3 Ų104.332%0.31854%0.538SS..  trans-128.9113.8171.4-62.6174.7000108.8L3341 Q3344 G3348 V3352L3341-I3350 HydrophobicContact CD2-CD1 4.35Å; Q3344-I3350 HydrophobicContact CB-CD1 3.72Å; Q3344-I3350 HydrophobicContact CB-CG1 3.97Å; Q3344-I3350 HydrophobicContact CG-CD1 4.37Å; Q3344-I3350 PolarHBondContact O-N 3.24Å; Q3344-I3350 VanDerWaalsContact O-N 3.13Å; G3348-I3350 VanDerWaalsContact C-N 3.28Å; G3348-I3350 PolarHBondContact O-N 3.34Å; I3350-V3352 HydrophobicContact CG2-CG2 3.92Å
3351V51.3Low53.8Low128 Ų128100.8 Ų100.878%0.77653%0.53SS*.  trans-89.2117.4163.7-1800000107.3E3353V3351-E3353 PolarHBondContact O-N 3.01Å
3352V50.7Low52.2Low62 Ų62100.1 Ų100.138%0.37653%0.525SS..  trans-89.9101.9179-175.30000109I3350 L3357I3350-V3352 HydrophobicContact CG2-CG2 3.92Å; V3352-L3357 HydrophobicContact CG1-CD1 4.26Å
3353E40.2Very low50.7Low165 Ų165100.4 Ų100.477%0.77154%0.535SS*.  trans-66141.3171.5-65.6-165.8134.900111V3351 H3355V3351-E3353 PolarHBondContact O-N 3.01Å; E3353-H3355 VanDerWaalsContact C-N 3.27Å; E3353-H3355 PolarHBondContact O-N 3.31Å
3354R36.6Very low48.7Very low187 Ų18796.7 Ų96.771%0.70653%0.525SS*.SBendtrans-69.8-15-166.5-73.4-172.9177.5-158.1-2.4115.3S3368R3354-S3368 PolarHBondContact NH2-OG 2.89Å
3355H33Very low46.9Very low187 Ų187100.2 Ų100.287%0.86654%0.538SS*.SBendtrans-105.695.3-167.3-70.269.9000111.9E3353E3353-H3355 VanDerWaalsContact C-N 3.27Å; E3353-H3355 PolarHBondContact O-N 3.31Å
3356G35.4Very low45.3Very low72 Ų7298.7 Ų98.774%0.74253%0.534SS*.SBendtrans139.9-21.2164.400000117.2
3357L32.1Very low43.5Very low88 Ų8898.6 Ų98.646%0.46154%0.543SS..  trans-100.122.8-168.4-67.3171.3000115.4V3352 G3359 F3360V3352-L3357 HydrophobicContact CG1-CD1 4.26Å; L3357-G3359 PolarHBondContact O-N 3.09Å; L3357-F3360 HydrophobicContact CD2-CD2 3.68Å; L3357-F3360 HydrophobicContact CD2-CE2 3.89Å; L3357-F3360 PolarHBondContact O-N 3.36Å; L3357-F3360 VanDerWaalsContact O-N 3.11Å
3358Q32.7Very low41.6Very low176 Ų17697 Ų9782%0.82253%0.531SS*.THydrogen-bonded Turntrans-76.725.9-173.9-144.5159.88.400114.8R3314R3314-Q3358 PolarHBondContact NH2-O 3.06Å
3359G33.2Very low40.1Very low44 Ų44100.1 Ų100.145%0.45454%0.54SS..THydrogen-bonded Turntrans-135.61.9171.700000114L3357 I3361L3357-G3359 PolarHBondContact O-N 3.09Å; G3359-I3361 PolarHBondContact O-N 2.87Å
3360F36Very low38.4Very low111 Ų111101 Ų10149%0.48754%0.544SS..  trans-77.4120.3178.4-108.2-99.8000111.8L3357 F3362 S3363L3357-F3360 HydrophobicContact CD2-CD2 3.68Å; L3357-F3360 HydrophobicContact CD2-CE2 3.89Å; L3357-F3360 PolarHBondContact O-N 3.36Å; L3357-F3360 VanDerWaalsContact O-N 3.11Å; F3360-F3362 PolarHBondContact O-N 2.93Å; F3360-S3363 PolarHBondContact O-N 3.32Å
3361I42.7Very low37.2Very low79 Ų79102.8 Ų102.841%0.40555%0.554SS.*THydrogen-bonded Turntrans-51.5-17.9-177.6-63.8172.1000114.2G3359G3359-I3361 PolarHBondContact O-N 2.87Å
3362F38.1Very low36.1Very low48 Ų48100.3 Ų100.321%0.21154%0.543CS..THydrogen-bonded Turntrans-117.4-3.3-175.6-49.7-60.6000114.4C3334 T3337 A3338 L3341 F3360 A3364C3334-F3362 HydrophobicContact CB-CZ 4.3Å; T3337-F3362 HydrophobicContact CG2-CD2 4.46Å; T3337-F3362 HydrophobicContact CG2-CE2 4.18Å; A3338-F3362 HydrophobicContact CB-CB 4.48Å; A3338-F3362 HydrophobicContact CB-CD1 3.42Å; A3338-F3362 VanDerWaalsContact CB-CD1 3.42Å; A3338-F3362 HydrophobicContact CB-CE1 3.78Å; A3338-F3362 HydrophobicContact CB-CG 4.01Å; L3341-F3362 HydrophobicContact CD1-CB 4.1Å; L3341-F3362 HydrophobicContact CD1-CD2 4.02Å; L3341-F3362 HydrophobicContact CD1-CG 4.38Å; F3360-F3362 PolarHBondContact O-N 2.93Å; F3362-A3364 PolarHBondContact O-N 3.02Å
3363S35.8Very low35Very low58 Ų58102.4 Ų102.441%0.40656%0.559SS.*  trans-102.843.9-171.1-168.30000113.7F3360F3360-S3363 PolarHBondContact O-N 3.32Å
3364A33.9Very low34.5Very low32 Ų32101 Ų10126%0.26456%0.556SS.*  trans-107.263.9-178.900000112.3D2737 Y2741 F3362D2737-A3364 HydrophobicContact CB-CB 4.35Å; Y2741-A3364 WeakPolarHBondContact CD1-O 3.41Å; Y2741-A3364 WeakPolarHBondContact CD2-O 3.31Å; F3362-A3364 PolarHBondContact O-N 3.02Å
3365K37.4Very low34.1Very low154 Ų154100.2 Ų100.267%0.6757%0.565SS**PPolyproline II helixtrans-68.3136.8164.4-164.2176.3-175.7179.70108
3366P35.8Very low33.8Very low37 Ų3793.1 Ų93.124%0.2454%0.537CS..PPolyproline II helixtrans-59.1153173.625-34.2000110.9
3367P33.2Very low33.7Very low104 Ų10497.6 Ų97.668%0.67554%0.538SS*.PPolyproline II helixtrans-59.8154.5179.626.1-34.6000111.8
3368S36.7Very low33.4Very low34 Ų3498.2 Ų98.224%0.23855%0.55CS..PPolyproline II helixtrans-61.9145-179.814.10000112R3354 E3370 D3371R3354-S3368 PolarHBondContact NH2-OG 2.89Å; S3368-E3370 PolarHBondContact O-N 2.91Å; S3368-D3371 WeakPolarHBondContact CB-OD2 3.49Å; S3368-D3371 PolarHBondContact O-N 3.4Å; S3368-D3371 PolarHBondContact OG-OD2 3.06Å
3369T39.7Very low33.1Very low119 Ų11997.9 Ų97.973%0.7355%0.549SS*.THydrogen-bonded Turntrans-64.23.5173.5340000115S3372T3369-S3372 PolarHBondContact O-OG 2.93Å
3370E34.9Very low32.9Very low173 Ų17399.4 Ų99.481%0.80855%0.55SS**THydrogen-bonded Turntrans-97.8-19175.1-65.1173.1156.900111.6S3368 S3372S3368-E3370 PolarHBondContact O-N 2.91Å; E3370-S3372 VanDerWaalsContact C-N 3.28Å; E3370-S3372 PolarHBondContact O-N 3.31Å
3371D31.9Very low32.8Very low100 Ų100101.1 Ų101.154%0.53557%0.569SS.*SBendtrans-82.6-3.1174.7-58.8-72.8000112.4S3368 C3373S3368-D3371 WeakPolarHBondContact CB-OD2 3.49Å; S3368-D3371 PolarHBondContact O-N 3.4Å; S3368-D3371 PolarHBondContact OG-OD2 3.06Å; D3371-C3373 PolarHBondContact O-N 3.32Å; D3371-C3373 VanDerWaalsContact O-N 3.13Å
3372S28.7Very low32.6Very low77 Ų77100.5 Ų100.554%0.53857%0.57SS.*THydrogen-bonded Turntrans-84.829.5-173.367.60000115T3369 E3370T3369-S3372 PolarHBondContact O-OG 2.93Å; E3370-S3372 VanDerWaalsContact C-N 3.28Å; E3370-S3372 PolarHBondContact O-N 3.31Å
3373C26.8Very low32.5Very low106 Ų106106.4 Ų106.472%0.71660%0.602SS**THydrogen-bonded Turntrans-119.226179.5-80.70000113.8D3371D3371-C3373 PolarHBondContact O-N 3.32Å; D3371-C3373 VanDerWaalsContact O-N 3.13Å
3374I30.2Very low33Very low136 Ų136104.3 Ų104.370%0.69759%0.59SS**  trans-128.681.5158.1-52.7-179.1000108.5S3376I3374-S3376 PolarHBondContact O-N 3.49Å
3375D27.1Very low34.2Very low170 Ų170103.8 Ų103.891%0.90958%0.583SS**  trans-72.858.2168.1-116.1-14.4000110.1
3376S27.8Very low35.5Very low38 Ų38102 Ų10227%0.26659%0.585SS.*  trans-70.6132156.867.80000107.6I3374 S3378I3374-S3376 PolarHBondContact O-N 3.49Å; S3376-S3378 PolarHBondContact O-N 2.98Å
3377E32Very low37.1Very low166 Ų166103.4 Ų103.478%0.77659%0.585SS**  trans-63.781.6167.5-70.1-170.9128.100109.5Q3379E3377-Q3379 PolarHBondContact O-N 2.82Å
3378S26.4Very low38.8Very low100 Ų10098.4 Ų98.470%0.69955%0.553SS**  trans-61.896.7150.448.90000105.6S3376 P3380S3376-S3378 PolarHBondContact O-N 2.98Å; S3378-P3380 VanDerWaalsContact O-N 3.07Å
3379Q26.6Very low40.5Very low170 Ų170103.1 Ų103.179%0.79457%0.565SS**  trans-46.1123.8165.7-71.7-173.4-2.800106.3E3377 V3381E3377-Q3379 PolarHBondContact O-N 2.82Å; Q3379-V3381 PolarHBondContact O-N 2.82Å
3380P29.1Very low42.4Very low76 Ų76100.4 Ų100.449%0.49455%0.551SS.*  trans-56.1145178.422.9-31.8000107.6S3378 T3382S3378-P3380 VanDerWaalsContact O-N 3.07Å; P3380-T3382 WeakPolarHBondContact O-CA 3.34Å; P3380-T3382 PolarHBondContact O-N 3.25Å; P3380-T3382 PolarHBondContact O-OG1 3.38Å
3381V34.6Very low44.6Very low146 Ų14692.8 Ų92.889%0.88552%0.517SS*.SBendtrans-72.538.6177.8-162.90000111.3Q3379 L3383Q3379-V3381 PolarHBondContact O-N 2.82Å; V3381-L3383 PolarHBondContact O-N 3.19Å
3382T38.8Very low47Very low67 Ų6788.4 Ų88.441%0.41149%0.493SS..  trans-60.365.1136.157.60000110.7P3380 G3384P3380-T3382 WeakPolarHBondContact O-CA 3.34Å; P3380-T3382 PolarHBondContact O-N 3.25Å; P3380-T3382 PolarHBondContact O-OG1 3.38Å; T3382-G3384 WeakPolarHBondContact O-CA 3.48Å; T3382-G3384 PolarHBondContact O-N 3.39Å
3383L36.2Very low49.6Very low171 Ų17188.4 Ų88.490%0.89548%0.484SS*.  trans-68.263.4143.7-158.878.3000106.7V3381 N3385V3381-L3383 PolarHBondContact O-N 3.19Å; L3383-N3385 PolarHBondContact O-N 2.71Å
3384G45Very low52.5Low14 Ų1487.1 Ų87.114%0.14446%0.464CS..  -107.772.3-125.900000111.6T3382T3382-G3384 WeakPolarHBondContact O-CA 3.48Å; T3382-G3384 PolarHBondContact O-N 3.39Å
3385N60.1Low55.4Low22 Ų2280.8 Ų80.812%0.11843%0.432CS..  trans46.176.1172.7-168-9.5000111.8V3183 L3383 R3387 A3388 R3389V3183-N3385 HydrophobicContact CG2-CB 3.84Å; V3183-N3385 VanDerWaalsContact CG2-CG 3.41Å; V3183-N3385 WeakPolarHBondContact CG2-ND2 3.46Å; L3383-N3385 PolarHBondContact O-N 2.71Å; N3385-R3387 PolarHBondContact O-N 3.03Å; N3385-R3387 WeakPolarHBondContact OD1-CB 3.21Å; N3385-R3387 PolarHBondContact OD1-N 2.96Å; N3385-A3388 HydrophobicContact CB-CB 3.76Å; N3385-A3388 WeakPolarHBondContact ND2-CB 3.13Å; N3385-A3388 WeakPolarHBondContact O-CA 3.32Å; N3385-A3388 WeakPolarHBondContact O-CB 3.35Å; N3385-A3388 PolarHBondContact O-N 3.36Å; N3385-A3388 PolarHBondContact OD1-N 3.43Å; N3385-R3389 PolarHBondContact O-N 2.99Å
3386V64.6Low58.3Low117 Ų11776.4 Ų76.471%0.70940%0.403SS*.Hα-helixtrans-54.7-38.7178179.50000110.6A3388 R3389 S3390V3386-A3388 VanDerWaalsContact C-N 3.32Å; V3386-A3388 PolarHBondContact O-N 3.38Å; V3386-R3389 PolarHBondContact O-N 2.77Å; V3386-S3390 PolarHBondContact O-N 3.15Å
3387R68Low61.3Low65 Ų6577.6 Ų77.625%0.24540%0.404CS..Hα-helixtrans-57.3-39.7172.3-170.3178.6-168.1143.39.5112.4E3186 N3385 S3390 V3391E3186-R3387 IonicContact OE1-CZ 2.97Å; E3186-R3387 IonicContact OE1-NH1 2.78Å; E3186-R3387 PolarHBondContact OE1-NH1 2.91Å; E3186-R3387 IonicContact OE2-CZ 3.44Å; E3186-R3387 IonicContact OE2-NH1 3.71Å; E3186-R3387 PolarHBondContact OE2-NH1 3.25Å; N3385-R3387 PolarHBondContact O-N 3.03Å; N3385-R3387 WeakPolarHBondContact OD1-CB 3.21Å; N3385-R3387 PolarHBondContact OD1-N 2.96Å; R3387-S3390 PolarHBondContact O-N 3.07Å; R3387-V3391 WeakPolarHBondContact O-CB 3.42Å; R3387-V3391 WeakPolarHBondContact O-CG2 3.44Å; R3387-V3391 PolarHBondContact O-N 2.71Å
3388A69.3Low64.3Low0 Ų069.9 Ų69.90%037%0.368CS..Hα-helixtrans-65.9-40.8175.200000114I3175 W3182 N3385 V3386 S3390 V3391 M3392I3175-A3388 HydrophobicContact CB-CB 4.33Å; I3175-A3388 HydrophobicContact CG1-CB 4.26Å; I3175-A3388 HydrophobicContact CG2-CB 3.98Å; W3182-A3388 HydrophobicContact CH2-CB 3.16Å; W3182-A3388 HydrophobicContact CZ2-CB 3.54Å; W3182-A3388 VanDerWaalsContact CZ3-CA 3.43Å; W3182-A3388 HydrophobicContact CZ3-CB 3.72Å; N3385-A3388 HydrophobicContact CB-CB 3.76Å; N3385-A3388 WeakPolarHBondContact ND2-CB 3.13Å; N3385-A3388 WeakPolarHBondContact O-CA 3.32Å; N3385-A3388 WeakPolarHBondContact O-CB 3.35Å; N3385-A3388 PolarHBondContact O-N 3.36Å; N3385-A3388 PolarHBondContact OD1-N 3.43Å; V3386-A3388 VanDerWaalsContact C-N 3.32Å; V3386-A3388 PolarHBondContact O-N 3.38Å; A3388-S3390 VanDerWaalsContact C-N 3.3Å; A3388-S3390 PolarHBondContact O-N 2.87Å; A3388-V3391 PolarHBondContact O-N 3.07Å; A3388-M3392 VanDerWaalsContact O-CB 3.24Å; A3388-M3392 WeakPolarHBondContact O-CB 3.34Å; A3388-M3392 VanDerWaalsContact O-CG 3.24Å; A3388-M3392 WeakPolarHBondContact O-CG 3.49Å; A3388-M3392 PolarHBondContact O-N 2.96Å
3389R73.4Confident67.4Low132 Ų13265.2 Ų65.250%0.49834%0.335SS..Hα-helixtrans-64.1-39.9175.1-62.5-178.6-174.9154.30.5110.5N3385 V3386 E3393N3385-R3389 PolarHBondContact O-N 2.99Å; V3386-R3389 PolarHBondContact O-N 2.77Å; R3389-E3393 WeakPolarHBondContact O-CB 3.23Å; R3389-E3393 PolarHBondContact O-N 3.13Å
3390S79.3Confident70.4Confident63 Ų6358.7 Ų58.744%0.44131%0.307SS..Hα-helixtrans-64.1-48.5174.4-172.30000113.1V3386 R3387 A3388 M3392 E3393 R3394V3386-S3390 PolarHBondContact O-N 3.15Å; R3387-S3390 PolarHBondContact O-N 3.07Å; A3388-S3390 VanDerWaalsContact C-N 3.3Å; A3388-S3390 PolarHBondContact O-N 2.87Å; S3390-M3392 PolarHBondContact O-N 3.24Å; S3390-E3393 PolarHBondContact O-N 2.71Å; S3390-R3394 WeakPolarHBondContact O-CB 3.35Å; S3390-R3394 PolarHBondContact O-N 3.04Å
3391V80.4Confident73.2Confident13 Ų1355.1 Ų55.18%0.07928%0.284CS..Hα-helixtrans-58.2-48.3175.6161.60000110.9F3115 W3182 R3387 A3388 E3393 R3394 I3395F3115-V3391 HydrophobicContact CB-CG1 3.76Å; F3115-V3391 HydrophobicContact CB-CG2 4.05Å; F3115-V3391 HydrophobicContact CD1-CG1 3.5Å; F3115-V3391 VanDerWaalsContact CD1-CG1 3.5Å; F3115-V3391 HydrophobicContact CE1-CG1 4.31Å; F3115-V3391 HydrophobicContact CG-CG1 3.8Å; W3182-V3391 HydrophobicContact CH2-CB 4.32Å; W3182-V3391 HydrophobicContact CH2-CG1 4.28Å; W3182-V3391 HydrophobicContact CZ3-CB 4.02Å; W3182-V3391 HydrophobicContact CZ3-CG1 4.22Å; W3182-V3391 HydrophobicContact CZ3-CG2 3.97Å; R3387-V3391 WeakPolarHBondContact O-CB 3.42Å; R3387-V3391 WeakPolarHBondContact O-CG2 3.44Å; R3387-V3391 PolarHBondContact O-N 2.71Å; A3388-V3391 PolarHBondContact O-N 3.07Å; V3391-E3393 VanDerWaalsContact C-N 3.35Å; V3391-E3393 PolarHBondContact O-N 3.44Å; V3391-R3394 PolarHBondContact O-N 3.4Å; V3391-R3394 VanDerWaalsContact O-N 3.16Å; V3391-I3395 HydrophobicContact CG1-CD1 3.9Å; V3391-I3395 HydrophobicContact CG1-CG1 4.49Å; V3391-I3395 VanDerWaalsContact O-CG1 3.31Å; V3391-I3395 WeakPolarHBondContact O-CG1 3.38Å; V3391-I3395 PolarHBondContact O-N 3.4Å
3392M82.6Confident75.7Confident7 Ų750.1 Ų50.13%0.03425%0.254CS..Hα-helixtrans-68.3-33.3-178-74-67.9-56.500113L3168 L3171 E3172 I3175 A3388 S3390 I3395 R3396L3168-M3392 HydrophobicContact CB-CE 4.42Å; L3168-M3392 HydrophobicContact CD2-CE 3.81Å; L3171-M3392 HydrophobicContact CB-CE 3.75Å; L3171-M3392 HydrophobicContact CB-SD 3.53Å; L3171-M3392 VanDerWaalsContact CB-SD 3.53Å; E3172-M3392 HydrophobicContact CB-CE 4.38Å; E3172-M3392 HydrophobicContact CG-CE 3.6Å; I3175-M3392 HydrophobicContact CD1-CB 4.31Å; I3175-M3392 HydrophobicContact CD1-CG 3.8Å; I3175-M3392 HydrophobicContact CG1-CG 3.81Å; A3388-M3392 VanDerWaalsContact O-CB 3.24Å; A3388-M3392 WeakPolarHBondContact O-CB 3.34Å; A3388-M3392 VanDerWaalsContact O-CG 3.24Å; A3388-M3392 WeakPolarHBondContact O-CG 3.49Å; A3388-M3392 PolarHBondContact O-N 2.96Å; S3390-M3392 PolarHBondContact O-N 3.24Å; M3392-I3395 HydrophobicContact SD-CD1 4.29Å; M3392-R3396 WeakPolarHBondContact O-CB 3.45Å; M3392-R3396 PolarHBondContact O-N 3.38Å
3393E83.8Confident77.8Confident77 Ų7749.9 Ų49.936%0.3625%0.248SC..Hα-helixtrans-68.2-39.7170.5-171.253.4-140.800111.6R3389 S3390 V3391 I3395 R3396 Q3397R3389-E3393 WeakPolarHBondContact O-CB 3.23Å; R3389-E3393 PolarHBondContact O-N 3.13Å; S3390-E3393 PolarHBondContact O-N 2.71Å; V3391-E3393 VanDerWaalsContact C-N 3.35Å; V3391-E3393 PolarHBondContact O-N 3.44Å; E3393-I3395 PolarHBondContact O-N 3.1Å; E3393-R3396 CarbonylContact O-C 3.54Å; E3393-R3396 WeakPolarHBondContact O-CA 3.35Å; E3393-R3396 WeakPolarHBondContact O-CB 3.37Å; E3393-R3396 PolarHBondContact O-N 2.85Å; E3393-R3396 WeakPolarHBondContact OE2-CD 3.4Å; E3393-R3396 IonicContact OE2-CZ 3.23Å; E3393-R3396 IonicContact OE2-NE 2.71Å; E3393-R3396 IonicContact OE2-NH1 2.73Å; E3393-R3396 PolarHBondContact OE2-NH1 3.1Å; E3393-Q3397 VanDerWaalsContact O-CG 3.3Å; E3393-Q3397 WeakPolarHBondContact O-CG 3.5Å; E3393-Q3397 PolarHBondContact O-N 2.96Å
3394R87.6Confident79.7Confident79 Ų7948.4 Ų48.430%0.29823%0.231SC..Hα-helixtrans-64.2-41.2175.1-162.3175.2-65.2-157.4-3.7112.1E3116 M3120 S3390 V3391 R3396 Q3397 K3398E3116-R3394 VanDerWaalsContact CD-CD 3.41Å; E3116-R3394 WeakPolarHBondContact OE1-CD 3.25Å; E3116-R3394 WeakPolarHBondContact OE2-CD 3.19Å; E3116-R3394 IonicContact OE2-CZ 3.72Å; E3116-R3394 IonicContact OE2-NE 2.62Å; E3116-R3394 IonicContact OE2-NH1 2.7Å; E3116-R3394 PolarHBondContact OE2-NH1 3.15Å; M3120-R3394 VanDerWaalsContact CE-NH1 3.32Å; S3390-R3394 WeakPolarHBondContact O-CB 3.35Å; S3390-R3394 PolarHBondContact O-N 3.04Å; V3391-R3394 PolarHBondContact O-N 3.4Å; V3391-R3394 VanDerWaalsContact O-N 3.16Å; R3394-R3396 VanDerWaalsContact C-N 3.33Å; R3394-R3396 PolarHBondContact O-N 2.83Å; R3394-Q3397 WeakPolarHBondContact O-CB 3.45Å; R3394-Q3397 PolarHBondContact O-N 2.66Å; R3394-K3398 WeakPolarHBondContact O-CG 3.46Å; R3394-K3398 PolarHBondContact O-N 3.47Å
3395I90Very high81.2Confident4 Ų455.6 Ų55.62%0.02127%0.266CS..Hα-helixtrans-62.7-40.8172.6-63.3172.9000110.8I3086 F3115 L3168 L3171 V3391 M3392 E3393 K3398 L3399I3086-I3395 HydrophobicContact CG2-CG2 4.15Å; F3115-I3395 HydrophobicContact CD1-CD1 3.91Å; F3115-I3395 HydrophobicContact CE1-CD1 3.92Å; L3168-I3395 HydrophobicContact CD2-CB 4.48Å; L3168-I3395 HydrophobicContact CD2-CG2 4.04Å; L3171-I3395 HydrophobicContact CD1-CD1 4.05Å; L3171-I3395 HydrophobicContact CD1-CG2 3.9Å; V3391-I3395 HydrophobicContact CG1-CD1 3.9Å; V3391-I3395 HydrophobicContact CG1-CG1 4.49Å; V3391-I3395 VanDerWaalsContact O-CG1 3.31Å; V3391-I3395 WeakPolarHBondContact O-CG1 3.38Å; V3391-I3395 PolarHBondContact O-N 3.4Å; M3392-I3395 HydrophobicContact SD-CD1 4.29Å; E3393-I3395 PolarHBondContact O-N 3.1Å; I3395-K3398 PolarHBondContact O-N 3.46Å; I3395-L3399 HydrophobicContact CG2-CD1 3.92Å; I3395-L3399 WeakPolarHBondContact O-CB 3.45Å; I3395-L3399 WeakPolarHBondContact O-CG 3.46Å; I3395-L3399 PolarHBondContact O-N 3.07Å
3396R89.7Confident82Confident77 Ų7761.8 Ų61.829%0.29129%0.294SS..Hα-helixtrans-58.9-47.2172.3178.4178.7-70115.12.9110.9L3168 E3172 M3392 E3393 R3394 K3398 L3399 T3400L3168-R3396 HydrophobicContact CD1-CB 4.15Å; L3168-R3396 HydrophobicContact CD1-CG 4.2Å; L3168-R3396 HydrophobicContact CD2-CB 4.19Å; E3172-R3396 IonicContact OE1-NH2 3.79Å; M3392-R3396 WeakPolarHBondContact O-CB 3.45Å; M3392-R3396 PolarHBondContact O-N 3.38Å; E3393-R3396 CarbonylContact O-C 3.54Å; E3393-R3396 WeakPolarHBondContact O-CA 3.35Å; E3393-R3396 WeakPolarHBondContact O-CB 3.37Å; E3393-R3396 PolarHBondContact O-N 2.85Å; E3393-R3396 WeakPolarHBondContact OE2-CD 3.4Å; E3393-R3396 IonicContact OE2-CZ 3.23Å; E3393-R3396 IonicContact OE2-NE 2.71Å; E3393-R3396 IonicContact OE2-NH1 2.73Å; E3393-R3396 PolarHBondContact OE2-NH1 3.1Å; R3394-R3396 VanDerWaalsContact C-N 3.33Å; R3394-R3396 PolarHBondContact O-N 2.83Å; R3396-K3398 PolarHBondContact O-N 3.43Å; R3396-L3399 CarbonylContact O-C 3.56Å; R3396-L3399 PolarHBondContact O-N 2.91Å; R3396-L3399 VanDerWaalsContact O-N 3.11Å; R3396-T3400 HydrophobicContact CG-CG2 4.41Å; R3396-T3400 WeakPolarHBondContact O-CG2 3.39Å; R3396-T3400 PolarHBondContact O-N 3.27Å; R3396-T3400 PolarHBondContact O-OG1 3.03Å; R3396-T3400 VanDerWaalsContact O-OG1 3.1Å
3397Q90.9Very high82.9Confident63 Ų6362 Ų6229%0.29430%0.295SS..Hα-helixtrans-60.1-39.2176.9-71.8169.2-6.800113.1E3393 R3394 T3400 G3401 T3402 E3403E3393-Q3397 VanDerWaalsContact O-CG 3.3Å; E3393-Q3397 WeakPolarHBondContact O-CG 3.5Å; E3393-Q3397 PolarHBondContact O-N 2.96Å; R3394-Q3397 WeakPolarHBondContact O-CB 3.45Å; R3394-Q3397 PolarHBondContact O-N 2.66Å; Q3397-T3400 VanDerWaalsContact CA-OG1 3.25Å; Q3397-T3400 WeakPolarHBondContact CA-OG1 3.27Å; Q3397-T3400 PolarHBondContact O-OG1 3.39Å; Q3397-G3401 CarbonylContact O-C 3.59Å; Q3397-G3401 WeakPolarHBondContact O-CA 3.46Å; Q3397-G3401 PolarHBondContact O-N 2.59Å; Q3397-T3402 PolarHBondContact O-N 3.06Å; Q3397-E3403 HydrophobicContact CB-CB 4.43Å
3398K93.8Very high83.9Confident5 Ų561.2 Ų61.22%0.02230%0.295CS..Hα-helixtrans-65.5-38.3173.1-66178.7-179.6170.50112.6Y3085 I3086 E3116 R3394 I3395 R3396 G3401 E3403 Q3413Y3085-K3398 HydrophobicContact CD2-CD 4.2Å; Y3085-K3398 HydrophobicContact CE1-CB 4.09Å; Y3085-K3398 HydrophobicContact CE1-CD 4.12Å; Y3085-K3398 HydrophobicContact CE1-CG 4.14Å; Y3085-K3398 HydrophobicContact CE2-CD 3.75Å; Y3085-K3398 HydrophobicContact CE2-CG 4.07Å; Y3085-K3398 WeakPolarHBondContact O-CD 3.24Å; Y3085-K3398 PolarHBondContact O-NZ 3.18Å; I3086-K3398 HydrophobicContact CD1-CB 3.65Å; E3116-K3398 VanDerWaalsContact OE1-CE 3.26Å; E3116-K3398 WeakPolarHBondContact OE1-CE 3.38Å; E3116-K3398 IonicContact OE1-NZ 3.78Å; E3116-K3398 PolarHBondContact OE1-NZ 3.31Å; R3394-K3398 WeakPolarHBondContact O-CG 3.46Å; R3394-K3398 PolarHBondContact O-N 3.47Å; I3395-K3398 PolarHBondContact O-N 3.46Å; R3396-K3398 PolarHBondContact O-N 3.43Å; K3398-G3401 PolarHBondContact O-N 3.48Å; K3398-E3403 WeakPolarHBondContact CE-OE1 3.46Å; K3398-E3403 WeakPolarHBondContact CG-OE1 3.33Å; K3398-Q3413 PolarHBondContact O-NE2 3.23Å
3399L92.7Very high85Confident1 Ų164.6 Ų64.61%0.00532%0.318CS..Hα-helixtrans-80-21179.3-70.8170.4000114.1I3086 L3160 R3161 R3164 L3167 L3168 I3395 R3396I3086-L3399 HydrophobicContact CD1-CD2 3.76Å; I3086-L3399 HydrophobicContact CD1-CG 4.07Å; I3086-L3399 HydrophobicContact CG1-CD2 4.11Å; I3086-L3399 HydrophobicContact CG2-CD1 4.33Å; I3086-L3399 HydrophobicContact CG2-CD2 4.01Å; I3086-L3399 HydrophobicContact CG2-CG 4.15Å; L3160-L3399 HydrophobicContact CB-CD2 3.99Å; R3161-L3399 WeakPolarHBondContact CB-O 3.37Å; R3161-L3399 VanDerWaalsContact CG-O 3.25Å; R3161-L3399 WeakPolarHBondContact CG-O 3.34Å; R3164-L3399 HydrophobicContact CB-CB 3.72Å; R3164-L3399 HydrophobicContact CB-CD1 3.99Å; R3164-L3399 HydrophobicContact CB-CD2 4.42Å; R3164-L3399 HydrophobicContact CB-CG 4.27Å; L3167-L3399 HydrophobicContact CB-CD1 4.3Å; L3167-L3399 HydrophobicContact CD1-CD1 4.42Å; L3167-L3399 HydrophobicContact CD1-CD2 3.98Å; L3168-L3399 HydrophobicContact CD2-CD1 4.28Å; L3168-L3399 HydrophobicContact CG-CD1 4.17Å; I3395-L3399 HydrophobicContact CG2-CD1 3.92Å; I3395-L3399 WeakPolarHBondContact O-CB 3.45Å; I3395-L3399 WeakPolarHBondContact O-CG 3.46Å; I3395-L3399 PolarHBondContact O-N 3.07Å; R3396-L3399 CarbonylContact O-C 3.56Å; R3396-L3399 PolarHBondContact O-N 2.91Å; R3396-L3399 VanDerWaalsContact O-N 3.11Å
3400T88.7Confident86Confident33 Ų3360.1 Ų60.120%0.20231%0.306CS..Hα-helixtrans-84.1-26.9165.851.20000111.5R3161 R3396 Q3397 T3402R3161-T3400 PolarHBondContact NH2-O 3.08Å; R3396-T3400 HydrophobicContact CG-CG2 4.41Å; R3396-T3400 WeakPolarHBondContact O-CG2 3.39Å; R3396-T3400 PolarHBondContact O-N 3.27Å; R3396-T3400 PolarHBondContact O-OG1 3.03Å; R3396-T3400 VanDerWaalsContact O-OG1 3.1Å; Q3397-T3400 VanDerWaalsContact CA-OG1 3.25Å; Q3397-T3400 WeakPolarHBondContact CA-OG1 3.27Å; Q3397-T3400 PolarHBondContact O-OG1 3.39Å; T3400-T3402 PolarHBondContact OG1-OG1 2.9Å
3401G88.2Confident86.8Confident1 Ų160 Ų601%0.0131%0.305CS..THydrogen-bonded Turntrans83.333-173.200000113Q3397 K3398 Q3406 M3408Q3397-G3401 CarbonylContact O-C 3.59Å; Q3397-G3401 WeakPolarHBondContact O-CA 3.46Å; Q3397-G3401 PolarHBondContact O-N 2.59Å; K3398-G3401 PolarHBondContact O-N 3.48Å; G3401-Q3406 VanDerWaalsContact O-O 3.09Å; G3401-M3408 PolarHBondContact O-N 3.14Å
3402T87.2Confident87.5Confident42 Ų4261.4 Ų61.426%0.25832%0.318SS..  trans-12423.7-172.464.70000113.4Q3397 T3400 R3404 D3405 V3407Q3397-T3402 PolarHBondContact O-N 3.06Å; T3400-T3402 PolarHBondContact OG1-OG1 2.9Å; T3402-R3404 PolarHBondContact O-N 2.97Å; T3402-D3405 PolarHBondContact O-N 3.16Å; T3402-V3407 HydrophobicContact CG2-CB 4.41Å; T3402-V3407 HydrophobicContact CG2-CG1 4.46Å; T3402-V3407 HydrophobicContact CG2-CG2 3.94Å
3403E81.9Confident88.1Confident61 Ų6161.2 Ų61.229%0.28532%0.317SS..THydrogen-bonded Turntrans-65.6-12.8179.9-178.5174.7-126.400114.1Y3085 Q3397 K3398Y3085-E3403 WeakPolarHBondContact CE2-OE2 3.3Å; Y3085-E3403 PolarHBondContact OH-OE2 3.48Å; Q3397-E3403 HydrophobicContact CB-CB 4.43Å; K3398-E3403 WeakPolarHBondContact CE-OE1 3.46Å; K3398-E3403 WeakPolarHBondContact CG-OE1 3.33Å
3404R77.1Confident88.7Confident141 Ų14157.5 Ų57.553%0.53230%0.3SS..THydrogen-bonded Turntrans-127.739.3-179.4-71.3-174.3157.5-159-0.8112.3T3402 Q3406 F3416 E3420T3402-R3404 PolarHBondContact O-N 2.97Å; R3404-Q3406 PolarHBondContact O-N 3.2Å; R3404-F3416 VanDerWaalsContact NH2-CZ 3.28Å; R3404-E3420 IonicContact NH2-OE1 3.14Å
3405D75.6Confident89.1Confident165 Ų16555.5 Ų55.588%0.88230%0.295SS*.SBendtrans58-1178.2-52.4-49.5000116.7T3402T3402-D3405 PolarHBondContact O-N 3.16Å
3406Q76.9Confident89.4Confident151 Ų15156.6 Ų56.671%0.70630%0.3SS*.SBendtrans-122143.7176.3-61.7-1751.800110.4G3401 R3404 M3408G3401-Q3406 VanDerWaalsContact O-O 3.09Å; R3404-Q3406 PolarHBondContact O-N 3.2Å; Q3406-M3408 PolarHBondContact O-N 3.36Å
3407V83.4Confident89.7Confident122 Ų12253.1 Ų53.174%0.73929%0.287SS*.  trans-79.3101.3179.5-171.60000110.3T3402T3402-V3407 HydrophobicContact CG2-CB 4.41Å; T3402-V3407 HydrophobicContact CG2-CG1 4.46Å; T3402-V3407 HydrophobicContact CG2-CG2 3.94Å
3408M88.8Confident90Very high49 Ų4950.2 Ų50.224%0.24127%0.273CS..  trans-81.5137.9178.7-59.5-171.578.600112.3R3161 G3401 Q3406 A3412 Q3413 F3416R3161-M3408 PolarHBondContact NH1-O 2.91Å; R3161-M3408 PolarHBondContact NH2-O 3.28Å; G3401-M3408 PolarHBondContact O-N 3.14Å; Q3406-M3408 PolarHBondContact O-N 3.36Å; M3408-A3412 HydrophobicContact CE-CB 4.27Å; M3408-A3412 WeakPolarHBondContact CE-O 3.27Å; M3408-Q3413 HydrophobicContact CB-CB 4.11Å; M3408-F3416 HydrophobicContact CE-CB 3.92Å; M3408-F3416 HydrophobicContact CE-CG 4.3Å
3409S93.5Very high90.1Very high70 Ų7057.4 Ų57.449%0.4930%0.3SS..  trans-65.8161.5166.378.60000111S3411 A3412 Q3413S3409-S3411 PolarHBondContact O-N 2.92Å; S3409-A3412 PolarHBondContact O-N 3.14Å; S3409-A3412 VanDerWaalsContact OG-CB 3.3Å; S3409-A3412 WeakPolarHBondContact OG-CB 3.5Å; S3409-A3412 PolarHBondContact OG-N 2.83Å; S3409-Q3413 WeakPolarHBondContact O-CB 2.95Å; S3409-Q3413 PolarHBondContact O-N 3.49Å
3410V94.5Very high90.3Very high38 Ų3859.9 Ų59.923%0.2331%0.312CS..Hα-helixtrans-59.9-47.8-178.5-178.90000111.3E3154 M3157 Q3413 V3414E3154-V3410 HydrophobicContact CB-CG1 4.46Å; E3154-V3410 WeakPolarHBondContact O-CG1 3.47Å; M3157-V3410 HydrophobicContact CB-CG1 3.95Å; M3157-V3410 HydrophobicContact CG-CG1 4.16Å; V3410-Q3413 PolarHBondContact O-N 3Å; V3410-V3414 WeakPolarHBondContact O-CG2 3.42Å; V3410-V3414 PolarHBondContact O-N 3.15Å
3411S95.5Very high90.7Very high60 Ų6058.3 Ų58.342%0.4230%0.302SS..Hα-helixtrans-64.9-43.6-179.8-172.30000111.9E3154 S3409 Q3413 V3414 D3415E3154-S3411 WeakPolarHBondContact OE1-CA 3.39Å; E3154-S3411 WeakPolarHBondContact OE1-CB 3.25Å; E3154-S3411 PolarHBondContact OE1-OG 3.34Å; S3409-S3411 PolarHBondContact O-N 2.92Å; S3411-Q3413 VanDerWaalsContact C-N 3.34Å; S3411-Q3413 PolarHBondContact O-N 3.37Å; S3411-V3414 PolarHBondContact O-N 3.47Å; S3411-D3415 WeakPolarHBondContact O-CB 3.49Å; S3411-D3415 PolarHBondContact O-N 2.87Å
3412A95.1Very high91Very high43 Ų4360.3 Ų60.336%0.35531%0.314SS..Hα-helixtrans-63.6-38.7176.900000112.4M3408 S3409 F3416M3408-A3412 HydrophobicContact CE-CB 4.27Å; M3408-A3412 WeakPolarHBondContact CE-O 3.27Å; S3409-A3412 PolarHBondContact O-N 3.14Å; S3409-A3412 VanDerWaalsContact OG-CB 3.3Å; S3409-A3412 WeakPolarHBondContact OG-CB 3.5Å; S3409-A3412 PolarHBondContact OG-N 2.83Å; A3412-F3416 VanDerWaalsContact O-CB 3.25Å; A3412-F3416 WeakPolarHBondContact O-CB 3.26Å; A3412-F3416 PolarHBondContact O-N 3.21Å
3413Q95.4Very high91.5Very high3 Ų359.8 Ų59.81%0.01431%0.312CS..Hα-helixtrans-67.2-44.4176-168179.611.400111.1Y3085 M3157 K3398 M3408 S3409 V3410 S3411 F3416 L3417Y3085-Q3413 PolarHBondContact OH-NE2 3.32Å; M3157-Q3413 HydrophobicContact CE-CG 4.23Å; M3157-Q3413 VanDerWaalsContact CE-OE1 3.28Å; K3398-Q3413 PolarHBondContact O-NE2 3.23Å; M3408-Q3413 HydrophobicContact CB-CB 4.11Å; S3409-Q3413 WeakPolarHBondContact O-CB 2.95Å; S3409-Q3413 PolarHBondContact O-N 3.49Å; V3410-Q3413 PolarHBondContact O-N 3Å; S3411-Q3413 VanDerWaalsContact C-N 3.34Å; S3411-Q3413 PolarHBondContact O-N 3.37Å; Q3413-F3416 PolarHBondContact O-N 3.37Å; Q3413-L3417 HydrophobicContact CG-CD1 4.16Å; Q3413-L3417 WeakPolarHBondContact O-CB 3.41Å; Q3413-L3417 WeakPolarHBondContact O-CD1 3.37Å; Q3413-L3417 WeakPolarHBondContact O-CG 3.39Å; Q3413-L3417 PolarHBondContact O-N 3.37Å
3414V96.9Very high92.1Very high0 Ų059.2 Ų59.20%031%0.311CS..Hα-helixtrans-63.7-44.7176.8168.60000111.8M3082 C3153 E3154 M3157 V3410 S3411 L3417 I3418M3082-V3414 HydrophobicContact SD-CG2 3.89Å; C3153-V3414 HydrophobicContact CB-CG1 3.6Å; C3153-V3414 HydrophobicContact CB-CG2 4.29Å; E3154-V3414 HydrophobicContact CG-CB 4.04Å; E3154-V3414 HydrophobicContact CG-CG1 3.99Å; E3154-V3414 HydrophobicContact CG-CG2 4.07Å; M3157-V3414 HydrophobicContact CB-CG2 4.01Å; M3157-V3414 HydrophobicContact CG-CG2 4.25Å; V3410-V3414 WeakPolarHBondContact O-CG2 3.42Å; V3410-V3414 PolarHBondContact O-N 3.15Å; S3411-V3414 PolarHBondContact O-N 3.47Å; V3414-L3417 PolarHBondContact O-N 3.11Å; V3414-I3418 HydrophobicContact CG1-CD1 3.76Å; V3414-I3418 HydrophobicContact CG1-CG1 4.41Å; V3414-I3418 WeakPolarHBondContact O-CB 3.41Å; V3414-I3418 VanDerWaalsContact O-CG1 3.29Å; V3414-I3418 WeakPolarHBondContact O-CG1 3.46Å; V3414-I3418 PolarHBondContact O-N 3.03Å
3415D96.1Very high92.9Very high37 Ų3757.7 Ų57.720%0.19831%0.31CS..Hα-helixtrans-64.3-41.7178.8-171.165.6000112.5R3150 S3411 I3418 R3419R3150-D3415 IonicContact CZ-OD1 3.26Å; R3150-D3415 VanDerWaalsContact CZ-OD1 3.22Å; R3150-D3415 IonicContact NH1-OD1 3.63Å; R3150-D3415 PolarHBondContact NH1-OD1 3.19Å; R3150-D3415 IonicContact NH2-OD1 2.62Å; R3150-D3415 PolarHBondContact NH2-OD1 3.36Å; S3411-D3415 WeakPolarHBondContact O-CB 3.49Å; S3411-D3415 PolarHBondContact O-N 2.87Å; D3415-I3418 PolarHBondContact O-N 3.48Å; D3415-R3419 WeakPolarHBondContact O-CG 3.16Å; D3415-R3419 PolarHBondContact O-N 2.93Å; D3415-R3419 IonicContact OD2-CZ 3.36Å; D3415-R3419 IonicContact OD2-NE 2.67Å; D3415-R3419 PolarHBondContact OD2-NE 3.3Å; D3415-R3419 IonicContact OD2-NH2 2.82Å; D3415-R3419 PolarHBondContact OD2-NH2 3.27Å
3416F95.4Very high93.8Very high27 Ų2750.8 Ų50.812%0.11827%0.273CS..Hα-helixtrans-57.9-49.8171.9165.5-106.2000112R3404 M3408 A3412 Q3413 I3418 R3419 E3420R3404-F3416 VanDerWaalsContact NH2-CZ 3.28Å; M3408-F3416 HydrophobicContact CE-CB 3.92Å; M3408-F3416 HydrophobicContact CE-CG 4.3Å; A3412-F3416 VanDerWaalsContact O-CB 3.25Å; A3412-F3416 WeakPolarHBondContact O-CB 3.26Å; A3412-F3416 PolarHBondContact O-N 3.21Å; Q3413-F3416 PolarHBondContact O-N 3.37Å; F3416-I3418 VanDerWaalsContact C-N 3.31Å; F3416-I3418 PolarHBondContact O-N 3.37Å; F3416-R3419 PolarHBondContact O-N 3.24Å; F3416-R3419 VanDerWaalsContact O-N 3.17Å; F3416-E3420 HydrophobicContact CD2-CG 4.07Å; F3416-E3420 HydrophobicContact CE1-CG 4.21Å; F3416-E3420 HydrophobicContact CE2-CG 3.37Å; F3416-E3420 WeakPolarHBondContact CE2-OE1 3.4Å; F3416-E3420 HydrophobicContact CZ-CG 3.43Å; F3416-E3420 VanDerWaalsContact CZ-CG 3.43Å; F3416-E3420 PolarHBondContact O-N 2.92Å
3417L96.6Very high94.6Very high3 Ų344 Ų442%0.01624%0.241CC..Hα-helixtrans-63.8-36.2-179.8-68.3166.5000112.7M3082 Y3085 P3129 F3130 Q3413 V3414 A3421M3082-L3417 HydrophobicContact CE-CD1 4.45Å; Y3085-L3417 HydrophobicContact CD1-CD1 3.56Å; Y3085-L3417 HydrophobicContact CD1-CD2 4.27Å; Y3085-L3417 HydrophobicContact CD2-CD1 4.42Å; Y3085-L3417 HydrophobicContact CD2-CD2 3.62Å; Y3085-L3417 HydrophobicContact CE1-CD1 3.46Å; Y3085-L3417 VanDerWaalsContact CE1-CD1 3.46Å; Y3085-L3417 HydrophobicContact CE1-CD2 4.09Å; Y3085-L3417 HydrophobicContact CE1-CG 4.39Å; Y3085-L3417 HydrophobicContact CE2-CD1 4.35Å; Y3085-L3417 HydrophobicContact CE2-CD2 3.42Å; Y3085-L3417 VanDerWaalsContact CE2-CD2 3.42Å; Y3085-L3417 HydrophobicContact CG-CD1 4.03Å; Y3085-L3417 HydrophobicContact CG-CD2 4.03Å; P3129-L3417 HydrophobicContact CB-CD2 3.72Å; P3129-L3417 HydrophobicContact CG-CB 4.32Å; P3129-L3417 HydrophobicContact CG-CD2 3.91Å; P3129-L3417 WeakPolarHBondContact CG-O 3.44Å; F3130-L3417 HydrophobicContact CE1-CB 3.96Å; F3130-L3417 HydrophobicContact CZ-CB 4.17Å; Q3413-L3417 HydrophobicContact CG-CD1 4.16Å; Q3413-L3417 WeakPolarHBondContact O-CB 3.41Å; Q3413-L3417 WeakPolarHBondContact O-CD1 3.37Å; Q3413-L3417 WeakPolarHBondContact O-CG 3.39Å; Q3413-L3417 PolarHBondContact O-N 3.37Å; V3414-L3417 PolarHBondContact O-N 3.11Å; L3417-A3421 VanDerWaalsContact O-CB 3.24Å; L3417-A3421 WeakPolarHBondContact O-CB 3.46Å; L3417-A3421 PolarHBondContact O-N 3.32Å
3418I97.1Very high95Very high3 Ų338.3 Ų38.32%0.01521%0.207CC..Hα-helixtrans-63.9-45.9173.5-73.7172.7000110.5L3132 I3145 Y3149 R3150 V3414 D3415 F3416 A3421 T3422L3132-I3418 HydrophobicContact CD2-CG2 4.38Å; I3145-I3418 HydrophobicContact CD1-CG2 3.65Å; I3145-I3418 HydrophobicContact CG1-CG2 4.48Å; Y3149-I3418 HydrophobicContact CD1-CD1 4.34Å; Y3149-I3418 HydrophobicContact CE1-CD1 4.18Å; Y3149-I3418 HydrophobicContact CE1-CG1 4.21Å; R3150-I3418 HydrophobicContact CB-CD1 4.45Å; V3414-I3418 HydrophobicContact CG1-CD1 3.76Å; V3414-I3418 HydrophobicContact CG1-CG1 4.41Å; V3414-I3418 WeakPolarHBondContact O-CB 3.41Å; V3414-I3418 VanDerWaalsContact O-CG1 3.29Å; V3414-I3418 WeakPolarHBondContact O-CG1 3.46Å; V3414-I3418 PolarHBondContact O-N 3.03Å; D3415-I3418 PolarHBondContact O-N 3.48Å; F3416-I3418 VanDerWaalsContact C-N 3.31Å; F3416-I3418 PolarHBondContact O-N 3.37Å; I3418-A3421 PolarHBondContact O-N 3.13Å; I3418-T3422 WeakPolarHBondContact O-CB 3.41Å; I3418-T3422 WeakPolarHBondContact O-CG2 3.41Å; I3418-T3422 PolarHBondContact O-N 3.38Å; I3418-T3422 PolarHBondContact O-OG1 3.43Å
3419R96.2Very high95.1Very high155 Ų15538.6 Ų38.659%0.58521%0.208SC*.Hα-helixtrans-61.1-44.2177.6-76.3-171.7-95.5147.5-13112.4D3415 F3416 T3422 S3423D3415-R3419 WeakPolarHBondContact O-CG 3.16Å; D3415-R3419 PolarHBondContact O-N 2.93Å; D3415-R3419 IonicContact OD2-CZ 3.36Å; D3415-R3419 IonicContact OD2-NE 2.67Å; D3415-R3419 PolarHBondContact OD2-NE 3.3Å; D3415-R3419 IonicContact OD2-NH2 2.82Å; D3415-R3419 PolarHBondContact OD2-NH2 3.27Å; F3416-R3419 PolarHBondContact O-N 3.24Å; F3416-R3419 VanDerWaalsContact O-N 3.17Å; R3419-T3422 PolarHBondContact O-N 3.46Å; R3419-T3422 PolarHBondContact O-OG1 2.74Å; R3419-S3423 WeakPolarHBondContact O-CB 3.41Å; R3419-S3423 PolarHBondContact O-N 3.02Å; R3419-S3423 VanDerWaalsContact O-N 3.11Å
3420E95.9Very high94.9Very high54 Ų5435.6 Ų35.625%0.25219%0.186SC..Hα-helixtrans-66.1-38.5176.3-66.1-66164.800112.7P3129 R3404 F3416 T3422 N3426P3129-E3420 HydrophobicContact CG-CB 4.28Å; R3404-E3420 IonicContact NH2-OE1 3.14Å; F3416-E3420 HydrophobicContact CD2-CG 4.07Å; F3416-E3420 HydrophobicContact CE1-CG 4.21Å; F3416-E3420 HydrophobicContact CE2-CG 3.37Å; F3416-E3420 WeakPolarHBondContact CE2-OE1 3.4Å; F3416-E3420 HydrophobicContact CZ-CG 3.43Å; F3416-E3420 VanDerWaalsContact CZ-CG 3.43Å; F3416-E3420 PolarHBondContact O-N 2.92Å; E3420-T3422 VanDerWaalsContact C-N 3.34Å; E3420-T3422 PolarHBondContact O-N 3.31Å; E3420-N3426 PolarHBondContact O-ND2 2.9Å; E3420-N3426 PolarHBondContact OE2-ND2 3.26Å
3421A96.5Very high94.3Very high0 Ų038.5 Ų38.50%019%0.194CC..Hα-helixtrans-72.4-23.6179.900000114.3P3129 F3130 L3132 L3417 I3418P3129-A3421 HydrophobicContact CG-CB 4.06Å; F3130-A3421 HydrophobicContact CD2-CB 3.68Å; F3130-A3421 HydrophobicContact CE2-CB 3.35Å; F3130-A3421 HydrophobicContact CG-CB 4.49Å; F3130-A3421 HydrophobicContact CZ-CB 3.94Å; F3130-A3421 WeakPolarHBondContact O-CB 3.14Å; L3132-A3421 HydrophobicContact CB-CB 3.86Å; L3417-A3421 VanDerWaalsContact O-CB 3.24Å; L3417-A3421 WeakPolarHBondContact O-CB 3.46Å; L3417-A3421 PolarHBondContact O-N 3.32Å; I3418-A3421 PolarHBondContact O-N 3.13Å
3422T95.8Very high93.5Very high43 Ų4336.8 Ų36.826%0.26418%0.18SC..Hα-helixtrans-99.9-5.1178.454.10000113.7L3132 I3137 I3418 R3419 E3420 N3424L3132-T3422 HydrophobicContact CB-CG2 4.36Å; L3132-T3422 HydrophobicContact CD2-CG2 3.86Å; L3132-T3422 HydrophobicContact CG-CG2 3.94Å; I3137-T3422 HydrophobicContact CD1-CG2 3.84Å; I3418-T3422 WeakPolarHBondContact O-CB 3.41Å; I3418-T3422 WeakPolarHBondContact O-CG2 3.41Å; I3418-T3422 PolarHBondContact O-N 3.38Å; I3418-T3422 PolarHBondContact O-OG1 3.43Å; R3419-T3422 PolarHBondContact O-N 3.46Å; R3419-T3422 PolarHBondContact O-OG1 2.74Å; E3420-T3422 VanDerWaalsContact C-N 3.34Å; E3420-T3422 PolarHBondContact O-N 3.31Å; T3422-N3424 PolarHBondContact O-N 2.9Å
3423S96.2Very high92.7Very high31 Ų3136.7 Ų36.722%0.21718%0.183CC..  trans-66.3118.7-178.2174.20000112.2R3419 Q3425 N3426 L3427R3419-S3423 WeakPolarHBondContact O-CB 3.41Å; R3419-S3423 PolarHBondContact O-N 3.02Å; R3419-S3423 VanDerWaalsContact O-N 3.11Å; S3423-Q3425 PolarHBondContact O-N 3.36Å; S3423-Q3425 PolarHBondContact OG-N 3.34Å; S3423-N3426 PolarHBondContact O-N 2.8Å; S3423-N3426 PolarHBondContact OG-N 3.08Å; S3423-L3427 WeakPolarHBondContact O-CG 3.03Å; S3423-L3427 PolarHBondContact O-N 2.95Å
3424N94.5Very high91.9Very high48 Ų4838.1 Ų38.126%0.25719%0.188SC..Hα-helixtrans-56.7-34.5173.2-72.2-19.4000112T3037 F3040 E3041 T3422 N3426 L3427 C3428T3037-N3424 HydrophobicContact CG2-CB 4.04Å; F3040-N3424 HydrophobicContact CD1-CB 4.36Å; E3041-N3424 HydrophobicContact CG-CB 4.37Å; E3041-N3424 WeakPolarHBondContact CG-ND2 3.43Å; E3041-N3424 PolarHBondContact OE1-ND2 3.18Å; T3422-N3424 PolarHBondContact O-N 2.9Å; N3424-N3426 VanDerWaalsContact C-N 3.31Å; N3424-N3426 PolarHBondContact O-N 3.16Å; N3424-L3427 PolarHBondContact O-N 3.09Å; N3424-C3428 VanDerWaalsContact O-CB 3.27Å; N3424-C3428 WeakPolarHBondContact O-CB 3.15Å; N3424-C3428 PolarHBondContact O-N 3.21Å; N3424-C3428 PolarHBondContact O-SG 2.92Å; N3424-C3428 VanDerWaalsContact O-SG 3.36Å
3425Q94.7Very high91.4Very high110 Ų11039.1 Ų39.151%0.51420%0.195SC..Hα-helixtrans-66.5-30177.2-62.4-177-7.100112.8V3033 T3037 S3423 C3428 Q3429V3033-Q3425 HydrophobicContact CG1-CB 4.22Å; T3037-Q3425 HydrophobicContact CG2-CG 4.04Å; S3423-Q3425 PolarHBondContact O-N 3.36Å; S3423-Q3425 PolarHBondContact OG-N 3.34Å; Q3425-C3428 PolarHBondContact O-SG 3.04Å; Q3425-C3428 VanDerWaalsContact O-SG 3.37Å; Q3425-Q3429 WeakPolarHBondContact O-CG 3.49Å; Q3425-Q3429 PolarHBondContact O-NE2 3.09Å
3426N94.4Very high90.6Very high19 Ų1937.6 Ų37.610%0.10219%0.187CC..Hα-helixtrans-83.3-41.8174.9-68-18.9000111.1K3127 V3128 E3420 S3423 N3424 Q3429K3127-N3426 HydrophobicContact CB-CB 3.91Å; K3127-N3426 PolarHBondContact O-ND2 3.02Å; V3128-N3426 HydrophobicContact CG1-CB 3.76Å; E3420-N3426 PolarHBondContact O-ND2 2.9Å; E3420-N3426 PolarHBondContact OE2-ND2 3.26Å; S3423-N3426 PolarHBondContact O-N 2.8Å; S3423-N3426 PolarHBondContact OG-N 3.08Å; N3424-N3426 VanDerWaalsContact C-N 3.31Å; N3424-N3426 PolarHBondContact O-N 3.16Å; N3426-Q3429 PolarHBondContact O-N 3.43Å
3427L93.6Very high90.2Very high8 Ų836.4 Ų36.44%0.04218%0.182CC..Hα-helixtrans-65.7-36.9179.7-69.3170.8000112.4F3040 V3128 T3133 S3423 N3424 Q3429 M3430 A3436F3040-L3427 HydrophobicContact CE1-CB 3.78Å; F3040-L3427 HydrophobicContact CZ-CB 3.8Å; V3128-L3427 HydrophobicContact CG1-CD2 3.92Å; V3128-L3427 HydrophobicContact CG1-CG 4.33Å; T3133-L3427 HydrophobicContact CG2-CD1 4.34Å; T3133-L3427 HydrophobicContact CG2-CD2 3.72Å; S3423-L3427 WeakPolarHBondContact O-CG 3.03Å; S3423-L3427 PolarHBondContact O-N 2.95Å; N3424-L3427 PolarHBondContact O-N 3.09Å; L3427-Q3429 PolarHBondContact O-N 2.96Å; L3427-M3430 HydrophobicContact CD2-SD 3.93Å; L3427-M3430 WeakPolarHBondContact O-CB 3.14Å; L3427-M3430 PolarHBondContact O-N 3.05Å; L3427-A3436 WeakPolarHBondContact O-CB 3.43Å
3428C92.2Very high89.7Confident3 Ų336.7 Ų36.72%0.0218%0.183CC..THydrogen-bonded Turntrans-72.1-9.7177.278.70000114.2K3036 T3037 F3040 N3424 Q3425K3036-C3428 HydrophobicContact CB-CB 4.1Å; T3037-C3428 PolarHBondContact OG1-SG 3.42Å; F3040-C3428 HydrophobicContact CB-CB 3.59Å; F3040-C3428 HydrophobicContact CD1-CB 3.99Å; F3040-C3428 HydrophobicContact CD2-CB 4.31Å; F3040-C3428 HydrophobicContact CG-CB 3.73Å; N3424-C3428 VanDerWaalsContact O-CB 3.27Å; N3424-C3428 WeakPolarHBondContact O-CB 3.15Å; N3424-C3428 PolarHBondContact O-N 3.21Å; N3424-C3428 PolarHBondContact O-SG 2.92Å; N3424-C3428 VanDerWaalsContact O-SG 3.36Å; Q3425-C3428 PolarHBondContact O-SG 3.04Å; Q3425-C3428 VanDerWaalsContact O-SG 3.37Å
3429Q91.3Very high89.3Confident55 Ų5538.4 Ų38.426%0.25719%0.191SC..THydrogen-bonded Turntrans-91.5-13.7173.8-71178.376.300113V3033 K3127 Q3425 N3426 L3427V3033-Q3429 HydrophobicContact CG1-CG 4.39Å; V3033-Q3429 HydrophobicContact CG2-CG 4.22Å; K3127-Q3429 HydrophobicContact CG-CB 4.22Å; Q3425-Q3429 WeakPolarHBondContact O-CG 3.49Å; Q3425-Q3429 PolarHBondContact O-NE2 3.09Å; N3426-Q3429 PolarHBondContact O-N 3.43Å; L3427-Q3429 PolarHBondContact O-N 2.96Å
3430M87.9Confident89Confident7 Ų732.2 Ų32.23%0.03417%0.171CC..SBendtrans-65.4150.7173.4-63.6-170.682.500110.9E3126 V3128 L3427 I3432 W3434 A3436E3126-M3430 HydrophobicContact CG-CE 4.18Å; V3128-M3430 HydrophobicContact CG2-CE 4.13Å; V3128-M3430 HydrophobicContact CG2-SD 3.97Å; L3427-M3430 HydrophobicContact CD2-SD 3.93Å; L3427-M3430 WeakPolarHBondContact O-CB 3.14Å; L3427-M3430 PolarHBondContact O-N 3.05Å; M3430-I3432 PolarHBondContact O-N 3.41Å; M3430-W3434 HydrophobicContact CB-CE3 4.1Å; M3430-W3434 HydrophobicContact CE-CE3 3.96Å; M3430-W3434 HydrophobicContact CE-CZ3 4.3Å; M3430-A3436 HydrophobicContact CB-CB 4.09Å; M3430-A3436 HydrophobicContact SD-CB 4.22Å
3431Y82Confident88.6Confident99 Ų9931 Ų3139%0.38817%0.166SC..  trans-58.2128175.8174.5-120.2000111.3F3124 G3433 W3434F3124-Y3431 HydrophobicContact CD1-CD2 4.23Å; F3124-Y3431 AromaticContact CD2-CD2 3.98Å; F3124-Y3431 HydrophobicContact CD2-CD2 3.98Å; F3124-Y3431 HydrophobicContact CD2-CG 4.44Å; F3124-Y3431 HydrophobicContact CE1-CD2 4.07Å; F3124-Y3431 AromaticContact CE2-CD2 3.81Å; F3124-Y3431 HydrophobicContact CE2-CD2 3.81Å; F3124-Y3431 HydrophobicContact CE2-CE2 4.33Å; F3124-Y3431 HydrophobicContact CG-CD2 4.19Å; F3124-Y3431 HydrophobicContact CG-CG 4.46Å; F3124-Y3431 AromaticContact CZ-CD2 3.85Å; F3124-Y3431 HydrophobicContact CZ-CD2 3.85Å; F3124-Y3431 HydrophobicContact CZ-CE2 4.38Å; Y3431-G3433 PolarHBondContact O-N 3.28Å; Y3431-G3433 VanDerWaalsContact O-N 3.13Å; Y3431-W3434 HydrophobicContact CD1-CD2 4.38Å; Y3431-W3434 HydrophobicContact CD1-CG 4.23Å; Y3431-W3434 WeakPolarHBondContact O-CB 3.21Å; Y3431-W3434 PolarHBondContact O-N 2.87Å
3432I79Confident88.1Confident24 Ų2432.8 Ų32.812%0.12318%0.176CC..G310 helixtrans-60-30.3-171.2-162.6165.8000113.3N3018 M3021 F3028 M3430 W3434 C3435N3018-I3432 WeakPolarHBondContact OD1-CD1 3.35Å; M3021-I3432 HydrophobicContact CE-CD1 3.75Å; M3021-I3432 HydrophobicContact CE-CG1 4.33Å; M3021-I3432 HydrophobicContact SD-CD1 4.31Å; F3028-I3432 HydrophobicContact CD1-CD1 4.14Å; F3028-I3432 HydrophobicContact CE1-CD1 4.48Å; M3430-I3432 PolarHBondContact O-N 3.41Å; I3432-W3434 VanDerWaalsContact C-N 3.26Å; I3432-W3434 PolarHBondContact O-N 2.8Å; I3432-C3435 PolarHBondContact O-N 3.46Å; I3432-C3435 VanDerWaalsContact O-N 3.11Å
3433G78Confident87.6Confident41 Ų4132.2 Ų32.242%0.42317%0.17SC..G310 helixtrans-67-20.3174.900000114.6Y3431 C3435Y3431-G3433 PolarHBondContact O-N 3.28Å; Y3431-G3433 VanDerWaalsContact O-N 3.13Å; G3433-C3435 PolarHBondContact O-N 2.92Å
3434W78.4Confident87.1Confident33 Ų3332.3 Ų32.313%0.12517%0.167CC..G310 helixtrans-75.81.5171.6-65.8-34.1000113.4D3091 H3093 P3094 E3126 R3131 M3430 Y3431 I3432D3091-W3434 WeakPolarHBondContact OD1-CZ2 3.48Å; D3091-W3434 PolarHBondContact OD1-NE1 3.01Å; H3093-W3434 HydrophobicContact CB-CB 3.89Å; H3093-W3434 VanDerWaalsContact CB-CD1 3.5Å; H3093-W3434 HydrophobicContact CB-CG 3.85Å; H3093-W3434 AromaticContact CD2-CD1 3.94Å; H3093-W3434 AromaticContact CD2-NE1 3.97Å; H3093-W3434 AromaticContact CG-CD1 3.86Å; P3094-W3434 WeakPolarHBondContact CD-O 3.35Å; E3126-W3434 HydrophobicContact CG-CH2 3.93Å; E3126-W3434 HydrophobicContact CG-CZ3 3.61Å; E3126-W3434 WeakPolarHBondContact OE1-CH2 3.41Å; R3131-W3434 PolarHBondContact NH2-O 2.7Å; M3430-W3434 HydrophobicContact CB-CE3 4.1Å; M3430-W3434 HydrophobicContact CE-CE3 3.96Å; M3430-W3434 HydrophobicContact CE-CZ3 4.3Å; Y3431-W3434 HydrophobicContact CD1-CD2 4.38Å; Y3431-W3434 HydrophobicContact CD1-CG 4.23Å; Y3431-W3434 WeakPolarHBondContact O-CB 3.21Å; Y3431-W3434 PolarHBondContact O-N 2.87Å; I3432-W3434 VanDerWaalsContact C-N 3.26Å; I3432-W3434 PolarHBondContact O-N 2.8Å
3435C87.3Confident86.5Confident21 Ų2131.1 Ų31.114%0.14216%0.161CC..  trans52.560.8177.3-55.10000112.1R3131 I3432 G3433 F3437 W3438R3131-C3435 PolarHBondContact NH1-O 3.28Å; I3432-C3435 PolarHBondContact O-N 3.46Å; I3432-C3435 VanDerWaalsContact O-N 3.11Å; G3433-C3435 PolarHBondContact O-N 2.92Å; C3435-F3437 HydrophobicContact CB-CE1 4.41Å; C3435-F3437 HydrophobicContact CB-CE2 4.04Å; C3435-F3437 HydrophobicContact CB-CZ 3.9Å; C3435-F3437 PolarHBondContact O-N 3.18Å; C3435-F3437 VanDerWaalsContact O-N 3.16Å; C3435-W3438 HydrophobicContact CB-CB 4.33Å; C3435-W3438 HydrophobicContact CB-CD2 3.67Å; C3435-W3438 HydrophobicContact CB-CE3 3.86Å; C3435-W3438 HydrophobicContact CB-CG 3.91Å; C3435-W3438 HydrophobicContact CB-CZ3 4.4Å; C3435-W3438 WeakPolarHBondContact O-CB 3.41Å; C3435-W3438 PolarHBondContact O-N 2.75Å
3436A79.8Confident85.9Confident5 Ų525.1 Ų25.14%0.04113%0.134CC..THydrogen-bonded Turntrans-63.8-15.7179.600000113.7F3040 T3133 L3427 M3430 W3438F3040-A3436 HydrophobicContact CE2-CB 3.94Å; F3040-A3436 HydrophobicContact CZ-CB 4.13Å; T3133-A3436 VanDerWaalsContact CG2-O 3.24Å; T3133-A3436 WeakPolarHBondContact CG2-O 3.29Å; L3427-A3436 WeakPolarHBondContact O-CB 3.43Å; M3430-A3436 HydrophobicContact CB-CB 4.09Å; M3430-A3436 HydrophobicContact SD-CB 4.22Å; A3436-W3438 VanDerWaalsContact C-N 3.31Å
3437F86.2Confident85.2Confident2 Ų225.6 Ų25.61%0.00914%0.137CC..THydrogen-bonded Turntrans-79.9-4.8173.346.5-93.4000114.4E3017 N3018 M3021 F3040 L3044 R3134 C3435E3017-F3437 HydrophobicContact CB-CB 4.22Å; E3017-F3437 HydrophobicContact CB-CD1 4.26Å; E3017-F3437 HydrophobicContact CB-CD2 3.54Å; E3017-F3437 HydrophobicContact CB-CE2 3.95Å; E3017-F3437 HydrophobicContact CB-CG 3.74Å; E3017-F3437 HydrophobicContact CB-CZ 4.48Å; E3017-F3437 HydrophobicContact CG-CB 4.33Å; E3017-F3437 HydrophobicContact CG-CD2 3.79Å; E3017-F3437 HydrophobicContact CG-CE2 4.45Å; E3017-F3437 HydrophobicContact CG-CG 4.2Å; N3018-F3437 HydrophobicContact CB-CE1 4.01Å; N3018-F3437 HydrophobicContact CB-CZ 3.84Å; M3021-F3437 HydrophobicContact SD-CD1 4.24Å; F3040-F3437 HydrophobicContact CE2-CB 4.14Å; F3040-F3437 HydrophobicContact CE2-CD1 4.47Å; L3044-F3437 HydrophobicContact CD2-CB 3.59Å; R3134-F3437 PolarHBondContact NE-O 3.25Å; C3435-F3437 HydrophobicContact CB-CE1 4.41Å; C3435-F3437 HydrophobicContact CB-CE2 4.04Å; C3435-F3437 HydrophobicContact CB-CZ 3.9Å; C3435-F3437 PolarHBondContact O-N 3.18Å; C3435-F3437 VanDerWaalsContact O-N 3.16Å
3438W86.5Confident84.4Confident9 Ų927.2 Ų27.23%0.03415%0.145CC..  trans-96.30171.5-64.9-3.3000111.1H3000 I3003 L3014 P3094 R3131 T3133 M3135 C3435 A3436H3000-W3438 HydrophobicContact CB-CZ3 4.31Å; H3000-W3438 AromaticContact ND1-CH2 3.86Å; H3000-W3438 AromaticContact ND1-CZ3 3.57Å; I3003-W3438 HydrophobicContact CB-CE3 4.39Å; I3003-W3438 HydrophobicContact CB-CZ3 4.37Å; I3003-W3438 HydrophobicContact CD1-CB 4.06Å; I3003-W3438 HydrophobicContact CD1-CD2 3.82Å; I3003-W3438 HydrophobicContact CD1-CE3 3.6Å; I3003-W3438 HydrophobicContact CD1-CG 4.03Å; I3003-W3438 HydrophobicContact CD1-CZ3 4.35Å; I3003-W3438 HydrophobicContact CG2-CD2 4.06Å; I3003-W3438 HydrophobicContact CG2-CE3 4.22Å; I3003-W3438 HydrophobicContact CG2-CH2 4.13Å; I3003-W3438 HydrophobicContact CG2-CZ2 3.93Å; I3003-W3438 HydrophobicContact CG2-CZ3 4.26Å; L3014-W3438 HydrophobicContact CD1-CH2 3.83Å; L3014-W3438 HydrophobicContact CD1-CZ2 3.91Å; L3014-W3438 HydrophobicContact CG-CH2 4.38Å; L3014-W3438 HydrophobicContact CG-CZ2 4.38Å; P3094-W3438 HydrophobicContact CB-CE3 3.98Å; P3094-W3438 HydrophobicContact CB-CZ3 4.44Å; P3094-W3438 HydrophobicContact CG-CB 4.43Å; P3094-W3438 HydrophobicContact CG-CE3 3.87Å; R3131-W3438 PolarHBondContact NH1-O 3Å; T3133-W3438 VanDerWaalsContact CB-C 3.45Å; T3133-W3438 WeakPolarHBondContact CB-O 3.48Å; T3133-W3438 WeakPolarHBondContact CB-OXT 3.28Å; T3133-W3438 PolarHBondContact OG1-O 3.22Å; T3133-W3438 PolarHBondContact OG1-OXT 3.23Å; M3135-W3438 WeakPolarHBondContact CB-OXT 3.38Å; M3135-W3438 HydrophobicContact CE-CB 4.38Å; M3135-W3438 HydrophobicContact CE-CG 4.04Å; M3135-W3438 VanDerWaalsContact CG-OXT 3.28Å; M3135-W3438 WeakPolarHBondContact CG-OXT 3.31Å; M3135-W3438 PolarHBondContact N-OXT 2.96Å; M3135-W3438 HydrophobicContact SD-CB 3.93Å; M3135-W3438 HydrophobicContact SD-CG 4.02Å; C3435-W3438 HydrophobicContact CB-CB 4.33Å; C3435-W3438 HydrophobicContact CB-CD2 3.67Å; C3435-W3438 HydrophobicContact CB-CE3 3.86Å; C3435-W3438 HydrophobicContact CB-CG 3.91Å; C3435-W3438 HydrophobicContact CB-CZ3 4.4Å; C3435-W3438 WeakPolarHBondContact O-CB 3.41Å; C3435-W3438 PolarHBondContact O-N 2.75Å; A3436-W3438 VanDerWaalsContact C-N 3.31Å

Retrieved 3,438 of 3,438 residues in 2724.5 ms (Link to these results)

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