A0A3Q0KPM9_SCHMA Loading...

RanBP2-type domain-containing protein AlphaSync Fragmented

AlphaFold DB , UniProt , Accession A0A3Q0KPM9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 3,710 aa.

>A0A3Q0KPM9_SCHMA|A0A3Q0KPM9
MTNIKSHAYTTKLKALNEACYKLVNNASNLPSSNDITSLLKFFQNSLYNILKDIQVLSIERFVNRINDQDWRSKHLPQLDYGTLYLCLLTISEHIQKLTNQSAVCEHLLRTIQSLIFCLDYDCLEGAPLAITWMLLYFPSNMQSSVIDLLCSVVIPLIYNMSDDQESYAIDCIPSILTLVFQHVEKVEYHVWVLESFMSKKKDLYKDLLMIIAYGPTEARLPAVCLFFHYWPENYPTAFYGNQALQPIHYTWESWKPIMCYRNDCPNKTGKALAMKMTVNPKISIQQSGKPPPLYVCLDCADALNRLDFDQLIDILLPTKQISLTCESKTCRSKNNSASVTCWSTGCTYLTGNRAIRLCELCHSLRHIYPDINQPSADRNKKQMDTNLTQNTSDTTTLFEVTNSTRINNDNNDEDDHSTTHIYQSSLPDVWDMSIDSQPYMIQAIISLTLETMPRWRQVLLGGVENGDESTNRIVAGLTCPSSSAPGGPTTTNEMVMIGLSGGSLISSNLSGNLMNSTNVVQVGGSTTGQISFSDFGTNPITGTATRNQTTSGSCVGNSGIAGINDFANNTGTETGAITLLGRYRDEDHRVLAIYGAFLVGEKCRPRERINLELLTRITAGIFNWFMDTIYTAEASITFDGRGNLRRRYELGDLLERIKSEYILKWIQEVHRLHPEAIYAVLLPHPLNYARVGSCWDAISDHLSRVKHGLSRIGSLIPYDIITFETWDFVMPYWLESIRTEVSRSDYPELEILLKKIFDATAGPFPFLPQKVYHFASERFINTPVSVQDQALSWLEILTIVEVPIPMKELLTMFAAGVASLFLELLLPTNDESDNDYLTDQDEYDDSLGQNTASEADWLNENGILSENVVPEDRLRDEESDIFLEDSRVDEDDENVDRNPAPIDNQFLSDENEYMVEGGEDDDTTLDETKSLLSYSADDKNTSKPFTSNTSRKANKQYPTKQITMTESYIHPNDSFSVTHDSNLKNQNLLLSNVKTDESFQNKSINQQNSTDENDAQQLTQEPENKDTRELTTDQEIKKKNSSQINQYRITACLTHMLDIAYRQLKILDPIGHSGYTQETPQLLLWLLGDMLELYWGNVTETADQTSSSGLRNLHCLGLETCILPKPKNKLSDMEPAISTTSAPMTEDHDENNINQIDINKQTDDVSECIDCLDMLTWFNYARLICQHLAPIRPTPKVTVDFTVDALKGVVDFPEYTDWSDSGDNETSENKSLAPGPDTTEISEKLPSSEDLCSIPPVLRLIYLLTRFVKEGTRRYVECENLNGEPDSLFRDTTPMTIPDENPTSCSPISSVNKTVIELKTFRDPVVLQCILECLAYLCHTGDALRQILTKAEKEEQKLSTTGSSSSTSISTNTVMAGGVTTSGVANIMSTTTTGPLGISSLIGLTGSKIASQMTIQDPSTKGQLIQNTKTLTSRNCTATPRAQKNFVYYLIHSHLIPSLWSLLKSELSYLASWTVPLVLHCLSFPGGFNVFWKLIEHDFSHCDWRIRFNAIEKVSVLLRELDYCILASGFSGSAGNKLNHLLSGGSMASSGAINLFSRLTGIAHMGRSKFNPGRKNLPSGHGMKQHGATNTEPINKATAHSCNNRHPLIQSAVAHAFCCLIGSLDDPDSTVAQYTSMQIASLNNISLACAIQCLEFQFDTVISDRCLILQRMHQLSCNLPNREIFTWDFFVNRFGILAIQAQLGNSPGQVDIDSVTDLNGSHRNGEHFQNQFERAAFAIHKSSGIKSISLHSHAYSLRFSTHTVGSLTQTQQSQLQINQQSLMFNSGSTTQIREECKNEDDGKRKPSIHIGSDSGMVDGVQRPHFRFSHGGRRSRPSISSVCGLLTGGLHASEFVDSNNKFLSSIQQALDLDGNERDTLHQWVRLLLKFMSTVQLDLKLDESCTGGTSGASSGGDGGVGSGIGSSSGGSVGSGRHNMPSKSRDELKDRKALSKAQRHLAFLLGYTDGSFDIPPHKMRNSTVFHAFLAHVAGVLDRNFSMGCCILHQTLVVLQFCASPQRYATDTQPPTFTLRLLEPHVRLHWLQTLLVILYKYEYNTPGGNHTGNTNISSATSYSSSIVAPHISNPSNSTTGGGGTFTSNANSNSISRTHKTSSESEAQLQLDNATGNSSGVGSNSNRLNPGGGNVSISGGGGSNATNTSASYQFAPSSLLGGGGGNTNLLSSPSNAIGGTRGMIEYLIQIVLNTLDSHVHVCRDRPNEDLIAPFNSQLRLREASNVSADFNTILETVTPPATPIQEEYDDDDENTVIMPGVTINLLPSCNELDEKSNSDLNTLSQPQQQRTTDNTADDVICMAKKYDNEKITFTEKQTDVQSGNKVTIAEGDDDLGKSKKHSEENSKSFDLLSGSSLSHRNVGCKKVITPKSVISMNKHMPQRHQPNDQSSLNNSFISLKTKLDDEKNENKPSTASIDPYTVTQDEQSIVTPLLTDTESTVARETTPESMKIQTCEEQLRRGSTDCKSPKRVTLKFSKRGSAFVFQDEKKPKPIRADSSSHVQQAQPLDSLSDSVNQIHKSKRANFQQSKPSMPIISTSSHPLESKDELLSQNITFNKDSSSINSLTVDRSRSIAEGYNLFEGIKPDTKSETTKKHSYIPSSSYATNATATTFLNTTNTNVQSHISSPNTVPSLTAAANTMALTTERCPWCQCILDHYDENTIGLGILCLSTFVHREPGLAAPYLRDMLLITARLANAYFYSWQPELPHVISPGNVASIAHQFLRCTMYNLAPNGLFTQLFQTHITDDNFFRTIISVLVDFEDHMSIFQPISLLMESLNKQKSISLDTLPILLENLANYLEHLPNLTDDSKLNHFIASGWTDIIGPLDLFLRKLATVTPIPINLATTVRIMTYVLRSPAASNFKTLPDTFSNLLRIIVENVHFRLTSVIELCSLSNRVLKDRTKAQLSRTMVDLFYQSIKFRACIPDENLIKLLQFILMDAGGTIEPNQVVEGLTTLFNPQTYHLFPTGAAELMRPHLPDCLAFISDIHTVNKIKQSQKSAVQLNSVGYGLGSSSMMSGSNPCGTGNLDSNTLTGGGGATSGNIGSSLFGGGFNSSGVSNSATGATGVNSNVGLGTNIPSLHEDVLGAHLKSGLSQYVSLELSRSNSGSDHDVLPLLAPGLLADVKTTRNGKNLAPGLPARSKAVTTAPSSNVTSMGLTGKSLNLLSESGHTANVEQSNAQIKLSKNSGSVVRRNEPHSDTANTAITQPSVNPSPSCKSSETNYTRSTIPITQTSSTKKQEATNTKLISSAIPIPSPAISHDQISSTNVTTSTTTTSVSNLTSPNFVSSTSTTPQTISSPSSANSRHPNYAHVMLASTFSHTAHSEAIILQYLPWLKSTPPSSQLGPKDFLIMVERVRTLSWLLLGATMNMALTREATGLSCRPIPLNLVPSVADLVKALLSGFPDQQKQSVTVMSSLYHVFLLCQVWTIYCETVASLSPVNSNQYKAAMATAFDFWIRIMPTILRLLSISEDFVIVSGRLLTVIEELMECQSSLASKLFTLWMPLLHGRQKQLPGNMLKRLQKCVEWEPPEPYNRLLLLLSLPDPLTNSRLPSGPTTGHSENLSFTAITGTANTFPSSHYEKPLIHSTSSSLPGWTESSLLACQANSLMGCNLIPKSLKECLTEGVNLTGGAQCIGHALAPSAPYANDGTADGVGLEAGAMGADLLTSRLVAWLKKHIFVLGRNEDQHSTATHIFVH

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

 

Download 13 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
1M37.4Very low70.4Confident204 Ų20496.5 Ų96.5100%1.00552%0.519SS*.  0-41.90-79.9-175.4172.600112.7N3 I4M1-N3 PolarHBondContact O-N 2.82Å; M1-I4 PolarHBondContact O-N 2.88Å
2T49.8Very low72Confident109 Ų10995.1 Ų95.167%0.66950%0.504SS*.Hα-helixtrans-38.8-55.6175.444.30000114.7I4 K5 S6T2-I4 PolarHBondContact O-N 3Å; T2-K5 WeakPolarHBondContact O-CA 3.34Å; T2-K5 WeakPolarHBondContact O-CB 3.35Å; T2-K5 PolarHBondContact O-N 2.94Å; T2-S6 PolarHBondContact O-N 2.89Å; T2-S6 PolarHBondContact O-OG 2.77Å
3N54Low73.4Confident129 Ų12988.6 Ų88.669%0.6947%0.47SS*.Hα-helixtrans-57.6-23.4-178.2-767.6000115.7M1 S6 H7M1-N3 PolarHBondContact O-N 2.82Å; N3-S6 WeakPolarHBondContact CA-OG 3.39Å; N3-S6 PolarHBondContact O-OG 3.42Å; N3-H7 WeakPolarHBondContact O-CB 3.48Å; N3-H7 PolarHBondContact O-N 2.8Å
4I59.1Low74.6Confident133 Ų13393.1 Ų93.168%0.68248%0.483SS*.Hα-helixtrans-80.5-37.8176.2-57.9176.7000110.1M1 T2 A8M1-I4 PolarHBondContact O-N 2.88Å; T2-I4 PolarHBondContact O-N 3Å; I4-A8 WeakPolarHBondContact O-CB 3.35Å; I4-A8 PolarHBondContact O-N 2.91Å; I4-A8 VanDerWaalsContact O-N 3.17Å
5K68.6Low75.5Confident132 Ų13289.3 Ų89.357%0.57447%0.47SS*.Hα-helixtrans-65-46.6173.9-70.6-171.9175.9-175.80111.1T2 A8 Y9T2-K5 WeakPolarHBondContact O-CA 3.34Å; T2-K5 WeakPolarHBondContact O-CB 3.35Å; T2-K5 PolarHBondContact O-N 2.94Å; K5-A8 PolarHBondContact O-N 2.74Å; K5-Y9 WeakPolarHBondContact O-CB 3.45Å; K5-Y9 PolarHBondContact O-N 2.79Å
6S74.9Confident76.4Confident38 Ų3883.7 Ų83.727%0.26644%0.441SS..Hα-helixtrans-65.7-44.6-179.157.30000112.4T2 N3 A8 Y9 T10T2-S6 PolarHBondContact O-N 2.89Å; T2-S6 PolarHBondContact O-OG 2.77Å; N3-S6 WeakPolarHBondContact CA-OG 3.39Å; N3-S6 PolarHBondContact O-OG 3.42Å; S6-A8 VanDerWaalsContact C-N 3.35Å; S6-A8 PolarHBondContact O-N 2.91Å; S6-Y9 WeakPolarHBondContact O-CB 3.48Å; S6-Y9 PolarHBondContact O-N 2.75Å; S6-T10 PolarHBondContact O-N 2.86Å; S6-T10 PolarHBondContact O-OG1 3.27Å
7H79.8Confident77.1Confident133 Ų13383.2 Ų83.262%0.61644%0.439SS*.Hα-helixtrans-60.5-43.7176.1-170.866.5000112N3 Y9 T10 T11N3-H7 WeakPolarHBondContact O-CB 3.48Å; N3-H7 PolarHBondContact O-N 2.8Å; H7-Y9 VanDerWaalsContact C-N 3.34Å; H7-Y9 PolarHBondContact O-N 3.44Å; H7-T10 PolarHBondContact O-N 2.99Å; H7-T11 WeakPolarHBondContact O-CB 3.43Å; H7-T11 PolarHBondContact O-N 2.75Å; H7-T11 PolarHBondContact O-OG1 2.76Å; H7-T11 VanDerWaalsContact O-OG1 3.09Å
8A85.5Confident77.8Confident39 Ų3984.7 Ų84.732%0.32244%0.443SS..Hα-helixtrans-62-39.6175.300000112.8I4 K5 S6 K12 F42I4-A8 WeakPolarHBondContact O-CB 3.35Å; I4-A8 PolarHBondContact O-N 2.91Å; I4-A8 VanDerWaalsContact O-N 3.17Å; K5-A8 PolarHBondContact O-N 2.74Å; S6-A8 VanDerWaalsContact C-N 3.35Å; S6-A8 PolarHBondContact O-N 2.91Å; A8-K12 WeakPolarHBondContact O-CB 3.38Å; A8-K12 WeakPolarHBondContact O-CG 3.45Å; A8-K12 PolarHBondContact O-N 3.45Å; A8-F42 HydrophobicContact CB-CZ 4.29Å
9Y88.1Confident78.1Confident4 Ų480.6 Ų80.62%0.01642%0.423CS..Hα-helixtrans-60.7-53.5174.2-178.2-85.6000111.3K5 S6 H7 T11 K12 L13 F43 L79 D80 L84K5-Y9 WeakPolarHBondContact O-CB 3.45Å; K5-Y9 PolarHBondContact O-N 2.79Å; S6-Y9 WeakPolarHBondContact O-CB 3.48Å; S6-Y9 PolarHBondContact O-N 2.75Å; H7-Y9 VanDerWaalsContact C-N 3.34Å; H7-Y9 PolarHBondContact O-N 3.44Å; Y9-T11 PolarHBondContact O-N 3.26Å; Y9-K12 PolarHBondContact O-N 3.24Å; Y9-K12 VanDerWaalsContact O-N 3.15Å; Y9-L13 HydrophobicContact CE1-CD2 4.11Å; Y9-L13 WeakPolarHBondContact O-CB 3.36Å; Y9-L13 PolarHBondContact O-N 2.78Å; Y9-F43 HydrophobicContact CD2-CD1 4.09Å; Y9-F43 AromaticContact CD2-CE1 3.92Å; Y9-F43 HydrophobicContact CD2-CE1 3.92Å; Y9-F43 AromaticContact CE2-CD1 3.77Å; Y9-F43 HydrophobicContact CE2-CD1 3.77Å; Y9-F43 AromaticContact CE2-CE1 3.78Å; Y9-F43 HydrophobicContact CE2-CE1 3.78Å; Y9-F43 HydrophobicContact CG-CE1 4.47Å; Y9-L79 HydrophobicContact CD1-CB 4.31Å; Y9-L79 HydrophobicContact CD1-CD1 4.43Å; Y9-L79 HydrophobicContact CD1-CD2 4.02Å; Y9-L79 HydrophobicContact CD1-CG 4.49Å; Y9-L79 HydrophobicContact CD2-CD1 4.21Å; Y9-L79 HydrophobicContact CE1-CB 4Å; Y9-L79 HydrophobicContact CE2-CD1 4.37Å; Y9-L79 HydrophobicContact CG-CD1 4.23Å; Y9-L79 HydrophobicContact CG-CD2 4.27Å; Y9-D80 VanDerWaalsContact CE1-O 3.28Å; Y9-D80 WeakPolarHBondContact CE1-O 3.41Å; Y9-D80 PolarHBondContact OH-O 3.14Å; Y9-L84 HydrophobicContact CE2-CD2 4.35Å; Y9-L84 WeakPolarHBondContact OH-CD2 3.21Å
10T88.4Confident78.6Confident65 Ų6576.9 Ų76.940%0.39940%0.404SS..Hα-helixtrans-61-40.5179.5-52.80000112.4S6 H7 L13 K14S6-T10 PolarHBondContact O-N 2.86Å; S6-T10 PolarHBondContact O-OG1 3.27Å; H7-T10 PolarHBondContact O-N 2.99Å; T10-L13 PolarHBondContact O-N 2.82Å; T10-K14 WeakPolarHBondContact O-CG 3.41Å; T10-K14 PolarHBondContact O-N 2.97Å
11T88.6Confident78.9Confident76 Ų7680.6 Ų80.647%0.46641%0.413SS..Hα-helixtrans-65-38.9176-61.70000112H7 Y9 A15H7-T11 WeakPolarHBondContact O-CB 3.43Å; H7-T11 PolarHBondContact O-N 2.75Å; H7-T11 PolarHBondContact O-OG1 2.76Å; H7-T11 VanDerWaalsContact O-OG1 3.09Å; Y9-T11 PolarHBondContact O-N 3.26Å; T11-A15 PolarHBondContact O-N 3.04Å; T11-A15 VanDerWaalsContact O-N 3.17Å
12K90.2Very high81.2Confident79 Ų7973.9 Ų73.934%0.34338%0.378SS..Hα-helixtrans-73.1-30.5176-75.1-76.4176.5-176.80112.8A8 Y9 A15 L16 L39 F42 F43A8-K12 WeakPolarHBondContact O-CB 3.38Å; A8-K12 WeakPolarHBondContact O-CG 3.45Å; A8-K12 PolarHBondContact O-N 3.45Å; Y9-K12 PolarHBondContact O-N 3.24Å; Y9-K12 VanDerWaalsContact O-N 3.15Å; K12-A15 PolarHBondContact O-N 2.93Å; K12-L16 PolarHBondContact O-N 2.95Å; K12-L39 HydrophobicContact CD-CD2 3.49Å; K12-L39 VanDerWaalsContact CD-CD2 3.49Å; K12-F42 HydrophobicContact CB-CD1 3.7Å; K12-F42 HydrophobicContact CB-CE1 3.54Å; K12-F42 HydrophobicContact CB-CZ 4.27Å; K12-F42 HydrophobicContact CD-CD1 4.35Å; K12-F42 HydrophobicContact CD-CG 4.42Å; K12-F42 HydrophobicContact CG-CD1 3.73Å; K12-F42 HydrophobicContact CG-CD2 4.4Å; K12-F42 HydrophobicContact CG-CE1 3.62Å; K12-F42 HydrophobicContact CG-CE2 4.29Å; K12-F42 HydrophobicContact CG-CG 4.14Å; K12-F42 HydrophobicContact CG-CZ 3.92Å; K12-F43 HydrophobicContact CB-CZ 3.97Å
13L89.4Confident82.8Confident11 Ų1168.7 Ų68.76%0.05835%0.347CS..Hα-helixtrans-68.4-42.4174.7-178.357.7000111.1Y9 T10 A15 L16 N17 F43 D80 T83 L84Y9-L13 HydrophobicContact CE1-CD2 4.11Å; Y9-L13 WeakPolarHBondContact O-CB 3.36Å; Y9-L13 PolarHBondContact O-N 2.78Å; T10-L13 PolarHBondContact O-N 2.82Å; L13-A15 VanDerWaalsContact C-N 3.33Å; L13-A15 PolarHBondContact O-N 3.37Å; L13-L16 PolarHBondContact O-N 3.11Å; L13-L16 VanDerWaalsContact O-N 3.17Å; L13-N17 PolarHBondContact O-N 2.91Å; L13-F43 HydrophobicContact CB-CZ 4.2Å; L13-D80 HydrophobicContact CD2-CB 3.94Å; L13-T83 HydrophobicContact CD1-CG2 4.36Å; L13-T83 HydrophobicContact CD2-CG2 4.4Å; L13-T83 HydrophobicContact CG-CG2 4.46Å; L13-L84 HydrophobicContact CD1-CB 3.93Å; L13-L84 HydrophobicContact CD1-CD1 4.15Å
14K90.1Very high84.3Confident152 Ų15265.5 Ų65.566%0.66133%0.332SS*.Hα-helixtrans-59.8-41.6171.1-71.4-174.7176.9-166.20112.3T10 L16 N17 E18T10-K14 WeakPolarHBondContact O-CG 3.41Å; T10-K14 PolarHBondContact O-N 2.97Å; K14-L16 VanDerWaalsContact C-N 3.33Å; K14-L16 PolarHBondContact O-N 3.23Å; K14-N17 PolarHBondContact O-N 3.22Å; K14-E18 WeakPolarHBondContact O-CB 3.21Å; K14-E18 PolarHBondContact O-N 3.22Å
15A88.9Confident85.4Confident35 Ų3563.4 Ų63.429%0.28932%0.322SS..Hα-helixtrans-67.2-30.1175.600000113.6T11 K12 L13 A19 L39T11-A15 PolarHBondContact O-N 3.04Å; T11-A15 VanDerWaalsContact O-N 3.17Å; K12-A15 PolarHBondContact O-N 2.93Å; L13-A15 VanDerWaalsContact C-N 3.33Å; L13-A15 PolarHBondContact O-N 3.37Å; A15-A19 PolarHBondContact O-N 3.14Å; A15-L39 HydrophobicContact CB-CD2 4.45Å
16L88.9Confident85.6Confident0 Ų062.5 Ų62.50%032%0.324CS..Hα-helixtrans-72.2-45.7173-170.770.7000111.1K12 L13 K14 E18 A19 C20 L39 F43 L84 C87 L88 I91K12-L16 PolarHBondContact O-N 2.95Å; L13-L16 PolarHBondContact O-N 3.11Å; L13-L16 VanDerWaalsContact O-N 3.17Å; K14-L16 VanDerWaalsContact C-N 3.33Å; K14-L16 PolarHBondContact O-N 3.23Å; L16-E18 VanDerWaalsContact C-N 3.35Å; L16-E18 PolarHBondContact O-N 3.33Å; L16-A19 CarbonylContact O-C 3.49Å; L16-A19 WeakPolarHBondContact O-CA 3.31Å; L16-A19 WeakPolarHBondContact O-CB 3.15Å; L16-A19 PolarHBondContact O-N 3.04Å; L16-C20 PolarHBondContact O-N 3.14Å; L16-C20 PolarHBondContact O-SG 3.08Å; L16-L39 HydrophobicContact CB-CD1 4.28Å; L16-L39 HydrophobicContact CD1-CB 4.03Å; L16-L39 HydrophobicContact CD1-CD1 3.89Å; L16-F43 HydrophobicContact CB-CE2 4.19Å; L16-F43 HydrophobicContact CD2-CD2 4.32Å; L16-F43 HydrophobicContact CD2-CE2 3.86Å; L16-L84 HydrophobicContact CD2-CD1 3.62Å; L16-C87 HydrophobicContact CD2-CB 3.74Å; L16-C87 HydrophobicContact CG-CB 4.15Å; L16-L88 HydrophobicContact CD2-CD2 4.35Å; L16-I91 HydrophobicContact CD1-CD1 3.68Å; L16-I91 HydrophobicContact CG-CD1 4.18Å
17N89.6Confident85.5Confident76 Ų7662.3 Ų62.341%0.40632%0.324SS..Hα-helixtrans-62.5-41176.8-167.9-18.9000111.2L13 K14 A19 C20 Y21L13-N17 PolarHBondContact O-N 2.91Å; K14-N17 PolarHBondContact O-N 3.22Å; N17-A19 PolarHBondContact O-N 3.29Å; N17-C20 WeakPolarHBondContact O-CB 3.29Å; N17-C20 PolarHBondContact O-N 2.89Å; N17-C20 VanDerWaalsContact O-N 3.08Å; N17-Y21 WeakPolarHBondContact O-CB 3.41Å; N17-Y21 PolarHBondContact O-N 3.38Å
18E88.3Confident84.8Confident109 Ų10961.8 Ų61.851%0.50934%0.335SS..Hα-helixtrans-60.2-31.7171.7-163.5-164.2144.400112.8K14 L16 K22K14-E18 WeakPolarHBondContact O-CB 3.21Å; K14-E18 PolarHBondContact O-N 3.22Å; L16-E18 VanDerWaalsContact C-N 3.35Å; L16-E18 PolarHBondContact O-N 3.33Å; E18-K22 WeakPolarHBondContact O-CD 3.39Å; E18-K22 VanDerWaalsContact O-CG 3.29Å; E18-K22 WeakPolarHBondContact O-CG 3.49Å; E18-K22 PolarHBondContact O-N 2.77Å; E18-K22 WeakPolarHBondContact OE1-CE 3.34Å; E18-K22 IonicContact OE1-NZ 2.77Å; E18-K22 PolarHBondContact OE1-NZ 3.19Å
19A84.8Confident84.1Confident8 Ų866.4 Ų66.47%0.06635%0.354CS..Hα-helixtrans-73.7-40.2172.600000112A15 L16 N17 K22 L23 P31A15-A19 PolarHBondContact O-N 3.14Å; L16-A19 CarbonylContact O-C 3.49Å; L16-A19 WeakPolarHBondContact O-CA 3.31Å; L16-A19 WeakPolarHBondContact O-CB 3.15Å; L16-A19 PolarHBondContact O-N 3.04Å; N17-A19 PolarHBondContact O-N 3.29Å; A19-K22 PolarHBondContact O-N 2.7Å; A19-L23 WeakPolarHBondContact O-CG 3.34Å; A19-L23 PolarHBondContact O-N 3.02Å; A19-P31 HydrophobicContact CB-CB 4.06Å; A19-P31 HydrophobicContact CB-CG 4.04Å
20C87.5Confident83.4Confident5 Ų569.5 Ų69.53%0.03437%0.371CS..Hα-helixtrans-60.1-49.3173.9-58.20000110.8L16 N17 K22 L23 V24 T90L16-C20 PolarHBondContact O-N 3.14Å; L16-C20 PolarHBondContact O-SG 3.08Å; N17-C20 WeakPolarHBondContact O-CB 3.29Å; N17-C20 PolarHBondContact O-N 2.89Å; N17-C20 VanDerWaalsContact O-N 3.08Å; C20-K22 PolarHBondContact O-N 2.96Å; C20-L23 WeakPolarHBondContact O-CA 3.31Å; C20-L23 WeakPolarHBondContact O-CB 3.32Å; C20-L23 PolarHBondContact O-N 3.41Å; C20-V24 WeakPolarHBondContact O-CG2 3.44Å; C20-V24 PolarHBondContact O-N 3.37Å; C20-T90 HydrophobicContact CB-CG2 4.35Å
21Y85.6Confident82.8Confident155 Ų15567.5 Ų67.561%0.60836%0.359SS*.Hα-helixtrans-56.6-36.6177-174.6-94.3000112.7N17 N25N17-Y21 WeakPolarHBondContact O-CB 3.41Å; N17-Y21 PolarHBondContact O-N 3.38Å; Y21-N25 WeakPolarHBondContact CD2-ND2 3.01Å; Y21-N25 VanDerWaalsContact CE2-ND2 3.31Å; Y21-N25 WeakPolarHBondContact CE2-ND2 3.28Å; Y21-N25 WeakPolarHBondContact O-CB 3.2Å; Y21-N25 PolarHBondContact O-N 2.76Å; Y21-N25 VanDerWaalsContact O-N 3.14Å; Y21-N25 PolarHBondContact O-ND2 3.26Å
22K85.1Confident82.3Confident63 Ų6366 Ų6627%0.27435%0.352SS..Hα-helixtrans-72.3-32.6174.6-72.4168.1-170.1168.20113.5E18 A19 C20 N26 A27 L30E18-K22 WeakPolarHBondContact O-CD 3.39Å; E18-K22 VanDerWaalsContact O-CG 3.29Å; E18-K22 WeakPolarHBondContact O-CG 3.49Å; E18-K22 PolarHBondContact O-N 2.77Å; E18-K22 WeakPolarHBondContact OE1-CE 3.34Å; E18-K22 IonicContact OE1-NZ 2.77Å; E18-K22 PolarHBondContact OE1-NZ 3.19Å; A19-K22 PolarHBondContact O-N 2.7Å; C20-K22 PolarHBondContact O-N 2.96Å; K22-N26 PolarHBondContact O-N 3.05Å; K22-A27 HydrophobicContact CB-CB 3.97Å; K22-A27 HydrophobicContact CG-CB 3.99Å; K22-A27 PolarHBondContact O-N 3.25Å; K22-L30 WeakPolarHBondContact O-CD1 3.38Å
23L84.1Confident82.1Confident1 Ų162.6 Ų62.61%0.00534%0.338CS..Hα-helixtrans-73.1-39.2176.6-74168.8000112.6A19 C20 L30 P31 I36 I91 H94 K97 L98A19-L23 WeakPolarHBondContact O-CG 3.34Å; A19-L23 PolarHBondContact O-N 3.02Å; C20-L23 WeakPolarHBondContact O-CA 3.31Å; C20-L23 WeakPolarHBondContact O-CB 3.32Å; C20-L23 PolarHBondContact O-N 3.41Å; L23-L30 HydrophobicContact CD2-CD1 4.33Å; L23-L30 HydrophobicContact CD2-CD2 4.33Å; L23-L30 HydrophobicContact CD2-CG 4.06Å; L23-P31 HydrophobicContact CD1-CG 4.31Å; L23-P31 HydrophobicContact CD2-CG 4.09Å; L23-P31 HydrophobicContact CG-CG 3.86Å; L23-I36 HydrophobicContact CD1-CD1 3.89Å; L23-I91 HydrophobicContact CD1-CG1 4.31Å; L23-H94 HydrophobicContact CB-CB 4.21Å; L23-K97 HydrophobicContact CD2-CB 4.43Å; L23-K97 VanDerWaalsContact O-CD 3.32Å; L23-K97 WeakPolarHBondContact O-CD 3.32Å; L23-K97 PolarHBondContact O-NZ 3.38Å; L23-L98 HydrophobicContact CD1-CD1 4.38Å; L23-L98 HydrophobicContact CD2-CD2 3.77Å; L23-L98 HydrophobicContact CD2-CG 4.05Å
24V85.7Confident81.9Confident62 Ų6267.6 Ų67.638%0.37637%0.365SS..Hα-helixtrans-63.2-60.9173.4175.40000109.1C20 N26 T90 K97C20-V24 WeakPolarHBondContact O-CG2 3.44Å; C20-V24 PolarHBondContact O-N 3.37Å; V24-N26 PolarHBondContact O-N 2.77Å; V24-T90 HydrophobicContact CG2-CG2 3.63Å; V24-K97 PolarHBondContact O-NZ 3.04Å
25N81.7Confident81.7Confident89 Ų8964.7 Ų64.748%0.47636%0.356SS..THydrogen-bonded Turntrans-7615.9-172.2-64.7-74.6000115.6Y21 A27Y21-N25 WeakPolarHBondContact CD2-ND2 3.01Å; Y21-N25 VanDerWaalsContact CE2-ND2 3.31Å; Y21-N25 WeakPolarHBondContact CE2-ND2 3.28Å; Y21-N25 WeakPolarHBondContact O-CB 3.2Å; Y21-N25 PolarHBondContact O-N 2.76Å; Y21-N25 VanDerWaalsContact O-N 3.14Å; Y21-N25 PolarHBondContact O-ND2 3.26Å; N25-A27 PolarHBondContact O-N 3.24Å
26N73.2Confident81.7Confident113 Ų11363 Ų6360%0.60434%0.343SS*.THydrogen-bonded Turntrans47.239.6179.5-69-30.3000114K22 V24 S28 K97K22-N26 PolarHBondContact O-N 3.05Å; V24-N26 PolarHBondContact O-N 2.77Å; N26-S28 PolarHBondContact O-N 3.4Å; N26-K97 WeakPolarHBondContact OD1-CE 3.2Å; N26-K97 PolarHBondContact OD1-NZ 2.8Å
27A72.2Confident81.7Confident33 Ų3363.6 Ų63.627%0.27335%0.346SS..  trans-63.4136.6-17200000111.4K22 N25 N29 L30K22-A27 HydrophobicContact CB-CB 3.97Å; K22-A27 HydrophobicContact CG-CB 3.99Å; K22-A27 PolarHBondContact O-N 3.25Å; N25-A27 PolarHBondContact O-N 3.24Å; A27-N29 CarbonylContact O-C 3.55Å; A27-N29 PolarHBondContact O-N 3.35Å; A27-L30 PolarHBondContact O-N 2.84Å; A27-L30 VanDerWaalsContact O-N 3.08Å
28S64.6Low81.8Confident122 Ų12262.7 Ų62.785%0.85335%0.346SS*.SBendtrans-57.3-23.4-176.156.20000114.7N26N26-S28 PolarHBondContact O-N 3.4Å
29N72.1Confident81.9Confident136 Ų13658.2 Ų58.273%0.72733%0.325SS*.SBendtrans-10267.3168.7-65.3-52.9000110.2A27A27-N29 CarbonylContact O-C 3.55Å; A27-N29 PolarHBondContact O-N 3.35Å
30L73.1Confident82.2Confident69 Ų6957.9 Ų57.936%0.36132%0.322SS..PPolyproline II helixtrans-61.3133.8178.4-14271.5000110K22 L23 A27 K97K22-L30 WeakPolarHBondContact O-CD1 3.38Å; L23-L30 HydrophobicContact CD2-CD1 4.33Å; L23-L30 HydrophobicContact CD2-CD2 4.33Å; L23-L30 HydrophobicContact CD2-CG 4.06Å; A27-L30 PolarHBondContact O-N 2.84Å; A27-L30 VanDerWaalsContact O-N 3.08Å; L30-K97 HydrophobicContact CD2-CB 4.29Å; L30-K97 WeakPolarHBondContact CD2-O 3.44Å
31P74.8Confident82.4Confident23 Ų2361.9 Ų61.915%0.14934%0.339CS..PPolyproline II helixtrans-61139-179.424.8-35.9000111.6A19 L23 I36A19-P31 HydrophobicContact CB-CB 4.06Å; A19-P31 HydrophobicContact CB-CG 4.04Å; L23-P31 HydrophobicContact CD1-CG 4.31Å; L23-P31 HydrophobicContact CD2-CG 4.09Å; L23-P31 HydrophobicContact CG-CG 3.86Å; P31-I36 HydrophobicContact CB-CD1 4.23Å; P31-I36 HydrophobicContact CB-CG1 4.26Å; P31-I36 HydrophobicContact CG-CD1 4.04Å
32S79.4Confident82.6Confident45 Ų4557.4 Ų57.432%0.31532%0.323SS..PPolyproline II helixtrans-71.6146178.490.40000111N34 D35 I36S32-N34 PolarHBondContact O-N 3.43Å; S32-N34 PolarHBondContact OG-N 3.25Å; S32-D35 VanDerWaalsContact CB-OD2 3.25Å; S32-D35 WeakPolarHBondContact CB-OD2 3.45Å; S32-D35 PolarHBondContact N-OD2 3.37Å; S32-D35 WeakPolarHBondContact O-CB 3.32Å; S32-D35 PolarHBondContact O-N 3.23Å; S32-D35 PolarHBondContact OG-N 3.06Å; S32-D35 PolarHBondContact OG-OD2 2.87Å; S32-I36 PolarHBondContact O-N 2.87Å; S32-I36 VanDerWaalsContact O-N 3.12Å
33S84.3Confident82.9Confident7 Ų754.4 Ų54.45%0.04931%0.31CS..Hα-helixtrans-58.5-28.6175.449.70000112.9T37 T99S33-T37 WeakPolarHBondContact O-CB 3.18Å; S33-T37 PolarHBondContact O-N 2.95Å; S33-T37 PolarHBondContact O-OG1 2.86Å; S33-T99 WeakPolarHBondContact CB-O 3.31Å; S33-T99 PolarHBondContact OG-O 2.93Å; S33-T99 VanDerWaalsContact OG-O 3.08Å; S33-T99 PolarHBondContact OG-OG1 2.9Å
34N86Confident83.2Confident117 Ų11755.6 Ų55.663%0.62632%0.315SS*.Hα-helixtrans-68.7-39.6172.2-70.8-47.6000112.4S32 T37 S38S32-N34 PolarHBondContact O-N 3.43Å; S32-N34 PolarHBondContact OG-N 3.25Å; N34-T37 PolarHBondContact O-N 2.93Å; N34-S38 WeakPolarHBondContact O-CB 3.24Å; N34-S38 PolarHBondContact O-N 2.67Å
35D86.7Confident83.4Confident90 Ų9057.3 Ų57.348%0.48132%0.322SS..Hα-helixtrans-66-48.6177.9-62.8-54.6000110.6S32 T37 S38 L39S32-D35 VanDerWaalsContact CB-OD2 3.25Å; S32-D35 WeakPolarHBondContact CB-OD2 3.45Å; S32-D35 PolarHBondContact N-OD2 3.37Å; S32-D35 WeakPolarHBondContact O-CB 3.32Å; S32-D35 PolarHBondContact O-N 3.23Å; S32-D35 PolarHBondContact OG-N 3.06Å; S32-D35 PolarHBondContact OG-OD2 2.87Å; D35-T37 VanDerWaalsContact C-N 3.34Å; D35-T37 PolarHBondContact O-N 3.42Å; D35-S38 WeakPolarHBondContact O-CA 3.43Å; D35-S38 WeakPolarHBondContact O-CB 3.42Å; D35-S38 PolarHBondContact O-N 3.1Å; D35-S38 PolarHBondContact O-OG 2.87Å; D35-L39 WeakPolarHBondContact O-CG 3.38Å; D35-L39 PolarHBondContact O-N 2.81Å
36I88.3Confident83.7Confident1 Ų154.4 Ų54.41%0.00531%0.309CS..Hα-helixtrans-58.6-47.2174.7-62.4174.8000110.1L23 P31 S32 S38 L39 L40 I91 L98 V104L23-I36 HydrophobicContact CD1-CD1 3.89Å; P31-I36 HydrophobicContact CB-CD1 4.23Å; P31-I36 HydrophobicContact CB-CG1 4.26Å; P31-I36 HydrophobicContact CG-CD1 4.04Å; S32-I36 PolarHBondContact O-N 2.87Å; S32-I36 VanDerWaalsContact O-N 3.12Å; I36-S38 PolarHBondContact O-N 2.94Å; I36-L39 PolarHBondContact O-N 3.44Å; I36-L40 HydrophobicContact CG2-CD1 3.99Å; I36-L40 HydrophobicContact CG2-CG 4.23Å; I36-L40 WeakPolarHBondContact O-CG 3.44Å; I36-L40 PolarHBondContact O-N 2.99Å; I36-I91 HydrophobicContact CG2-CD1 4.32Å; I36-I91 HydrophobicContact CG2-CG2 4.47Å; I36-L98 HydrophobicContact CD1-CD1 3.64Å; I36-L98 HydrophobicContact CD1-CD2 3.66Å; I36-L98 HydrophobicContact CD1-CG 4.31Å; I36-V104 HydrophobicContact CG2-CG1 4.29Å
37T89.6Confident84.4Confident11 Ų1149 Ų497%0.06728%0.28CS..Hα-helixtrans-57.8-34.2174.9-63.90000112.1S33 N34 D35 K41S33-T37 WeakPolarHBondContact O-CB 3.18Å; S33-T37 PolarHBondContact O-N 2.95Å; S33-T37 PolarHBondContact O-OG1 2.86Å; N34-T37 PolarHBondContact O-N 2.93Å; D35-T37 VanDerWaalsContact C-N 3.34Å; D35-T37 PolarHBondContact O-N 3.42Å; T37-K41 HydrophobicContact CG2-CD 3.97Å; T37-K41 VanDerWaalsContact CG2-CE 3.47Å; T37-K41 VanDerWaalsContact CG2-NZ 3.33Å; T37-K41 VanDerWaalsContact O-CB 3.31Å; T37-K41 WeakPolarHBondContact O-CB 3.26Å; T37-K41 WeakPolarHBondContact O-CD 3.37Å; T37-K41 WeakPolarHBondContact O-CG 3.33Å; T37-K41 PolarHBondContact O-N 3.35Å
38S90.6Very high85Confident58 Ų5850.4 Ų50.441%0.40628%0.279SS..Hα-helixtrans-70.7-36.7175.487.60000112.8N34 D35 I36 F42N34-S38 WeakPolarHBondContact O-CB 3.24Å; N34-S38 PolarHBondContact O-N 2.67Å; D35-S38 WeakPolarHBondContact O-CA 3.43Å; D35-S38 WeakPolarHBondContact O-CB 3.42Å; D35-S38 PolarHBondContact O-N 3.1Å; D35-S38 PolarHBondContact O-OG 2.87Å; I36-S38 PolarHBondContact O-N 2.94Å; S38-F42 PolarHBondContact O-N 3.07Å
39L90Very high86Confident15 Ų1547.9 Ų47.98%0.07926%0.256CS..Hα-helixtrans-68.4-48.2174.7-64.2176.2000110.5K12 A15 L16 D35 I36 K41 F42 F43K12-L39 HydrophobicContact CD-CD2 3.49Å; K12-L39 VanDerWaalsContact CD-CD2 3.49Å; A15-L39 HydrophobicContact CB-CD2 4.45Å; L16-L39 HydrophobicContact CB-CD1 4.28Å; L16-L39 HydrophobicContact CD1-CB 4.03Å; L16-L39 HydrophobicContact CD1-CD1 3.89Å; D35-L39 WeakPolarHBondContact O-CG 3.38Å; D35-L39 PolarHBondContact O-N 2.81Å; I36-L39 PolarHBondContact O-N 3.44Å; L39-K41 VanDerWaalsContact C-N 3.32Å; L39-K41 PolarHBondContact O-N 3.45Å; L39-F42 WeakPolarHBondContact O-CA 3.16Å; L39-F42 WeakPolarHBondContact O-CB 3.46Å; L39-F42 PolarHBondContact O-N 2.88Å; L39-F43 HydrophobicContact CB-CE2 4.5Å; L39-F43 WeakPolarHBondContact O-CD2 3.2Å; L39-F43 PolarHBondContact O-N 3.36Å
40L91.1Very high86.6Confident0 Ų042.4 Ų42.40%023%0.227CC..Hα-helixtrans-56.5-45.2174.1-65.7174.9000111.2I36 F42 F43 Q44 L88 V104 H107 L108 T111I36-L40 HydrophobicContact CG2-CD1 3.99Å; I36-L40 HydrophobicContact CG2-CG 4.23Å; I36-L40 WeakPolarHBondContact O-CG 3.44Å; I36-L40 PolarHBondContact O-N 2.99Å; L40-F42 VanDerWaalsContact C-N 3.3Å; L40-F42 PolarHBondContact O-N 2.76Å; L40-F43 PolarHBondContact O-N 3.08Å; L40-F43 VanDerWaalsContact O-N 3.17Å; L40-Q44 WeakPolarHBondContact O-CB 3.32Å; L40-Q44 VanDerWaalsContact O-CG 3.25Å; L40-Q44 WeakPolarHBondContact O-CG 3.39Å; L40-Q44 PolarHBondContact O-N 3.42Å; L40-L88 HydrophobicContact CD2-CD2 3.38Å; L40-V104 HydrophobicContact CD1-CG1 4.36Å; L40-H107 HydrophobicContact CB-CB 4.13Å; L40-H107 HydrophobicContact CD1-CB 4.01Å; L40-L108 HydrophobicContact CD1-CB 4.43Å; L40-L108 HydrophobicContact CD2-CD1 4.28Å; L40-T111 HydrophobicContact CD2-CG2 4.42Å
41K91.7Very high87Confident90 Ų9039.2 Ų39.239%0.39121%0.21SC..Hα-helixtrans-60.9-34.8173.5-76.9167.6-177.3169.40113.1T37 L39 N45 H107T37-K41 HydrophobicContact CG2-CD 3.97Å; T37-K41 VanDerWaalsContact CG2-CE 3.47Å; T37-K41 VanDerWaalsContact CG2-NZ 3.33Å; T37-K41 VanDerWaalsContact O-CB 3.31Å; T37-K41 WeakPolarHBondContact O-CB 3.26Å; T37-K41 WeakPolarHBondContact O-CD 3.37Å; T37-K41 WeakPolarHBondContact O-CG 3.33Å; T37-K41 PolarHBondContact O-N 3.35Å; L39-K41 VanDerWaalsContact C-N 3.32Å; L39-K41 PolarHBondContact O-N 3.45Å; K41-N45 WeakPolarHBondContact O-CB 3.23Å; K41-N45 PolarHBondContact O-N 3.31Å; K41-N45 VanDerWaalsContact O-N 3.13Å; K41-N45 PolarHBondContact O-ND2 3.19Å; K41-H107 WeakPolarHBondContact CE-CE1 2.91Å; K41-H107 WeakPolarHBondContact CE-NE2 3.36Å
42F91.6Very high87.3Confident60 Ų6044.1 Ų44.126%0.26323%0.229SC..Hα-helixtrans-67.2-42.6173.5171.2-88.7000111.7A8 K12 S38 L39 L40 S46A8-F42 HydrophobicContact CB-CZ 4.29Å; K12-F42 HydrophobicContact CB-CD1 3.7Å; K12-F42 HydrophobicContact CB-CE1 3.54Å; K12-F42 HydrophobicContact CB-CZ 4.27Å; K12-F42 HydrophobicContact CD-CD1 4.35Å; K12-F42 HydrophobicContact CD-CG 4.42Å; K12-F42 HydrophobicContact CG-CD1 3.73Å; K12-F42 HydrophobicContact CG-CD2 4.4Å; K12-F42 HydrophobicContact CG-CE1 3.62Å; K12-F42 HydrophobicContact CG-CE2 4.29Å; K12-F42 HydrophobicContact CG-CG 4.14Å; K12-F42 HydrophobicContact CG-CZ 3.92Å; S38-F42 PolarHBondContact O-N 3.07Å; L39-F42 WeakPolarHBondContact O-CA 3.16Å; L39-F42 WeakPolarHBondContact O-CB 3.46Å; L39-F42 PolarHBondContact O-N 2.88Å; L40-F42 VanDerWaalsContact C-N 3.3Å; L40-F42 PolarHBondContact O-N 2.76Å; F42-S46 WeakPolarHBondContact O-CB 3.49Å; F42-S46 PolarHBondContact O-N 3.44Å; F42-S46 PolarHBondContact O-OG 3.43Å
43F91.4Very high87.4Confident0 Ų047.5 Ų47.50%024%0.243CC..Hα-helixtrans-68.2-44176.7-70.6-65.7000112.6Y9 K12 L13 L16 L39 L40 N45 S46 L47 L84 T111Y9-F43 HydrophobicContact CD2-CD1 4.09Å; Y9-F43 AromaticContact CD2-CE1 3.92Å; Y9-F43 HydrophobicContact CD2-CE1 3.92Å; Y9-F43 AromaticContact CE2-CD1 3.77Å; Y9-F43 HydrophobicContact CE2-CD1 3.77Å; Y9-F43 AromaticContact CE2-CE1 3.78Å; Y9-F43 HydrophobicContact CE2-CE1 3.78Å; Y9-F43 HydrophobicContact CG-CE1 4.47Å; K12-F43 HydrophobicContact CB-CZ 3.97Å; L13-F43 HydrophobicContact CB-CZ 4.2Å; L16-F43 HydrophobicContact CB-CE2 4.19Å; L16-F43 HydrophobicContact CD2-CD2 4.32Å; L16-F43 HydrophobicContact CD2-CE2 3.86Å; L39-F43 HydrophobicContact CB-CE2 4.5Å; L39-F43 WeakPolarHBondContact O-CD2 3.2Å; L39-F43 PolarHBondContact O-N 3.36Å; L40-F43 PolarHBondContact O-N 3.08Å; L40-F43 VanDerWaalsContact O-N 3.17Å; F43-N45 VanDerWaalsContact C-N 3.35Å; F43-N45 PolarHBondContact O-N 2.95Å; F43-S46 PolarHBondContact O-N 3.31Å; F43-L47 WeakPolarHBondContact O-CB 3.39Å; F43-L47 WeakPolarHBondContact O-CG 3.38Å; F43-L47 PolarHBondContact O-N 3.42Å; F43-L84 HydrophobicContact CB-CD2 4.39Å; F43-L84 HydrophobicContact CD1-CD1 4.01Å; F43-L84 HydrophobicContact CD1-CD2 3.74Å; F43-L84 HydrophobicContact CD2-CD1 3.95Å; F43-L84 HydrophobicContact CE1-CD1 4.1Å; F43-L84 HydrophobicContact CE1-CD2 4.25Å; F43-L84 HydrophobicContact CE2-CD1 4.05Å; F43-L84 HydrophobicContact CG-CD1 3.95Å; F43-L84 HydrophobicContact CG-CD2 4.11Å; F43-L84 HydrophobicContact CZ-CD1 4.11Å; F43-T111 HydrophobicContact CB-CG2 3.9Å
44Q90.2Very high87.1Confident26 Ų2647.4 Ų47.412%0.12124%0.242CC..Hα-helixtrans-51.2-52.1171.7-74167.41.600111.6L40 S46 Y48 H107 T111L40-Q44 WeakPolarHBondContact O-CB 3.32Å; L40-Q44 VanDerWaalsContact O-CG 3.25Å; L40-Q44 WeakPolarHBondContact O-CG 3.39Å; L40-Q44 PolarHBondContact O-N 3.42Å; Q44-S46 VanDerWaalsContact C-N 3.32Å; Q44-S46 PolarHBondContact O-N 3.11Å; Q44-Y48 WeakPolarHBondContact O-CB 3.43Å; Q44-Y48 PolarHBondContact O-N 3.26Å; Q44-H107 VanDerWaalsContact NE2-CA 3.33Å; Q44-H107 PolarHBondContact NE2-ND1 2.7Å; Q44-H107 VanDerWaalsContact NE2-ND1 3.19Å; Q44-H107 PolarHBondContact NE2-O 2.61Å; Q44-H107 PolarHBondContact OE1-ND1 2.94Å; Q44-T111 WeakPolarHBondContact CG-OG1 3.12Å; Q44-T111 PolarHBondContact NE2-OG1 2.99Å; Q44-T111 VanDerWaalsContact NE2-OG1 3.16Å
45N89.8Confident86.2Confident98 Ų9849.1 Ų49.152%0.52425%0.246SC..Hα-helixtrans-64.9-35.6177.7-78.7-70.3000112.3K41 F43 N49K41-N45 WeakPolarHBondContact O-CB 3.23Å; K41-N45 PolarHBondContact O-N 3.31Å; K41-N45 VanDerWaalsContact O-N 3.13Å; K41-N45 PolarHBondContact O-ND2 3.19Å; F43-N45 VanDerWaalsContact C-N 3.35Å; F43-N45 PolarHBondContact O-N 2.95Å; N45-N49 WeakPolarHBondContact O-CB 3.38Å; N45-N49 PolarHBondContact O-N 3.2Å; N45-N49 VanDerWaalsContact O-N 3.13Å; N45-N49 PolarHBondContact O-ND2 3.22Å
46S87.5Confident85.3Confident28 Ų2848.8 Ų48.820%0.19625%0.248CC..Hα-helixtrans-68.5-50.2179.2-60.60000111.8F42 F43 Q44 N49 I50F42-S46 WeakPolarHBondContact O-CB 3.49Å; F42-S46 PolarHBondContact O-N 3.44Å; F42-S46 PolarHBondContact O-OG 3.43Å; F43-S46 PolarHBondContact O-N 3.31Å; Q44-S46 VanDerWaalsContact C-N 3.32Å; Q44-S46 PolarHBondContact O-N 3.11Å; S46-N49 PolarHBondContact O-N 3.47Å; S46-I50 WeakPolarHBondContact O-CG1 3.18Å; S46-I50 PolarHBondContact O-N 3.25Å; S46-I50 VanDerWaalsContact O-N 3.13Å
47L86.8Confident84.6Confident0 Ų049.1 Ų49.10%025%0.249CC..Hα-helixtrans-62-47.1176.5-66.9166.3000111.1F43 N49 I50 L51 Y81 L84 T111 L115 C118F43-L47 WeakPolarHBondContact O-CB 3.39Å; F43-L47 WeakPolarHBondContact O-CG 3.38Å; F43-L47 PolarHBondContact O-N 3.42Å; L47-N49 VanDerWaalsContact C-N 3.27Å; L47-N49 PolarHBondContact O-N 3.24Å; L47-I50 WeakPolarHBondContact O-CA 3.3Å; L47-I50 WeakPolarHBondContact O-CB 3.2Å; L47-I50 PolarHBondContact O-N 2.88Å; L47-L51 WeakPolarHBondContact O-CG 3.33Å; L47-L51 PolarHBondContact O-N 2.83Å; L47-Y81 HydrophobicContact CD2-CD1 4.22Å; L47-Y81 HydrophobicContact CD2-CE1 4.13Å; L47-L84 HydrophobicContact CD1-CD2 4.43Å; L47-T111 HydrophobicContact CD1-CG2 4.24Å; L47-L115 HydrophobicContact CD1-CB 3.98Å; L47-L115 HydrophobicContact CD1-CD1 4.21Å; L47-L115 HydrophobicContact CD2-CD1 4.03Å; L47-C118 HydrophobicContact CD2-CB 4.2Å
48Y85.5Confident83.7Confident62 Ų6250.7 Ų50.724%0.24326%0.261CS..Hα-helixtrans-58.4-36.5176.7-179.1-99.2000113.1Q44 K52 I285 G289Q44-Y48 WeakPolarHBondContact O-CB 3.43Å; Q44-Y48 PolarHBondContact O-N 3.26Å; Y48-K52 WeakPolarHBondContact O-CB 3.34Å; Y48-K52 PolarHBondContact O-N 2.91Å; Y48-I285 HydrophobicContact CD2-CD1 4.41Å; Y48-I285 HydrophobicContact CE2-CD1 4.01Å; Y48-I285 HydrophobicContact CE2-CG1 3.86Å; Y48-G289 PolarHBondContact OH-O 3.23Å
49N84.8Confident82.9Confident70 Ų7049.1 Ų49.137%0.37425%0.248SC..Hα-helixtrans-70-33.5173.3-81.7-71.1000112.6N45 S46 L47 D53N45-N49 WeakPolarHBondContact O-CB 3.38Å; N45-N49 PolarHBondContact O-N 3.2Å; N45-N49 VanDerWaalsContact O-N 3.13Å; N45-N49 PolarHBondContact O-ND2 3.22Å; S46-N49 PolarHBondContact O-N 3.47Å; L47-N49 VanDerWaalsContact C-N 3.27Å; L47-N49 PolarHBondContact O-N 3.24Å; N49-D53 PolarHBondContact O-N 2.93Å
50I84.7Confident81.9Confident21 Ų2154.5 Ų54.511%0.10827%0.272CS..Hα-helixtrans-67.2-47.3173.3-65.5165.3000110S46 L47 K52 D53 I54 P77 L79 Y81S46-I50 WeakPolarHBondContact O-CG1 3.18Å; S46-I50 PolarHBondContact O-N 3.25Å; S46-I50 VanDerWaalsContact O-N 3.13Å; L47-I50 WeakPolarHBondContact O-CA 3.3Å; L47-I50 WeakPolarHBondContact O-CB 3.2Å; L47-I50 PolarHBondContact O-N 2.88Å; I50-K52 PolarHBondContact O-N 2.95Å; I50-D53 PolarHBondContact O-N 3.18Å; I50-I54 HydrophobicContact CG2-CD1 4.49Å; I50-I54 PolarHBondContact O-N 2.82Å; I50-P77 HydrophobicContact CD1-CG 4.48Å; I50-P77 HydrophobicContact CG1-CG 4.36Å; I50-P77 HydrophobicContact CG2-CG 4.41Å; I50-L79 HydrophobicContact CD1-CD1 3.93Å; I50-Y81 HydrophobicContact CD1-CE1 4.44Å
51L82.3Confident81.3Confident2 Ų254.7 Ų54.71%0.0127%0.273CS..Hα-helixtrans-59.3-34.6177-64.1176.5000112.6L47 D53 I54 F117 P281 I285L47-L51 WeakPolarHBondContact O-CG 3.33Å; L47-L51 PolarHBondContact O-N 2.83Å; L51-D53 VanDerWaalsContact C-N 3.33Å; L51-D53 PolarHBondContact O-N 3.2Å; L51-I54 HydrophobicContact CD2-CD1 4.33Å; L51-I54 PolarHBondContact O-N 3.5Å; L51-F117 HydrophobicContact CD1-CB 4.49Å; L51-F117 HydrophobicContact CD2-CB 3.51Å; L51-F117 HydrophobicContact CD2-CG 4.32Å; L51-P281 HydrophobicContact CB-CB 4.14Å; L51-P281 WeakPolarHBondContact O-CB 3.46Å; L51-P281 WeakPolarHBondContact O-CG 3.16Å; L51-I285 HydrophobicContact CB-CD1 4.37Å
52K82.1Confident80.6Confident125 Ų12550.6 Ų50.654%0.54326%0.255SS..Hα-helixtrans-68.4-28.5176.3-172.9179.8176.3-173.30113.9Y48 I50 I54 I285Y48-K52 WeakPolarHBondContact O-CB 3.34Å; Y48-K52 PolarHBondContact O-N 2.91Å; I50-K52 PolarHBondContact O-N 2.95Å; K52-I54 VanDerWaalsContact C-N 3.32Å; K52-I285 HydrophobicContact CB-CD1 4.09Å; K52-I285 HydrophobicContact CG-CG2 4.47Å
53D79.5Confident79.7Confident116 Ų11649.3 Ų49.362%0.6225%0.252SS*.Hα-helixtrans-82.1-12.6179.4-69-20.9000111.9N49 I50 L51N49-D53 PolarHBondContact O-N 2.93Å; I50-D53 PolarHBondContact O-N 3.18Å; L51-D53 VanDerWaalsContact C-N 3.33Å; L51-D53 PolarHBondContact O-N 3.2Å
54I77.9Confident78.9Confident6 Ų651.1 Ų51.13%0.03126%0.262CS..  trans-80.8125.3176.7-68.6164.4000110.8I50 L51 K52 W71 L76 P281I50-I54 HydrophobicContact CG2-CD1 4.49Å; I50-I54 PolarHBondContact O-N 2.82Å; L51-I54 HydrophobicContact CD2-CD1 4.33Å; L51-I54 PolarHBondContact O-N 3.5Å; K52-I54 VanDerWaalsContact C-N 3.32Å; I54-W71 HydrophobicContact CD1-CH2 3.93Å; I54-W71 HydrophobicContact CD1-CZ2 4.43Å; I54-W71 HydrophobicContact CG2-CH2 4.43Å; I54-W71 HydrophobicContact CG2-CZ2 3.91Å; I54-L76 HydrophobicContact CD1-CD1 4Å; I54-P281 HydrophobicContact CB-CG 4.05Å; I54-P281 HydrophobicContact CG2-CG 3.85Å
55Q67.3Low78.3Confident152 Ų15255.9 Ų55.971%0.7128%0.279SS*.  trans-93.3-33.2-173-58.3-176.130.400113.9N280 K282Q55-N280 PolarHBondContact O-ND2 3.26Å; Q55-K282 WeakPolarHBondContact O-CD 3.41Å
56V69Low77.7Confident84 Ų8457.3 Ų57.351%0.50929%0.285SS..  trans-141.2131.1179.4-176.50000108.8W71V56-W71 PolarHBondContact O-NE1 3.3Å
57L72.1Confident77.2Confident8 Ų859 Ų594%0.04229%0.292CS..  trans-128.3112.8166.1170.665.5000106.4R61 F62 W71 F117 V279L57-R61 HydrophobicContact CD1-CB 4.22Å; L57-R61 HydrophobicContact CD1-CG 4.44Å; L57-F62 HydrophobicContact CD1-CE2 4.06Å; L57-F62 HydrophobicContact CD2-CE2 4.22Å; L57-F62 HydrophobicContact CD2-CZ 4.48Å; L57-F62 HydrophobicContact CG-CE2 4.43Å; L57-W71 HydrophobicContact CB-CZ2 4.19Å; L57-W71 HydrophobicContact CD1-CD2 4.5Å; L57-W71 HydrophobicContact CD1-CH2 3.82Å; L57-W71 HydrophobicContact CD1-CZ2 3.54Å; L57-W71 HydrophobicContact CD1-CZ3 4.4Å; L57-W71 HydrophobicContact CG-CZ2 4.43Å; L57-F117 HydrophobicContact CD2-CD1 3.7Å; L57-F117 HydrophobicContact CD2-CE1 4.05Å; L57-V279 HydrophobicContact CD2-CG2 4.38Å; L57-V279 HydrophobicContact CG-CG2 4.38Å
58S71.4Confident76.9Confident44 Ų4459.1 Ų59.131%0.30829%0.293SS..  trans-84.1153.1167.5-175.10000109.9E60 R61S58-E60 WeakPolarHBondContact CB-OE2 3.21Å; S58-E60 PolarHBondContact O-N 2.99Å; S58-E60 VanDerWaalsContact OG-CD 3.29Å; S58-E60 WeakPolarHBondContact OG-CG 3.07Å; S58-E60 PolarHBondContact OG-N 3.46Å; S58-E60 PolarHBondContact OG-OE2 3.38Å; S58-R61 WeakPolarHBondContact O-CB 3.1Å
59I74Confident76.6Confident25 Ų2561.5 Ų61.513%0.12831%0.306CS..G310 helixtrans-67.9-26.4170.4-69.4-169.8000111.2R61 F62 N160 V279 I313I59-R61 PolarHBondContact O-N 3.13Å; I59-F62 PolarHBondContact O-N 3.17Å; I59-N160 HydrophobicContact CG2-CB 3.78Å; I59-N160 WeakPolarHBondContact CG2-ND2 3.39Å; I59-V279 HydrophobicContact CD1-CG1 3.85Å; I59-V279 HydrophobicContact CD1-CG2 4.27Å; I59-V279 HydrophobicContact CG1-CB 4.47Å; I59-V279 HydrophobicContact CG1-CG1 4.03Å; I59-V279 HydrophobicContact CG1-CG2 3.63Å; I59-I313 HydrophobicContact CD1-CD1 3.39Å; I59-I313 HydrophobicContact CG1-CD1 4.35Å
60E69.5Low76.4Confident127 Ų12762.3 Ų62.359%0.59331%0.31SS*.G310 helixtrans-50.9-27.2176.9-62.9161.1123.700113.5S58 F62 V63 N67S58-E60 WeakPolarHBondContact CB-OE2 3.21Å; S58-E60 PolarHBondContact O-N 2.99Å; S58-E60 VanDerWaalsContact OG-CD 3.29Å; S58-E60 WeakPolarHBondContact OG-CG 3.07Å; S58-E60 PolarHBondContact OG-N 3.46Å; S58-E60 PolarHBondContact OG-OE2 3.38Å; E60-F62 VanDerWaalsContact C-N 3.29Å; E60-F62 PolarHBondContact O-N 3.28Å; E60-V63 WeakPolarHBondContact O-CB 3.23Å; E60-V63 PolarHBondContact O-N 3.37Å; E60-N67 VanDerWaalsContact O-CB 3.32Å; E60-N67 WeakPolarHBondContact O-CB 3.41Å; E60-N67 PolarHBondContact O-ND2 2.83Å
61R77.6Confident76.3Confident4 Ų462.8 Ų62.82%0.01531%0.311CS..G310 helixtrans-53.4-44.4172.1-175.9-147.1161.1-175.2-8.9112.4L57 S58 I59 V63 D68 W71 F117 L119L57-R61 HydrophobicContact CD1-CB 4.22Å; L57-R61 HydrophobicContact CD1-CG 4.44Å; S58-R61 WeakPolarHBondContact O-CB 3.1Å; I59-R61 PolarHBondContact O-N 3.13Å; R61-V63 VanDerWaalsContact C-N 3.27Å; R61-V63 PolarHBondContact O-N 2.54Å; R61-D68 IonicContact CZ-OD1 2.59Å; R61-D68 IonicContact NE-OD1 3.1Å; R61-D68 PolarHBondContact NE-OD1 3.11Å; R61-D68 IonicContact NH2-OD1 3.71Å; R61-D68 PolarHBondContact NH2-OD1 3.43Å; R61-D68 PolarHBondContact O-N 3.07Å; R61-W71 HydrophobicContact CB-CG 4.5Å; R61-W71 VanDerWaalsContact CD-CE3 3.4Å; R61-W71 HydrophobicContact CG-CB 4.03Å; R61-W71 HydrophobicContact CG-CD2 3.92Å; R61-W71 HydrophobicContact CG-CE3 3.86Å; R61-W71 HydrophobicContact CG-CG 4Å; R61-F117 PolarHBondContact NH1-O 2.85Å; R61-L119 PolarHBondContact NH2-O 3.25Å
62F77Confident76.3Confident5 Ų564 Ų642%0.02232%0.315CS..G310 helixtrans-81.8-4.9-175-60.3-81.7000113.2L57 I59 E60 F117 L124 L157 M161L57-F62 HydrophobicContact CD1-CE2 4.06Å; L57-F62 HydrophobicContact CD2-CE2 4.22Å; L57-F62 HydrophobicContact CD2-CZ 4.48Å; L57-F62 HydrophobicContact CG-CE2 4.43Å; I59-F62 PolarHBondContact O-N 3.17Å; E60-F62 VanDerWaalsContact C-N 3.29Å; E60-F62 PolarHBondContact O-N 3.28Å; F62-F117 HydrophobicContact CZ-CD1 4.23Å; F62-L124 HydrophobicContact CD1-CD1 4.03Å; F62-L124 HydrophobicContact CE1-CD1 4.11Å; F62-L157 VanDerWaalsContact CB-O 3.25Å; F62-L157 WeakPolarHBondContact CB-O 3.33Å; F62-L157 HydrophobicContact CD2-CD2 4.32Å; F62-L157 HydrophobicContact CE2-CD2 3.83Å; F62-L157 HydrophobicContact CZ-CD2 4.14Å; F62-M161 WeakPolarHBondContact O-CE 3.47Å
63V73.1Confident76.1Confident33 Ų3362.2 Ų62.220%0.232%0.318CS..G310 helixtrans-77.8-28.4-174.1178.60000112.6E60 R61 M161 Q165E60-V63 WeakPolarHBondContact O-CB 3.23Å; E60-V63 PolarHBondContact O-N 3.37Å; R61-V63 VanDerWaalsContact C-N 3.27Å; R61-V63 PolarHBondContact O-N 2.54Å; V63-M161 VanDerWaalsContact O-SD 3.32Å; V63-Q165 PolarHBondContact O-OE1 3.5Å
64N74.3Confident76.1Confident38 Ų3863 Ų6320%0.20332%0.316CS..  trans-160.3162.4172.862.160.1000113.2I66 N67 D68 Y121N64-I66 PolarHBondContact O-N 3.38Å; N64-I66 WeakPolarHBondContact OD1-CB 3.27Å; N64-I66 PolarHBondContact OD1-N 2.95Å; N64-I66 VanDerWaalsContact OD1-N 3.1Å; N64-N67 PolarHBondContact O-N 2.59Å; N64-N67 PolarHBondContact OD1-N 3.42Å; N64-D68 PolarHBondContact O-N 3.49Å; N64-D68 VanDerWaalsContact O-N 3.07Å; N64-Y121 VanDerWaalsContact C-CD2 3.5Å
65R78.6Confident76.2Confident125 Ų12566.8 Ų66.847%0.47233%0.334SS..Hα-helixtrans-50-36.2176.3-173.7-174.5-69.5-92-3.7114.2Q69 Y121 D122R65-Q69 VanDerWaalsContact O-CB 3.31Å; R65-Q69 WeakPolarHBondContact O-CB 3.38Å; R65-Q69 PolarHBondContact O-N 3.39Å; R65-Q69 VanDerWaalsContact O-N 3.1Å; R65-Y121 HydrophobicContact CB-CD1 3.75Å; R65-Y121 HydrophobicContact CB-CE1 4.2Å; R65-Y121 HydrophobicContact CB-CG 3.98Å; R65-Y121 HydrophobicContact CG-CD1 4.3Å; R65-D122 IonicContact CZ-OD1 2.69Å; R65-D122 IonicContact CZ-OD2 2.72Å; R65-D122 IonicContact NH1-OD1 3.87Å; R65-D122 PolarHBondContact NH1-OD1 3.37Å; R65-D122 IonicContact NH1-OD2 2.55Å; R65-D122 PolarHBondContact NH1-OD2 2.9Å; R65-D122 IonicContact NH2-OD1 3.62Å; R65-D122 PolarHBondContact NH2-OD1 3.32Å; R65-D122 IonicContact NH2-OD2 3.89Å
66I77.2Confident76.9Confident129 Ų12960.6 Ų60.666%0.66231%0.305SS*.Hα-helixtrans-71.9-52.7-177.7-58.5172.2000109.8N64 D68 Q69 D70N64-I66 PolarHBondContact O-N 3.38Å; N64-I66 WeakPolarHBondContact OD1-CB 3.27Å; N64-I66 PolarHBondContact OD1-N 2.95Å; N64-I66 VanDerWaalsContact OD1-N 3.1Å; I66-D68 VanDerWaalsContact C-N 3.29Å; I66-D68 PolarHBondContact O-N 3.28Å; I66-Q69 PolarHBondContact O-N 2.66Å; I66-D70 VanDerWaalsContact O-CB 3.25Å; I66-D70 WeakPolarHBondContact O-CB 3.48Å; I66-D70 PolarHBondContact O-N 2.81Å
67N77.2Confident77.5Confident63 Ų6359.6 Ų59.634%0.33730%0.3SS..Hα-helixtrans-58.6-41.1178.5-71-4.5000111.7E60 N64 W71E60-N67 VanDerWaalsContact O-CB 3.32Å; E60-N67 WeakPolarHBondContact O-CB 3.41Å; E60-N67 PolarHBondContact O-ND2 2.83Å; N64-N67 PolarHBondContact O-N 2.59Å; N64-N67 PolarHBondContact OD1-N 3.42Å; N67-W71 WeakPolarHBondContact O-CB 3.44Å; N67-W71 PolarHBondContact O-N 3.13Å
68D80.7Confident77.8Confident3 Ų369 Ų692%0.01634%0.344CS..Hα-helixtrans-62.1-54.3175.7-178.751.9000111.8R61 N64 I66 D70 W71 R72 D120 Y121R61-D68 IonicContact CZ-OD1 2.59Å; R61-D68 IonicContact NE-OD1 3.1Å; R61-D68 PolarHBondContact NE-OD1 3.11Å; R61-D68 IonicContact NH2-OD1 3.71Å; R61-D68 PolarHBondContact NH2-OD1 3.43Å; R61-D68 PolarHBondContact O-N 3.07Å; N64-D68 PolarHBondContact O-N 3.49Å; N64-D68 VanDerWaalsContact O-N 3.07Å; I66-D68 VanDerWaalsContact C-N 3.29Å; I66-D68 PolarHBondContact O-N 3.28Å; D68-D70 VanDerWaalsContact C-N 3.31Å; D68-D70 PolarHBondContact O-N 3.46Å; D68-W71 PolarHBondContact O-N 3.24Å; D68-R72 VanDerWaalsContact O-CB 3.3Å; D68-R72 WeakPolarHBondContact O-CB 3.42Å; D68-R72 WeakPolarHBondContact O-CG 3.3Å; D68-R72 PolarHBondContact O-N 2.65Å; D68-R72 VanDerWaalsContact OD1-CD 3.23Å; D68-R72 WeakPolarHBondContact OD1-CD 3.06Å; D68-R72 WeakPolarHBondContact OD2-CD 3.47Å; D68-R72 IonicContact OD2-NE 3.94Å; D68-D120 WeakPolarHBondContact OD2-CA 3.42Å; D68-Y121 HydrophobicContact CB-CD2 4.38Å; D68-Y121 PolarHBondContact OD2-N 3.18Å
69Q79.3Confident78.4Confident111 Ų11168.6 Ų68.652%0.51934%0.338SS..Hα-helixtrans-61.1-40.7-178.2179.163.9-11.800112.2R65 I66 S73R65-Q69 VanDerWaalsContact O-CB 3.31Å; R65-Q69 WeakPolarHBondContact O-CB 3.38Å; R65-Q69 PolarHBondContact O-N 3.39Å; R65-Q69 VanDerWaalsContact O-N 3.1Å; I66-Q69 PolarHBondContact O-N 2.66Å; Q69-S73 VanDerWaalsContact O-CB 3.31Å; Q69-S73 WeakPolarHBondContact O-CB 3.4Å; Q69-S73 PolarHBondContact O-N 3.04Å; Q69-S73 PolarHBondContact O-OG 3.3Å
70D79.6Confident79Confident87 Ų8770.9 Ų70.947%0.46535%0.351SS..Hα-helixtrans-71.9-33.3-178.6-148.439.3000111.6I66 D68 K74I66-D70 VanDerWaalsContact O-CB 3.25Å; I66-D70 WeakPolarHBondContact O-CB 3.48Å; I66-D70 PolarHBondContact O-N 2.81Å; D68-D70 VanDerWaalsContact C-N 3.31Å; D68-D70 PolarHBondContact O-N 3.46Å; D70-K74 WeakPolarHBondContact O-CD 3.11Å; D70-K74 WeakPolarHBondContact O-CE 3.45Å; D70-K74 VanDerWaalsContact O-CG 3.23Å; D70-K74 WeakPolarHBondContact O-CG 3.22Å; D70-K74 PolarHBondContact O-NZ 2.87Å; D70-K74 IonicContact OD1-NZ 3.49Å; D70-K74 IonicContact OD2-NZ 3.45Å; D70-K74 PolarHBondContact OD2-NZ 3.07Å
71W82.2Confident79.9Confident31 Ų3165.1 Ų65.112%0.11732%0.324CS..Hα-helixtrans-76.5-43.7173.5-177.492000112.5I54 V56 L57 R61 N67 D68 S73 K74 H75 L76I54-W71 HydrophobicContact CD1-CH2 3.93Å; I54-W71 HydrophobicContact CD1-CZ2 4.43Å; I54-W71 HydrophobicContact CG2-CH2 4.43Å; I54-W71 HydrophobicContact CG2-CZ2 3.91Å; V56-W71 PolarHBondContact O-NE1 3.3Å; L57-W71 HydrophobicContact CB-CZ2 4.19Å; L57-W71 HydrophobicContact CD1-CD2 4.5Å; L57-W71 HydrophobicContact CD1-CH2 3.82Å; L57-W71 HydrophobicContact CD1-CZ2 3.54Å; L57-W71 HydrophobicContact CD1-CZ3 4.4Å; L57-W71 HydrophobicContact CG-CZ2 4.43Å; R61-W71 HydrophobicContact CB-CG 4.5Å; R61-W71 VanDerWaalsContact CD-CE3 3.4Å; R61-W71 HydrophobicContact CG-CB 4.03Å; R61-W71 HydrophobicContact CG-CD2 3.92Å; R61-W71 HydrophobicContact CG-CE3 3.86Å; R61-W71 HydrophobicContact CG-CG 4Å; N67-W71 WeakPolarHBondContact O-CB 3.44Å; N67-W71 PolarHBondContact O-N 3.13Å; D68-W71 PolarHBondContact O-N 3.24Å; W71-S73 VanDerWaalsContact C-N 3.3Å; W71-S73 PolarHBondContact O-N 2.83Å; W71-K74 PolarHBondContact O-N 2.76Å; W71-H75 AromaticContact CD1-CD2 3.39Å; W71-H75 AromaticContact CD1-NE2 3.95Å; W71-H75 HydrophobicContact CD2-CB 4.43Å; W71-H75 AromaticContact CE2-CD2 3.71Å; W71-H75 AromaticContact CG-CD2 3.82Å; W71-H75 HydrophobicContact CZ2-CB 4.17Å; W71-H75 AromaticContact NE1-CD2 3.29Å; W71-H75 PolarHBondContact NE1-CD2 2.85Å; W71-H75 VanDerWaalsContact NE1-CD2 3.29Å; W71-H75 AromaticContact NE1-NE2 3.89Å; W71-H75 PolarHBondContact O-CD2 3Å; W71-H75 PolarHBondContact O-N 3.34Å; W71-L76 HydrophobicContact CE3-CD1 4.12Å; W71-L76 HydrophobicContact CH2-CD1 3.67Å; W71-L76 HydrophobicContact CZ3-CD1 3.31Å
72R82.1Confident80.4Confident29 Ų2965.8 Ų65.811%0.10933%0.331CS..Hα-helixtrans-54.8-47.1175.1-76.5167.967.476.4-14.5110.8D68 K74 H75 L76 C118 L119 D120D68-R72 VanDerWaalsContact O-CB 3.3Å; D68-R72 WeakPolarHBondContact O-CB 3.42Å; D68-R72 WeakPolarHBondContact O-CG 3.3Å; D68-R72 PolarHBondContact O-N 2.65Å; D68-R72 VanDerWaalsContact OD1-CD 3.23Å; D68-R72 WeakPolarHBondContact OD1-CD 3.06Å; D68-R72 WeakPolarHBondContact OD2-CD 3.47Å; D68-R72 IonicContact OD2-NE 3.94Å; R72-K74 PolarHBondContact O-N 3Å; R72-H75 PolarHBondContact O-N 2.94Å; R72-L76 HydrophobicContact CG-CD2 4.5Å; R72-L76 PolarHBondContact O-N 3.12Å; R72-C118 PolarHBondContact NH1-O 3.17Å; R72-L119 PolarHBondContact NH1-O 2.84Å; R72-D120 IonicContact CZ-OD2 3.63Å; R72-D120 IonicContact NH2-OD2 3.71Å; R72-D120 PolarHBondContact NH2-OD2 3.01Å
73S78Confident81.1Confident87 Ų8767.8 Ų67.861%0.60834%0.344SS*.Hα-helixtrans-61.2-25.3178.7-61.10000114Q69 W71Q69-S73 VanDerWaalsContact O-CB 3.31Å; Q69-S73 WeakPolarHBondContact O-CB 3.4Å; Q69-S73 PolarHBondContact O-N 3.04Å; Q69-S73 PolarHBondContact O-OG 3.3Å; W71-S73 VanDerWaalsContact C-N 3.3Å; W71-S73 PolarHBondContact O-N 2.83Å
74K80.5Confident81.9Confident131 Ų13166.2 Ų66.257%0.5734%0.335SS*.Hα-helixtrans-93.5-29.1-179.3-67163.4-161.3162.40113.3D70 W71 R72D70-K74 WeakPolarHBondContact O-CD 3.11Å; D70-K74 WeakPolarHBondContact O-CE 3.45Å; D70-K74 VanDerWaalsContact O-CG 3.23Å; D70-K74 WeakPolarHBondContact O-CG 3.22Å; D70-K74 PolarHBondContact O-NZ 2.87Å; D70-K74 IonicContact OD1-NZ 3.49Å; D70-K74 IonicContact OD2-NZ 3.45Å; D70-K74 PolarHBondContact OD2-NZ 3.07Å; W71-K74 PolarHBondContact O-N 2.76Å; R72-K74 PolarHBondContact O-N 3Å
75H78.8Confident82.8Confident86 Ų8665 Ų6540%0.39833%0.328SS..Hα-helixtrans-122.5-22.2-166.4-64.7-64.6000115.9W71 R72W71-H75 AromaticContact CD1-CD2 3.39Å; W71-H75 AromaticContact CD1-NE2 3.95Å; W71-H75 HydrophobicContact CD2-CB 4.43Å; W71-H75 AromaticContact CE2-CD2 3.71Å; W71-H75 AromaticContact CG-CD2 3.82Å; W71-H75 HydrophobicContact CZ2-CB 4.17Å; W71-H75 AromaticContact NE1-CD2 3.29Å; W71-H75 PolarHBondContact NE1-CD2 2.85Å; W71-H75 VanDerWaalsContact NE1-CD2 3.29Å; W71-H75 AromaticContact NE1-NE2 3.89Å; W71-H75 PolarHBondContact O-CD2 3Å; W71-H75 PolarHBondContact O-N 3.34Å; R72-H75 PolarHBondContact O-N 2.94Å
76L82.3Confident83.4Confident23 Ų2364.1 Ų64.112%0.1233%0.332CS..SBendtrans-100.4141.6-177-93.567.1000112.8I54 W71 R72 Y81 C118I54-L76 HydrophobicContact CD1-CD1 4Å; W71-L76 HydrophobicContact CE3-CD1 4.12Å; W71-L76 HydrophobicContact CH2-CD1 3.67Å; W71-L76 HydrophobicContact CZ3-CD1 3.31Å; R72-L76 HydrophobicContact CG-CD2 4.5Å; R72-L76 PolarHBondContact O-N 3.12Å; L76-Y81 HydrophobicContact CD2-CE2 3.99Å; L76-C118 HydrophobicContact CD2-CB 3.98Å
77P81.1Confident84.1Confident62 Ų6258.2 Ų58.240%0.40330%0.302SS..  trans-60.9136.4161.4-19.832.6000110.4I50 L79 Y81I50-P77 HydrophobicContact CD1-CG 4.48Å; I50-P77 HydrophobicContact CG1-CG 4.36Å; I50-P77 HydrophobicContact CG2-CG 4.41Å; P77-L79 HydrophobicContact CB-CD1 4.23Å; P77-L79 HydrophobicContact CB-CG 4.15Å; P77-L79 PolarHBondContact O-N 2.97Å; P77-Y81 WeakPolarHBondContact O-CE2 3.35Å; P77-Y81 PolarHBondContact O-OH 2.92Å
78Q79.8Confident84.8Confident205 Ų20555.2 Ų55.296%0.95829%0.286SS*.  trans-64.694.2167.8-70.4176.9-16.600109.4
79L83.4Confident85.3Confident36 Ų3656.5 Ų56.519%0.18829%0.292CS..  trans-131.8157.4174.1-65.3173.7000108.2Y9 I50 P77 Y81Y9-L79 HydrophobicContact CD1-CB 4.31Å; Y9-L79 HydrophobicContact CD1-CD1 4.43Å; Y9-L79 HydrophobicContact CD1-CD2 4.02Å; Y9-L79 HydrophobicContact CD1-CG 4.49Å; Y9-L79 HydrophobicContact CD2-CD1 4.21Å; Y9-L79 HydrophobicContact CE1-CB 4Å; Y9-L79 HydrophobicContact CE2-CD1 4.37Å; Y9-L79 HydrophobicContact CG-CD1 4.23Å; Y9-L79 HydrophobicContact CG-CD2 4.27Å; I50-L79 HydrophobicContact CD1-CD1 3.93Å; P77-L79 HydrophobicContact CB-CD1 4.23Å; P77-L79 HydrophobicContact CB-CG 4.15Å; P77-L79 PolarHBondContact O-N 2.97Å; L79-Y81 HydrophobicContact CB-CE1 4.13Å; L79-Y81 HydrophobicContact CB-CE2 4.01Å; L79-Y81 HydrophobicContact CD1-CE1 4.44Å; L79-Y81 WeakPolarHBondContact O-CD2 3.19Å; L79-Y81 WeakPolarHBondContact O-CE2 3.2Å; L79-Y81 PolarHBondContact O-N 3.3Å
80D86.6Confident85.9Confident73 Ų7352.9 Ų52.939%0.3928%0.278SS..  trans-79.298.4175.5-174.9-7.6000110.1Y9 L13 G82 T83Y9-D80 VanDerWaalsContact CE1-O 3.28Å; Y9-D80 WeakPolarHBondContact CE1-O 3.41Å; Y9-D80 PolarHBondContact OH-O 3.14Å; L13-D80 HydrophobicContact CD2-CB 3.94Å; D80-G82 PolarHBondContact OD1-N 3.06Å; D80-T83 VanDerWaalsContact CG-CB 3.45Å; D80-T83 VanDerWaalsContact CG-OG1 3.23Å; D80-T83 VanDerWaalsContact OD1-CB 3.24Å; D80-T83 WeakPolarHBondContact OD1-CB 3.48Å; D80-T83 PolarHBondContact OD1-N 2.82Å; D80-T83 PolarHBondContact OD1-OG1 2.66Å; D80-T83 VanDerWaalsContact OD1-OG1 3.08Å; D80-T83 WeakPolarHBondContact OD2-CB 3.41Å; D80-T83 PolarHBondContact OD2-OG1 2.88Å
81Y88.8Confident86.4Confident7 Ų748.8 Ų48.83%0.02726%0.256CS..  trans-91.4-29.9175.6-55.4-75.2000112L47 I50 L76 P77 L79 L84 Y85 L115 C118L47-Y81 HydrophobicContact CD2-CD1 4.22Å; L47-Y81 HydrophobicContact CD2-CE1 4.13Å; I50-Y81 HydrophobicContact CD1-CE1 4.44Å; L76-Y81 HydrophobicContact CD2-CE2 3.99Å; P77-Y81 WeakPolarHBondContact O-CE2 3.35Å; P77-Y81 PolarHBondContact O-OH 2.92Å; L79-Y81 HydrophobicContact CB-CE1 4.13Å; L79-Y81 HydrophobicContact CB-CE2 4.01Å; L79-Y81 HydrophobicContact CD1-CE1 4.44Å; L79-Y81 WeakPolarHBondContact O-CD2 3.19Å; L79-Y81 WeakPolarHBondContact O-CE2 3.2Å; L79-Y81 PolarHBondContact O-N 3.3Å; Y81-L84 WeakPolarHBondContact O-CB 3.02Å; Y81-L84 PolarHBondContact O-N 3.37Å; Y81-Y85 PolarHBondContact O-N 2.97Å; Y81-L115 HydrophobicContact CD1-CD1 4.04Å; Y81-C118 HydrophobicContact CD1-CB 3.71Å; Y81-C118 WeakPolarHBondContact CD2-O 3.43Å; Y81-C118 HydrophobicContact CE1-CB 3.76Å; Y81-C118 HydrophobicContact CG-CB 4.2Å
82G88.7Confident86.7Confident17 Ų1747.5 Ų47.518%0.17525%0.252CS..Hα-helixtrans-68.6-48.4-179.300000113.1D80 L84 Y85 L86D80-G82 PolarHBondContact OD1-N 3.06Å; G82-L84 PolarHBondContact O-N 3Å; G82-Y85 WeakPolarHBondContact O-CB 3.34Å; G82-Y85 PolarHBondContact O-N 3.03Å; G82-Y85 VanDerWaalsContact O-N 3.08Å; G82-L86 WeakPolarHBondContact O-CG 3.45Å; G82-L86 PolarHBondContact O-N 3.28Å
83T90.1Very high87.1Confident48 Ų4849.7 Ų49.729%0.29426%0.263SS..Hα-helixtrans-63.3-32.7174.3-55.50000111.3L13 D80 C87L13-T83 HydrophobicContact CD1-CG2 4.36Å; L13-T83 HydrophobicContact CD2-CG2 4.4Å; L13-T83 HydrophobicContact CG-CG2 4.46Å; D80-T83 VanDerWaalsContact CG-CB 3.45Å; D80-T83 VanDerWaalsContact CG-OG1 3.23Å; D80-T83 VanDerWaalsContact OD1-CB 3.24Å; D80-T83 WeakPolarHBondContact OD1-CB 3.48Å; D80-T83 PolarHBondContact OD1-N 2.82Å; D80-T83 PolarHBondContact OD1-OG1 2.66Å; D80-T83 VanDerWaalsContact OD1-OG1 3.08Å; D80-T83 WeakPolarHBondContact OD2-CB 3.41Å; D80-T83 PolarHBondContact OD2-OG1 2.88Å; T83-C87 WeakPolarHBondContact O-CB 3.46Å; T83-C87 PolarHBondContact O-N 3.1Å; T83-C87 PolarHBondContact O-SG 3Å
84L91.7Very high87.5Confident0 Ų047.2 Ų47.20%024%0.242CC..Hα-helixtrans-63.6-47.9172.5177.459.7000110.3Y9 L13 L16 F43 L47 Y81 G82 C87 L88 L115Y9-L84 HydrophobicContact CE2-CD2 4.35Å; Y9-L84 WeakPolarHBondContact OH-CD2 3.21Å; L13-L84 HydrophobicContact CD1-CB 3.93Å; L13-L84 HydrophobicContact CD1-CD1 4.15Å; L16-L84 HydrophobicContact CD2-CD1 3.62Å; F43-L84 HydrophobicContact CB-CD2 4.39Å; F43-L84 HydrophobicContact CD1-CD1 4.01Å; F43-L84 HydrophobicContact CD1-CD2 3.74Å; F43-L84 HydrophobicContact CD2-CD1 3.95Å; F43-L84 HydrophobicContact CE1-CD1 4.1Å; F43-L84 HydrophobicContact CE1-CD2 4.25Å; F43-L84 HydrophobicContact CE2-CD1 4.05Å; F43-L84 HydrophobicContact CG-CD1 3.95Å; F43-L84 HydrophobicContact CG-CD2 4.11Å; F43-L84 HydrophobicContact CZ-CD1 4.11Å; L47-L84 HydrophobicContact CD1-CD2 4.43Å; Y81-L84 WeakPolarHBondContact O-CB 3.02Å; Y81-L84 PolarHBondContact O-N 3.37Å; G82-L84 PolarHBondContact O-N 3Å; L84-C87 WeakPolarHBondContact O-CB 3.24Å; L84-C87 PolarHBondContact O-N 2.86Å; L84-L88 HydrophobicContact CD1-CD2 4.37Å; L84-L88 HydrophobicContact CD1-CG 4.38Å; L84-L88 WeakPolarHBondContact O-CG 3.39Å; L84-L88 PolarHBondContact O-N 3.21Å; L84-L115 HydrophobicContact CD2-CD1 4.03Å; L84-L115 HydrophobicContact CD2-CD2 4.24Å; L84-L115 HydrophobicContact CG-CD2 4.04Å
85Y92.5Very high87.8Confident13 Ų1341 Ų415%0.05122%0.215CC..Hα-helixtrans-56.5-51.3177.8-179.2-126.2000112.4Y81 G82 C87 L88 L89 L115 L119 C123 A127 A130Y81-Y85 PolarHBondContact O-N 2.97Å; G82-Y85 WeakPolarHBondContact O-CB 3.34Å; G82-Y85 PolarHBondContact O-N 3.03Å; G82-Y85 VanDerWaalsContact O-N 3.08Å; Y85-C87 VanDerWaalsContact C-N 3.33Å; Y85-C87 PolarHBondContact O-N 3.46Å; Y85-L88 WeakPolarHBondContact O-CA 3.35Å; Y85-L88 WeakPolarHBondContact O-CB 3.21Å; Y85-L88 PolarHBondContact O-N 3.34Å; Y85-L89 HydrophobicContact CD1-CD1 4.45Å; Y85-L89 HydrophobicContact CE1-CD1 3.94Å; Y85-L89 HydrophobicContact CE2-CD1 4.38Å; Y85-L89 HydrophobicContact CE2-CD2 3.98Å; Y85-L89 HydrophobicContact CE2-CG 4.22Å; Y85-L89 PolarHBondContact O-N 3.21Å; Y85-L115 HydrophobicContact CD2-CD2 4.34Å; Y85-L119 HydrophobicContact CD1-CD2 4.38Å; Y85-L119 HydrophobicContact CD2-CD1 4.11Å; Y85-L119 HydrophobicContact CD2-CD2 4.28Å; Y85-L119 HydrophobicContact CE2-CD1 4.19Å; Y85-L119 HydrophobicContact CG-CD1 4.32Å; Y85-L119 HydrophobicContact CG-CD2 3.9Å; Y85-C123 HydrophobicContact CD1-CB 3.99Å; Y85-C123 HydrophobicContact CE1-CB 4.1Å; Y85-A127 WeakPolarHBondContact OH-CA 3.49Å; Y85-A130 WeakPolarHBondContact OH-CB 3.42Å
86L91.9Very high88.1Confident106 Ų10643 Ų4356%0.55522%0.224SC*.Hα-helixtrans-56.3-45175.7-65.8172.2000111.7G82 L88 L89 T90G82-L86 WeakPolarHBondContact O-CG 3.45Å; G82-L86 PolarHBondContact O-N 3.28Å; L86-L88 VanDerWaalsContact C-N 3.26Å; L86-L88 PolarHBondContact O-N 2.66Å; L86-L89 PolarHBondContact O-N 2.85Å; L86-L89 VanDerWaalsContact O-N 3.14Å; L86-T90 PolarHBondContact O-N 3.41Å; L86-T90 PolarHBondContact O-OG1 3.28Å; L86-T90 VanDerWaalsContact O-OG1 3.12Å
87C90.7Very high88Confident5 Ų545.6 Ų45.63%0.03424%0.235CC..Hα-helixtrans-60-33.8174.6-68.30000113L16 T83 L84 Y85 I91L16-C87 HydrophobicContact CD2-CB 3.74Å; L16-C87 HydrophobicContact CG-CB 4.15Å; T83-C87 WeakPolarHBondContact O-CB 3.46Å; T83-C87 PolarHBondContact O-N 3.1Å; T83-C87 PolarHBondContact O-SG 3Å; L84-C87 WeakPolarHBondContact O-CB 3.24Å; L84-C87 PolarHBondContact O-N 2.86Å; Y85-C87 VanDerWaalsContact C-N 3.33Å; Y85-C87 PolarHBondContact O-N 3.46Å; C87-I91 WeakPolarHBondContact O-CD1 3.33Å; C87-I91 WeakPolarHBondContact O-CG1 3.37Å; C87-I91 PolarHBondContact O-N 2.94Å
88L92.3Very high88.1Confident0 Ų043 Ų430%022%0.218CC..Hα-helixtrans-71.9-37176.2-61.2-177000111.7L16 L40 L84 Y85 L86 I91 S92 L108 T111 I112 L115L16-L88 HydrophobicContact CD2-CD2 4.35Å; L40-L88 HydrophobicContact CD2-CD2 3.38Å; L84-L88 HydrophobicContact CD1-CD2 4.37Å; L84-L88 HydrophobicContact CD1-CG 4.38Å; L84-L88 WeakPolarHBondContact O-CG 3.39Å; L84-L88 PolarHBondContact O-N 3.21Å; Y85-L88 WeakPolarHBondContact O-CA 3.35Å; Y85-L88 WeakPolarHBondContact O-CB 3.21Å; Y85-L88 PolarHBondContact O-N 3.34Å; L86-L88 VanDerWaalsContact C-N 3.26Å; L86-L88 PolarHBondContact O-N 2.66Å; L88-I91 PolarHBondContact O-N 3.49Å; L88-S92 PolarHBondContact O-N 3.07Å; L88-S92 VanDerWaalsContact O-N 3.15Å; L88-L108 HydrophobicContact CB-CD1 3.72Å; L88-L108 HydrophobicContact CD2-CD1 3.66Å; L88-L108 HydrophobicContact CG-CD1 4.14Å; L88-T111 HydrophobicContact CD1-CG2 3.75Å; L88-T111 HydrophobicContact CD2-CG2 4.29Å; L88-I112 HydrophobicContact CB-CG1 4.36Å; L88-I112 HydrophobicContact CD1-CG1 3.89Å; L88-L115 HydrophobicContact CD1-CD2 3.74Å
89L91.9Very high88.1Confident29 Ų2938 Ų3815%0.15220%0.201CC..Hα-helixtrans-64.5-48.9174.4-61.6-174000111.3Y85 L86 I91 S92 E93 A130 M134Y85-L89 HydrophobicContact CD1-CD1 4.45Å; Y85-L89 HydrophobicContact CE1-CD1 3.94Å; Y85-L89 HydrophobicContact CE2-CD1 4.38Å; Y85-L89 HydrophobicContact CE2-CD2 3.98Å; Y85-L89 HydrophobicContact CE2-CG 4.22Å; Y85-L89 PolarHBondContact O-N 3.21Å; L86-L89 PolarHBondContact O-N 2.85Å; L86-L89 VanDerWaalsContact O-N 3.14Å; L89-I91 VanDerWaalsContact C-N 3.27Å; L89-I91 PolarHBondContact O-N 3.29Å; L89-S92 WeakPolarHBondContact O-CA 3.39Å; L89-S92 VanDerWaalsContact O-CB 3.29Å; L89-S92 WeakPolarHBondContact O-CB 3.49Å; L89-S92 PolarHBondContact O-N 2.94Å; L89-S92 PolarHBondContact O-OG 2.67Å; L89-E93 PolarHBondContact O-N 2.87Å; L89-A130 HydrophobicContact CD1-CB 4.21Å; L89-A130 HydrophobicContact CD2-CB 3.99Å; L89-M134 HydrophobicContact CD2-CE 3.46Å; L89-M134 VanDerWaalsContact CD2-CE 3.46Å
90T90.6Very high88.1Confident36 Ų3641.5 Ų41.522%0.22122%0.22CC..Hα-helixtrans-59.1-36.6177.9-48.60000112.4C20 V24 L86 S92 H94C20-T90 HydrophobicContact CB-CG2 4.35Å; V24-T90 HydrophobicContact CG2-CG2 3.63Å; L86-T90 PolarHBondContact O-N 3.41Å; L86-T90 PolarHBondContact O-OG1 3.28Å; L86-T90 VanDerWaalsContact O-OG1 3.12Å; T90-S92 VanDerWaalsContact C-N 3.29Å; T90-S92 PolarHBondContact O-N 3.1Å; T90-H94 WeakPolarHBondContact O-CB 3.35Å; T90-H94 PolarHBondContact O-N 3.39Å; T90-H94 PolarHBondContact O-ND1 3.48Å
91I89.7Confident88Confident0 Ų041.1 Ų41.10%022%0.216CC..Hα-helixtrans-68.5-28.6174-68.1166.5000111.8L16 L23 I36 C87 L88 L89 I95 V104 L108L16-I91 HydrophobicContact CD1-CD1 3.68Å; L16-I91 HydrophobicContact CG-CD1 4.18Å; L23-I91 HydrophobicContact CD1-CG1 4.31Å; I36-I91 HydrophobicContact CG2-CD1 4.32Å; I36-I91 HydrophobicContact CG2-CG2 4.47Å; C87-I91 WeakPolarHBondContact O-CD1 3.33Å; C87-I91 WeakPolarHBondContact O-CG1 3.37Å; C87-I91 PolarHBondContact O-N 2.94Å; L88-I91 PolarHBondContact O-N 3.49Å; L89-I91 VanDerWaalsContact C-N 3.27Å; L89-I91 PolarHBondContact O-N 3.29Å; I91-I95 PolarHBondContact O-N 3.01Å; I91-I95 VanDerWaalsContact O-N 3.15Å; I91-V104 HydrophobicContact CG2-CG1 4.44Å; I91-L108 HydrophobicContact CG2-CD2 4.07Å
92S90.1Very high87.9Confident5 Ų542.3 Ų42.34%0.03523%0.225CC..Hα-helixtrans-71.9-43.3179.4820000112.6L88 L89 T90 I95 Y137L88-S92 PolarHBondContact O-N 3.07Å; L88-S92 VanDerWaalsContact O-N 3.15Å; L89-S92 WeakPolarHBondContact O-CA 3.39Å; L89-S92 VanDerWaalsContact O-CB 3.29Å; L89-S92 WeakPolarHBondContact O-CB 3.49Å; L89-S92 PolarHBondContact O-N 2.94Å; L89-S92 PolarHBondContact O-OG 2.67Å; T90-S92 VanDerWaalsContact C-N 3.29Å; T90-S92 PolarHBondContact O-N 3.1Å; S92-I95 WeakPolarHBondContact O-CB 3.35Å; S92-I95 WeakPolarHBondContact O-CG2 3.03Å; S92-Y137 WeakPolarHBondContact O-CB 3.46Å
93E89.4Confident87.8Confident75 Ų7542.6 Ų42.635%0.3523%0.226SC..Hα-helixtrans-60.7-47.3172.4-61.2145.2-15500110.7L89 I95 Y137L89-E93 PolarHBondContact O-N 2.87Å; E93-I95 PolarHBondContact O-N 3.26Å; E93-Y137 HydrophobicContact CB-CE2 4.41Å; E93-Y137 HydrophobicContact CG-CE2 4.04Å
94H87.7Confident87.8Confident35 Ų3540.3 Ų40.316%0.16221%0.212CC..G310 helixtrans-84.87.2-172.1-68.377.5000113.6L23 T90 Q96 K97L23-H94 HydrophobicContact CB-CB 4.21Å; T90-H94 WeakPolarHBondContact O-CB 3.35Å; T90-H94 PolarHBondContact O-N 3.39Å; T90-H94 PolarHBondContact O-ND1 3.48Å; H94-Q96 PolarHBondContact O-N 3.33Å; H94-Q96 VanDerWaalsContact O-N 3.13Å; H94-K97 PolarHBondContact CD2-NZ 3.24Å; H94-K97 WeakPolarHBondContact O-CB 3.45Å; H94-K97 PolarHBondContact O-N 3.21Å
95I86.2Confident87.7Confident0 Ų040.3 Ų40.30%021%0.212CC..G310 helixtrans-56.1-33.3-174.4-166.964.2000113I91 S92 E93 K97 L98 Q101 V104 Y137 F138I91-I95 PolarHBondContact O-N 3.01Å; I91-I95 VanDerWaalsContact O-N 3.15Å; S92-I95 WeakPolarHBondContact O-CB 3.35Å; S92-I95 WeakPolarHBondContact O-CG2 3.03Å; E93-I95 PolarHBondContact O-N 3.26Å; I95-K97 PolarHBondContact O-N 3.06Å; I95-L98 HydrophobicContact CD1-CD1 4.37Å; I95-L98 WeakPolarHBondContact O-CB 3.25Å; I95-L98 PolarHBondContact O-N 2.84Å; I95-Q101 HydrophobicContact CG1-CB 4.34Å; I95-V104 HydrophobicContact CD1-CB 3.87Å; I95-V104 HydrophobicContact CD1-CG1 3.69Å; I95-Y137 VanDerWaalsContact CG2-O 3.29Å; I95-Y137 WeakPolarHBondContact CG2-O 2.99Å; I95-F138 HydrophobicContact CG2-CD1 4.17Å
96Q84Confident87.6Confident127 Ų12743.4 Ų43.459%0.59323%0.227SC*.G310 helixtrans-62.1-29.2-178.6-62.3-174.23.500112.5H94 L98 Q101H94-Q96 PolarHBondContact O-N 3.33Å; H94-Q96 VanDerWaalsContact O-N 3.13Å; Q96-L98 PolarHBondContact O-N 3.01Å; Q96-Q101 PolarHBondContact O-NE2 3.24Å
97K81.9Confident87.6Confident78 Ų7839.7 Ų39.734%0.33921%0.207SC..G310 helixtrans-72.8-9.2177.8-53.9-175.1-174.3-178.10113.3L23 V24 N26 L30 H94 I95L23-K97 HydrophobicContact CD2-CB 4.43Å; L23-K97 VanDerWaalsContact O-CD 3.32Å; L23-K97 WeakPolarHBondContact O-CD 3.32Å; L23-K97 PolarHBondContact O-NZ 3.38Å; V24-K97 PolarHBondContact O-NZ 3.04Å; N26-K97 WeakPolarHBondContact OD1-CE 3.2Å; N26-K97 PolarHBondContact OD1-NZ 2.8Å; L30-K97 HydrophobicContact CD2-CB 4.29Å; L30-K97 WeakPolarHBondContact CD2-O 3.44Å; H94-K97 PolarHBondContact CD2-NZ 3.24Å; H94-K97 WeakPolarHBondContact O-CB 3.45Å; H94-K97 PolarHBondContact O-N 3.21Å; I95-K97 PolarHBondContact O-N 3.06Å
98L81.9Confident87.7Confident9 Ų939.5 Ų39.55%0.04721%0.205CC..SBendtrans-101.2144.4-175.5-69.2172.8000113.2L23 I36 I95 Q96 Q101 V104L23-L98 HydrophobicContact CD1-CD1 4.38Å; L23-L98 HydrophobicContact CD2-CD2 3.77Å; L23-L98 HydrophobicContact CD2-CG 4.05Å; I36-L98 HydrophobicContact CD1-CD1 3.64Å; I36-L98 HydrophobicContact CD1-CD2 3.66Å; I36-L98 HydrophobicContact CD1-CG 4.31Å; I95-L98 HydrophobicContact CD1-CD1 4.37Å; I95-L98 WeakPolarHBondContact O-CB 3.25Å; I95-L98 PolarHBondContact O-N 2.84Å; Q96-L98 PolarHBondContact O-N 3.01Å; L98-Q101 WeakPolarHBondContact O-CG 3.14Å; L98-V104 HydrophobicContact CD1-CG1 4.14Å
99T81.2Confident87.7Confident100 Ų10040 Ų4061%0.61321%0.208SC*.THydrogen-bonded Turntrans-75.6150.9169.257.30000110.9S33 Q101S33-T99 WeakPolarHBondContact CB-O 3.31Å; S33-T99 PolarHBondContact OG-O 2.93Å; S33-T99 VanDerWaalsContact OG-O 3.08Å; S33-T99 PolarHBondContact OG-OG1 2.9Å; T99-Q101 PolarHBondContact O-N 3.3Å
100N82.2Confident87.6Confident108 Ų10844 Ų4458%0.57822%0.221SC*.THydrogen-bonded Turntrans56.245.6179.9-166.316.8000113.7S102 A103 V104N100-S102 PolarHBondContact O-N 3.05Å; N100-A103 WeakPolarHBondContact ND2-CB 3.45Å; N100-A103 PolarHBondContact O-N 3.2Å; N100-A103 VanDerWaalsContact O-N 3.11Å; N100-V104 PolarHBondContact O-N 2.91Å
101Q84.7Confident87.7Confident66 Ų6642.2 Ų42.231%0.30821%0.21SC..Hα-helixtrans-44.7-52.8-175.4-62.3169.9-9.900113.1I95 Q96 L98 T99 A103 V104 C105I95-Q101 HydrophobicContact CG1-CB 4.34Å; Q96-Q101 PolarHBondContact O-NE2 3.24Å; L98-Q101 WeakPolarHBondContact O-CG 3.14Å; T99-Q101 PolarHBondContact O-N 3.3Å; Q101-A103 VanDerWaalsContact C-N 3.3Å; Q101-A103 PolarHBondContact O-N 3.35Å; Q101-V104 CarbonylContact O-C 3.59Å; Q101-V104 WeakPolarHBondContact O-CA 3.38Å; Q101-V104 WeakPolarHBondContact O-CB 3.46Å; Q101-V104 PolarHBondContact O-N 3.22Å; Q101-C105 PolarHBondContact O-N 2.58Å; Q101-C105 PolarHBondContact O-SG 3.44Å; Q101-C105 VanDerWaalsContact O-SG 3.33Å
102S86.8Confident87.8Confident31 Ų3142.3 Ų42.322%0.21721%0.211CC..Hα-helixtrans-57.1-36.8-177-55.90000114N100 C105 E106 N141 M142N100-S102 PolarHBondContact O-N 3.05Å; S102-C105 PolarHBondContact O-N 3.02Å; S102-E106 WeakPolarHBondContact O-CB 3.49Å; S102-E106 PolarHBondContact O-N 3.45Å; S102-N141 PolarHBondContact OG-ND2 2.74Å; S102-N141 PolarHBondContact OG-OD1 2.55Å; S102-M142 VanDerWaalsContact O-SD 3.42Å
103A87.1Confident87.8Confident24 Ų2444.1 Ų44.120%0.19822%0.218CC..Hα-helixtrans-72.1-32.8176.900000112.3N100 Q101 H107N100-A103 WeakPolarHBondContact ND2-CB 3.45Å; N100-A103 PolarHBondContact O-N 3.2Å; N100-A103 VanDerWaalsContact O-N 3.11Å; Q101-A103 VanDerWaalsContact C-N 3.3Å; Q101-A103 PolarHBondContact O-N 3.35Å; A103-H107 PolarHBondContact O-CD2 2.77Å; A103-H107 PolarHBondContact O-N 3.32Å
104V89.2Confident87.8Confident0 Ų040.9 Ų40.90%020%0.204CC..Hα-helixtrans-68.6-47.6172.1-178.10000109.5I36 L40 I91 I95 L98 N100 Q101 E106 H107 L108I36-V104 HydrophobicContact CG2-CG1 4.29Å; L40-V104 HydrophobicContact CD1-CG1 4.36Å; I91-V104 HydrophobicContact CG2-CG1 4.44Å; I95-V104 HydrophobicContact CD1-CB 3.87Å; I95-V104 HydrophobicContact CD1-CG1 3.69Å; L98-V104 HydrophobicContact CD1-CG1 4.14Å; N100-V104 PolarHBondContact O-N 2.91Å; Q101-V104 CarbonylContact O-C 3.59Å; Q101-V104 WeakPolarHBondContact O-CA 3.38Å; Q101-V104 WeakPolarHBondContact O-CB 3.46Å; Q101-V104 PolarHBondContact O-N 3.22Å; V104-E106 PolarHBondContact O-N 2.71Å; V104-H107 CarbonylContact O-C 3.31Å; V104-H107 PolarHBondContact O-N 3.37Å; V104-L108 VanDerWaalsContact O-CB 3.26Å; V104-L108 WeakPolarHBondContact O-CB 3.34Å; V104-L108 PolarHBondContact O-N 3.13Å
105C90.6Very high87.9Confident0 Ų039.2 Ų39.20%020%0.197CC..Hα-helixtrans-54.4-46.8174.2-64.90000112.7Q101 S102 H107 L108 L109 F138 M142Q101-C105 PolarHBondContact O-N 2.58Å; Q101-C105 PolarHBondContact O-SG 3.44Å; Q101-C105 VanDerWaalsContact O-SG 3.33Å; S102-C105 PolarHBondContact O-N 3.02Å; C105-H107 VanDerWaalsContact C-N 3.33Å; C105-H107 PolarHBondContact O-N 2.71Å; C105-L108 WeakPolarHBondContact O-CB 3.36Å; C105-L108 PolarHBondContact O-N 3Å; C105-L108 VanDerWaalsContact O-N 3.11Å; C105-L109 WeakPolarHBondContact O-CG 3.06Å; C105-L109 PolarHBondContact O-N 2.69Å; C105-F138 HydrophobicContact CB-CD2 4.05Å; C105-F138 HydrophobicContact CB-CE2 3.8Å; C105-F138 HydrophobicContact CB-CZ 4.21Å; C105-M142 HydrophobicContact CB-CB 4.45Å; C105-M142 HydrophobicContact CB-CG 3.76Å; C105-M142 HydrophobicContact CB-SD 3.72Å
106E90.3Very high88Confident78 Ų7839.2 Ų39.236%0.36420%0.197SC..Hα-helixtrans-61.6-39.1179.6-171.5-172.4160.900112S102 V104 R110S102-E106 WeakPolarHBondContact O-CB 3.49Å; S102-E106 PolarHBondContact O-N 3.45Å; V104-E106 PolarHBondContact O-N 2.71Å; E106-R110 WeakPolarHBondContact O-CG 3.38Å; E106-R110 PolarHBondContact O-N 3.48Å; E106-R110 IonicContact OE1-CZ 3.75Å; E106-R110 IonicContact OE1-NH1 3.13Å; E106-R110 PolarHBondContact OE1-NH1 3.19Å; E106-R110 IonicContact OE1-NH2 2.7Å; E106-R110 PolarHBondContact OE1-NH2 3.26Å
107H90.9Very high88.1Confident28 Ų2833.2 Ų33.213%0.1317%0.169CC..Hα-helixtrans-78-29172.5-78.1-74.7000112.9L40 K41 Q44 A103 V104 C105 T111L40-H107 HydrophobicContact CB-CB 4.13Å; L40-H107 HydrophobicContact CD1-CB 4.01Å; K41-H107 WeakPolarHBondContact CE-CE1 2.91Å; K41-H107 WeakPolarHBondContact CE-NE2 3.36Å; Q44-H107 VanDerWaalsContact NE2-CA 3.33Å; Q44-H107 PolarHBondContact NE2-ND1 2.7Å; Q44-H107 VanDerWaalsContact NE2-ND1 3.19Å; Q44-H107 PolarHBondContact NE2-O 2.61Å; Q44-H107 PolarHBondContact OE1-ND1 2.94Å; A103-H107 PolarHBondContact O-CD2 2.77Å; A103-H107 PolarHBondContact O-N 3.32Å; V104-H107 CarbonylContact O-C 3.31Å; V104-H107 PolarHBondContact O-N 3.37Å; C105-H107 VanDerWaalsContact C-N 3.33Å; C105-H107 PolarHBondContact O-N 2.71Å; H107-T111 WeakPolarHBondContact O-CB 3.31Å; H107-T111 PolarHBondContact O-N 3.32Å; H107-T111 PolarHBondContact O-OG1 3.23Å
108L92.3Very high88.3Confident0 Ų029.5 Ų29.50%015%0.152CC..Hα-helixtrans-64.6-54.8176.9-17350.6000110.1L40 L88 I91 V104 C105 R110 T111 I112 F138L40-L108 HydrophobicContact CD1-CB 4.43Å; L40-L108 HydrophobicContact CD2-CD1 4.28Å; L88-L108 HydrophobicContact CB-CD1 3.72Å; L88-L108 HydrophobicContact CD2-CD1 3.66Å; L88-L108 HydrophobicContact CG-CD1 4.14Å; I91-L108 HydrophobicContact CG2-CD2 4.07Å; V104-L108 VanDerWaalsContact O-CB 3.26Å; V104-L108 WeakPolarHBondContact O-CB 3.34Å; V104-L108 PolarHBondContact O-N 3.13Å; C105-L108 WeakPolarHBondContact O-CB 3.36Å; C105-L108 PolarHBondContact O-N 3Å; C105-L108 VanDerWaalsContact O-N 3.11Å; L108-R110 PolarHBondContact O-N 3.37Å; L108-T111 WeakPolarHBondContact O-CA 3.21Å; L108-T111 WeakPolarHBondContact O-CB 3.17Å; L108-T111 PolarHBondContact O-N 3.31Å; L108-I112 HydrophobicContact CD1-CD1 4.28Å; L108-I112 HydrophobicContact CG-CD1 4.06Å; L108-I112 WeakPolarHBondContact O-CG1 3.14Å; L108-I112 PolarHBondContact O-N 2.9Å; L108-F138 HydrophobicContact CD2-CE1 4.36Å; L108-F138 HydrophobicContact CD2-CZ 4Å
109L92.5Very high88.6Confident10 Ų1029.1 Ų29.15%0.05215%0.15CC..Hα-helixtrans-58.5-41.5177.2-66.1172.7000112.9C105 T111 I112 Q113 M134 F138 V146 L149C105-L109 WeakPolarHBondContact O-CG 3.06Å; C105-L109 PolarHBondContact O-N 2.69Å; L109-T111 VanDerWaalsContact C-N 3.29Å; L109-T111 PolarHBondContact O-N 3.28Å; L109-I112 HydrophobicContact CD2-CD1 4.48Å; L109-I112 PolarHBondContact O-N 3.12Å; L109-Q113 WeakPolarHBondContact O-CB 3.31Å; L109-Q113 PolarHBondContact O-N 3.41Å; L109-M134 HydrophobicContact CD2-SD 4.16Å; L109-F138 HydrophobicContact CD1-CE2 4.02Å; L109-F138 HydrophobicContact CD2-CE2 4.04Å; L109-F138 HydrophobicContact CG-CE2 3.95Å; L109-V146 HydrophobicContact CD1-CG2 4.02Å; L109-V146 HydrophobicContact CD2-CG2 4.2Å; L109-L149 HydrophobicContact CB-CD2 4.36Å; L109-L149 HydrophobicContact CD2-CD2 3.72Å
110R90.6Very high88.8Confident113 Ų11326.5 Ų26.543%0.42613%0.133SC..Hα-helixtrans-66.7-28.8174.4-76.7-178.3-176.8135.711113.8E106 L108 S114E106-R110 WeakPolarHBondContact O-CG 3.38Å; E106-R110 PolarHBondContact O-N 3.48Å; E106-R110 IonicContact OE1-CZ 3.75Å; E106-R110 IonicContact OE1-NH1 3.13Å; E106-R110 PolarHBondContact OE1-NH1 3.19Å; E106-R110 IonicContact OE1-NH2 2.7Å; E106-R110 PolarHBondContact OE1-NH2 3.26Å; L108-R110 PolarHBondContact O-N 3.37Å; R110-S114 PolarHBondContact O-N 2.74Å; R110-S114 PolarHBondContact O-OG 2.82Å
111T91.7Very high89Confident0 Ų022.3 Ų22.30%011%0.109CC..Hα-helixtrans-72.4-45.5173.9-47.30000109.5L40 F43 Q44 L47 L88 H107 L108 L109 S114 L115L40-T111 HydrophobicContact CD2-CG2 4.42Å; F43-T111 HydrophobicContact CB-CG2 3.9Å; Q44-T111 WeakPolarHBondContact CG-OG1 3.12Å; Q44-T111 PolarHBondContact NE2-OG1 2.99Å; Q44-T111 VanDerWaalsContact NE2-OG1 3.16Å; L47-T111 HydrophobicContact CD1-CG2 4.24Å; L88-T111 HydrophobicContact CD1-CG2 3.75Å; L88-T111 HydrophobicContact CD2-CG2 4.29Å; H107-T111 WeakPolarHBondContact O-CB 3.31Å; H107-T111 PolarHBondContact O-N 3.32Å; H107-T111 PolarHBondContact O-OG1 3.23Å; L108-T111 WeakPolarHBondContact O-CA 3.21Å; L108-T111 WeakPolarHBondContact O-CB 3.17Å; L108-T111 PolarHBondContact O-N 3.31Å; L109-T111 VanDerWaalsContact C-N 3.29Å; L109-T111 PolarHBondContact O-N 3.28Å; T111-S114 CarbonylContact O-C 3.59Å; T111-S114 PolarHBondContact O-N 3.25Å; T111-S114 VanDerWaalsContact O-N 3.16Å; T111-L115 VanDerWaalsContact O-CB 3.24Å; T111-L115 WeakPolarHBondContact O-CB 3.18Å; T111-L115 PolarHBondContact O-N 3.13Å
112I92.1Very high89Confident2 Ų223.3 Ų23.31%0.0112%0.116CC..Hα-helixtrans-58.8-48.2175-63.1157.9000110.9L88 L108 L109 S114 L115 I116 I131 M134 L149L88-I112 HydrophobicContact CB-CG1 4.36Å; L88-I112 HydrophobicContact CD1-CG1 3.89Å; L108-I112 HydrophobicContact CD1-CD1 4.28Å; L108-I112 HydrophobicContact CG-CD1 4.06Å; L108-I112 WeakPolarHBondContact O-CG1 3.14Å; L108-I112 PolarHBondContact O-N 2.9Å; L109-I112 HydrophobicContact CD2-CD1 4.48Å; L109-I112 PolarHBondContact O-N 3.12Å; I112-S114 PolarHBondContact O-N 2.96Å; I112-L115 CarbonylContact O-C 3.54Å; I112-L115 WeakPolarHBondContact O-CA 3.17Å; I112-L115 PolarHBondContact O-N 2.86Å; I112-I116 HydrophobicContact CG2-CD1 4.11Å; I112-I116 HydrophobicContact CG2-CG1 4.34Å; I112-I116 WeakPolarHBondContact O-CG1 3.26Å; I112-I116 PolarHBondContact O-N 2.82Å; I112-I131 HydrophobicContact CG2-CD1 3.79Å; I112-I131 HydrophobicContact CG2-CG1 4.13Å; I112-M134 HydrophobicContact CD1-CE 3.63Å; I112-M134 HydrophobicContact CD1-SD 3.8Å; I112-L149 HydrophobicContact CB-CD2 4.39Å; I112-L149 HydrophobicContact CG2-CD2 4.07Å
113Q91.3Very high89Confident42 Ų4223.4 Ų23.420%0.19612%0.117CC..Hα-helixtrans-52.5-43.8174.6-170.6-171.50.300112.1L109 L115 F117 L149 V153 P292L109-Q113 WeakPolarHBondContact O-CB 3.31Å; L109-Q113 PolarHBondContact O-N 3.41Å; Q113-L115 VanDerWaalsContact C-N 3.32Å; Q113-F117 VanDerWaalsContact O-CD2 3.25Å; Q113-F117 WeakPolarHBondContact O-CD2 3.4Å; Q113-L149 HydrophobicContact CB-CD1 3.7Å; Q113-L149 HydrophobicContact CG-CD1 3.92Å; Q113-V153 HydrophobicContact CG-CG1 4.31Å; Q113-V153 HydrophobicContact CG-CG2 4.23Å; Q113-P292 PolarHBondContact NE2-O 3.13Å
114S87.8Confident89Confident8 Ų822.5 Ų22.56%0.05611%0.108CC..Hα-helixtrans-75.7-22.4179.1-52.60000112.8R110 T111 I112R110-S114 PolarHBondContact O-N 2.74Å; R110-S114 PolarHBondContact O-OG 2.82Å; T111-S114 CarbonylContact O-C 3.59Å; T111-S114 PolarHBondContact O-N 3.25Å; T111-S114 VanDerWaalsContact O-N 3.16Å; I112-S114 PolarHBondContact O-N 2.96Å
115L90.6Very high88.9Confident0 Ų023.7 Ų23.70%011%0.114CC..Hα-helixtrans-88.6-32.2-176.5-175.860000112.6L47 Y81 L84 Y85 L88 T111 I112 Q113 F117 C118 L119L47-L115 HydrophobicContact CD1-CB 3.98Å; L47-L115 HydrophobicContact CD1-CD1 4.21Å; L47-L115 HydrophobicContact CD2-CD1 4.03Å; Y81-L115 HydrophobicContact CD1-CD1 4.04Å; L84-L115 HydrophobicContact CD2-CD1 4.03Å; L84-L115 HydrophobicContact CD2-CD2 4.24Å; L84-L115 HydrophobicContact CG-CD2 4.04Å; Y85-L115 HydrophobicContact CD2-CD2 4.34Å; L88-L115 HydrophobicContact CD1-CD2 3.74Å; T111-L115 VanDerWaalsContact O-CB 3.24Å; T111-L115 WeakPolarHBondContact O-CB 3.18Å; T111-L115 PolarHBondContact O-N 3.13Å; I112-L115 CarbonylContact O-C 3.54Å; I112-L115 WeakPolarHBondContact O-CA 3.17Å; I112-L115 PolarHBondContact O-N 2.86Å; Q113-L115 VanDerWaalsContact C-N 3.32Å; L115-F117 VanDerWaalsContact C-N 3.25Å; L115-F117 PolarHBondContact O-N 3.45Å; L115-C118 HydrophobicContact CD1-CB 4.44Å; L115-C118 CarbonylContact O-C 3.59Å; L115-C118 VanDerWaalsContact O-C 3.26Å; L115-C118 VanDerWaalsContact O-CA 3.25Å; L115-C118 WeakPolarHBondContact O-CA 3.35Å; L115-C118 PolarHBondContact O-N 3Å; L115-L119 HydrophobicContact CD1-CD2 4.29Å; L115-L119 HydrophobicContact CD2-CD2 4.22Å; L115-L119 HydrophobicContact CG-CD2 3.84Å; L115-L119 HydrophobicContact CG-CG 4.22Å; L115-L119 WeakPolarHBondContact O-CG 3.12Å; L115-L119 PolarHBondContact O-N 2.79Å
116I89Confident88.8Confident0 Ų024.8 Ų24.80%013%0.125CC..Hα-helixtrans-50.3-46.7175.3-74.4160.1000110.9I112 C118 L119 L124 I131 L149 V154 L157I112-I116 HydrophobicContact CG2-CD1 4.11Å; I112-I116 HydrophobicContact CG2-CG1 4.34Å; I112-I116 WeakPolarHBondContact O-CG1 3.26Å; I112-I116 PolarHBondContact O-N 2.82Å; I116-C118 PolarHBondContact O-N 2.89Å; I116-L119 PolarHBondContact O-N 3.08Å; I116-L124 HydrophobicContact CG2-CD2 3.84Å; I116-I131 HydrophobicContact CD1-CD1 4.03Å; I116-L149 HydrophobicContact CD1-CD1 4.4Å; I116-V154 HydrophobicContact CD1-CG2 3.84Å; I116-L157 HydrophobicContact CG2-CD1 4.01Å
117F85.8Confident88.8Confident1 Ų121 Ų210%0.00411%0.107CC..THydrogen-bonded Turntrans-64.9-6.8175.5-62.7-81.2000114.3L51 L57 R61 F62 Q113 L115 V153 L157 P292L51-F117 HydrophobicContact CD1-CB 4.49Å; L51-F117 HydrophobicContact CD2-CB 3.51Å; L51-F117 HydrophobicContact CD2-CG 4.32Å; L57-F117 HydrophobicContact CD2-CD1 3.7Å; L57-F117 HydrophobicContact CD2-CE1 4.05Å; R61-F117 PolarHBondContact NH1-O 2.85Å; F62-F117 HydrophobicContact CZ-CD1 4.23Å; Q113-F117 VanDerWaalsContact O-CD2 3.25Å; Q113-F117 WeakPolarHBondContact O-CD2 3.4Å; L115-F117 VanDerWaalsContact C-N 3.25Å; L115-F117 PolarHBondContact O-N 3.45Å; F117-V153 HydrophobicContact CE2-CG1 4.22Å; F117-V153 HydrophobicContact CZ-CG1 4.32Å; F117-L157 HydrophobicContact CD1-CD1 4.42Å; F117-L157 HydrophobicContact CE1-CD1 3.62Å; F117-L157 HydrophobicContact CE1-CD2 3.91Å; F117-L157 HydrophobicContact CE1-CG 4.44Å; F117-L157 HydrophobicContact CE2-CD1 4.24Å; F117-L157 HydrophobicContact CZ-CD1 3.51Å; F117-L157 HydrophobicContact CZ-CD2 4.39Å; F117-P292 HydrophobicContact CD1-CG 4.15Å; F117-P292 HydrophobicContact CD2-CG 4.13Å; F117-P292 HydrophobicContact CE1-CB 4.09Å; F117-P292 HydrophobicContact CE1-CG 3.77Å; F117-P292 HydrophobicContact CE2-CB 4.32Å; F117-P292 HydrophobicContact CE2-CG 3.76Å; F117-P292 WeakPolarHBondContact CE2-O 3.49Å; F117-P292 HydrophobicContact CG-CG 4.32Å; F117-P292 HydrophobicContact CZ-CB 3.76Å; F117-P292 HydrophobicContact CZ-CG 3.56Å
118C86.5Confident88.9Confident0 Ų019.7 Ų19.70%010%0.101CC..THydrogen-bonded Turntrans-122.81.4175.9-600000115.1L47 R72 L76 Y81 L115 I116L47-C118 HydrophobicContact CD2-CB 4.2Å; R72-C118 PolarHBondContact NH1-O 3.17Å; L76-C118 HydrophobicContact CD2-CB 3.98Å; Y81-C118 HydrophobicContact CD1-CB 3.71Å; Y81-C118 WeakPolarHBondContact CD2-O 3.43Å; Y81-C118 HydrophobicContact CE1-CB 3.76Å; Y81-C118 HydrophobicContact CG-CB 4.2Å; L115-C118 HydrophobicContact CD1-CB 4.44Å; L115-C118 CarbonylContact O-C 3.59Å; L115-C118 VanDerWaalsContact O-C 3.26Å; L115-C118 VanDerWaalsContact O-CA 3.25Å; L115-C118 WeakPolarHBondContact O-CA 3.35Å; L115-C118 PolarHBondContact O-N 3Å; I116-C118 PolarHBondContact O-N 2.89Å
119L87.8Confident89Confident1 Ų120.6 Ų20.61%0.00511%0.106CC..SBendtrans-72.1156.7170.3-68.8-177000111.3R61 R72 Y85 L115 I116 C123 L124R61-L119 PolarHBondContact NH2-O 3.25Å; R72-L119 PolarHBondContact NH1-O 2.84Å; Y85-L119 HydrophobicContact CD1-CD2 4.38Å; Y85-L119 HydrophobicContact CD2-CD1 4.11Å; Y85-L119 HydrophobicContact CD2-CD2 4.28Å; Y85-L119 HydrophobicContact CE2-CD1 4.19Å; Y85-L119 HydrophobicContact CG-CD1 4.32Å; Y85-L119 HydrophobicContact CG-CD2 3.9Å; L115-L119 HydrophobicContact CD1-CD2 4.29Å; L115-L119 HydrophobicContact CD2-CD2 4.22Å; L115-L119 HydrophobicContact CG-CD2 3.84Å; L115-L119 HydrophobicContact CG-CG 4.22Å; L115-L119 WeakPolarHBondContact O-CG 3.12Å; L115-L119 PolarHBondContact O-N 2.79Å; I116-L119 PolarHBondContact O-N 3.08Å; L119-C123 HydrophobicContact CB-CB 4.28Å; L119-C123 HydrophobicContact CD1-CB 4.13Å; L119-C123 HydrophobicContact CD2-CB 4.12Å; L119-C123 HydrophobicContact CG-CB 4.4Å; L119-L124 HydrophobicContact CB-CD1 4.35Å; L119-L124 HydrophobicContact CB-CD2 3.94Å; L119-L124 HydrophobicContact CB-CG 3.74Å; L119-L124 HydrophobicContact CD1-CD2 4.21Å
120D86.1Confident89Confident45 Ų4520.8 Ų20.824%0.24111%0.109CC..  trans-79.9158.4164.817.248000110.7D68 R72 D122 C123 L124D68-D120 WeakPolarHBondContact OD2-CA 3.42Å; R72-D120 IonicContact CZ-OD2 3.63Å; R72-D120 IonicContact NH2-OD2 3.71Å; R72-D120 PolarHBondContact NH2-OD2 3.01Å; D120-D122 VanDerWaalsContact C-N 3.3Å; D120-D122 PolarHBondContact O-N 3.17Å; D120-C123 PolarHBondContact O-N 2.78Å; D120-C123 VanDerWaalsContact O-N 3.17Å; D120-C123 WeakPolarHBondContact OD1-CB 3.39Å; D120-C123 PolarHBondContact OD1-SG 3.26Å; D120-L124 WeakPolarHBondContact O-CG 3.47Å; D120-L124 PolarHBondContact O-N 2.74Å
121Y85.1Confident89.1Confident20 Ų2015.4 Ų15.48%0.0789%0.089CC..Hα-helixtrans-49.1-45.5178.9-168.3-92.1000113.5N64 R65 D68 C123 L124 E125 M161N64-Y121 VanDerWaalsContact C-CD2 3.5Å; R65-Y121 HydrophobicContact CB-CD1 3.75Å; R65-Y121 HydrophobicContact CB-CE1 4.2Å; R65-Y121 HydrophobicContact CB-CG 3.98Å; R65-Y121 HydrophobicContact CG-CD1 4.3Å; D68-Y121 HydrophobicContact CB-CD2 4.38Å; D68-Y121 PolarHBondContact OD2-N 3.18Å; Y121-C123 PolarHBondContact O-N 3.23Å; Y121-L124 WeakPolarHBondContact O-CA 3.44Å; Y121-L124 WeakPolarHBondContact O-CB 3.48Å; Y121-L124 PolarHBondContact O-N 3.01Å; Y121-E125 HydrophobicContact CD1-CG 4.24Å; Y121-E125 HydrophobicContact CE1-CG 3.72Å; Y121-E125 WeakPolarHBondContact CE1-OE1 3.33Å; Y121-E125 VanDerWaalsContact CE1-OE2 3.29Å; Y121-E125 WeakPolarHBondContact CE1-OE2 3.46Å; Y121-E125 VanDerWaalsContact CZ-OE1 3.29Å; Y121-E125 PolarHBondContact O-N 2.99Å; Y121-E125 PolarHBondContact OH-OE1 2.73Å; Y121-M161 HydrophobicContact CE2-CE 4.1Å; Y121-M161 VanDerWaalsContact OH-CE 3.25Å; Y121-M161 WeakPolarHBondContact OH-CE 3.24Å
122D84.7Confident89.1Confident87 Ų8715.4 Ų15.447%0.4659%0.089SC..Hα-helixtrans-58.9-47.1177.9-61.6-88.3000113.3R65 D120 L124R65-D122 IonicContact CZ-OD1 2.69Å; R65-D122 IonicContact CZ-OD2 2.72Å; R65-D122 IonicContact NH1-OD1 3.87Å; R65-D122 PolarHBondContact NH1-OD1 3.37Å; R65-D122 IonicContact NH1-OD2 2.55Å; R65-D122 PolarHBondContact NH1-OD2 2.9Å; R65-D122 IonicContact NH2-OD1 3.62Å; R65-D122 PolarHBondContact NH2-OD1 3.32Å; R65-D122 IonicContact NH2-OD2 3.89Å; D120-D122 VanDerWaalsContact C-N 3.3Å; D120-D122 PolarHBondContact O-N 3.17Å; D122-L124 VanDerWaalsContact C-N 3.25Å; D122-L124 PolarHBondContact O-N 2.95Å
123C86.9Confident89.2Confident33 Ų3322 Ų2222%0.22311%0.113CC..Hα-helixtrans-71.4-22.2175.8-65.30000112.5Y85 L119 D120 Y121 A127Y85-C123 HydrophobicContact CD1-CB 3.99Å; Y85-C123 HydrophobicContact CE1-CB 4.1Å; L119-C123 HydrophobicContact CB-CB 4.28Å; L119-C123 HydrophobicContact CD1-CB 4.13Å; L119-C123 HydrophobicContact CD2-CB 4.12Å; L119-C123 HydrophobicContact CG-CB 4.4Å; D120-C123 PolarHBondContact O-N 2.78Å; D120-C123 VanDerWaalsContact O-N 3.17Å; D120-C123 WeakPolarHBondContact OD1-CB 3.39Å; D120-C123 PolarHBondContact OD1-SG 3.26Å; Y121-C123 PolarHBondContact O-N 3.23Å; C123-A127 PolarHBondContact O-N 2.8Å
124L87.6Confident89.2Confident4 Ų420 Ų202%0.02110%0.104CC..Hα-helixtrans-74.4-43.4177.7-76.5165.3000111.9F62 I116 L119 D120 Y121 D122 G126 A127 P128 I158F62-L124 HydrophobicContact CD1-CD1 4.03Å; F62-L124 HydrophobicContact CE1-CD1 4.11Å; I116-L124 HydrophobicContact CG2-CD2 3.84Å; L119-L124 HydrophobicContact CB-CD1 4.35Å; L119-L124 HydrophobicContact CB-CD2 3.94Å; L119-L124 HydrophobicContact CB-CG 3.74Å; L119-L124 HydrophobicContact CD1-CD2 4.21Å; D120-L124 WeakPolarHBondContact O-CG 3.47Å; D120-L124 PolarHBondContact O-N 2.74Å; Y121-L124 WeakPolarHBondContact O-CA 3.44Å; Y121-L124 WeakPolarHBondContact O-CB 3.48Å; Y121-L124 PolarHBondContact O-N 3.01Å; D122-L124 VanDerWaalsContact C-N 3.25Å; D122-L124 PolarHBondContact O-N 2.95Å; L124-G126 VanDerWaalsContact C-N 3.26Å; L124-G126 PolarHBondContact O-N 2.69Å; L124-A127 WeakPolarHBondContact O-CB 3.28Å; L124-A127 PolarHBondContact O-N 2.72Å; L124-P128 VanDerWaalsContact O-CD 3.29Å; L124-P128 WeakPolarHBondContact O-CD 3.25Å; L124-I158 HydrophobicContact CB-CD1 4.25Å; L124-I158 HydrophobicContact CD2-CD1 3.93Å; L124-I158 HydrophobicContact CD2-CG1 4.49Å; L124-I158 VanDerWaalsContact O-CD1 3.32Å; L124-I158 WeakPolarHBondContact O-CD1 3.49Å
125E86.5Confident89.4Confident26 Ų2619.9 Ų19.912%0.12110%0.103CC..Hα-helixtrans-60.9-35.5-179.8-68.8-172.5128.300112.4Y121 P128 S167 Y168 A169Y121-E125 HydrophobicContact CD1-CG 4.24Å; Y121-E125 HydrophobicContact CE1-CG 3.72Å; Y121-E125 WeakPolarHBondContact CE1-OE1 3.33Å; Y121-E125 VanDerWaalsContact CE1-OE2 3.29Å; Y121-E125 WeakPolarHBondContact CE1-OE2 3.46Å; Y121-E125 VanDerWaalsContact CZ-OE1 3.29Å; Y121-E125 PolarHBondContact O-N 2.99Å; Y121-E125 PolarHBondContact OH-OE1 2.73Å; E125-P128 WeakPolarHBondContact O-CD 3.09Å; E125-S167 WeakPolarHBondContact OE1-CB 3.43Å; E125-S167 PolarHBondContact OE1-OG 2.93Å; E125-Y168 HydrophobicContact CB-CD1 4.5Å; E125-A169 HydrophobicContact CB-CB 4.49Å
126G88.7Confident89.4Confident22 Ų2223.2 Ų23.223%0.22712%0.121CC..THydrogen-bonded Turntrans-81.3-12.4173.400000115.8L124 L129 A130L124-G126 VanDerWaalsContact C-N 3.26Å; L124-G126 PolarHBondContact O-N 2.69Å; G126-L129 PolarHBondContact O-N 2.9Å; G126-A130 WeakPolarHBondContact O-CB 3.09Å; G126-A130 PolarHBondContact O-N 3Å; G126-A130 VanDerWaalsContact O-N 3.09Å
127A91.5Very high89.3Confident0 Ų027.2 Ų27.20%014%0.136CC..Hα-helixtrans-62.7-38.6-175.600000115.4Y85 C123 L124 L129 I131 I158Y85-A127 WeakPolarHBondContact OH-CA 3.49Å; C123-A127 PolarHBondContact O-N 2.8Å; L124-A127 WeakPolarHBondContact O-CB 3.28Å; L124-A127 PolarHBondContact O-N 2.72Å; A127-L129 PolarHBondContact O-N 3.26Å; A127-I131 HydrophobicContact CB-CD1 4.49Å; A127-I131 VanDerWaalsContact O-CB 3.32Å; A127-I131 WeakPolarHBondContact O-CB 3.41Å; A127-I131 WeakPolarHBondContact O-CD1 3.5Å; A127-I131 VanDerWaalsContact O-CG1 3.24Å; A127-I131 WeakPolarHBondContact O-CG1 3.47Å; A127-I131 PolarHBondContact O-N 2.8Å; A127-I158 HydrophobicContact CB-CD1 4.3Å
128P92.5Very high89.5Confident0 Ų027.6 Ų27.60%014%0.138CC..Hα-helixtrans-59.1-44.3176.6-2332.8000113L124 E125 T132 L150 V154 I158 Y159 I176L124-P128 VanDerWaalsContact O-CD 3.29Å; L124-P128 WeakPolarHBondContact O-CD 3.25Å; E125-P128 WeakPolarHBondContact O-CD 3.09Å; P128-T132 WeakPolarHBondContact O-CB 3.26Å; P128-T132 PolarHBondContact O-N 3.04Å; P128-T132 PolarHBondContact O-OG1 3.08Å; P128-L150 HydrophobicContact CB-CD1 4.45Å; P128-V154 HydrophobicContact CB-CG1 4.01Å; P128-V154 HydrophobicContact CG-CG1 3.71Å; P128-I158 HydrophobicContact CG-CD1 4.18Å; P128-Y159 HydrophobicContact CB-CE2 4.07Å; P128-Y159 WeakPolarHBondContact CB-OH 3.28Å; P128-Y159 HydrophobicContact CG-CE2 3.69Å; P128-Y159 WeakPolarHBondContact CG-OH 3.25Å; P128-I176 HydrophobicContact CB-CD1 3.55Å
129L93Very high89.4Confident18 Ų1829.3 Ų29.39%0.09415%0.149CC..Hα-helixtrans-70.2-47.6179-175.961.6000111.3G126 A127 I131 T132 W133 C172 I176 L179G126-L129 PolarHBondContact O-N 2.9Å; A127-L129 PolarHBondContact O-N 3.26Å; L129-I131 VanDerWaalsContact C-N 3.34Å; L129-I131 PolarHBondContact O-N 3.48Å; L129-T132 CarbonylContact O-C 3.6Å; L129-T132 WeakPolarHBondContact O-CA 3.29Å; L129-T132 WeakPolarHBondContact O-CB 3.43Å; L129-T132 PolarHBondContact O-N 3.04Å; L129-W133 PolarHBondContact O-N 3.31Å; L129-C172 HydrophobicContact CB-CB 4.31Å; L129-I176 HydrophobicContact CB-CG1 4.42Å; L129-I176 HydrophobicContact CD1-CG1 4.1Å; L129-L179 HydrophobicContact CD1-CD1 3.74Å
130A92.6Very high89.3Confident15 Ų1533.8 Ų33.812%0.12418%0.181CC..Hα-helixtrans-62.5-37.1-179.600000113.2Y85 L89 G126 T132 W133Y85-A130 WeakPolarHBondContact OH-CB 3.42Å; L89-A130 HydrophobicContact CD1-CB 4.21Å; L89-A130 HydrophobicContact CD2-CB 3.99Å; G126-A130 WeakPolarHBondContact O-CB 3.09Å; G126-A130 PolarHBondContact O-N 3Å; G126-A130 VanDerWaalsContact O-N 3.09Å; A130-T132 VanDerWaalsContact C-N 3.31Å; A130-W133 PolarHBondContact O-N 3.45Å
131I93.2Very high89.3Confident0 Ų036.2 Ų36.20%019%0.194CC..Hα-helixtrans-68.1-34172.8-70.2167.2000110.8I112 I116 A127 L129 M134 V146 L149 V154I112-I131 HydrophobicContact CG2-CD1 3.79Å; I112-I131 HydrophobicContact CG2-CG1 4.13Å; I116-I131 HydrophobicContact CD1-CD1 4.03Å; A127-I131 HydrophobicContact CB-CD1 4.49Å; A127-I131 VanDerWaalsContact O-CB 3.32Å; A127-I131 WeakPolarHBondContact O-CB 3.41Å; A127-I131 WeakPolarHBondContact O-CD1 3.5Å; A127-I131 VanDerWaalsContact O-CG1 3.24Å; A127-I131 WeakPolarHBondContact O-CG1 3.47Å; A127-I131 PolarHBondContact O-N 2.8Å; L129-I131 VanDerWaalsContact C-N 3.34Å; L129-I131 PolarHBondContact O-N 3.48Å; I131-M134 WeakPolarHBondContact O-CB 3.25Å; I131-M134 PolarHBondContact O-N 3.18Å; I131-V146 HydrophobicContact CG2-CG1 4.07Å; I131-V146 VanDerWaalsContact O-CG1 3.27Å; I131-V146 WeakPolarHBondContact O-CG1 3.22Å; I131-L149 HydrophobicContact CD1-CD2 4.16Å; I131-L149 HydrophobicContact CG2-CD2 4.1Å; I131-L149 HydrophobicContact CG2-CG 4.47Å; I131-V154 HydrophobicContact CD1-CG2 3.57Å
132T92.8Very high89.5Confident0 Ų036.3 Ų36.30%020%0.195CC..Hα-helixtrans-71.8-35.4176.7-53.90000112P128 L129 A130 M134 L135 I176 L179 V180P128-T132 WeakPolarHBondContact O-CB 3.26Å; P128-T132 PolarHBondContact O-N 3.04Å; P128-T132 PolarHBondContact O-OG1 3.08Å; L129-T132 CarbonylContact O-C 3.6Å; L129-T132 WeakPolarHBondContact O-CA 3.29Å; L129-T132 WeakPolarHBondContact O-CB 3.43Å; L129-T132 PolarHBondContact O-N 3.04Å; A130-T132 VanDerWaalsContact C-N 3.31Å; T132-M134 PolarHBondContact O-N 3.19Å; T132-L135 HydrophobicContact CG2-CD1 3.86Å; T132-L135 VanDerWaalsContact O-CB 3.22Å; T132-L135 WeakPolarHBondContact O-CB 3.4Å; T132-L135 VanDerWaalsContact O-CG 3.24Å; T132-L135 WeakPolarHBondContact O-CG 3.47Å; T132-L135 PolarHBondContact O-N 3.27Å; T132-I176 HydrophobicContact CG2-CG2 4.14Å; T132-L179 HydrophobicContact CG2-CB 3.67Å; T132-L179 HydrophobicContact CG2-CD1 3.97Å; T132-V180 HydrophobicContact CG2-CG2 3.94Å
133W93.1Very high89.8Confident139 Ų13933.3 Ų33.353%0.52718%0.178SC..Hα-helixtrans-59.6-23.3171.8-85.6-12.2000113.9L129 A130 L135 L136 Y137 L179L129-W133 PolarHBondContact O-N 3.31Å; A130-W133 PolarHBondContact O-N 3.45Å; W133-L135 PolarHBondContact O-N 3.28Å; W133-L135 VanDerWaalsContact O-N 3.09Å; W133-L136 HydrophobicContact CB-CD1 4.31Å; W133-L136 HydrophobicContact CG-CD1 4.35Å; W133-L136 VanDerWaalsContact O-CD1 3.28Å; W133-L136 WeakPolarHBondContact O-CD1 3.25Å; W133-L136 PolarHBondContact O-N 3.07Å; W133-Y137 WeakPolarHBondContact O-CD2 3.23Å; W133-L179 VanDerWaalsContact CD1-CD1 3.45Å
134M91.8Very high90Very high1 Ų134.1 Ų34.11%0.00518%0.184CC..Hα-helixtrans-61.7-18.9173.4-56.1-175.9-174.500112.7L89 L109 I112 I131 T132 L136 Y137 F138L89-M134 HydrophobicContact CD2-CE 3.46Å; L89-M134 VanDerWaalsContact CD2-CE 3.46Å; L109-M134 HydrophobicContact CD2-SD 4.16Å; I112-M134 HydrophobicContact CD1-CE 3.63Å; I112-M134 HydrophobicContact CD1-SD 3.8Å; I131-M134 WeakPolarHBondContact O-CB 3.25Å; I131-M134 PolarHBondContact O-N 3.18Å; T132-M134 PolarHBondContact O-N 3.19Å; M134-L136 VanDerWaalsContact C-N 3.28Å; M134-L136 PolarHBondContact O-N 3.31Å; M134-Y137 PolarHBondContact O-N 2.83Å; M134-F138 HydrophobicContact CB-CD1 4.22Å; M134-F138 HydrophobicContact CB-CD2 4.37Å; M134-F138 HydrophobicContact CB-CE1 4.04Å; M134-F138 HydrophobicContact CB-CE2 4.18Å; M134-F138 HydrophobicContact CB-CG 4.39Å; M134-F138 HydrophobicContact CB-CZ 4Å; M134-F138 HydrophobicContact CG-CE1 4.46Å; M134-F138 HydrophobicContact CG-CZ 4.33Å; M134-F138 WeakPolarHBondContact O-CB 3.2Å; M134-F138 WeakPolarHBondContact O-CD1 3.41Å; M134-F138 VanDerWaalsContact O-CG 3.27Å; M134-F138 WeakPolarHBondContact O-CG 3.3Å; M134-F138 PolarHBondContact O-N 3.36Å; M134-F138 HydrophobicContact SD-CZ 4.03Å
135L91.5Very high90.2Very high5 Ų536.1 Ų36.13%0.02620%0.198CC..Hα-helixtrans-66-24174.1-62.6173000113.8T132 W133 Q143 V146 I147 V180 H183 V184T132-L135 HydrophobicContact CG2-CD1 3.86Å; T132-L135 VanDerWaalsContact O-CB 3.22Å; T132-L135 WeakPolarHBondContact O-CB 3.4Å; T132-L135 VanDerWaalsContact O-CG 3.24Å; T132-L135 WeakPolarHBondContact O-CG 3.47Å; T132-L135 PolarHBondContact O-N 3.27Å; W133-L135 PolarHBondContact O-N 3.28Å; W133-L135 VanDerWaalsContact O-N 3.09Å; L135-Q143 HydrophobicContact CD2-CB 4.17Å; L135-Q143 HydrophobicContact CD2-CG 3.95Å; L135-V146 HydrophobicContact CD2-CB 3.8Å; L135-V146 HydrophobicContact CD2-CG1 3.75Å; L135-V146 HydrophobicContact CD2-CG2 4.26Å; L135-V146 HydrophobicContact CG-CG1 4.02Å; L135-I147 HydrophobicContact CD1-CD1 4.31Å; L135-V180 HydrophobicContact CD1-CG2 3.86Å; L135-H183 HydrophobicContact CB-CB 4.34Å; L135-V184 HydrophobicContact CD1-CG2 3.96Å; L135-V184 HydrophobicContact CD2-CG2 4.19Å
136L89.8Confident90.5Very high71 Ų7134.9 Ų34.937%0.37219%0.193SC..Hα-helixtrans-74.8-38.8175.5-68.3102.4000111.9W133 M134 L179W133-L136 HydrophobicContact CB-CD1 4.31Å; W133-L136 HydrophobicContact CG-CD1 4.35Å; W133-L136 VanDerWaalsContact O-CD1 3.28Å; W133-L136 WeakPolarHBondContact O-CD1 3.25Å; W133-L136 PolarHBondContact O-N 3.07Å; M134-L136 VanDerWaalsContact C-N 3.28Å; M134-L136 PolarHBondContact O-N 3.31Å; L136-L179 HydrophobicContact CD1-CD2 3.95Å
137Y88.3Confident90.8Very high83 Ų8333.9 Ų33.933%0.32518%0.182SC..Hα-helixtrans-93.8-25.3-172.2-50.5-68.6000113.5S92 E93 I95 W133 M134S92-Y137 WeakPolarHBondContact O-CB 3.46Å; E93-Y137 HydrophobicContact CB-CE2 4.41Å; E93-Y137 HydrophobicContact CG-CE2 4.04Å; I95-Y137 VanDerWaalsContact CG2-O 3.29Å; I95-Y137 WeakPolarHBondContact CG2-O 2.99Å; W133-Y137 WeakPolarHBondContact O-CD2 3.23Å; M134-Y137 PolarHBondContact O-N 2.83Å
138F89.1Confident90.8Very high9 Ų936.9 Ų36.94%0.03920%0.198CC..SBendtrans-84.6142.1-174.2-76.920000112.5I95 C105 L108 L109 M134 M142 V146I95-F138 HydrophobicContact CG2-CD1 4.17Å; C105-F138 HydrophobicContact CB-CD2 4.05Å; C105-F138 HydrophobicContact CB-CE2 3.8Å; C105-F138 HydrophobicContact CB-CZ 4.21Å; L108-F138 HydrophobicContact CD2-CE1 4.36Å; L108-F138 HydrophobicContact CD2-CZ 4Å; L109-F138 HydrophobicContact CD1-CE2 4.02Å; L109-F138 HydrophobicContact CD2-CE2 4.04Å; L109-F138 HydrophobicContact CG-CE2 3.95Å; M134-F138 HydrophobicContact CB-CD1 4.22Å; M134-F138 HydrophobicContact CB-CD2 4.37Å; M134-F138 HydrophobicContact CB-CE1 4.04Å; M134-F138 HydrophobicContact CB-CE2 4.18Å; M134-F138 HydrophobicContact CB-CG 4.39Å; M134-F138 HydrophobicContact CB-CZ 4Å; M134-F138 HydrophobicContact CG-CE1 4.46Å; M134-F138 HydrophobicContact CG-CZ 4.33Å; M134-F138 WeakPolarHBondContact O-CB 3.2Å; M134-F138 WeakPolarHBondContact O-CD1 3.41Å; M134-F138 VanDerWaalsContact O-CG 3.27Å; M134-F138 WeakPolarHBondContact O-CG 3.3Å; M134-F138 PolarHBondContact O-N 3.36Å; M134-F138 HydrophobicContact SD-CZ 4.03Å; F138-M142 HydrophobicContact CB-CB 4.24Å; F138-M142 HydrophobicContact CD2-CB 4Å; F138-V146 HydrophobicContact CD2-CG2 3.71Å; F138-V146 HydrophobicContact CE2-CG2 4.06Å
139P85.9Confident90.8Very high36 Ų3637.2 Ų37.223%0.23420%0.2CC..  trans-62148.6173.425.9-33.9000111.7N141 M142P139-N141 WeakPolarHBondContact CG-OD1 3.41Å; P139-N141 PolarHBondContact O-N 3.1Å; P139-M142 HydrophobicContact CG-CG 4.04Å; P139-M142 WeakPolarHBondContact O-CB 3.31Å; P139-M142 PolarHBondContact O-N 3.33Å
140S84.5Confident90.8Very high96 Ų9636.4 Ų36.467%0.67120%0.196SC*.G310 helixtrans-55.2-27.3-173.458.60000114.6M142 Q143S140-M142 PolarHBondContact O-N 3.36Å; S140-Q143 PolarHBondContact O-N 3.1Å
141N87.3Confident90.8Very high96 Ų9635.9 Ų35.951%0.51319%0.191SC..G310 helixtrans-66.6-18.7174.672.3-17.4000114.2S102 P139S102-N141 PolarHBondContact OG-ND2 2.74Å; S102-N141 PolarHBondContact OG-OD1 2.55Å; P139-N141 WeakPolarHBondContact CG-OD1 3.41Å; P139-N141 PolarHBondContact O-N 3.1Å
142M89.3Confident90.6Very high22 Ų2236 Ų3611%0.10819%0.192CC..G310 helixtrans-94.8-14.9177.1-63.9-67.294.300113.6S102 C105 F138 P139 S140 S144 S145 V146S102-M142 VanDerWaalsContact O-SD 3.42Å; C105-M142 HydrophobicContact CB-CB 4.45Å; C105-M142 HydrophobicContact CB-CG 3.76Å; C105-M142 HydrophobicContact CB-SD 3.72Å; F138-M142 HydrophobicContact CB-CB 4.24Å; F138-M142 HydrophobicContact CD2-CB 4Å; P139-M142 HydrophobicContact CG-CG 4.04Å; P139-M142 WeakPolarHBondContact O-CB 3.31Å; P139-M142 PolarHBondContact O-N 3.33Å; S140-M142 PolarHBondContact O-N 3.36Å; M142-S144 PolarHBondContact O-N 3.49Å; M142-S145 WeakPolarHBondContact O-CB 3.31Å; M142-S145 PolarHBondContact O-N 3.36Å; M142-V146 PolarHBondContact O-N 3.29Å
143Q89.6Confident90.5Very high23 Ų2336.3 Ų36.311%0.10719%0.194CC..Hα-helixtrans-54.4-39.1-178.5-71.3-178.7-14.600112.3L135 S140 S145 V146 I147 H183L135-Q143 HydrophobicContact CD2-CB 4.17Å; L135-Q143 HydrophobicContact CD2-CG 3.95Å; S140-Q143 PolarHBondContact O-N 3.1Å; Q143-S145 PolarHBondContact O-N 3.42Å; Q143-V146 PolarHBondContact O-N 2.69Å; Q143-V146 VanDerWaalsContact O-N 3.14Å; Q143-I147 WeakPolarHBondContact O-CG1 3.31Å; Q143-I147 PolarHBondContact O-N 2.67Å; Q143-H183 PolarHBondContact NE2-O 3.31Å
144S91.7Very high90.4Very high50 Ų5029.7 Ų29.735%0.3517%0.169SC..Hα-helixtrans-57.6-30.8175.6-170.20000113.8M142 D148 Y189M142-S144 PolarHBondContact O-N 3.49Å; S144-D148 VanDerWaalsContact O-CB 3.31Å; S144-D148 WeakPolarHBondContact O-CB 3.46Å; S144-D148 PolarHBondContact O-N 2.96Å; S144-D148 VanDerWaalsContact O-N 3.12Å; S144-Y189 WeakPolarHBondContact CB-OH 3.29Å; S144-Y189 PolarHBondContact OG-OH 3.33Å
145S91.7Very high90.3Very high46 Ų4629.8 Ų29.832%0.32217%0.169SC..Hα-helixtrans-83.1-29.6-179.8-53.90000112M142 Q143 L149M142-S145 WeakPolarHBondContact O-CB 3.31Å; M142-S145 PolarHBondContact O-N 3.36Å; Q143-S145 PolarHBondContact O-N 3.42Å; S145-L149 WeakPolarHBondContact O-CB 3.45Å; S145-L149 PolarHBondContact O-N 3.48Å; S145-L149 VanDerWaalsContact O-N 3.08Å
146V93.6Very high90Very high1 Ų130.6 Ų30.61%0.00618%0.175CC..Hα-helixtrans-70.5-46.2173-177.20000109.9L109 I131 L135 F138 M142 Q143 L149 L150L109-V146 HydrophobicContact CD1-CG2 4.02Å; L109-V146 HydrophobicContact CD2-CG2 4.2Å; I131-V146 HydrophobicContact CG2-CG1 4.07Å; I131-V146 VanDerWaalsContact O-CG1 3.27Å; I131-V146 WeakPolarHBondContact O-CG1 3.22Å; L135-V146 HydrophobicContact CD2-CB 3.8Å; L135-V146 HydrophobicContact CD2-CG1 3.75Å; L135-V146 HydrophobicContact CD2-CG2 4.26Å; L135-V146 HydrophobicContact CG-CG1 4.02Å; F138-V146 HydrophobicContact CD2-CG2 3.71Å; F138-V146 HydrophobicContact CE2-CG2 4.06Å; M142-V146 PolarHBondContact O-N 3.29Å; Q143-V146 PolarHBondContact O-N 2.69Å; Q143-V146 VanDerWaalsContact O-N 3.14Å; V146-L149 PolarHBondContact O-N 3.03Å; V146-L150 WeakPolarHBondContact O-CB 3.37Å; V146-L150 PolarHBondContact O-N 3.32Å
147I93.4Very high89.8Confident0 Ų027.2 Ų27.20%016%0.157CC..Hα-helixtrans-66.2-38.8177.5-60.4-65.6000111.6L135 Q143 L150 C151 V180 V184 Y189 W192 V193L135-I147 HydrophobicContact CD1-CD1 4.31Å; Q143-I147 WeakPolarHBondContact O-CG1 3.31Å; Q143-I147 PolarHBondContact O-N 2.67Å; I147-L150 PolarHBondContact O-N 2.96Å; I147-C151 WeakPolarHBondContact O-CB 3.17Å; I147-C151 PolarHBondContact O-N 3.06Å; I147-C151 PolarHBondContact O-SG 3.48Å; I147-V180 HydrophobicContact CD1-CG1 4.35Å; I147-V180 HydrophobicContact CD1-CG2 4.02Å; I147-V184 HydrophobicContact CD1-CG2 4.48Å; I147-Y189 HydrophobicContact CB-CD1 4.47Å; I147-Y189 HydrophobicContact CB-CG 4.38Å; I147-Y189 HydrophobicContact CG1-CD2 4.38Å; I147-Y189 HydrophobicContact CG1-CG 4.19Å; I147-Y189 HydrophobicContact CG2-CD1 4Å; I147-Y189 HydrophobicContact CG2-CG 4.09Å; I147-W192 HydrophobicContact CG2-CD2 4.48Å; I147-W192 HydrophobicContact CG2-CE3 3.72Å; I147-W192 HydrophobicContact CG2-CZ3 4.13Å; I147-V193 HydrophobicContact CD1-CG2 3.97Å; I147-V193 HydrophobicContact CG2-CG2 4.14Å
148D92.1Very high89.7Confident63 Ų6323.5 Ų23.534%0.33714%0.143SC..Hα-helixtrans-63.4-42.1172.3-178.643000111.8S144 L150 S152 W192S144-D148 VanDerWaalsContact O-CB 3.31Å; S144-D148 WeakPolarHBondContact O-CB 3.46Å; S144-D148 PolarHBondContact O-N 2.96Å; S144-D148 VanDerWaalsContact O-N 3.12Å; D148-L150 PolarHBondContact O-N 2.71Å; D148-S152 WeakPolarHBondContact O-CA 3.39Å; D148-S152 WeakPolarHBondContact O-CB 3.5Å; D148-S152 PolarHBondContact O-N 2.85Å; D148-S152 PolarHBondContact O-OG 3.34Å; D148-S152 VanDerWaalsContact OD1-CB 3.31Å; D148-S152 WeakPolarHBondContact OD1-CB 3.41Å; D148-S152 PolarHBondContact OD1-OG 3.27Å; D148-W192 HydrophobicContact CB-CH2 4.12Å; D148-W192 HydrophobicContact CB-CZ3 4.41Å
149L92.3Very high89.4Confident7 Ų723.5 Ų23.54%0.03714%0.143CC..Hα-helixtrans-61.2-45.6173.6-177.862000111.5L109 I112 Q113 I116 I131 S145 V146 V153 V154L109-L149 HydrophobicContact CB-CD2 4.36Å; L109-L149 HydrophobicContact CD2-CD2 3.72Å; I112-L149 HydrophobicContact CB-CD2 4.39Å; I112-L149 HydrophobicContact CG2-CD2 4.07Å; Q113-L149 HydrophobicContact CB-CD1 3.7Å; Q113-L149 HydrophobicContact CG-CD1 3.92Å; I116-L149 HydrophobicContact CD1-CD1 4.4Å; I131-L149 HydrophobicContact CD1-CD2 4.16Å; I131-L149 HydrophobicContact CG2-CD2 4.1Å; I131-L149 HydrophobicContact CG2-CG 4.47Å; S145-L149 WeakPolarHBondContact O-CB 3.45Å; S145-L149 PolarHBondContact O-N 3.48Å; S145-L149 VanDerWaalsContact O-N 3.08Å; V146-L149 PolarHBondContact O-N 3.03Å; L149-V153 HydrophobicContact CD1-CB 4.06Å; L149-V153 HydrophobicContact CD1-CG1 4.46Å; L149-V153 HydrophobicContact CD1-CG2 4.03Å; L149-V153 VanDerWaalsContact O-CB 3.28Å; L149-V153 WeakPolarHBondContact O-CB 3.36Å; L149-V153 PolarHBondContact O-N 3.08Å; L149-V154 HydrophobicContact CG-CG2 4.34Å; L149-V154 WeakPolarHBondContact O-CG2 3.48Å; L149-V154 PolarHBondContact O-N 3.13Å
150L93.6Very high88.9Confident1 Ų123.7 Ų23.71%0.00514%0.142CC..Iπ-helixtrans-62.9-53.4-179.8-174.664.7000111.7P128 V146 I147 D148 V154 I155 I176 V193P128-L150 HydrophobicContact CB-CD1 4.45Å; V146-L150 WeakPolarHBondContact O-CB 3.37Å; V146-L150 PolarHBondContact O-N 3.32Å; I147-L150 PolarHBondContact O-N 2.96Å; D148-L150 PolarHBondContact O-N 2.71Å; L150-V154 HydrophobicContact CD1-CB 4.2Å; L150-V154 HydrophobicContact CD1-CG1 4.24Å; L150-V154 WeakPolarHBondContact O-CB 3.24Å; L150-V154 PolarHBondContact O-N 3.23Å; L150-I155 HydrophobicContact CD1-CD1 4.42Å; L150-I155 HydrophobicContact CD1-CG1 4.26Å; L150-I155 HydrophobicContact CG-CD1 4.01Å; L150-I155 HydrophobicContact CG-CG1 4.3Å; L150-I155 WeakPolarHBondContact O-CG1 3.35Å; L150-I155 PolarHBondContact O-N 2.84Å; L150-I176 HydrophobicContact CD2-CG2 4.05Å; L150-V193 HydrophobicContact CD2-CG1 4.37Å; L150-V193 HydrophobicContact CD2-CG2 4.18Å
151C92Very high88.1Confident4 Ų420.7 Ų20.73%0.02712%0.117CC..Iπ-helixtrans-82.6-36.6-173-52.40000113.5I147 P156 W192 V193I147-C151 WeakPolarHBondContact O-CB 3.17Å; I147-C151 PolarHBondContact O-N 3.06Å; I147-C151 PolarHBondContact O-SG 3.48Å; C151-P156 WeakPolarHBondContact O-CD 3.4Å; C151-P156 WeakPolarHBondContact O-CG 3.12Å; C151-W192 HydrophobicContact CB-CD2 3.8Å; C151-W192 VanDerWaalsContact CB-CE2 3.41Å; C151-W192 HydrophobicContact CB-CE3 4.46Å; C151-W192 HydrophobicContact CB-CG 4.09Å; C151-W192 HydrophobicContact CB-CH2 4.44Å; C151-W192 HydrophobicContact CB-CZ2 3.78Å; C151-V193 VanDerWaalsContact SG-CG2 3.54Å
152S89.3Confident86.8Confident3 Ų318.6 Ų18.62%0.02111%0.111CC..Iπ-helixtrans-88.8-11.4-177.2-55.40000113.8D148 W192 P293 Y295D148-S152 WeakPolarHBondContact O-CA 3.39Å; D148-S152 WeakPolarHBondContact O-CB 3.5Å; D148-S152 PolarHBondContact O-N 2.85Å; D148-S152 PolarHBondContact O-OG 3.34Å; D148-S152 VanDerWaalsContact OD1-CB 3.31Å; D148-S152 WeakPolarHBondContact OD1-CB 3.41Å; D148-S152 PolarHBondContact OD1-OG 3.27Å; S152-W192 WeakPolarHBondContact OG-CZ2 3.42Å; S152-P293 WeakPolarHBondContact O-CG 3.46Å; S152-Y295 WeakPolarHBondContact CA-OH 3.22Å; S152-Y295 PolarHBondContact O-OH 3.46Å
153V89.6Confident85.4Confident7 Ų721.5 Ų21.54%0.04213%0.127CC..Iπ-helixtrans-133.9-57.9-176.6-169.50000112.4Q113 F117 L149 L157Q113-V153 HydrophobicContact CG-CG1 4.31Å; Q113-V153 HydrophobicContact CG-CG2 4.23Å; F117-V153 HydrophobicContact CE2-CG1 4.22Å; F117-V153 HydrophobicContact CZ-CG1 4.32Å; L149-V153 HydrophobicContact CD1-CB 4.06Å; L149-V153 HydrophobicContact CD1-CG1 4.46Å; L149-V153 HydrophobicContact CD1-CG2 4.03Å; L149-V153 VanDerWaalsContact O-CB 3.28Å; L149-V153 WeakPolarHBondContact O-CB 3.36Å; L149-V153 PolarHBondContact O-N 3.08Å; V153-L157 HydrophobicContact CG1-CD1 3.75Å; V153-L157 WeakPolarHBondContact O-CB 3.25Å; V153-L157 VanDerWaalsContact O-CD1 3.26Å; V153-L157 WeakPolarHBondContact O-CD1 3.44Å; V153-L157 WeakPolarHBondContact O-CG 3.41Å; V153-L157 PolarHBondContact O-N 3.38Å
154V91Very high83.8Confident0 Ų028 Ų280%016%0.162CC..Iπ-helixtrans-69.1-55.7-169.8-179.10000111.7I116 P128 I131 L149 L150 L157 I158I116-V154 HydrophobicContact CD1-CG2 3.84Å; P128-V154 HydrophobicContact CB-CG1 4.01Å; P128-V154 HydrophobicContact CG-CG1 3.71Å; I131-V154 HydrophobicContact CD1-CG2 3.57Å; L149-V154 HydrophobicContact CG-CG2 4.34Å; L149-V154 WeakPolarHBondContact O-CG2 3.48Å; L149-V154 PolarHBondContact O-N 3.13Å; L150-V154 HydrophobicContact CD1-CB 4.2Å; L150-V154 HydrophobicContact CD1-CG1 4.24Å; L150-V154 WeakPolarHBondContact O-CB 3.24Å; L150-V154 PolarHBondContact O-N 3.23Å; V154-L157 PolarHBondContact O-N 3.12Å; V154-I158 HydrophobicContact CG1-CD1 3.86Å; V154-I158 HydrophobicContact CG1-CG1 4.44Å; V154-I158 PolarHBondContact O-N 2.88Å
155I90.5Very high82.4Confident2 Ų229 Ų291%0.0116%0.161CC..Hα-helixtrans-60.5-45.6-177.4-62.4170.6000111.7L150 L157 Y159 F197 K200L150-I155 HydrophobicContact CD1-CD1 4.42Å; L150-I155 HydrophobicContact CD1-CG1 4.26Å; L150-I155 HydrophobicContact CG-CD1 4.01Å; L150-I155 HydrophobicContact CG-CG1 4.3Å; L150-I155 WeakPolarHBondContact O-CG1 3.35Å; L150-I155 PolarHBondContact O-N 2.84Å; I155-L157 PolarHBondContact O-N 2.92Å; I155-Y159 HydrophobicContact CB-CD2 4.36Å; I155-Y159 HydrophobicContact CG1-CD2 4.39Å; I155-Y159 HydrophobicContact CG1-CE2 4.34Å; I155-Y159 HydrophobicContact CG2-CD2 4.21Å; I155-Y159 PolarHBondContact O-N 2.77Å; I155-F197 HydrophobicContact CD1-CD1 4.14Å; I155-F197 HydrophobicContact CD1-CD2 4.28Å; I155-F197 HydrophobicContact CD1-CE1 3.68Å; I155-F197 HydrophobicContact CD1-CE2 3.87Å; I155-F197 HydrophobicContact CD1-CG 4.42Å; I155-F197 HydrophobicContact CD1-CZ 3.54Å; I155-F197 HydrophobicContact CG1-CD1 4.4Å; I155-F197 HydrophobicContact CG1-CE1 3.75Å; I155-F197 HydrophobicContact CG1-CZ 3.95Å; I155-F197 HydrophobicContact CG2-CD1 4.16Å; I155-F197 HydrophobicContact CG2-CE1 4.26Å; I155-K200 HydrophobicContact CG2-CG 4.15Å
156P86.3Confident81.3Confident22 Ų2236.1 Ų36.114%0.14319%0.189CC..Hα-helixtrans-67.5-14.9178.2-22.835.1000115.7C151 N160 M277C151-P156 WeakPolarHBondContact O-CD 3.4Å; C151-P156 WeakPolarHBondContact O-CG 3.12Å; P156-N160 PolarHBondContact O-ND2 3.28Å; P156-M277 HydrophobicContact CB-CE 3.93Å; P156-M277 HydrophobicContact CB-SD 4.23Å
157L84.8Confident80.6Confident1 Ų136.3 Ų36.31%0.00519%0.191CC..Hα-helixtrans-97.6-48178.8-72171.6000113.2F62 I116 F117 V153 V154 I155 N160 V279F62-L157 VanDerWaalsContact CB-O 3.25Å; F62-L157 WeakPolarHBondContact CB-O 3.33Å; F62-L157 HydrophobicContact CD2-CD2 4.32Å; F62-L157 HydrophobicContact CE2-CD2 3.83Å; F62-L157 HydrophobicContact CZ-CD2 4.14Å; I116-L157 HydrophobicContact CG2-CD1 4.01Å; F117-L157 HydrophobicContact CD1-CD1 4.42Å; F117-L157 HydrophobicContact CE1-CD1 3.62Å; F117-L157 HydrophobicContact CE1-CD2 3.91Å; F117-L157 HydrophobicContact CE1-CG 4.44Å; F117-L157 HydrophobicContact CE2-CD1 4.24Å; F117-L157 HydrophobicContact CZ-CD1 3.51Å; F117-L157 HydrophobicContact CZ-CD2 4.39Å; V153-L157 HydrophobicContact CG1-CD1 3.75Å; V153-L157 WeakPolarHBondContact O-CB 3.25Å; V153-L157 VanDerWaalsContact O-CD1 3.26Å; V153-L157 WeakPolarHBondContact O-CD1 3.44Å; V153-L157 WeakPolarHBondContact O-CG 3.41Å; V153-L157 PolarHBondContact O-N 3.38Å; V154-L157 PolarHBondContact O-N 3.12Å; I155-L157 PolarHBondContact O-N 2.92Å; L157-N160 PolarHBondContact O-ND2 3.27Å; L157-V279 HydrophobicContact CD2-CB 4.02Å; L157-V279 HydrophobicContact CD2-CG1 3.54Å
158I85.1Confident80.2Confident4 Ų442.5 Ų42.52%0.02122%0.215CC..Hα-helixtrans-87.6-37.8-167.8-55.3-173.1000111L124 A127 P128 V154 N160 M161 A169L124-I158 HydrophobicContact CB-CD1 4.25Å; L124-I158 HydrophobicContact CD2-CD1 3.93Å; L124-I158 HydrophobicContact CD2-CG1 4.49Å; L124-I158 VanDerWaalsContact O-CD1 3.32Å; L124-I158 WeakPolarHBondContact O-CD1 3.49Å; A127-I158 HydrophobicContact CB-CD1 4.3Å; P128-I158 HydrophobicContact CG-CD1 4.18Å; V154-I158 HydrophobicContact CG1-CD1 3.86Å; V154-I158 HydrophobicContact CG1-CG1 4.44Å; V154-I158 PolarHBondContact O-N 2.88Å; I158-N160 VanDerWaalsContact C-N 3.28Å; I158-N160 PolarHBondContact O-N 3.13Å; I158-M161 WeakPolarHBondContact O-CE 3.44Å; I158-A169 HydrophobicContact CG2-CB 4.11Å
159Y84.1Confident79.9Confident9 Ų939.6 Ų39.64%0.03520%0.2CC..  trans-87.870.3-179.4-60.8-99.6000109.9P128 I155 A169 I170 I173 F197 K200P128-Y159 HydrophobicContact CB-CE2 4.07Å; P128-Y159 WeakPolarHBondContact CB-OH 3.28Å; P128-Y159 HydrophobicContact CG-CE2 3.69Å; P128-Y159 WeakPolarHBondContact CG-OH 3.25Å; I155-Y159 HydrophobicContact CB-CD2 4.36Å; I155-Y159 HydrophobicContact CG1-CD2 4.39Å; I155-Y159 HydrophobicContact CG1-CE2 4.34Å; I155-Y159 HydrophobicContact CG2-CD2 4.21Å; I155-Y159 PolarHBondContact O-N 2.77Å; Y159-A169 HydrophobicContact CE1-CB 4.07Å; Y159-A169 WeakPolarHBondContact CE1-O 3.45Å; Y159-A169 VanDerWaalsContact CZ-O 3.28Å; Y159-A169 PolarHBondContact OH-O 3.18Å; Y159-I170 HydrophobicContact CD1-CG1 4.43Å; Y159-I173 HydrophobicContact CD1-CD1 4.05Å; Y159-I173 HydrophobicContact CD1-CG1 4.49Å; Y159-I173 HydrophobicContact CE1-CD1 3.65Å; Y159-I173 HydrophobicContact CE1-CG1 3.63Å; Y159-F197 HydrophobicContact CD1-CD1 4.5Å; Y159-F197 HydrophobicContact CD1-CE1 4.31Å; Y159-F197 HydrophobicContact CD2-CE1 4.29Å; Y159-F197 HydrophobicContact CE1-CD1 4.43Å; Y159-F197 AromaticContact CE1-CE1 3.9Å; Y159-F197 HydrophobicContact CE1-CE1 3.9Å; Y159-F197 AromaticContact CE2-CE1 3.87Å; Y159-F197 HydrophobicContact CE2-CE1 3.87Å; Y159-F197 HydrophobicContact CG-CE1 4.49Å; Y159-F197 AromaticContact CZ-CE1 3.66Å; Y159-K200 WeakPolarHBondContact O-CD 3.42Å; Y159-K200 WeakPolarHBondContact O-CE 3.37Å; Y159-K200 PolarHBondContact O-NZ 3.19Å
160N75.5Confident79.6Confident41 Ų4141.1 Ų41.122%0.21921%0.207CC..  trans-127.822.4174.9-69.5-63.9000112.1I59 P156 L157 I158 K200I59-N160 HydrophobicContact CG2-CB 3.78Å; I59-N160 WeakPolarHBondContact CG2-ND2 3.39Å; P156-N160 PolarHBondContact O-ND2 3.28Å; L157-N160 PolarHBondContact O-ND2 3.27Å; I158-N160 VanDerWaalsContact C-N 3.28Å; I158-N160 PolarHBondContact O-N 3.13Å; N160-K200 PolarHBondContact OD1-NZ 2.86Å
161M66.6Low79.3Confident32 Ų3245.7 Ų45.716%0.15823%0.232CC..  trans-72.8154.8-177.5-47.5-40.5-167.400111.8F62 V63 Y121 I158 I170F62-M161 WeakPolarHBondContact O-CE 3.47Å; V63-M161 VanDerWaalsContact O-SD 3.32Å; Y121-M161 HydrophobicContact CE2-CE 4.1Å; Y121-M161 VanDerWaalsContact OH-CE 3.25Å; Y121-M161 WeakPolarHBondContact OH-CE 3.24Å; I158-M161 WeakPolarHBondContact O-CE 3.44Å; M161-I170 HydrophobicContact CB-CD1 4.35Å; M161-I170 HydrophobicContact CG-CD1 4.28Å
162S61.7Low79.3Confident53 Ų5345.9 Ų45.937%0.37123%0.233SC..  trans-68.8149.6159.846.60000110.4D164 Q165S162-D164 PolarHBondContact O-N 3.25Å; S162-D164 VanDerWaalsContact O-N 3.08Å; S162-Q165 PolarHBondContact O-N 3.01Å
163D58.2Low79.5Confident83 Ų8345.7 Ų45.744%0.44423%0.232SC..THydrogen-bonded Turntrans-55.8-28.7-178.8-59.9-84000113.5Q165 K202D163-Q165 PolarHBondContact O-N 2.89Å; D163-K202 VanDerWaalsContact OD1-CD 3.26Å; D163-K202 WeakPolarHBondContact OD1-CD 3.43Å; D163-K202 VanDerWaalsContact OD1-CE 3.29Å; D163-K202 WeakPolarHBondContact OD1-CE 3.4Å; D163-K202 IonicContact OD1-NZ 2.78Å; D163-K202 PolarHBondContact OD1-NZ 3.26Å; D163-K202 VanDerWaalsContact OD1-NZ 3.1Å; D163-K202 IonicContact OD2-NZ 3.59Å; D163-K202 PolarHBondContact OD2-NZ 3.08Å
164D56.2Low79.7Confident158 Ų15845.7 Ų45.785%0.84523%0.232SC*.THydrogen-bonded Turntrans-7913.5-176-48.9-41.2000114.6S162S162-D164 PolarHBondContact O-N 3.25Å; S162-D164 VanDerWaalsContact O-N 3.08Å
165Q62.8Low79.8Confident71 Ų7148.5 Ų48.533%0.33225%0.252SS..  trans-122108-178.1-69.7-166.1-28.500112.8V63 S162 D163V63-Q165 PolarHBondContact O-OE1 3.5Å; S162-Q165 PolarHBondContact O-N 3.01Å; D163-Q165 PolarHBondContact O-N 2.89Å
166E68Low80Confident196 Ų19648.4 Ų48.492%0.91625%0.251SS*.  trans-59.1132.2162.3-65.3175.1176.500109.6
167S79.2Confident80.4Confident5 Ų547.3 Ų47.34%0.03524%0.244CC..  trans-156.8129.8-176.9168.90000109E125 A169 I170 D171E125-S167 WeakPolarHBondContact OE1-CB 3.43Å; E125-S167 PolarHBondContact OE1-OG 2.93Å; S167-A169 PolarHBondContact O-N 2.82Å; S167-A169 PolarHBondContact OG-N 3.16Å; S167-I170 WeakPolarHBondContact O-CA 3.38Å; S167-I170 WeakPolarHBondContact O-CB 3.45Å; S167-I170 PolarHBondContact O-N 3.26Å; S167-D171 PolarHBondContact O-N 3.43Å
168Y85.7Confident80.9Confident130 Ų13048.5 Ų48.551%0.5125%0.251SS..Hα-helixtrans-51.9-28.6-179.9-179.9-102.8000113.5E125 I170 D171 C172E125-Y168 HydrophobicContact CB-CD1 4.5Å; Y168-I170 PolarHBondContact O-N 2.88Å; Y168-D171 PolarHBondContact O-N 3.05Å; Y168-C172 WeakPolarHBondContact CE1-SG 3.03Å; Y168-C172 WeakPolarHBondContact O-CB 3.36Å; Y168-C172 PolarHBondContact O-N 2.96Å; Y168-C172 PolarHBondContact O-SG 3.23Å
169A85.1Confident81.3Confident2 Ų249.2 Ų49.22%0.01726%0.255CS..Hα-helixtrans-62-41.2173.900000112.7E125 I158 Y159 S167E125-A169 HydrophobicContact CB-CB 4.49Å; I158-A169 HydrophobicContact CG2-CB 4.11Å; Y159-A169 HydrophobicContact CE1-CB 4.07Å; Y159-A169 WeakPolarHBondContact CE1-O 3.45Å; Y159-A169 VanDerWaalsContact CZ-O 3.28Å; Y159-A169 PolarHBondContact OH-O 3.18Å; S167-A169 PolarHBondContact O-N 2.82Å; S167-A169 PolarHBondContact OG-N 3.16Å
170I86.7Confident81.8Confident39 Ų3948.8 Ų48.820%0.225%0.254CS..Hα-helixtrans-69.4-36.9-179.7-66.7177.6000111.1Y159 M161 S167 Y168 I173 K201Y159-I170 HydrophobicContact CD1-CG1 4.43Å; M161-I170 HydrophobicContact CB-CD1 4.35Å; M161-I170 HydrophobicContact CG-CD1 4.28Å; S167-I170 WeakPolarHBondContact O-CA 3.38Å; S167-I170 WeakPolarHBondContact O-CB 3.45Å; S167-I170 PolarHBondContact O-N 3.26Å; Y168-I170 PolarHBondContact O-N 2.88Å; I170-I173 WeakPolarHBondContact O-CD1 3.32Å; I170-I173 WeakPolarHBondContact O-CG1 3.09Å; I170-I173 PolarHBondContact O-N 2.77Å; I170-K201 HydrophobicContact CG2-CD 3.96Å; I170-K201 PolarHBondContact O-NZ 3Å
171D87.6Confident82.7Confident98 Ų9846.9 Ų46.952%0.52424%0.243SC..Hα-helixtrans-78.7-23.5-179.8-51.4-43.2000112.1S167 Y168 I173 P174S167-D171 PolarHBondContact O-N 3.43Å; Y168-D171 PolarHBondContact O-N 3.05Å; D171-I173 VanDerWaalsContact C-N 3.31Å; D171-I173 PolarHBondContact O-N 2.95Å; D171-P174 WeakPolarHBondContact O-CD 3.49Å
172C91.9Very high83.8Confident7 Ų747.4 Ų47.45%0.04725%0.245CC..THydrogen-bonded Turntrans-75.5-11.2173-75.40000114.7L129 Y168 S175 I176L129-C172 HydrophobicContact CB-CB 4.31Å; Y168-C172 WeakPolarHBondContact CE1-SG 3.03Å; Y168-C172 WeakPolarHBondContact O-CB 3.36Å; Y168-C172 PolarHBondContact O-N 2.96Å; Y168-C172 PolarHBondContact O-SG 3.23Å; C172-S175 WeakPolarHBondContact O-CB 3.37Å; C172-S175 PolarHBondContact O-N 3.24Å; C172-I176 HydrophobicContact CB-CD1 4.04Å; C172-I176 WeakPolarHBondContact O-CD1 3.38Å; C172-I176 VanDerWaalsContact O-CG1 3.29Å; C172-I176 WeakPolarHBondContact O-CG1 3.45Å; C172-I176 PolarHBondContact O-N 2.88Å
173I93.3Very high85.1Confident0 Ų046.4 Ų46.40%024%0.235CC..Hα-helixtrans-55.4-46.2-177.3-65.4172.6000113.1Y159 I170 D171 S175 I176 L177 F197 K201 L204 D207Y159-I173 HydrophobicContact CD1-CD1 4.05Å; Y159-I173 HydrophobicContact CD1-CG1 4.49Å; Y159-I173 HydrophobicContact CE1-CD1 3.65Å; Y159-I173 HydrophobicContact CE1-CG1 3.63Å; I170-I173 WeakPolarHBondContact O-CD1 3.32Å; I170-I173 WeakPolarHBondContact O-CG1 3.09Å; I170-I173 PolarHBondContact O-N 2.77Å; D171-I173 VanDerWaalsContact C-N 3.31Å; D171-I173 PolarHBondContact O-N 2.95Å; I173-S175 VanDerWaalsContact C-N 3.33Å; I173-S175 PolarHBondContact O-N 3.19Å; I173-I176 PolarHBondContact O-N 2.68Å; I173-L177 HydrophobicContact CG2-CD1 3.83Å; I173-L177 HydrophobicContact CG2-CG 4.29Å; I173-L177 WeakPolarHBondContact O-CB 3.44Å; I173-L177 WeakPolarHBondContact O-CG 3.41Å; I173-L177 PolarHBondContact O-N 3.44Å; I173-F197 HydrophobicContact CD1-CD1 3.87Å; I173-F197 HydrophobicContact CD1-CE1 4.16Å; I173-F197 HydrophobicContact CD1-CG 4.49Å; I173-F197 HydrophobicContact CG1-CD1 3.93Å; I173-F197 HydrophobicContact CG1-CE1 3.75Å; I173-F197 HydrophobicContact CG1-CZ 4.17Å; I173-F197 HydrophobicContact CG2-CB 4.45Å; I173-F197 HydrophobicContact CG2-CD1 4.22Å; I173-F197 HydrophobicContact CG2-CD2 3.92Å; I173-F197 HydrophobicContact CG2-CE1 4.44Å; I173-F197 HydrophobicContact CG2-CE2 4.12Å; I173-F197 HydrophobicContact CG2-CG 3.96Å; I173-F197 HydrophobicContact CG2-CZ 4.38Å; I173-K201 HydrophobicContact CD1-CB 4.4Å; I173-K201 HydrophobicContact CD1-CD 3.55Å; I173-L204 HydrophobicContact CG2-CD1 4.28Å; I173-D207 WeakPolarHBondContact CG2-OD2 3.29Å
174P92.8Very high86.6Confident7 Ų742.5 Ų42.55%0.04521%0.214CC..Hα-helixtrans-62.5-39.2178.7-20.834.3000112.4D171 L177 T178 D207 M210 I211D171-P174 WeakPolarHBondContact O-CD 3.49Å; P174-L177 PolarHBondContact O-N 2.73Å; P174-T178 WeakPolarHBondContact O-CB 3.25Å; P174-T178 PolarHBondContact O-N 3.41Å; P174-T178 PolarHBondContact O-OG1 2.84Å; P174-D207 HydrophobicContact CG-CB 3.92Å; P174-M210 HydrophobicContact CB-CE 3.52Å; P174-M210 HydrophobicContact CG-CE 3.47Å; P174-M210 VanDerWaalsContact CG-CE 3.47Å; P174-I211 HydrophobicContact CB-CG1 4.21Å
175S93.7Very high88Confident58 Ų5841.9 Ų41.941%0.40621%0.206SC..Hα-helixtrans-65.1-43.8175.7-54.70000111.6C172 I173 T178 L179C172-S175 WeakPolarHBondContact O-CB 3.37Å; C172-S175 PolarHBondContact O-N 3.24Å; I173-S175 VanDerWaalsContact C-N 3.33Å; I173-S175 PolarHBondContact O-N 3.19Å; S175-T178 PolarHBondContact O-N 3.17Å; S175-L179 WeakPolarHBondContact O-CB 3.42Å; S175-L179 WeakPolarHBondContact O-CD1 3.43Å; S175-L179 VanDerWaalsContact O-CG 3.23Å; S175-L179 WeakPolarHBondContact O-CG 3.37Å; S175-L179 PolarHBondContact O-N 3.41Å
176I94.9Very high89.3Confident0 Ų042.9 Ų42.90%021%0.209CC..Hα-helixtrans-61.3-48.1176.2-69.1160.3000110.8P128 L129 T132 L150 C172 I173 L179 V180 F197P128-I176 HydrophobicContact CB-CD1 3.55Å; L129-I176 HydrophobicContact CB-CG1 4.42Å; L129-I176 HydrophobicContact CD1-CG1 4.1Å; T132-I176 HydrophobicContact CG2-CG2 4.14Å; L150-I176 HydrophobicContact CD2-CG2 4.05Å; C172-I176 HydrophobicContact CB-CD1 4.04Å; C172-I176 WeakPolarHBondContact O-CD1 3.38Å; C172-I176 VanDerWaalsContact O-CG1 3.29Å; C172-I176 WeakPolarHBondContact O-CG1 3.45Å; C172-I176 PolarHBondContact O-N 2.88Å; I173-I176 PolarHBondContact O-N 2.68Å; I176-L179 PolarHBondContact O-N 2.96Å; I176-V180 WeakPolarHBondContact O-CB 3.45Å; I176-V180 VanDerWaalsContact O-CG2 3.29Å; I176-V180 WeakPolarHBondContact O-CG2 3.34Å; I176-V180 PolarHBondContact O-N 2.69Å; I176-F197 HydrophobicContact CD1-CZ 4.29Å; I176-F197 HydrophobicContact CG2-CE2 3.89Å; I176-F197 HydrophobicContact CG2-CZ 3.95Å
177L95.7Very high90.3Very high0 Ų034.2 Ų34.20%017%0.17CC..Hα-helixtrans-62.6-43.7177.4-73.6172.5000111.6I173 P174 V180 F181 V193 L194 F197 I211I173-L177 HydrophobicContact CG2-CD1 3.83Å; I173-L177 HydrophobicContact CG2-CG 4.29Å; I173-L177 WeakPolarHBondContact O-CB 3.44Å; I173-L177 WeakPolarHBondContact O-CG 3.41Å; I173-L177 PolarHBondContact O-N 3.44Å; P174-L177 PolarHBondContact O-N 2.73Å; L177-V180 PolarHBondContact O-N 3.17Å; L177-F181 HydrophobicContact CB-CE2 4.14Å; L177-F181 HydrophobicContact CB-CZ 4.22Å; L177-F181 HydrophobicContact CD2-CE1 4.17Å; L177-F181 HydrophobicContact CD2-CZ 3.86Å; L177-F181 WeakPolarHBondContact O-CB 3.13Å; L177-F181 WeakPolarHBondContact O-CD1 3.38Å; L177-F181 WeakPolarHBondContact O-CD2 3.49Å; L177-F181 WeakPolarHBondContact O-CG 3.32Å; L177-F181 PolarHBondContact O-N 2.77Å; L177-V193 HydrophobicContact CD2-CG1 3.85Å; L177-L194 HydrophobicContact CD1-CD1 3.88Å; L177-L194 HydrophobicContact CD2-CB 4.41Å; L177-L194 HydrophobicContact CD2-CD1 3.92Å; L177-F197 HydrophobicContact CD2-CD2 4.08Å; L177-F197 HydrophobicContact CD2-CE2 4.33Å; L177-F197 HydrophobicContact CG-CD2 4.26Å; L177-F197 HydrophobicContact CG-CE2 4.35Å; L177-I211 HydrophobicContact CB-CD1 3.45Å; L177-I211 VanDerWaalsContact CB-CD1 3.45Å; L177-I211 HydrophobicContact CD1-CD1 4.03Å; L177-I211 HydrophobicContact CG-CD1 4.4Å
178T94.5Very high90.9Very high25 Ų2534.8 Ų34.815%0.15317%0.172CC..Hα-helixtrans-57.9-50.9175.9-590000111.4P174 S175 V180 F181 Q182 I211 P216 A219P174-T178 WeakPolarHBondContact O-CB 3.25Å; P174-T178 PolarHBondContact O-N 3.41Å; P174-T178 PolarHBondContact O-OG1 2.84Å; S175-T178 PolarHBondContact O-N 3.17Å; T178-V180 VanDerWaalsContact C-N 3.34Å; T178-V180 PolarHBondContact O-N 2.75Å; T178-F181 PolarHBondContact O-N 3.26Å; T178-Q182 VanDerWaalsContact O-CB 3.24Å; T178-Q182 WeakPolarHBondContact O-CB 3.45Å; T178-Q182 PolarHBondContact O-N 3.32Å; T178-I211 WeakPolarHBondContact OG1-CG1 3.44Å; T178-P216 HydrophobicContact CG2-CG 4.25Å; T178-A219 HydrophobicContact CG2-CB 4.07Å
179L94Very high91.2Very high20 Ų2029.5 Ų29.511%0.10515%0.151CC..Hα-helixtrans-59.8-43179-73.3167.3000112.1L129 T132 W133 L136 S175 I176 H183L129-L179 HydrophobicContact CD1-CD1 3.74Å; T132-L179 HydrophobicContact CG2-CB 3.67Å; T132-L179 HydrophobicContact CG2-CD1 3.97Å; W133-L179 VanDerWaalsContact CD1-CD1 3.45Å; L136-L179 HydrophobicContact CD1-CD2 3.95Å; S175-L179 WeakPolarHBondContact O-CB 3.42Å; S175-L179 WeakPolarHBondContact O-CD1 3.43Å; S175-L179 VanDerWaalsContact O-CG 3.23Å; S175-L179 WeakPolarHBondContact O-CG 3.37Å; S175-L179 PolarHBondContact O-N 3.41Å; I176-L179 PolarHBondContact O-N 2.96Å; L179-H183 WeakPolarHBondContact O-CB 3.35Å; L179-H183 PolarHBondContact O-N 3.17Å; L179-H183 PolarHBondContact O-ND1 2.92Å
180V94.5Very high91.7Very high0 Ų029.5 Ų29.50%015%0.151CC..Hα-helixtrans-63.2-50.3175.7167.60000110.8T132 L135 I147 I176 L177 T178 Q182 V184 H190 V193T132-V180 HydrophobicContact CG2-CG2 3.94Å; L135-V180 HydrophobicContact CD1-CG2 3.86Å; I147-V180 HydrophobicContact CD1-CG1 4.35Å; I147-V180 HydrophobicContact CD1-CG2 4.02Å; I176-V180 WeakPolarHBondContact O-CB 3.45Å; I176-V180 VanDerWaalsContact O-CG2 3.29Å; I176-V180 WeakPolarHBondContact O-CG2 3.34Å; I176-V180 PolarHBondContact O-N 2.69Å; L177-V180 PolarHBondContact O-N 3.17Å; T178-V180 VanDerWaalsContact C-N 3.34Å; T178-V180 PolarHBondContact O-N 2.75Å; V180-Q182 VanDerWaalsContact C-N 3.31Å; V180-Q182 PolarHBondContact O-N 2.91Å; V180-V184 HydrophobicContact CG1-CG2 4.42Å; V180-V184 WeakPolarHBondContact O-CB 3.13Å; V180-V184 WeakPolarHBondContact O-CG2 3.38Å; V180-V184 PolarHBondContact O-N 2.87Å; V180-H190 PolarHBondContact O-NE2 2.76Å; V180-V193 HydrophobicContact CG1-CG2 4.23Å; V180-V193 HydrophobicContact CG2-CG2 4.33Å
181F92.9Very high92Very high0 Ų027.7 Ų27.70%014%0.141CC..Hα-helixtrans-64.3-34.5-179-63.3-14.2000112.6L177 T178 H190 L208 I211 A219 P222 A223 L226L177-F181 HydrophobicContact CB-CE2 4.14Å; L177-F181 HydrophobicContact CB-CZ 4.22Å; L177-F181 HydrophobicContact CD2-CE1 4.17Å; L177-F181 HydrophobicContact CD2-CZ 3.86Å; L177-F181 WeakPolarHBondContact O-CB 3.13Å; L177-F181 WeakPolarHBondContact O-CD1 3.38Å; L177-F181 WeakPolarHBondContact O-CD2 3.49Å; L177-F181 WeakPolarHBondContact O-CG 3.32Å; L177-F181 PolarHBondContact O-N 2.77Å; T178-F181 PolarHBondContact O-N 3.26Å; F181-H190 HydrophobicContact CD1-CB 3.9Å; F181-H190 AromaticContact CD1-CD2 3.95Å; F181-H190 AromaticContact CD1-CG 3.77Å; F181-H190 HydrophobicContact CE1-CB 3.81Å; F181-L208 HydrophobicContact CE2-CD2 4.09Å; F181-L208 HydrophobicContact CZ-CD2 4.34Å; F181-I211 HydrophobicContact CD2-CG2 4.45Å; F181-I211 HydrophobicContact CE2-CD1 4.28Å; F181-A219 HydrophobicContact CB-CB 3.88Å; F181-P222 HydrophobicContact CB-CB 3.84Å; F181-P222 HydrophobicContact CB-CG 4Å; F181-P222 HydrophobicContact CD1-CB 4Å; F181-P222 HydrophobicContact CD2-CB 4.06Å; F181-P222 HydrophobicContact CG-CB 3.7Å; F181-P222 HydrophobicContact CG-CG 4.41Å; F181-A223 HydrophobicContact CD2-CB 4.05Å; F181-A223 HydrophobicContact CE2-CB 3.91Å; F181-L226 HydrophobicContact CE1-CD1 3.65Å; F181-L226 HydrophobicContact CE2-CD1 4.46Å; F181-L226 HydrophobicContact CZ-CD1 3.58Å
182Q90.8Very high92.3Very high43 Ų4324.3 Ų24.320%0.20112%0.121CC..Hα-helixtrans-77.4-40.3179-172.5-1802200113.3T178 V180 P216 E218 A219 L580 R583T178-Q182 VanDerWaalsContact O-CB 3.24Å; T178-Q182 WeakPolarHBondContact O-CB 3.45Å; T178-Q182 PolarHBondContact O-N 3.32Å; V180-Q182 VanDerWaalsContact C-N 3.31Å; V180-Q182 PolarHBondContact O-N 2.91Å; Q182-P216 HydrophobicContact CG-CG 4.36Å; Q182-E218 HydrophobicContact CG-CB 4.3Å; Q182-A219 HydrophobicContact CB-CB 4.35Å; Q182-L580 HydrophobicContact CG-CD1 4.3Å; Q182-R583 PolarHBondContact O-NH1 3.23Å
183H89.4Confident92.4Very high33 Ų3324 Ų2415%0.15312%0.119CC..Hα-helixtrans-100.7-21.6-170.5-62.387.2000114.3L135 Q143 L179L135-H183 HydrophobicContact CB-CB 4.34Å; Q143-H183 PolarHBondContact NE2-O 3.31Å; L179-H183 WeakPolarHBondContact O-CB 3.35Å; L179-H183 PolarHBondContact O-N 3.17Å; L179-H183 PolarHBondContact O-ND1 2.92Å
184V89.7Confident92.5Very high1 Ų124 Ų241%0.00612%0.119CC..  trans-100.5128.7-177.8-1770000109.6L135 I147 V180 K186 Y189 H190L135-V184 HydrophobicContact CD1-CG2 3.96Å; L135-V184 HydrophobicContact CD2-CG2 4.19Å; I147-V184 HydrophobicContact CD1-CG2 4.48Å; V180-V184 HydrophobicContact CG1-CG2 4.42Å; V180-V184 WeakPolarHBondContact O-CB 3.13Å; V180-V184 WeakPolarHBondContact O-CG2 3.38Å; V180-V184 PolarHBondContact O-N 2.87Å; V184-K186 HydrophobicContact CG1-CB 4.3Å; V184-Y189 HydrophobicContact CG1-CD2 3.66Å; V184-Y189 HydrophobicContact CG1-CG 4.3Å; V184-H190 PolarHBondContact O-CE1 2.72Å; V184-H190 VanDerWaalsContact O-CE1 3.26Å; V184-H190 PolarHBondContact O-NE2 3.41Å
185E84.9Confident92.5Very high145 Ų14524.1 Ų24.168%0.67812%0.119SC*.  trans-88.9-13.5-178.7-66.4175.617400113.2R583E185-R583 IonicContact OE1-CZ 3.98Å; E185-R583 IonicContact OE1-NE 3.86Å; E185-R583 IonicContact OE1-NH2 2.76Å; E185-R583 PolarHBondContact OE1-NH2 3.33Å
186K89.1Confident92.4Very high91 Ų9122.1 Ų22.140%0.39611%0.105SC..  trans-90.4114.7-176.2-70.2-151.6-163.1168.20113V184 E188 Y189 H190V184-K186 HydrophobicContact CG1-CB 4.3Å; K186-E188 HydrophobicContact CB-CG 3.98Å; K186-E188 HydrophobicContact CD-CG 3.75Å; K186-E188 WeakPolarHBondContact CD-OE1 3.19Å; K186-E188 IonicContact NZ-OE1 3.13Å; K186-E188 PolarHBondContact NZ-OE1 2.88Å; K186-E188 PolarHBondContact O-N 2.92Å; K186-Y189 HydrophobicContact CB-CD2 3.67Å; K186-Y189 HydrophobicContact CB-CE2 4.04Å; K186-Y189 HydrophobicContact CB-CG 4.21Å; K186-Y189 HydrophobicContact CD-CD2 4.04Å; K186-Y189 HydrophobicContact CD-CE2 3.54Å; K186-Y189 HydrophobicContact CG-CD2 4.21Å; K186-Y189 HydrophobicContact CG-CE2 4.09Å; K186-Y189 PolarHBondContact NZ-OH 2.74Å; K186-Y189 PolarHBondContact O-N 3.05Å; K186-H190 PolarHBondContact O-N 2.58Å
187V89.9Confident92.3Very high15 Ų1522.1 Ų22.19%0.09111%0.105CC..Hα-helixtrans-54.8-36.7171.7-175.60000112.5Y189 H190 V191 Y250 T251V187-Y189 PolarHBondContact O-N 3.28Å; V187-Y189 VanDerWaalsContact O-N 3.08Å; V187-H190 PolarHBondContact O-N 3.47Å; V187-H190 VanDerWaalsContact O-N 3.12Å; V187-V191 HydrophobicContact CG1-CG2 3.95Å; V187-V191 WeakPolarHBondContact O-CG2 3.17Å; V187-V191 PolarHBondContact O-N 3.17Å; V187-Y250 HydrophobicContact CG1-CE1 3.89Å; V187-Y250 HydrophobicContact CG1-CE2 4.4Å; V187-Y250 HydrophobicContact CG2-CD2 3.99Å; V187-Y250 HydrophobicContact CG2-CE1 4.31Å; V187-Y250 HydrophobicContact CG2-CE2 3.72Å; V187-Y250 HydrophobicContact CG2-CG 4.39Å; V187-T251 WeakPolarHBondContact CG1-O 3.31Å
188E92Very high92Very high16 Ų1622.2 Ų22.28%0.07511%0.106CC..Hα-helixtrans-56.9-26.3176.563.4164.1159.400114K186 W192 W255 K256K186-E188 HydrophobicContact CB-CG 3.98Å; K186-E188 HydrophobicContact CD-CG 3.75Å; K186-E188 WeakPolarHBondContact CD-OE1 3.19Å; K186-E188 IonicContact NZ-OE1 3.13Å; K186-E188 PolarHBondContact NZ-OE1 2.88Å; K186-E188 PolarHBondContact O-N 2.92Å; E188-W192 WeakPolarHBondContact O-CB 3.39Å; E188-W192 PolarHBondContact O-N 2.7Å; E188-W255 VanDerWaalsContact O-CB 3.31Å; E188-W255 WeakPolarHBondContact O-CB 3.37Å; E188-K256 VanDerWaalsContact CD-NZ 3.25Å; E188-K256 IonicContact OE1-NZ 3.69Å; E188-K256 PolarHBondContact OE1-NZ 3.08Å; E188-K256 IonicContact OE2-NZ 2.67Å; E188-K256 PolarHBondContact OE2-NZ 3.39Å
189Y92.8Very high91.7Very high19 Ų1922.4 Ų22.48%0.07511%0.108CC..Hα-helixtrans-88.8-35.8177.3-62.8-28.7000112.2S144 I147 V184 K186 V187 V191 W192 V193S144-Y189 WeakPolarHBondContact CB-OH 3.29Å; S144-Y189 PolarHBondContact OG-OH 3.33Å; I147-Y189 HydrophobicContact CB-CD1 4.47Å; I147-Y189 HydrophobicContact CB-CG 4.38Å; I147-Y189 HydrophobicContact CG1-CD2 4.38Å; I147-Y189 HydrophobicContact CG1-CG 4.19Å; I147-Y189 HydrophobicContact CG2-CD1 4Å; I147-Y189 HydrophobicContact CG2-CG 4.09Å; V184-Y189 HydrophobicContact CG1-CD2 3.66Å; V184-Y189 HydrophobicContact CG1-CG 4.3Å; K186-Y189 HydrophobicContact CB-CD2 3.67Å; K186-Y189 HydrophobicContact CB-CE2 4.04Å; K186-Y189 HydrophobicContact CB-CG 4.21Å; K186-Y189 HydrophobicContact CD-CD2 4.04Å; K186-Y189 HydrophobicContact CD-CE2 3.54Å; K186-Y189 HydrophobicContact CG-CD2 4.21Å; K186-Y189 HydrophobicContact CG-CE2 4.09Å; K186-Y189 PolarHBondContact NZ-OH 2.74Å; K186-Y189 PolarHBondContact O-N 3.05Å; V187-Y189 PolarHBondContact O-N 3.28Å; V187-Y189 VanDerWaalsContact O-N 3.08Å; Y189-V191 VanDerWaalsContact C-N 3.33Å; Y189-V191 PolarHBondContact O-N 2.89Å; Y189-W192 HydrophobicContact CD1-CE3 4.34Å; Y189-W192 PolarHBondContact O-N 3.31Å; Y189-V193 WeakPolarHBondContact O-CG2 3.48Å; Y189-V193 PolarHBondContact O-N 3.22Å
190H93.9Very high91.4Very high3 Ų324.1 Ų24.11%0.01412%0.115CC..Hα-helixtrans-59.5-46.2173.2-58172.1000111.4V180 F181 V184 K186 V187 L194 L226 Y250V180-H190 PolarHBondContact O-NE2 2.76Å; F181-H190 HydrophobicContact CD1-CB 3.9Å; F181-H190 AromaticContact CD1-CD2 3.95Å; F181-H190 AromaticContact CD1-CG 3.77Å; F181-H190 HydrophobicContact CE1-CB 3.81Å; V184-H190 PolarHBondContact O-CE1 2.72Å; V184-H190 VanDerWaalsContact O-CE1 3.26Å; V184-H190 PolarHBondContact O-NE2 3.41Å; K186-H190 PolarHBondContact O-N 2.58Å; V187-H190 PolarHBondContact O-N 3.47Å; V187-H190 VanDerWaalsContact O-N 3.12Å; H190-L194 WeakPolarHBondContact O-CB 3.48Å; H190-L194 PolarHBondContact O-N 3.39Å; H190-L194 VanDerWaalsContact O-N 3.12Å; H190-L226 HydrophobicContact CB-CD1 4.09Å; H190-Y250 AromaticContact ND1-CE2 3.46Å; H190-Y250 WeakPolarHBondContact ND1-CE2 3.48Å; H190-Y250 AromaticContact ND1-CZ 3.81Å; H190-Y250 PolarHBondContact ND1-OH 3.4Å
191V93.6Very high91.1Very high0 Ų026.2 Ų26.20%012%0.124CC..Hα-helixtrans-64.3-41.1178.4174.50000110.7V187 Y189 E195 L226V187-V191 HydrophobicContact CG1-CG2 3.95Å; V187-V191 WeakPolarHBondContact O-CG2 3.17Å; V187-V191 PolarHBondContact O-N 3.17Å; Y189-V191 VanDerWaalsContact C-N 3.33Å; Y189-V191 PolarHBondContact O-N 2.89Å; V191-E195 HydrophobicContact CG1-CG 4.46Å; V191-E195 WeakPolarHBondContact O-CB 3.37Å; V191-E195 WeakPolarHBondContact O-CG 3.37Å; V191-E195 PolarHBondContact O-N 2.91Å; V191-L226 HydrophobicContact CG2-CD2 3.61Å
192W94.3Very high90.8Very high27 Ų2728.8 Ų28.810%0.10214%0.135CC..Hα-helixtrans-65.7-47.1179.8-168.610.1000113.2I147 D148 C151 S152 E188 Y189 L194 S196 W255 I258I147-W192 HydrophobicContact CG2-CD2 4.48Å; I147-W192 HydrophobicContact CG2-CE3 3.72Å; I147-W192 HydrophobicContact CG2-CZ3 4.13Å; D148-W192 HydrophobicContact CB-CH2 4.12Å; D148-W192 HydrophobicContact CB-CZ3 4.41Å; C151-W192 HydrophobicContact CB-CD2 3.8Å; C151-W192 VanDerWaalsContact CB-CE2 3.41Å; C151-W192 HydrophobicContact CB-CE3 4.46Å; C151-W192 HydrophobicContact CB-CG 4.09Å; C151-W192 HydrophobicContact CB-CH2 4.44Å; C151-W192 HydrophobicContact CB-CZ2 3.78Å; S152-W192 WeakPolarHBondContact OG-CZ2 3.42Å; E188-W192 WeakPolarHBondContact O-CB 3.39Å; E188-W192 PolarHBondContact O-N 2.7Å; Y189-W192 HydrophobicContact CD1-CE3 4.34Å; Y189-W192 PolarHBondContact O-N 3.31Å; W192-L194 VanDerWaalsContact C-N 3.33Å; W192-L194 PolarHBondContact O-N 3.03Å; W192-S196 WeakPolarHBondContact O-CB 3.14Å; W192-S196 PolarHBondContact O-N 3.43Å; W192-S196 PolarHBondContact O-OG 3.27Å; W192-W255 HydrophobicContact CB-CB 3.71Å; W192-W255 HydrophobicContact CB-CD2 4.11Å; W192-W255 HydrophobicContact CB-CG 3.7Å; W192-W255 AromaticContact CD1-CD2 3.41Å; W192-W255 VanDerWaalsContact CD1-CD2 3.41Å; W192-W255 AromaticContact CD1-CE2 3.57Å; W192-W255 AromaticContact CD1-CE3 3.59Å; W192-W255 AromaticContact CD1-CG 3.93Å; W192-W255 AromaticContact CD1-CZ2 3.96Å; W192-W255 AromaticContact CD1-CZ3 3.96Å; W192-W255 HydrophobicContact CD2-CD2 4.23Å; W192-W255 AromaticContact CD2-CE3 3.88Å; W192-W255 HydrophobicContact CD2-CE3 3.88Å; W192-W255 HydrophobicContact CD2-CZ3 4.46Å; W192-W255 AromaticContact CE2-CE3 3.72Å; W192-W255 AromaticContact CE2-CZ3 3.82Å; W192-W255 HydrophobicContact CG-CB 4.12Å; W192-W255 AromaticContact CG-CD2 3.66Å; W192-W255 HydrophobicContact CG-CD2 3.66Å; W192-W255 AromaticContact CG-CE3 3.82Å; W192-W255 HydrophobicContact CG-CE3 3.82Å; W192-W255 AromaticContact CG-CG 3.81Å; W192-W255 HydrophobicContact CG-CG 3.81Å; W192-W255 HydrophobicContact CZ2-CE3 4.4Å; W192-W255 HydrophobicContact CZ2-CZ3 4.26Å; W192-W255 AromaticContact NE1-CD2 3.84Å; W192-W255 AromaticContact NE1-CE3 3.52Å; W192-W255 AromaticContact NE1-CH2 3.76Å; W192-W255 AromaticContact NE1-CZ3 3.49Å; W192-I258 HydrophobicContact CZ2-CD1 4.35Å; W192-I258 HydrophobicContact CZ2-CG1 4.34Å
193V94.6Very high90.6Very high0 Ų028.4 Ų28.40%013%0.134CC..Hα-helixtrans-61.5-44.6177.61760000110.2I147 L150 C151 L177 V180 Y189 S196 F197I147-V193 HydrophobicContact CD1-CG2 3.97Å; I147-V193 HydrophobicContact CG2-CG2 4.14Å; L150-V193 HydrophobicContact CD2-CG1 4.37Å; L150-V193 HydrophobicContact CD2-CG2 4.18Å; C151-V193 VanDerWaalsContact SG-CG2 3.54Å; L177-V193 HydrophobicContact CD2-CG1 3.85Å; V180-V193 HydrophobicContact CG1-CG2 4.23Å; V180-V193 HydrophobicContact CG2-CG2 4.33Å; Y189-V193 WeakPolarHBondContact O-CG2 3.48Å; Y189-V193 PolarHBondContact O-N 3.22Å; V193-S196 WeakPolarHBondContact O-CB 3.41Å; V193-S196 PolarHBondContact O-N 3.08Å; V193-F197 HydrophobicContact CG1-CD2 3.85Å; V193-F197 HydrophobicContact CG1-CE2 3.51Å; V193-F197 WeakPolarHBondContact O-CD2 3.38Å; V193-F197 PolarHBondContact O-N 3.45Å; V193-F197 VanDerWaalsContact O-N 3.13Å
194L94.2Very high90.7Very high0 Ų026.8 Ų26.80%013%0.127CC..Hα-helixtrans-66.5-46.8-179.1-169.367.3000112.4L177 H190 W192 S196 F197 M198 L204 L208 L226 Y230L177-L194 HydrophobicContact CD1-CD1 3.88Å; L177-L194 HydrophobicContact CD2-CB 4.41Å; L177-L194 HydrophobicContact CD2-CD1 3.92Å; H190-L194 WeakPolarHBondContact O-CB 3.48Å; H190-L194 PolarHBondContact O-N 3.39Å; H190-L194 VanDerWaalsContact O-N 3.12Å; W192-L194 VanDerWaalsContact C-N 3.33Å; W192-L194 PolarHBondContact O-N 3.03Å; L194-S196 PolarHBondContact O-N 2.99Å; L194-F197 PolarHBondContact O-N 3.12Å; L194-M198 HydrophobicContact CD1-CE 4.28Å; L194-M198 HydrophobicContact CD2-CE 3.93Å; L194-M198 HydrophobicContact CG-CE 3.88Å; L194-M198 HydrophobicContact CG-CG 4.37Å; L194-M198 WeakPolarHBondContact O-CG 3.02Å; L194-M198 PolarHBondContact O-N 3.18Å; L194-L204 HydrophobicContact CD1-CD2 3.55Å; L194-L204 HydrophobicContact CG-CD2 4.35Å; L194-L208 HydrophobicContact CD1-CD1 4.23Å; L194-L208 HydrophobicContact CD1-CD2 4.02Å; L194-L208 HydrophobicContact CD1-CG 4.31Å; L194-L208 HydrophobicContact CD2-CD1 4.22Å; L194-L208 HydrophobicContact CD2-CD2 4.4Å; L194-L226 HydrophobicContact CD2-CB 3.64Å; L194-L226 HydrophobicContact CD2-CD1 3.88Å; L194-L226 HydrophobicContact CD2-CG 4.22Å; L194-Y230 HydrophobicContact CD2-CD2 3.88Å; L194-Y230 HydrophobicContact CD2-CE2 3.7Å
195E92.9Very high90.8Very high10 Ų1027.2 Ų27.25%0.04713%0.128CC..Hα-helixtrans-60.6-32.4174.8-71.7-155.5147.600112.6V191 M198 S199 Y230 W255 P318 T319 W343V191-E195 HydrophobicContact CG1-CG 4.46Å; V191-E195 WeakPolarHBondContact O-CB 3.37Å; V191-E195 WeakPolarHBondContact O-CG 3.37Å; V191-E195 PolarHBondContact O-N 2.91Å; E195-M198 PolarHBondContact O-N 2.98Å; E195-S199 PolarHBondContact O-N 2.96Å; E195-Y230 HydrophobicContact CG-CE1 4.32Å; E195-Y230 VanDerWaalsContact CG-OH 3.24Å; E195-Y230 WeakPolarHBondContact CG-OH 3.26Å; E195-Y230 PolarHBondContact OE1-OH 3.12Å; E195-W255 PolarHBondContact OE2-NE1 3.19Å; E195-P318 WeakPolarHBondContact OE2-CA 3.29Å; E195-T319 WeakPolarHBondContact OE1-CA 3.47Å; E195-T319 WeakPolarHBondContact OE1-CB 3.41Å; E195-T319 PolarHBondContact OE1-N 3.17Å; E195-T319 PolarHBondContact OE1-OG1 3.49Å; E195-T319 PolarHBondContact OE2-N 2.98Å; E195-W343 HydrophobicContact CB-CH2 4.17Å; E195-W343 HydrophobicContact CB-CZ3 3.9Å; E195-W343 HydrophobicContact CG-CH2 3.76Å; E195-W343 HydrophobicContact CG-CZ3 3.96Å
196S91.3Very high91.2Very high17 Ų1723.6 Ų23.612%0.11911%0.11CC..Hα-helixtrans-63.4-46.8175.4-570000110.9W192 V193 L194 S199W192-S196 WeakPolarHBondContact O-CB 3.14Å; W192-S196 PolarHBondContact O-N 3.43Å; W192-S196 PolarHBondContact O-OG 3.27Å; V193-S196 WeakPolarHBondContact O-CB 3.41Å; V193-S196 PolarHBondContact O-N 3.08Å; L194-S196 PolarHBondContact O-N 2.99Å; S196-S199 PolarHBondContact O-N 3.14Å; S196-S199 PolarHBondContact O-OG 2.88Å
197F92.9Very high91.3Very high0 Ų019.8 Ų19.80%010%0.095CC..Hα-helixtrans-70.3-35.6175.5-69.7-55.5000113.9I155 Y159 I173 I176 L177 V193 L194 S199 K200 K201 L204I155-F197 HydrophobicContact CD1-CD1 4.14Å; I155-F197 HydrophobicContact CD1-CD2 4.28Å; I155-F197 HydrophobicContact CD1-CE1 3.68Å; I155-F197 HydrophobicContact CD1-CE2 3.87Å; I155-F197 HydrophobicContact CD1-CG 4.42Å; I155-F197 HydrophobicContact CD1-CZ 3.54Å; I155-F197 HydrophobicContact CG1-CD1 4.4Å; I155-F197 HydrophobicContact CG1-CE1 3.75Å; I155-F197 HydrophobicContact CG1-CZ 3.95Å; I155-F197 HydrophobicContact CG2-CD1 4.16Å; I155-F197 HydrophobicContact CG2-CE1 4.26Å; Y159-F197 HydrophobicContact CD1-CD1 4.5Å; Y159-F197 HydrophobicContact CD1-CE1 4.31Å; Y159-F197 HydrophobicContact CD2-CE1 4.29Å; Y159-F197 HydrophobicContact CE1-CD1 4.43Å; Y159-F197 AromaticContact CE1-CE1 3.9Å; Y159-F197 HydrophobicContact CE1-CE1 3.9Å; Y159-F197 AromaticContact CE2-CE1 3.87Å; Y159-F197 HydrophobicContact CE2-CE1 3.87Å; Y159-F197 HydrophobicContact CG-CE1 4.49Å; Y159-F197 AromaticContact CZ-CE1 3.66Å; I173-F197 HydrophobicContact CD1-CD1 3.87Å; I173-F197 HydrophobicContact CD1-CE1 4.16Å; I173-F197 HydrophobicContact CD1-CG 4.49Å; I173-F197 HydrophobicContact CG1-CD1 3.93Å; I173-F197 HydrophobicContact CG1-CE1 3.75Å; I173-F197 HydrophobicContact CG1-CZ 4.17Å; I173-F197 HydrophobicContact CG2-CB 4.45Å; I173-F197 HydrophobicContact CG2-CD1 4.22Å; I173-F197 HydrophobicContact CG2-CD2 3.92Å; I173-F197 HydrophobicContact CG2-CE1 4.44Å; I173-F197 HydrophobicContact CG2-CE2 4.12Å; I173-F197 HydrophobicContact CG2-CG 3.96Å; I173-F197 HydrophobicContact CG2-CZ 4.38Å; I176-F197 HydrophobicContact CD1-CZ 4.29Å; I176-F197 HydrophobicContact CG2-CE2 3.89Å; I176-F197 HydrophobicContact CG2-CZ 3.95Å; L177-F197 HydrophobicContact CD2-CD2 4.08Å; L177-F197 HydrophobicContact CD2-CE2 4.33Å; L177-F197 HydrophobicContact CG-CD2 4.26Å; L177-F197 HydrophobicContact CG-CE2 4.35Å; V193-F197 HydrophobicContact CG1-CD2 3.85Å; V193-F197 HydrophobicContact CG1-CE2 3.51Å; V193-F197 WeakPolarHBondContact O-CD2 3.38Å; V193-F197 PolarHBondContact O-N 3.45Å; V193-F197 VanDerWaalsContact O-N 3.13Å; L194-F197 PolarHBondContact O-N 3.12Å; F197-S199 PolarHBondContact O-N 3.18Å; F197-S199 VanDerWaalsContact O-N 3.12Å; F197-K200 PolarHBondContact O-N 2.95Å; F197-K201 PolarHBondContact O-N 3.38Å; F197-L204 HydrophobicContact CB-CD1 4Å; F197-L204 HydrophobicContact CB-CD2 3.85Å
198M90.3Very high91.5Very high1 Ų119.1 Ų19.11%0.0059%0.09CC..Hα-helixtrans-57.7-27.2175.1-68.2-86.4-16900112.6L194 E195 K200 L204 L208 Y230 W231 W343 Q424L194-M198 HydrophobicContact CD1-CE 4.28Å; L194-M198 HydrophobicContact CD2-CE 3.93Å; L194-M198 HydrophobicContact CG-CE 3.88Å; L194-M198 HydrophobicContact CG-CG 4.37Å; L194-M198 WeakPolarHBondContact O-CG 3.02Å; L194-M198 PolarHBondContact O-N 3.18Å; E195-M198 PolarHBondContact O-N 2.98Å; M198-K200 VanDerWaalsContact C-N 3.32Å; M198-L204 HydrophobicContact CB-CD2 4.4Å; M198-L204 HydrophobicContact CE-CD2 4.11Å; M198-L204 HydrophobicContact CG-CD2 3.65Å; M198-L204 HydrophobicContact SD-CB 4.08Å; M198-L204 HydrophobicContact SD-CD2 3.78Å; M198-L208 HydrophobicContact CE-CD1 4.48Å; M198-Y230 HydrophobicContact CE-CD1 4.28Å; M198-Y230 HydrophobicContact CE-CD2 3.73Å; M198-Y230 HydrophobicContact CE-CE2 4.4Å; M198-Y230 HydrophobicContact CE-CG 3.7Å; M198-W231 HydrophobicContact CE-CH2 3.52Å; M198-W231 HydrophobicContact CE-CZ3 3.59Å; M198-W231 HydrophobicContact SD-CH2 3.91Å; M198-W343 HydrophobicContact CB-CD2 3.77Å; M198-W343 HydrophobicContact CB-CE3 4.01Å; M198-W343 HydrophobicContact CB-CG 4.38Å; M198-W343 HydrophobicContact CB-CH2 4.07Å; M198-W343 HydrophobicContact CB-CZ2 3.77Å; M198-W343 HydrophobicContact CB-CZ3 4.16Å; M198-W343 HydrophobicContact CG-CH2 4.43Å; M198-W343 HydrophobicContact CG-CZ2 4.08Å; M198-W343 HydrophobicContact SD-CZ2 4.46Å; M198-Q424 PolarHBondContact O-NE2 3.32Å; M198-Q424 VanDerWaalsContact O-NE2 3.08Å; M198-Q424 HydrophobicContact SD-CG 3.66Å
199S88.1Confident91.6Very high30 Ų3018.4 Ų18.421%0.219%0.087CC..THydrogen-bonded Turntrans-79.3-9.5175.981.30000114.8E195 S196 F197 I422E195-S199 PolarHBondContact O-N 2.96Å; S196-S199 PolarHBondContact O-N 3.14Å; S196-S199 PolarHBondContact O-OG 2.88Å; F197-S199 PolarHBondContact O-N 3.18Å; F197-S199 VanDerWaalsContact O-N 3.12Å; S199-I422 VanDerWaalsContact O-CD1 3.25Å; S199-I422 WeakPolarHBondContact O-CD1 3.07Å
200K86.9Confident91.7Very high56 Ų5620.4 Ų20.424%0.24310%0.098CC..THydrogen-bonded Turntrans-123.3-33.5-169.9-60.8-50.8-154.2161.70115.4I155 Y159 N160 F197 M198I155-K200 HydrophobicContact CG2-CG 4.15Å; Y159-K200 WeakPolarHBondContact O-CD 3.42Å; Y159-K200 WeakPolarHBondContact O-CE 3.37Å; Y159-K200 PolarHBondContact O-NZ 3.19Å; N160-K200 PolarHBondContact OD1-NZ 2.86Å; F197-K200 PolarHBondContact O-N 2.95Å; M198-K200 VanDerWaalsContact C-N 3.32Å
201K87.8Confident91.7Very high43 Ų4320.4 Ų20.419%0.18710%0.098CC..  trans-121133.5-177.7178.4173.5-177.3-171.80110.7I170 I173 F197 L204 D207 Q424I170-K201 HydrophobicContact CG2-CD 3.96Å; I170-K201 PolarHBondContact O-NZ 3Å; I173-K201 HydrophobicContact CD1-CB 4.4Å; I173-K201 HydrophobicContact CD1-CD 3.55Å; F197-K201 PolarHBondContact O-N 3.38Å; K201-L204 HydrophobicContact CB-CD1 3.98Å; K201-L204 HydrophobicContact CD-CD1 4Å; K201-L204 HydrophobicContact CG-CD1 4.15Å; K201-D207 WeakPolarHBondContact CD-OD2 3.35Å; K201-D207 WeakPolarHBondContact CE-OD2 3.23Å; K201-D207 IonicContact NZ-OD1 2.71Å; K201-D207 PolarHBondContact NZ-OD1 2.81Å; K201-D207 IonicContact NZ-OD2 3.07Å; K201-D207 PolarHBondContact NZ-OD2 3.31Å; K201-Q424 PolarHBondContact O-NE2 3.19Å
202K87.2Confident91.7Very high54 Ų5420.4 Ų20.424%0.23510%0.098CC..SBendtrans-73.7158.5171.6-65.7175.1-175.5153.60110.6D163 L204D163-K202 VanDerWaalsContact OD1-CD 3.26Å; D163-K202 WeakPolarHBondContact OD1-CD 3.43Å; D163-K202 VanDerWaalsContact OD1-CE 3.29Å; D163-K202 WeakPolarHBondContact OD1-CE 3.4Å; D163-K202 IonicContact OD1-NZ 2.78Å; D163-K202 PolarHBondContact OD1-NZ 3.26Å; D163-K202 VanDerWaalsContact OD1-NZ 3.1Å; D163-K202 IonicContact OD2-NZ 3.59Å; D163-K202 PolarHBondContact OD2-NZ 3.08Å; K202-L204 VanDerWaalsContact C-N 3.3Å; K202-L204 PolarHBondContact O-N 3.47Å
203D86.6Confident91.6Very high35 Ų3519.3 Ų19.319%0.18710%0.095CC..  trans51.240.1177.3-62.6-11.1000115.1Y205 K206 S425D203-Y205 HydrophobicContact CB-CD1 4.1Å; D203-Y205 HydrophobicContact CB-CE1 3.46Å; D203-Y205 VanDerWaalsContact CB-CE1 3.46Å; D203-Y205 PolarHBondContact O-N 3.12Å; D203-K206 HydrophobicContact CB-CD 3.83Å; D203-K206 HydrophobicContact CB-CG 4.32Å; D203-K206 WeakPolarHBondContact O-CB 3.4Å; D203-K206 PolarHBondContact O-N 3.19Å; D203-K206 IonicContact OD2-NZ 2.64Å; D203-K206 PolarHBondContact OD2-NZ 3.32Å; D203-S425 PolarHBondContact OD1-OG 2.86Å
204L92.3Very high91.5Very high0 Ų026 Ų260%012%0.121CC..THydrogen-bonded Turntrans-62.1-9.2-178.3-154.980.1000113.7I173 L194 F197 M198 K201 K202 K206 D207 L208I173-L204 HydrophobicContact CG2-CD1 4.28Å; L194-L204 HydrophobicContact CD1-CD2 3.55Å; L194-L204 HydrophobicContact CG-CD2 4.35Å; F197-L204 HydrophobicContact CB-CD1 4Å; F197-L204 HydrophobicContact CB-CD2 3.85Å; M198-L204 HydrophobicContact CB-CD2 4.4Å; M198-L204 HydrophobicContact CE-CD2 4.11Å; M198-L204 HydrophobicContact CG-CD2 3.65Å; M198-L204 HydrophobicContact SD-CB 4.08Å; M198-L204 HydrophobicContact SD-CD2 3.78Å; K201-L204 HydrophobicContact CB-CD1 3.98Å; K201-L204 HydrophobicContact CD-CD1 4Å; K201-L204 HydrophobicContact CG-CD1 4.15Å; K202-L204 VanDerWaalsContact C-N 3.3Å; K202-L204 PolarHBondContact O-N 3.47Å; L204-K206 PolarHBondContact O-N 2.98Å; L204-D207 VanDerWaalsContact CD1-OD2 3.29Å; L204-D207 WeakPolarHBondContact CD1-OD2 3.42Å; L204-D207 PolarHBondContact O-N 3.35Å; L204-L208 PolarHBondContact O-N 3.49Å
205Y91.5Very high91.1Very high9 Ų926.5 Ų26.54%0.03513%0.126CC..Hα-helixtrans-62.5-27.9168.165.2-97.5000112.6D203 L208 L209 W231 S425 L427D203-Y205 HydrophobicContact CB-CD1 4.1Å; D203-Y205 HydrophobicContact CB-CE1 3.46Å; D203-Y205 VanDerWaalsContact CB-CE1 3.46Å; D203-Y205 PolarHBondContact O-N 3.12Å; Y205-L208 PolarHBondContact O-N 2.89Å; Y205-L209 HydrophobicContact CD2-CD1 4.12Å; Y205-L209 WeakPolarHBondContact O-CB 3.43Å; Y205-L209 VanDerWaalsContact O-CG 3.26Å; Y205-L209 WeakPolarHBondContact O-CG 3.42Å; Y205-L209 PolarHBondContact O-N 3.36Å; Y205-W231 AromaticContact CD1-CZ2 3.94Å; Y205-W231 HydrophobicContact CD1-CZ2 3.94Å; Y205-W231 HydrophobicContact CG-CZ2 4.32Å; Y205-S425 WeakPolarHBondContact CE1-OG 3.46Å; Y205-L427 HydrophobicContact CD2-CD1 3.24Å; Y205-L427 HydrophobicContact CE2-CD1 3.52Å; Y205-L427 HydrophobicContact CG-CD1 3.8Å
206K92Very high90.9Very high69 Ų6928.1 Ų28.130%0.314%0.137SC..Hα-helixtrans-62-49.5176.7-68.9168.9174.7157.10110.3D203 L204 L208 L209 M210D203-K206 HydrophobicContact CB-CD 3.83Å; D203-K206 HydrophobicContact CB-CG 4.32Å; D203-K206 WeakPolarHBondContact O-CB 3.4Å; D203-K206 PolarHBondContact O-N 3.19Å; D203-K206 IonicContact OD2-NZ 2.64Å; D203-K206 PolarHBondContact OD2-NZ 3.32Å; L204-K206 PolarHBondContact O-N 2.98Å; K206-L208 PolarHBondContact O-N 3.41Å; K206-L209 PolarHBondContact O-N 3.11Å; K206-M210 PolarHBondContact O-N 3.04Å
207D93.1Very high90.4Very high12 Ų1229.1 Ų29.16%0.06414%0.143CC..Hα-helixtrans-58.8-46.8175.7-62.7-18.3000111.1I173 P174 K201 L204 M210 I211I173-D207 WeakPolarHBondContact CG2-OD2 3.29Å; P174-D207 HydrophobicContact CG-CB 3.92Å; K201-D207 WeakPolarHBondContact CD-OD2 3.35Å; K201-D207 WeakPolarHBondContact CE-OD2 3.23Å; K201-D207 IonicContact NZ-OD1 2.71Å; K201-D207 PolarHBondContact NZ-OD1 2.81Å; K201-D207 IonicContact NZ-OD2 3.07Å; K201-D207 PolarHBondContact NZ-OD2 3.31Å; L204-D207 VanDerWaalsContact CD1-OD2 3.29Å; L204-D207 WeakPolarHBondContact CD1-OD2 3.42Å; L204-D207 PolarHBondContact O-N 3.35Å; D207-M210 PolarHBondContact O-N 3.34Å; D207-I211 VanDerWaalsContact O-CG1 3.3Å; D207-I211 WeakPolarHBondContact O-CG1 3.44Å; D207-I211 PolarHBondContact O-N 3.21Å; D207-I211 VanDerWaalsContact O-N 3.12Å
208L94.2Very high90Very high0 Ų030.3 Ų30.30%015%0.148CC..Hα-helixtrans-64-41.2177.7-72.4169.4000112.9F181 L194 M198 L204 Y205 K206 M210 I211 I212 A223 F227 W231F181-L208 HydrophobicContact CE2-CD2 4.09Å; F181-L208 HydrophobicContact CZ-CD2 4.34Å; L194-L208 HydrophobicContact CD1-CD1 4.23Å; L194-L208 HydrophobicContact CD1-CD2 4.02Å; L194-L208 HydrophobicContact CD1-CG 4.31Å; L194-L208 HydrophobicContact CD2-CD1 4.22Å; L194-L208 HydrophobicContact CD2-CD2 4.4Å; M198-L208 HydrophobicContact CE-CD1 4.48Å; L204-L208 PolarHBondContact O-N 3.49Å; Y205-L208 PolarHBondContact O-N 2.89Å; K206-L208 PolarHBondContact O-N 3.41Å; L208-M210 VanDerWaalsContact C-N 3.32Å; L208-M210 PolarHBondContact O-N 2.9Å; L208-I211 HydrophobicContact CD2-CD1 4.48Å; L208-I211 PolarHBondContact O-N 3.39Å; L208-I212 WeakPolarHBondContact O-CD1 3.44Å; L208-I212 WeakPolarHBondContact O-CG1 3.42Å; L208-I212 PolarHBondContact O-N 2.75Å; L208-A223 HydrophobicContact CD2-CB 4.41Å; L208-F227 HydrophobicContact CB-CD2 4.38Å; L208-F227 HydrophobicContact CD1-CB 4.33Å; L208-W231 HydrophobicContact CD1-CH2 4.32Å; L208-W231 HydrophobicContact CD1-CZ3 3.7Å
209L93.7Very high89.9Confident1 Ų130.2 Ų30.21%0.00515%0.148CC..Hα-helixtrans-62.8-39.5175.8-75171.4000111.3Y205 K206 I211 I212 A213 F227 L427 M433 M441 A444Y205-L209 HydrophobicContact CD2-CD1 4.12Å; Y205-L209 WeakPolarHBondContact O-CB 3.43Å; Y205-L209 VanDerWaalsContact O-CG 3.26Å; Y205-L209 WeakPolarHBondContact O-CG 3.42Å; Y205-L209 PolarHBondContact O-N 3.36Å; K206-L209 PolarHBondContact O-N 3.11Å; L209-I211 VanDerWaalsContact C-N 3.34Å; L209-I211 PolarHBondContact O-N 3.16Å; L209-I212 PolarHBondContact O-N 2.71Å; L209-I212 VanDerWaalsContact O-N 3.16Å; L209-A213 WeakPolarHBondContact O-CB 3.49Å; L209-A213 PolarHBondContact O-N 2.64Å; L209-F227 HydrophobicContact CD2-CE2 4.02Å; L209-F227 HydrophobicContact CD2-CZ 4.2Å; L209-F227 HydrophobicContact CG-CE2 4.12Å; L209-L427 HydrophobicContact CD1-CD1 4.17Å; L209-M433 HydrophobicContact CD1-CE 4.5Å; L209-M441 HydrophobicContact CD1-CB 4.27Å; L209-M441 HydrophobicContact CD1-CE 3.76Å; L209-A444 HydrophobicContact CD2-CB 3.98Å
210M93.8Very high90Very high61 Ų6129.8 Ų29.830%0.314%0.142SC..Hα-helixtrans-64.5-36.9176.1-164.2169.867.800112.3P174 K206 D207 L208 A213 Y214 Y440P174-M210 HydrophobicContact CB-CE 3.52Å; P174-M210 HydrophobicContact CG-CE 3.47Å; P174-M210 VanDerWaalsContact CG-CE 3.47Å; K206-M210 PolarHBondContact O-N 3.04Å; D207-M210 PolarHBondContact O-N 3.34Å; L208-M210 VanDerWaalsContact C-N 3.32Å; L208-M210 PolarHBondContact O-N 2.9Å; M210-A213 PolarHBondContact O-N 3.38Å; M210-Y214 HydrophobicContact CG-CD2 3.7Å; M210-Y214 HydrophobicContact CG-CE2 4.02Å; M210-Y214 WeakPolarHBondContact O-CD2 3.19Å; M210-Y214 PolarHBondContact O-N 2.82Å; M210-Y440 HydrophobicContact CG-CD1 4.46Å; M210-Y440 HydrophobicContact SD-CE1 4.22Å; M210-Y440 HydrophobicContact SD-CE2 4.43Å
211I94Very high90.1Very high3 Ų327.1 Ų27.12%0.01513%0.13CC..Hα-helixtrans-66.3-38172.5-58.7165.6000111.2P174 L177 T178 F181 D207 L208 L209 G215 A219 A223P174-I211 HydrophobicContact CB-CG1 4.21Å; L177-I211 HydrophobicContact CB-CD1 3.45Å; L177-I211 VanDerWaalsContact CB-CD1 3.45Å; L177-I211 HydrophobicContact CD1-CD1 4.03Å; L177-I211 HydrophobicContact CG-CD1 4.4Å; T178-I211 WeakPolarHBondContact OG1-CG1 3.44Å; F181-I211 HydrophobicContact CD2-CG2 4.45Å; F181-I211 HydrophobicContact CE2-CD1 4.28Å; D207-I211 VanDerWaalsContact O-CG1 3.3Å; D207-I211 WeakPolarHBondContact O-CG1 3.44Å; D207-I211 PolarHBondContact O-N 3.21Å; D207-I211 VanDerWaalsContact O-N 3.12Å; L208-I211 HydrophobicContact CD2-CD1 4.48Å; L208-I211 PolarHBondContact O-N 3.39Å; L209-I211 VanDerWaalsContact C-N 3.34Å; L209-I211 PolarHBondContact O-N 3.16Å; I211-G215 WeakPolarHBondContact O-CA 3.31Å; I211-G215 PolarHBondContact O-N 3.17Å; I211-A219 HydrophobicContact CG2-CB 4.44Å; I211-A223 HydrophobicContact CB-CB 4.32Å; I211-A223 HydrophobicContact CG2-CB 3.85Å
212I93.7Very high90.2Very high1 Ų125 Ų251%0.00512%0.121CC..Hα-helixtrans-70-37.4177.7-64.6163.2000110.8L208 L209 R220 A223 V224 F227 A444 L448L208-I212 WeakPolarHBondContact O-CD1 3.44Å; L208-I212 WeakPolarHBondContact O-CG1 3.42Å; L208-I212 PolarHBondContact O-N 2.75Å; L209-I212 PolarHBondContact O-N 2.71Å; L209-I212 VanDerWaalsContact O-N 3.16Å; I212-R220 HydrophobicContact CG2-CG 4.33Å; I212-R220 PolarHBondContact O-NE 3.05Å; I212-R220 PolarHBondContact O-NH2 2.96Å; I212-A223 HydrophobicContact CD1-CB 4.42Å; I212-A223 HydrophobicContact CG1-CB 3.77Å; I212-V224 HydrophobicContact CD1-CG2 3.81Å; I212-V224 HydrophobicContact CG1-CG2 3.77Å; I212-V224 HydrophobicContact CG2-CG2 4Å; I212-F227 HydrophobicContact CD1-CB 4.35Å; I212-F227 HydrophobicContact CD1-CG 4.45Å; I212-A444 HydrophobicContact CB-CB 3.96Å; I212-A444 HydrophobicContact CG2-CB 3.69Å; I212-L448 HydrophobicContact CG2-CD1 3.63Å; I212-L448 HydrophobicContact CG2-CD2 4.08Å; I212-L448 HydrophobicContact CG2-CG 3.67Å
213A92.1Very high90.5Very high4 Ų422.5 Ų22.53%0.03311%0.11CC..Hα-helixtrans-65.3-62.3175.100000112.2L209 M210 R220 Q443 A444 S447L209-A213 WeakPolarHBondContact O-CB 3.49Å; L209-A213 PolarHBondContact O-N 2.64Å; M210-A213 PolarHBondContact O-N 3.38Å; A213-R220 PolarHBondContact O-NH2 3.45Å; A213-Q443 HydrophobicContact CB-CB 3.87Å; A213-Q443 HydrophobicContact CB-CG 3.91Å; A213-A444 HydrophobicContact CB-CB 4.22Å; A213-S447 PolarHBondContact O-OG 3.03Å
214Y92.1Very high90.8Very high141 Ų14120.8 Ų20.855%0.55310%0.101SC*.Hα-helixtrans-109.7-7.6-165.8-50.4-77.7000114.6M210 Y440 Q443M210-Y214 HydrophobicContact CG-CD2 3.7Å; M210-Y214 HydrophobicContact CG-CE2 4.02Å; M210-Y214 WeakPolarHBondContact O-CD2 3.19Å; M210-Y214 PolarHBondContact O-N 2.82Å; Y214-Y440 AromaticContact CE2-CD1 3.91Å; Y214-Y440 HydrophobicContact CE2-CD1 3.91Å; Y214-Y440 HydrophobicContact CE2-CE1 4.39Å; Y214-Q443 HydrophobicContact CD1-CG 4.37Å; Y214-Q443 HydrophobicContact CE1-CG 3.83Å
215G87.1Confident90.7Very high10 Ų1021.7 Ų21.710%0.10311%0.107CC..SBendtrans-71.7159.9-179.400000113.7I211 R220I211-G215 WeakPolarHBondContact O-CA 3.31Å; I211-G215 PolarHBondContact O-N 3.17Å; G215-R220 PolarHBondContact O-NH2 3.13Å
216P87.3Confident90.7Very high44 Ų4421.3 Ų21.329%0.28611%0.105SC..  trans-66.6152.5172.629.7-34.9000111T178 Q182 E218 A219 R220T178-P216 HydrophobicContact CG2-CG 4.25Å; Q182-P216 HydrophobicContact CG-CG 4.36Å; P216-E218 PolarHBondContact O-N 3.01Å; P216-E218 VanDerWaalsContact O-N 3.14Å; P216-A219 HydrophobicContact CG-CB 4.04Å; P216-A219 WeakPolarHBondContact O-CA 3.2Å; P216-A219 PolarHBondContact O-N 3Å; P216-R220 PolarHBondContact O-N 2.98Å
217T82Confident90.7Very high37 Ų3718 Ų1823%0.2279%0.091CC..Hα-helixtrans-59-29.7-175.4-67.20000113.3A219 R220 L221 E451 H589T217-A219 VanDerWaalsContact C-N 3.28Å; T217-A219 PolarHBondContact O-N 3.36Å; T217-R220 PolarHBondContact O-N 2.86Å; T217-R220 PolarHBondContact OG1-NH1 2.74Å; T217-R220 VanDerWaalsContact OG1-NH1 3.07Å; T217-L221 PolarHBondContact O-N 2.9Å; T217-E451 VanDerWaalsContact CG2-OE1 3.31Å; T217-E451 WeakPolarHBondContact CG2-OE1 3.35Å; T217-E451 VanDerWaalsContact CG2-OE2 3.23Å; T217-E451 WeakPolarHBondContact CG2-OE2 3.19Å; T217-E451 PolarHBondContact OG1-OE1 3.04Å; T217-H589 VanDerWaalsContact CG2-CE1 3.49Å; T217-H589 WeakPolarHBondContact CG2-CE1 3.3Å
218E83.4Confident90.6Very high25 Ų2518.1 Ų18.112%0.1179%0.091CC..Hα-helixtrans-61-35.9173.2-6669.9-15100112.6Q182 P216 P222 L580 Y584Q182-E218 HydrophobicContact CG-CB 4.3Å; P216-E218 PolarHBondContact O-N 3.01Å; P216-E218 VanDerWaalsContact O-N 3.14Å; E218-P222 WeakPolarHBondContact O-CD 3.4Å; E218-L580 HydrophobicContact CG-CB 4.4Å; E218-Y584 WeakPolarHBondContact O-CE2 3.49Å; E218-Y584 PolarHBondContact O-OH 2.84Å
219A89Confident90.3Very high0 Ų020 Ų200%010%0.1CC..Hα-helixtrans-88.3-28.1178.700000113.1T178 F181 Q182 I211 P216 T217 L221 P222 A223T178-A219 HydrophobicContact CG2-CB 4.07Å; F181-A219 HydrophobicContact CB-CB 3.88Å; Q182-A219 HydrophobicContact CB-CB 4.35Å; I211-A219 HydrophobicContact CG2-CB 4.44Å; P216-A219 HydrophobicContact CG-CB 4.04Å; P216-A219 WeakPolarHBondContact O-CA 3.2Å; P216-A219 PolarHBondContact O-N 3Å; T217-A219 VanDerWaalsContact C-N 3.28Å; T217-A219 PolarHBondContact O-N 3.36Å; A219-L221 PolarHBondContact O-N 2.93Å; A219-P222 WeakPolarHBondContact O-CD 3.46Å; A219-A223 WeakPolarHBondContact O-CB 3.24Å; A219-A223 PolarHBondContact O-N 2.84Å; A219-A223 VanDerWaalsContact O-N 3.1Å
220R89.9Confident90.1Very high20 Ų2020.2 Ų20.28%0.07510%0.1CC..Hα-helixtrans-58.8-43.1177.2-172.5175.4-72.1106.69111.9I212 A213 G215 P216 T217 A223 V224 L448 E451 L592I212-R220 HydrophobicContact CG2-CG 4.33Å; I212-R220 PolarHBondContact O-NE 3.05Å; I212-R220 PolarHBondContact O-NH2 2.96Å; A213-R220 PolarHBondContact O-NH2 3.45Å; G215-R220 PolarHBondContact O-NH2 3.13Å; P216-R220 PolarHBondContact O-N 2.98Å; T217-R220 PolarHBondContact O-N 2.86Å; T217-R220 PolarHBondContact OG1-NH1 2.74Å; T217-R220 VanDerWaalsContact OG1-NH1 3.07Å; R220-A223 PolarHBondContact O-N 3.4Å; R220-V224 HydrophobicContact CG-CG2 4.32Å; R220-V224 WeakPolarHBondContact O-CG2 3.32Å; R220-V224 PolarHBondContact O-N 3.23Å; R220-L448 HydrophobicContact CG-CD2 4.08Å; R220-E451 WeakPolarHBondContact CD-OE1 3.38Å; R220-E451 IonicContact CZ-OE1 3.25Å; R220-E451 IonicContact NE-OE1 3.96Å; R220-E451 IonicContact NH1-OE1 3.7Å; R220-E451 PolarHBondContact NH1-OE1 3.47Å; R220-L592 HydrophobicContact CG-CD1 4.5Å
221L88.4Confident89.9Confident0 Ų017.4 Ų17.40%09%0.087CC..Hα-helixtrans-61.9-52.5-179.9-177.166.8000113.5T217 A219 A223 V224 C225 P247 Y584 D588 L592T217-L221 PolarHBondContact O-N 2.9Å; A219-L221 PolarHBondContact O-N 2.93Å; L221-A223 VanDerWaalsContact C-N 3.34Å; L221-A223 PolarHBondContact O-N 2.92Å; L221-V224 PolarHBondContact O-N 2.99Å; L221-C225 WeakPolarHBondContact O-CB 3.39Å; L221-C225 PolarHBondContact O-N 2.68Å; L221-C225 PolarHBondContact O-SG 3.47Å; L221-P247 HydrophobicContact CD1-CB 3.83Å; L221-P247 HydrophobicContact CD1-CG 3.81Å; L221-P247 HydrophobicContact CD2-CB 4.3Å; L221-Y584 HydrophobicContact CB-CD2 3.89Å; L221-Y584 HydrophobicContact CB-CE2 3.49Å; L221-Y584 VanDerWaalsContact CB-CE2 3.49Å; L221-Y584 HydrophobicContact CD2-CD1 3.65Å; L221-Y584 HydrophobicContact CD2-CD2 3.63Å; L221-Y584 HydrophobicContact CD2-CE1 3.75Å; L221-Y584 HydrophobicContact CD2-CE2 3.73Å; L221-Y584 HydrophobicContact CD2-CG 3.6Å; L221-Y584 HydrophobicContact CG-CD2 4.4Å; L221-Y584 HydrophobicContact CG-CE2 4.21Å; L221-D588 HydrophobicContact CD2-CB 4.21Å; L221-L592 HydrophobicContact CB-CD1 4.25Å; L221-L592 HydrophobicContact CD1-CD1 4.16Å; L221-L592 HydrophobicContact CD1-CD2 3.62Å; L221-L592 HydrophobicContact CD1-CG 3.83Å
222P91.1Very high89.5Confident0 Ų017.7 Ų17.70%09%0.088CC..Hα-helixtrans-54.5-45.5171.2-27.634.2000113.5F181 E218 A219 V224 C225 L226 Y250F181-P222 HydrophobicContact CB-CB 3.84Å; F181-P222 HydrophobicContact CB-CG 4Å; F181-P222 HydrophobicContact CD1-CB 4Å; F181-P222 HydrophobicContact CD2-CB 4.06Å; F181-P222 HydrophobicContact CG-CB 3.7Å; F181-P222 HydrophobicContact CG-CG 4.41Å; E218-P222 WeakPolarHBondContact O-CD 3.4Å; A219-P222 WeakPolarHBondContact O-CD 3.46Å; P222-V224 PolarHBondContact O-N 3.1Å; P222-C225 PolarHBondContact O-N 3.42Å; P222-L226 WeakPolarHBondContact O-CB 3.4Å; P222-L226 VanDerWaalsContact O-CG 3.23Å; P222-L226 WeakPolarHBondContact O-CG 3.47Å; P222-L226 PolarHBondContact O-N 2.96Å; P222-Y250 HydrophobicContact CB-CD2 4.31Å; P222-Y250 HydrophobicContact CB-CE2 3.53Å; P222-Y250 HydrophobicContact CG-CD2 4.05Å; P222-Y250 HydrophobicContact CG-CE2 3.62Å
223A93.3Very high89Confident0 Ų020 Ų200%010%0.1CC..Hα-helixtrans-59.9-47.4-177.700000112.2F181 L208 I211 I212 A219 R220 L221 F227F181-A223 HydrophobicContact CD2-CB 4.05Å; F181-A223 HydrophobicContact CE2-CB 3.91Å; L208-A223 HydrophobicContact CD2-CB 4.41Å; I211-A223 HydrophobicContact CB-CB 4.32Å; I211-A223 HydrophobicContact CG2-CB 3.85Å; I212-A223 HydrophobicContact CD1-CB 4.42Å; I212-A223 HydrophobicContact CG1-CB 3.77Å; A219-A223 WeakPolarHBondContact O-CB 3.24Å; A219-A223 PolarHBondContact O-N 2.84Å; A219-A223 VanDerWaalsContact O-N 3.1Å; R220-A223 PolarHBondContact O-N 3.4Å; L221-A223 VanDerWaalsContact C-N 3.34Å; L221-A223 PolarHBondContact O-N 2.92Å; A223-F227 WeakPolarHBondContact O-CB 3.1Å; A223-F227 PolarHBondContact O-N 2.83Å
224V91.9Very high88.6Confident0 Ų019.9 Ų19.90%010%0.098CC..Hα-helixtrans-64.6-46176.9175.90000111.8I212 R220 L221 P222 L226 F227 F228 L448 L592 Y595I212-V224 HydrophobicContact CD1-CG2 3.81Å; I212-V224 HydrophobicContact CG1-CG2 3.77Å; I212-V224 HydrophobicContact CG2-CG2 4Å; R220-V224 HydrophobicContact CG-CG2 4.32Å; R220-V224 WeakPolarHBondContact O-CG2 3.32Å; R220-V224 PolarHBondContact O-N 3.23Å; L221-V224 PolarHBondContact O-N 2.99Å; P222-V224 PolarHBondContact O-N 3.1Å; V224-L226 VanDerWaalsContact C-N 3.29Å; V224-L226 PolarHBondContact O-N 3.08Å; V224-F227 PolarHBondContact O-N 3.46Å; V224-F228 HydrophobicContact CG1-CD2 3.78Å; V224-F228 HydrophobicContact CG1-CE2 4.05Å; V224-F228 PolarHBondContact O-N 3.42Å; V224-L448 HydrophobicContact CG2-CD1 4.13Å; V224-L448 HydrophobicContact CG2-CD2 3.58Å; V224-L448 HydrophobicContact CG2-CG 4.42Å; V224-L592 HydrophobicContact CB-CD2 3.79Å; V224-L592 HydrophobicContact CG1-CD2 3.9Å; V224-L592 HydrophobicContact CG2-CD2 3.84Å; V224-Y595 HydrophobicContact CG1-CD1 4.42Å; V224-Y595 HydrophobicContact CG1-CD2 3.68Å; V224-Y595 HydrophobicContact CG1-CE2 4.42Å; V224-Y595 HydrophobicContact CG1-CG 3.7Å
225C90.4Very high88.2Confident19 Ų1914.3 Ų14.313%0.1288%0.076CC..Hα-helixtrans-60.5-40.2-179.2-68.30000112L221 P222 H229 Y250L221-C225 WeakPolarHBondContact O-CB 3.39Å; L221-C225 PolarHBondContact O-N 2.68Å; L221-C225 PolarHBondContact O-SG 3.47Å; P222-C225 PolarHBondContact O-N 3.42Å; C225-H229 WeakPolarHBondContact O-CB 3.36Å; C225-H229 PolarHBondContact O-N 3.34Å; C225-Y250 HydrophobicContact CB-CD1 3.3Å; C225-Y250 HydrophobicContact CB-CE1 3.47Å; C225-Y250 VanDerWaalsContact CB-CE1 3.47Å; C225-Y250 HydrophobicContact CB-CG 4.14Å
226L91.8Very high88Confident0 Ų014 Ų140%07%0.072CC..Hα-helixtrans-73.7-42.5177.2-64.8169.8000111.4F181 H190 V191 L194 P222 V224 F228 H229 Y230 Y250F181-L226 HydrophobicContact CE1-CD1 3.65Å; F181-L226 HydrophobicContact CE2-CD1 4.46Å; F181-L226 HydrophobicContact CZ-CD1 3.58Å; H190-L226 HydrophobicContact CB-CD1 4.09Å; V191-L226 HydrophobicContact CG2-CD2 3.61Å; L194-L226 HydrophobicContact CD2-CB 3.64Å; L194-L226 HydrophobicContact CD2-CD1 3.88Å; L194-L226 HydrophobicContact CD2-CG 4.22Å; P222-L226 WeakPolarHBondContact O-CB 3.4Å; P222-L226 VanDerWaalsContact O-CG 3.23Å; P222-L226 WeakPolarHBondContact O-CG 3.47Å; P222-L226 PolarHBondContact O-N 2.96Å; V224-L226 VanDerWaalsContact C-N 3.29Å; V224-L226 PolarHBondContact O-N 3.08Å; L226-F228 PolarHBondContact O-N 2.94Å; L226-H229 WeakPolarHBondContact O-CB 3.36Å; L226-H229 PolarHBondContact O-N 3.15Å; L226-H229 VanDerWaalsContact O-N 3.08Å; L226-Y230 HydrophobicContact CB-CD2 4.46Å; L226-Y230 HydrophobicContact CB-CE2 4.43Å; L226-Y230 HydrophobicContact CD2-CE2 4.23Å; L226-Y230 WeakPolarHBondContact O-CD2 3Å; L226-Y230 PolarHBondContact O-N 2.96Å; L226-Y250 HydrophobicContact CG-CE1 4.48Å
227F92.9Very high87.5Confident1 Ų118.2 Ų18.20%0.00410%0.097CC..Hα-helixtrans-55.9-51.1175.7172.7-87000112L208 L209 I212 A223 V224 H229 Y230 W231 N234 L427 L599L208-F227 HydrophobicContact CB-CD2 4.38Å; L208-F227 HydrophobicContact CD1-CB 4.33Å; L209-F227 HydrophobicContact CD2-CE2 4.02Å; L209-F227 HydrophobicContact CD2-CZ 4.2Å; L209-F227 HydrophobicContact CG-CE2 4.12Å; I212-F227 HydrophobicContact CD1-CB 4.35Å; I212-F227 HydrophobicContact CD1-CG 4.45Å; A223-F227 WeakPolarHBondContact O-CB 3.1Å; A223-F227 PolarHBondContact O-N 2.83Å; V224-F227 PolarHBondContact O-N 3.46Å; F227-H229 PolarHBondContact O-N 3.38Å; F227-Y230 PolarHBondContact O-N 2.77Å; F227-W231 HydrophobicContact CD2-CE3 4.18Å; F227-W231 PolarHBondContact O-N 3.11Å; F227-N234 HydrophobicContact CE1-CB 4.41Å; F227-N234 WeakPolarHBondContact CE1-ND2 3.41Å; F227-N234 VanDerWaalsContact CZ-ND2 3.3Å; F227-N234 WeakPolarHBondContact CZ-ND2 3.29Å; F227-L427 HydrophobicContact CE2-CD2 4.34Å; F227-L427 HydrophobicContact CZ-CD2 3.71Å; F227-L599 HydrophobicContact CE1-CD2 3.89Å; F227-L599 HydrophobicContact CZ-CD2 4.03Å
228F89.6Confident87.3Confident13 Ų1320.3 Ų20.36%0.05712%0.119CC..Hα-helixtrans-70-18.8176.9-83.3-87.2000113.6V224 L226 P232 N234 Y235 Y595 F598 L599V224-F228 HydrophobicContact CG1-CD2 3.78Å; V224-F228 HydrophobicContact CG1-CE2 4.05Å; V224-F228 PolarHBondContact O-N 3.42Å; L226-F228 PolarHBondContact O-N 2.94Å; F228-P232 WeakPolarHBondContact O-CA 3.49Å; F228-N234 HydrophobicContact CD1-CB 4.31Å; F228-N234 HydrophobicContact CE1-CB 3.94Å; F228-N234 WeakPolarHBondContact CE1-O 3.39Å; F228-Y235 AromaticContact CD1-CD2 3.97Å; F228-Y235 HydrophobicContact CD1-CD2 3.97Å; F228-Y595 HydrophobicContact CB-CD1 4.43Å; F228-Y595 HydrophobicContact CB-CE1 4.02Å; F228-Y595 AromaticContact CD1-CD1 3.8Å; F228-Y595 HydrophobicContact CD1-CD1 3.8Å; F228-Y595 AromaticContact CD1-CE1 3.89Å; F228-Y595 HydrophobicContact CD1-CE1 3.89Å; F228-Y595 AromaticContact CD2-CD1 3.4Å; F228-Y595 HydrophobicContact CD2-CD1 3.4Å; F228-Y595 VanDerWaalsContact CD2-CD1 3.4Å; F228-Y595 AromaticContact CD2-CE1 3.87Å; F228-Y595 HydrophobicContact CD2-CE1 3.87Å; F228-Y595 AromaticContact CD2-CG 3.98Å; F228-Y595 HydrophobicContact CD2-CG 3.98Å; F228-Y595 AromaticContact CE1-CD1 3.78Å; F228-Y595 HydrophobicContact CE1-CD1 3.78Å; F228-Y595 HydrophobicContact CE1-CE1 4.3Å; F228-Y595 AromaticContact CE2-CD1 3.43Å; F228-Y595 HydrophobicContact CE2-CD1 3.43Å; F228-Y595 VanDerWaalsContact CE2-CD1 3.43Å; F228-Y595 HydrophobicContact CE2-CE1 4.32Å; F228-Y595 AromaticContact CE2-CG 3.86Å; F228-Y595 HydrophobicContact CE2-CG 3.86Å; F228-Y595 AromaticContact CG-CD1 3.6Å; F228-Y595 HydrophobicContact CG-CD1 3.6Å; F228-Y595 AromaticContact CG-CE1 3.65Å; F228-Y595 HydrophobicContact CG-CE1 3.65Å; F228-Y595 AromaticContact CZ-CD1 3.6Å; F228-Y595 HydrophobicContact CZ-CD1 3.6Å; F228-Y595 HydrophobicContact CZ-CG 4.31Å; F228-F598 HydrophobicContact CE1-CB 4.49Å; F228-F598 HydrophobicContact CZ-CB 4.45Å; F228-L599 HydrophobicContact CE2-CG 4.48Å; F228-L599 HydrophobicContact CZ-CD2 4.36Å; F228-L599 HydrophobicContact CZ-CG 4.05Å
229H88.7Confident87.1Confident39 Ų3919.7 Ų19.718%0.18112%0.116CC..Hα-helixtrans-73.5-48.6171.2-175.593.2000112.1C225 L226 F227 W252 I322C225-H229 WeakPolarHBondContact O-CB 3.36Å; C225-H229 PolarHBondContact O-N 3.34Å; L226-H229 WeakPolarHBondContact O-CB 3.36Å; L226-H229 PolarHBondContact O-N 3.15Å; L226-H229 VanDerWaalsContact O-N 3.08Å; F227-H229 PolarHBondContact O-N 3.38Å; H229-W252 AromaticContact CD2-CD1 4Å; H229-W252 AromaticContact CD2-NE1 3.6Å; H229-W252 AromaticContact CE1-CD1 3.67Å; H229-W252 AromaticContact CE1-CD2 3.45Å; H229-W252 VanDerWaalsContact CE1-CD2 3.45Å; H229-W252 AromaticContact CE1-CE2 3.3Å; H229-W252 AromaticContact CE1-CG 3.7Å; H229-W252 AromaticContact CE1-CZ2 3.77Å; H229-W252 AromaticContact CE1-NE1 3.42Å; H229-W252 PolarHBondContact CE1-NE1 3.03Å; H229-W252 AromaticContact CG-CD1 3.83Å; H229-W252 AromaticContact CG-NE1 3.91Å; H229-W252 AromaticContact ND1-CD1 3.62Å; H229-W252 AromaticContact ND1-CD2 3.99Å; H229-W252 AromaticContact ND1-CG 3.73Å; H229-W252 AromaticContact ND1-NE1 3.81Å; H229-W252 AromaticContact NE2-CD1 3.92Å; H229-W252 AromaticContact NE2-CE2 3.34Å; H229-W252 VanDerWaalsContact NE2-CE2 3.34Å; H229-W252 AromaticContact NE2-CZ2 3.57Å; H229-W252 AromaticContact NE2-NE1 3.29Å; H229-W252 PolarHBondContact NE2-NE1 3.09Å; H229-I322 VanDerWaalsContact CD2-CD1 3.45Å; H229-I322 WeakPolarHBondContact CD2-CD1 3.46Å
230Y89.5Confident86.3Confident6 Ų625 Ų252%0.02414%0.137CC..Hα-helixtrans-80.9-28.6-176.6-69.1-73.1000113.9L194 E195 M198 L226 F227 P232 I322 W343 R357L194-Y230 HydrophobicContact CD2-CD2 3.88Å; L194-Y230 HydrophobicContact CD2-CE2 3.7Å; E195-Y230 HydrophobicContact CG-CE1 4.32Å; E195-Y230 VanDerWaalsContact CG-OH 3.24Å; E195-Y230 WeakPolarHBondContact CG-OH 3.26Å; E195-Y230 PolarHBondContact OE1-OH 3.12Å; M198-Y230 HydrophobicContact CE-CD1 4.28Å; M198-Y230 HydrophobicContact CE-CD2 3.73Å; M198-Y230 HydrophobicContact CE-CE2 4.4Å; M198-Y230 HydrophobicContact CE-CG 3.7Å; L226-Y230 HydrophobicContact CB-CD2 4.46Å; L226-Y230 HydrophobicContact CB-CE2 4.43Å; L226-Y230 HydrophobicContact CD2-CE2 4.23Å; L226-Y230 WeakPolarHBondContact O-CD2 3Å; L226-Y230 PolarHBondContact O-N 2.96Å; F227-Y230 PolarHBondContact O-N 2.77Å; Y230-P232 WeakPolarHBondContact O-CD 3.34Å; Y230-I322 HydrophobicContact CD1-CD1 3.31Å; Y230-I322 HydrophobicContact CE1-CD1 3.68Å; Y230-I322 HydrophobicContact CG-CD1 4.12Å; Y230-W343 HydrophobicContact CD1-CZ2 4.22Å; Y230-W343 HydrophobicContact CE1-CH2 4.09Å; Y230-W343 HydrophobicContact CE1-CZ2 4.19Å; Y230-R357 PolarHBondContact O-NH1 3.37Å
231W90.2Very high85.2Confident3 Ų326.7 Ų26.71%0.01116%0.16CC..  trans-115.567.8171.5-65.9-92.7000111.4M198 Y205 L208 F227 E233 N234 Q424 S425M198-W231 HydrophobicContact CE-CH2 3.52Å; M198-W231 HydrophobicContact CE-CZ3 3.59Å; M198-W231 HydrophobicContact SD-CH2 3.91Å; Y205-W231 AromaticContact CD1-CZ2 3.94Å; Y205-W231 HydrophobicContact CD1-CZ2 3.94Å; Y205-W231 HydrophobicContact CG-CZ2 4.32Å; L208-W231 HydrophobicContact CD1-CH2 4.32Å; L208-W231 HydrophobicContact CD1-CZ3 3.7Å; F227-W231 HydrophobicContact CD2-CE3 4.18Å; F227-W231 PolarHBondContact O-N 3.11Å; W231-E233 HydrophobicContact CB-CG 4.47Å; W231-E233 PolarHBondContact O-N 2.82Å; W231-E233 VanDerWaalsContact O-N 3.12Å; W231-N234 WeakPolarHBondContact CB-ND2 3.39Å; W231-N234 WeakPolarHBondContact O-CB 3.5Å; W231-N234 PolarHBondContact O-N 2.77Å; W231-N234 VanDerWaalsContact O-N 3.13Å; W231-Q424 HydrophobicContact CZ2-CB 3.89Å; W231-Q424 HydrophobicContact CZ2-CG 4.24Å; W231-S425 PolarHBondContact NE1-O 3.49Å
232P84.7Confident84.4Confident8 Ų829.5 Ų29.55%0.05218%0.175CC..G310 helixtrans-69.9-8.2-177.132.4-38.1000113.5F228 Y230 N234 Y235 Y240 I322 L324F228-P232 WeakPolarHBondContact O-CA 3.49Å; Y230-P232 WeakPolarHBondContact O-CD 3.34Å; P232-N234 PolarHBondContact O-N 3.05Å; P232-Y235 WeakPolarHBondContact O-CB 3.45Å; P232-Y235 PolarHBondContact O-N 2.94Å; P232-Y240 HydrophobicContact CB-CE2 4.48Å; P232-I322 HydrophobicContact CG-CG2 4.33Å; P232-L324 HydrophobicContact CB-CD2 3.97Å; P232-L324 HydrophobicContact CG-CD2 3.83Å
233E83Confident83.3Confident51 Ų5137 Ų3724%0.23821%0.21CC..G310 helixtrans-67.1-20.4169.766.5-141.6-137.100114W231 Y235 R357 S426W231-E233 HydrophobicContact CB-CG 4.47Å; W231-E233 PolarHBondContact O-N 2.82Å; W231-E233 VanDerWaalsContact O-N 3.12Å; E233-Y235 PolarHBondContact O-N 3.26Å; E233-R357 IonicContact OE2-CZ 2.7Å; E233-R357 IonicContact OE2-NH1 3.1Å; E233-R357 IonicContact OE2-NH2 3.79Å; E233-R357 PolarHBondContact OE2-NH2 3.18Å; E233-S426 WeakPolarHBondContact OE1-CA 3.24Å; E233-S426 WeakPolarHBondContact OE1-CB 3.45Å
234N84.4Confident82.2Confident0 Ų038 Ų380%022%0.218CC..G310 helixtrans-78.9-6.9175.2-60.6-26.6000112.1F227 F228 W231 P232 K603F227-N234 HydrophobicContact CE1-CB 4.41Å; F227-N234 WeakPolarHBondContact CE1-ND2 3.41Å; F227-N234 VanDerWaalsContact CZ-ND2 3.3Å; F227-N234 WeakPolarHBondContact CZ-ND2 3.29Å; F228-N234 HydrophobicContact CD1-CB 4.31Å; F228-N234 HydrophobicContact CE1-CB 3.94Å; F228-N234 WeakPolarHBondContact CE1-O 3.39Å; W231-N234 WeakPolarHBondContact CB-ND2 3.39Å; W231-N234 WeakPolarHBondContact O-CB 3.5Å; W231-N234 PolarHBondContact O-N 2.77Å; W231-N234 VanDerWaalsContact O-N 3.13Å; P232-N234 PolarHBondContact O-N 3.05Å; N234-K603 WeakPolarHBondContact OD1-CE 3.49Å
235Y84.2Confident81.4Confident24 Ų2438.1 Ų38.19%0.09422%0.219CC..SBendtrans-95.8117.6-177.7-161.9-70000110F228 P232 E233 T237 F239 Y240 L245 Y595 F598F228-Y235 AromaticContact CD1-CD2 3.97Å; F228-Y235 HydrophobicContact CD1-CD2 3.97Å; P232-Y235 WeakPolarHBondContact O-CB 3.45Å; P232-Y235 PolarHBondContact O-N 2.94Å; E233-Y235 PolarHBondContact O-N 3.26Å; Y235-T237 PolarHBondContact O-N 3.48Å; Y235-F239 HydrophobicContact CE1-CB 3.92Å; Y235-Y240 AromaticContact CD1-CD2 3.96Å; Y235-Y240 HydrophobicContact CD1-CD2 3.96Å; Y235-Y240 HydrophobicContact CG-CD2 4.35Å; Y235-L245 WeakPolarHBondContact OH-CB 3.39Å; Y235-L245 WeakPolarHBondContact OH-CD1 3.42Å; Y235-Y595 AromaticContact CD2-CE1 3.94Å; Y235-Y595 HydrophobicContact CD2-CE1 3.94Å; Y235-Y595 AromaticContact CE2-CE1 3.72Å; Y235-Y595 HydrophobicContact CE2-CE1 3.72Å; Y235-F598 HydrophobicContact CE1-CE2 4.18Å; Y235-F598 HydrophobicContact CE2-CE2 4.18Å; Y235-F598 AromaticContact CZ-CE2 3.99Å
236P82.7Confident80.7Confident3 Ų343.1 Ų43.12%0.01924%0.24CC..  trans-61.5127.3-175-22.932.6000112.1A238 F239 F598 E602 Y662P236-A238 PolarHBondContact O-N 3.02Å; P236-F239 HydrophobicContact CB-CD2 4.1Å; P236-F239 PolarHBondContact O-N 3.38Å; P236-F598 HydrophobicContact CG-CB 4.12Å; P236-F598 HydrophobicContact CG-CD1 3.75Å; P236-F598 HydrophobicContact CG-CD2 4.3Å; P236-F598 HydrophobicContact CG-CE1 4.18Å; P236-F598 HydrophobicContact CG-CG 3.81Å; P236-E602 HydrophobicContact CG-CG 4.04Å; P236-Y662 HydrophobicContact CB-CE2 4.13Å; P236-Y662 HydrophobicContact CG-CE1 4.22Å; P236-Y662 HydrophobicContact CG-CE2 4.15Å; P236-Y662 WeakPolarHBondContact CG-OH 3.48Å
237T76.6Confident79.9Confident133 Ų13343.4 Ų43.482%0.81624%0.242SC*.G310 helixtrans-56.3-27.2-171.757.40000114.2Y235 F239 Y240Y235-T237 PolarHBondContact O-N 3.48Å; T237-F239 VanDerWaalsContact C-N 3.26Å; T237-F239 PolarHBondContact O-N 3.45Å; T237-Y240 PolarHBondContact O-N 3.47Å
238A76.5Confident78.8Confident82 Ų8247.9 Ų47.968%0.67827%0.265SS*.G310 helixtrans-64.7-23178.600000114.6P236P236-A238 PolarHBondContact O-N 3.02Å
239F80.3Confident78Confident11 Ų1150.9 Ų50.95%0.04828%0.279CS..G310 helixtrans-109.5-2-178-55.6-65.1000113.2Y235 P236 T237 G241 N242 L245 F598 L654 I658 Y662Y235-F239 HydrophobicContact CE1-CB 3.92Å; P236-F239 HydrophobicContact CB-CD2 4.1Å; P236-F239 PolarHBondContact O-N 3.38Å; T237-F239 VanDerWaalsContact C-N 3.26Å; T237-F239 PolarHBondContact O-N 3.45Å; F239-G241 PolarHBondContact O-N 2.79Å; F239-N242 VanDerWaalsContact O-CB 3.26Å; F239-N242 WeakPolarHBondContact O-CB 3.34Å; F239-N242 PolarHBondContact O-N 3.5Å; F239-L245 HydrophobicContact CB-CD1 4.25Å; F239-F598 HydrophobicContact CB-CZ 4.1Å; F239-F598 AromaticContact CD2-CE1 3.58Å; F239-F598 HydrophobicContact CD2-CE1 3.58Å; F239-F598 AromaticContact CD2-CZ 3.53Å; F239-F598 HydrophobicContact CD2-CZ 3.53Å; F239-F598 AromaticContact CE2-CE1 3.85Å; F239-F598 HydrophobicContact CE2-CE1 3.85Å; F239-F598 HydrophobicContact CE2-CZ 4.25Å; F239-F598 HydrophobicContact CG-CE1 4.41Å; F239-F598 AromaticContact CG-CZ 3.97Å; F239-F598 HydrophobicContact CG-CZ 3.97Å; F239-L654 HydrophobicContact CD1-CD1 3.99Å; F239-L654 HydrophobicContact CE1-CD1 4.13Å; F239-I658 HydrophobicContact CD1-CG1 4.46Å; F239-I658 HydrophobicContact CE1-CG1 3.86Å; F239-I658 HydrophobicContact CE2-CG1 4.01Å; F239-I658 HydrophobicContact CZ-CG1 3.62Å; F239-Y662 HydrophobicContact CE2-CG 4.31Å
240Y72Confident77.7Confident113 Ų11349.7 Ų49.744%0.44327%0.273SS..THydrogen-bonded Turntrans-61.5123.3-167.3-166.2-87.4000112.6P232 Y235 T237 L324P232-Y240 HydrophobicContact CB-CE2 4.48Å; Y235-Y240 AromaticContact CD1-CD2 3.96Å; Y235-Y240 HydrophobicContact CD1-CD2 3.96Å; Y235-Y240 HydrophobicContact CG-CD2 4.35Å; T237-Y240 PolarHBondContact O-N 3.47Å; Y240-L324 HydrophobicContact CE1-CD1 4.23Å; Y240-L324 HydrophobicContact CE2-CD1 4.13Å
241G66.5Low77.4Confident55 Ų5554 Ų5457%0.56730%0.3SS*.THydrogen-bonded Turntrans867.6-177.600000115.3F239 Q243F239-G241 PolarHBondContact O-N 2.79Å; G241-Q243 PolarHBondContact O-N 3.5Å
242N71.9Confident77.2Confident59 Ų5957.3 Ų57.332%0.31631%0.313SS..  trans-67.5120.3171.8-169.9-12.8000111F239 A244 L245 L654F239-N242 VanDerWaalsContact O-CB 3.26Å; F239-N242 WeakPolarHBondContact O-CB 3.34Å; F239-N242 PolarHBondContact O-N 3.5Å; N242-A244 VanDerWaalsContact C-N 3.27Å; N242-A244 PolarHBondContact O-N 3.32Å; N242-A244 PolarHBondContact OD1-N 3.28Å; N242-L245 PolarHBondContact O-N 2.94Å; N242-L654 WeakPolarHBondContact ND2-CD2 3.42Å
243Q68.7Low77.3Confident158 Ų15862.4 Ų62.474%0.73834%0.336SS*.G310 helixtrans-68.3-24.9-175.1-64.4178.215.500113G241 L245 Q246G241-Q243 PolarHBondContact O-N 3.5Å; Q243-L245 PolarHBondContact O-N 3.13Å; Q243-Q246 PolarHBondContact O-N 3.01Å
244A68.8Low77.5Confident20 Ų2062.3 Ų62.317%0.16534%0.341CS..G310 helixtrans-67-15.5176.800000113.7N242 L654N242-A244 VanDerWaalsContact C-N 3.27Å; N242-A244 PolarHBondContact O-N 3.32Å; N242-A244 PolarHBondContact OD1-N 3.28Å; A244-L654 HydrophobicContact CB-CD2 4.02Å
245L76.4Confident77.8Confident2 Ų263.2 Ų63.21%0.0134%0.344CS..G310 helixtrans-100.813.7178.5-62.3175.9000113.3Y235 F239 N242 Q243 P247 V591 I594 Y595 F598 L651 L654Y235-L245 WeakPolarHBondContact OH-CB 3.39Å; Y235-L245 WeakPolarHBondContact OH-CD1 3.42Å; F239-L245 HydrophobicContact CB-CD1 4.25Å; N242-L245 PolarHBondContact O-N 2.94Å; Q243-L245 PolarHBondContact O-N 3.13Å; L245-P247 WeakPolarHBondContact O-CD 3.49Å; L245-V591 HydrophobicContact CD2-CG2 4.49Å; L245-I594 HydrophobicContact CD2-CB 4.33Å; L245-I594 HydrophobicContact CD2-CD1 3.76Å; L245-I594 HydrophobicContact CD2-CG2 3.78Å; L245-Y595 PolarHBondContact O-OH 3.22Å; L245-F598 HydrophobicContact CD1-CE2 3.93Å; L245-F598 HydrophobicContact CD1-CZ 3.81Å; L245-L651 HydrophobicContact CD2-CD1 4.22Å; L245-L654 HydrophobicContact CD1-CD2 3.88Å; L245-L654 HydrophobicContact CD2-CD2 3.7Å; L245-L654 HydrophobicContact CG-CD2 3.58Å
246Q74.5Confident78Confident125 Ų12568.7 Ų68.758%0.58437%0.369SS*.SBendtrans-94.6115.7169.2-64.5-171.9-17.500109.3Q243 I248Q243-Q246 PolarHBondContact O-N 3.01Å; Q246-I248 PolarHBondContact O-N 3.01Å
247P75.2Confident78.2Confident6 Ų670.6 Ų70.64%0.03938%0.381CS..  trans-57.8135.8175.7-28.138.6000111.9L221 L245 H249 Y250 V591 Y595L221-P247 HydrophobicContact CD1-CB 3.83Å; L221-P247 HydrophobicContact CD1-CG 3.81Å; L221-P247 HydrophobicContact CD2-CB 4.3Å; L245-P247 WeakPolarHBondContact O-CD 3.49Å; P247-H249 VanDerWaalsContact C-N 3.3Å; P247-H249 PolarHBondContact O-N 3.41Å; P247-Y250 PolarHBondContact O-N 3.05Å; P247-V591 HydrophobicContact CG-CG1 3.86Å; P247-Y595 HydrophobicContact CG-CE2 4.44Å
248I70.8Confident78.8Confident94 Ų9465 Ų6548%0.48235%0.346SS..THydrogen-bonded Turntrans-79.2-21.8-162.6-56.3170.9000111Q246 R585 E587 D588Q246-I248 PolarHBondContact O-N 3.01Å; I248-R585 VanDerWaalsContact CD1-NH2 3.26Å; I248-E587 HydrophobicContact CD1-CB 4.03Å; I248-D588 PolarHBondContact N-OD1 2.98Å
249H71.8Confident79.4Confident77 Ų7763.9 Ų63.936%0.35633%0.327SS..THydrogen-bonded Turntrans-102.9-3175.7-50.288.3000113.2P247 Y584 R585 D588P247-H249 VanDerWaalsContact C-N 3.3Å; P247-H249 PolarHBondContact O-N 3.41Å; H249-Y584 HydrophobicContact CB-CD1 3.95Å; H249-Y584 HydrophobicContact CB-CE1 4.42Å; H249-R585 VanDerWaalsContact CE1-CG 3.49Å; H249-R585 WeakPolarHBondContact CE1-CG 3.38Å; H249-R585 PolarHBondContact CE1-NH1 2.9Å; H249-R585 PolarHBondContact NE2-NH1 2.8Å; H249-D588 IonicContact CE1-OD2 3.14Å; H249-D588 PolarHBondContact CE1-OD2 3.43Å; H249-D588 IonicContact CG-OD2 2.88Å; H249-D588 IonicContact ND1-OD1 2.7Å; H249-D588 PolarHBondContact ND1-OD1 3.1Å; H249-D588 IonicContact ND1-OD2 3.7Å; H249-D588 PolarHBondContact ND1-OD2 2.85Å
250Y82.5Confident79.9Confident14 Ų1463.5 Ų63.56%0.05533%0.326CS..  trans-129.287.6-179.3-157.1-82.5000112V187 H190 P222 C225 L226 P247V187-Y250 HydrophobicContact CG1-CE1 3.89Å; V187-Y250 HydrophobicContact CG1-CE2 4.4Å; V187-Y250 HydrophobicContact CG2-CD2 3.99Å; V187-Y250 HydrophobicContact CG2-CE1 4.31Å; V187-Y250 HydrophobicContact CG2-CE2 3.72Å; V187-Y250 HydrophobicContact CG2-CG 4.39Å; H190-Y250 AromaticContact ND1-CE2 3.46Å; H190-Y250 WeakPolarHBondContact ND1-CE2 3.48Å; H190-Y250 AromaticContact ND1-CZ 3.81Å; H190-Y250 PolarHBondContact ND1-OH 3.4Å; P222-Y250 HydrophobicContact CB-CD2 4.31Å; P222-Y250 HydrophobicContact CB-CE2 3.53Å; P222-Y250 HydrophobicContact CG-CD2 4.05Å; P222-Y250 HydrophobicContact CG-CE2 3.62Å; C225-Y250 HydrophobicContact CB-CD1 3.3Å; C225-Y250 HydrophobicContact CB-CE1 3.47Å; C225-Y250 VanDerWaalsContact CB-CE1 3.47Å; C225-Y250 HydrophobicContact CB-CG 4.14Å; L226-Y250 HydrophobicContact CG-CE1 4.48Å; P247-Y250 PolarHBondContact O-N 3.05Å
251T83.1Confident80.6Confident97 Ų9760.8 Ų60.860%0.59532%0.315SS*.  trans-96.8126.8169.4-61.70000109.6V187 E253V187-T251 WeakPolarHBondContact CG1-O 3.31Å; T251-E253 PolarHBondContact O-N 3.3Å
252W86.3Confident81.4Confident72 Ų7259 Ų5927%0.27329%0.292SS..  trans-60.9128.4177.1178.392.1000111.9H229H229-W252 AromaticContact CD2-CD1 4Å; H229-W252 AromaticContact CD2-NE1 3.6Å; H229-W252 AromaticContact CE1-CD1 3.67Å; H229-W252 AromaticContact CE1-CD2 3.45Å; H229-W252 VanDerWaalsContact CE1-CD2 3.45Å; H229-W252 AromaticContact CE1-CE2 3.3Å; H229-W252 AromaticContact CE1-CG 3.7Å; H229-W252 AromaticContact CE1-CZ2 3.77Å; H229-W252 AromaticContact CE1-NE1 3.42Å; H229-W252 PolarHBondContact CE1-NE1 3.03Å; H229-W252 AromaticContact CG-CD1 3.83Å; H229-W252 AromaticContact CG-NE1 3.91Å; H229-W252 AromaticContact ND1-CD1 3.62Å; H229-W252 AromaticContact ND1-CD2 3.99Å; H229-W252 AromaticContact ND1-CG 3.73Å; H229-W252 AromaticContact ND1-NE1 3.81Å; H229-W252 AromaticContact NE2-CD1 3.92Å; H229-W252 AromaticContact NE2-CE2 3.34Å; H229-W252 VanDerWaalsContact NE2-CE2 3.34Å; H229-W252 AromaticContact NE2-CZ2 3.57Å; H229-W252 AromaticContact NE2-NE1 3.29Å; H229-W252 PolarHBondContact NE2-NE1 3.09Å
253E86.9Confident81.8Confident114 Ų11461 Ų6153%0.53330%0.302SS..  trans-128.8127.6173.8-66.5-162.9152.300111T251T251-E253 PolarHBondContact O-N 3.3Å
254S87.5Confident82.4Confident50 Ų5058.1 Ų58.135%0.3529%0.292SS..PPolyproline II helixtrans-70.1136.9176.5-165.60000111.2P318 T319S254-P318 WeakPolarHBondContact OG-CB 3.49Å; S254-T319 PolarHBondContact OG-O 3.34Å; S254-T319 VanDerWaalsContact OG-O 3.05Å
255W90.8Very high83.1Confident19 Ų1957.5 Ų57.57%0.07229%0.286CS..PPolyproline II helixtrans-70.2157.9-177.567.8-86.7000113E188 W192 E195 P257 I258 P318E188-W255 VanDerWaalsContact O-CB 3.31Å; E188-W255 WeakPolarHBondContact O-CB 3.37Å; W192-W255 HydrophobicContact CB-CB 3.71Å; W192-W255 HydrophobicContact CB-CD2 4.11Å; W192-W255 HydrophobicContact CB-CG 3.7Å; W192-W255 AromaticContact CD1-CD2 3.41Å; W192-W255 VanDerWaalsContact CD1-CD2 3.41Å; W192-W255 AromaticContact CD1-CE2 3.57Å; W192-W255 AromaticContact CD1-CE3 3.59Å; W192-W255 AromaticContact CD1-CG 3.93Å; W192-W255 AromaticContact CD1-CZ2 3.96Å; W192-W255 AromaticContact CD1-CZ3 3.96Å; W192-W255 HydrophobicContact CD2-CD2 4.23Å; W192-W255 AromaticContact CD2-CE3 3.88Å; W192-W255 HydrophobicContact CD2-CE3 3.88Å; W192-W255 HydrophobicContact CD2-CZ3 4.46Å; W192-W255 AromaticContact CE2-CE3 3.72Å; W192-W255 AromaticContact CE2-CZ3 3.82Å; W192-W255 HydrophobicContact CG-CB 4.12Å; W192-W255 AromaticContact CG-CD2 3.66Å; W192-W255 HydrophobicContact CG-CD2 3.66Å; W192-W255 AromaticContact CG-CE3 3.82Å; W192-W255 HydrophobicContact CG-CE3 3.82Å; W192-W255 AromaticContact CG-CG 3.81Å; W192-W255 HydrophobicContact CG-CG 3.81Å; W192-W255 HydrophobicContact CZ2-CE3 4.4Å; W192-W255 HydrophobicContact CZ2-CZ3 4.26Å; W192-W255 AromaticContact NE1-CD2 3.84Å; W192-W255 AromaticContact NE1-CE3 3.52Å; W192-W255 AromaticContact NE1-CH2 3.76Å; W192-W255 AromaticContact NE1-CZ3 3.49Å; E195-W255 PolarHBondContact OE2-NE1 3.19Å; W255-P257 WeakPolarHBondContact O-CD 3.45Å; W255-I258 HydrophobicContact CH2-CG1 4.48Å; W255-I258 HydrophobicContact CZ3-CG1 4.07Å; W255-P318 HydrophobicContact CD2-CB 4.07Å; W255-P318 HydrophobicContact CD2-CG 3.63Å; W255-P318 VanDerWaalsContact CE2-CG 3.46Å; W255-P318 HydrophobicContact CE3-CG 4.04Å; W255-P318 HydrophobicContact CG-CB 4.05Å; W255-P318 HydrophobicContact CG-CG 4.05Å; W255-P318 HydrophobicContact CH2-CG 4.11Å; W255-P318 HydrophobicContact CZ2-CB 4.27Å; W255-P318 HydrophobicContact CZ2-CG 3.73Å; W255-P318 HydrophobicContact CZ3-CG 4.26Å; W255-P318 WeakPolarHBondContact O-CG 3.49Å
256K88.2Confident83.3Confident139 Ų13961.4 Ų61.460%0.60431%0.311SS*.PPolyproline II helixtrans-81.4116.9-175.1-64.7179.417871.30110.2E188E188-K256 VanDerWaalsContact CD-NZ 3.25Å; E188-K256 IonicContact OE1-NZ 3.69Å; E188-K256 PolarHBondContact OE1-NZ 3.08Å; E188-K256 IonicContact OE2-NZ 2.67Å; E188-K256 PolarHBondContact OE2-NZ 3.39Å
257P87.7Confident83.4Confident42 Ų4258.7 Ų58.727%0.27330%0.301SS..PPolyproline II helixtrans-54.5144.7-176.6-19.824.6000113.5W255 M259 L273 L317 P318W255-P257 WeakPolarHBondContact O-CD 3.45Å; P257-M259 PolarHBondContact O-N 2.72Å; P257-L273 HydrophobicContact CB-CD2 3.95Å; P257-L273 HydrophobicContact CG-CD2 4.15Å; P257-L317 HydrophobicContact CB-CD2 4.39Å; P257-P318 HydrophobicContact CB-CG 4.25Å; P257-P318 HydrophobicContact CG-CG 3.79Å
258I88.4Confident83.4Confident16 Ų1665.8 Ų65.88%0.08233%0.331CS..PPolyproline II helixtrans-62.9134171.5-57.2176.8000109.2W192 W255 Y261 A274 Y295W192-I258 HydrophobicContact CZ2-CD1 4.35Å; W192-I258 HydrophobicContact CZ2-CG1 4.34Å; W255-I258 HydrophobicContact CH2-CG1 4.48Å; W255-I258 HydrophobicContact CZ3-CG1 4.07Å; I258-Y261 HydrophobicContact CG2-CE1 4.06Å; I258-A274 HydrophobicContact CB-CB 4.34Å; I258-A274 HydrophobicContact CG2-CB 4.2Å; I258-A274 WeakPolarHBondContact O-CB 3.26Å; I258-A274 PolarHBondContact O-N 3.41Å; I258-Y295 HydrophobicContact CB-CD1 4.43Å; I258-Y295 HydrophobicContact CD1-CD1 4Å; I258-Y295 HydrophobicContact CD1-CE1 3.51Å; I258-Y295 HydrophobicContact CD1-CE2 4.1Å; I258-Y295 HydrophobicContact CD1-CG 4.47Å; I258-Y295 HydrophobicContact CG2-CD1 3.9Å; I258-Y295 HydrophobicContact CG2-CD2 4.04Å; I258-Y295 HydrophobicContact CG2-CE1 4.47Å; I258-Y295 HydrophobicContact CG2-CG 3.64Å
259M89.5Confident83.3Confident59 Ų5965.2 Ų65.229%0.29133%0.332SS..BIsolated β-bridgetrans-97.7151.6179-55.1-54.7-71.600110.6P257 Y261 G270 K271 L273P257-M259 PolarHBondContact O-N 2.72Å; M259-Y261 WeakPolarHBondContact O-CD1 3.47Å; M259-Y261 VanDerWaalsContact O-CE1 3.3Å; M259-Y261 WeakPolarHBondContact O-CE1 3.37Å; M259-Y261 PolarHBondContact O-N 3Å; M259-G270 VanDerWaalsContact CE-O 3.27Å; M259-G270 WeakPolarHBondContact CE-O 3.28Å; M259-K271 WeakPolarHBondContact CE-O 3.47Å; M259-L273 HydrophobicContact CE-CD2 4.21Å; M259-L273 HydrophobicContact SD-CD2 3.88Å
260C90.6Very high83.3Confident3 Ų363.5 Ų63.52%0.0234%0.335CS..PPolyproline II helixtrans-58.4126.4-179.6179.30000112.7A272 C297C260-A272 HydrophobicContact CB-CB 4.46Å; C260-A272 PolarHBondContact N-O 2.89Å; C260-C297 HydrophobicContact CB-CB 4.14Å
261Y86.7Confident83.2Confident55 Ų5570.3 Ų70.322%0.21637%0.366CS..  trans-87.8-0.3-178.1-68.6-7.2000114.4I258 M259 N263 S288 K290 Y295I258-Y261 HydrophobicContact CG2-CE1 4.06Å; M259-Y261 WeakPolarHBondContact O-CD1 3.47Å; M259-Y261 VanDerWaalsContact O-CE1 3.3Å; M259-Y261 WeakPolarHBondContact O-CE1 3.37Å; M259-Y261 PolarHBondContact O-N 3Å; Y261-N263 PolarHBondContact O-N 2.75Å; Y261-S288 WeakPolarHBondContact O-CB 3.48Å; Y261-K290 HydrophobicContact CD2-CD 4.41Å; Y261-Y295 AromaticContact CD2-CD2 4Å; Y261-Y295 HydrophobicContact CD2-CD2 4Å; Y261-Y295 AromaticContact CE2-CD2 3.6Å; Y261-Y295 HydrophobicContact CE2-CD2 3.6Å; Y261-Y295 HydrophobicContact CE2-CE2 4.39Å; Y261-Y295 HydrophobicContact CE2-CG 4.41Å; Y261-Y295 PolarHBondContact N-O 3.1Å
262R83.6Confident83.3Confident19 Ų1966.2 Ų66.27%0.07234%0.342CS..  trans-72.4120.9175.4-127.6-176.376.3-167.53.3110D264 C265 Q287 C300R262-D264 WeakPolarHBondContact CG-OD1 3.37Å; R262-D264 IonicContact CZ-OD1 3.87Å; R262-D264 IonicContact CZ-OD2 2.83Å; R262-D264 IonicContact NE-OD1 2.71Å; R262-D264 PolarHBondContact NE-OD1 3.34Å; R262-D264 IonicContact NE-OD2 2.87Å; R262-D264 PolarHBondContact NE-OD2 3.25Å; R262-D264 IonicContact NH2-OD1 3.54Å; R262-D264 IonicContact NH2-OD2 2.76Å; R262-D264 PolarHBondContact NH2-OD2 2.62Å; R262-D264 PolarHBondContact O-N 3.3Å; R262-C265 WeakPolarHBondContact O-CB 3.37Å; R262-C265 PolarHBondContact O-N 3.26Å; R262-Q287 HydrophobicContact CG-CB 4.06Å; R262-Q287 WeakPolarHBondContact CG-O 3.27Å; R262-C300 PolarHBondContact NH1-O 3.23Å; R262-C300 VanDerWaalsContact NH1-O 3.14Å
263N79Confident83.4Confident101 Ų10166.3 Ų66.354%0.5435%0.347SS..THydrogen-bonded Turntrans-62.8-31-173.5-66.2-56.3000112.6Y261 T269 S288Y261-N263 PolarHBondContact O-N 2.75Å; N263-T269 PolarHBondContact O-OG1 3.14Å; N263-S288 PolarHBondContact ND2-O 3.18Å
264D81.7Confident83.5Confident97 Ų9760.9 Ų60.952%0.51932%0.322SS..THydrogen-bonded Turntrans-102.424.5-177.571.2-44.2000113.4R262R262-D264 WeakPolarHBondContact CG-OD1 3.37Å; R262-D264 IonicContact CZ-OD1 3.87Å; R262-D264 IonicContact CZ-OD2 2.83Å; R262-D264 IonicContact NE-OD1 2.71Å; R262-D264 PolarHBondContact NE-OD1 3.34Å; R262-D264 IonicContact NE-OD2 2.87Å; R262-D264 PolarHBondContact NE-OD2 3.25Å; R262-D264 IonicContact NH2-OD1 3.54Å; R262-D264 IonicContact NH2-OD2 2.76Å; R262-D264 PolarHBondContact NH2-OD2 2.62Å; R262-D264 PolarHBondContact O-N 3.3Å
265C83.2Confident83.6Confident7 Ų761 Ų615%0.04732%0.317CS..  trans-53.4127179.7177.30000112.3R262 N267 K268R262-C265 WeakPolarHBondContact O-CB 3.37Å; R262-C265 PolarHBondContact O-N 3.26Å; C265-N267 PolarHBondContact O-N 3Å; C265-K268 WeakPolarHBondContact O-CA 3.24Å; C265-K268 PolarHBondContact O-N 3.22Å
266P80.6Confident83.5Confident83 Ų8361 Ų6154%0.53932%0.318SS..THydrogen-bonded Turntrans-63.4-31.1-17625.5-34.5000112.7K268 D299P266-K268 PolarHBondContact O-N 3.3Å; P266-K268 VanDerWaalsContact O-N 3.14Å; P266-D299 HydrophobicContact CG-CB 4.09Å
267N78.3Confident83.5Confident69 Ų6954.8 Ų54.837%0.36929%0.291SS..THydrogen-bonded Turntrans-76.28.6176.5-67.8-29.6000114C265 A272 D299C265-N267 PolarHBondContact O-N 3Å; N267-A272 HydrophobicContact CB-CB 3.81Å; N267-D299 PolarHBondContact ND2-OD2 3Å
268K74.5Confident83.5Confident154 Ų15453 Ų5367%0.6728%0.279SS*.  trans74.4131.5-169.6-52.3170.1-175.9174.10112.4C265 P266 G270 K271C265-K268 WeakPolarHBondContact O-CA 3.24Å; C265-K268 PolarHBondContact O-N 3.22Å; P266-K268 PolarHBondContact O-N 3.3Å; P266-K268 VanDerWaalsContact O-N 3.14Å; K268-G270 PolarHBondContact O-N 3.05Å; K268-K271 PolarHBondContact O-N 2.72Å
269T68.7Low83.3Confident82 Ų8252.7 Ų52.750%0.50328%0.278SS..THydrogen-bonded Turntrans-47.9128.1179.5-31.10000111.1N263 K271N263-T269 PolarHBondContact O-OG1 3.14Å; T269-K271 VanDerWaalsContact C-N 3.32Å; T269-K271 PolarHBondContact O-N 3.43Å
270G71.1Confident83Confident41 Ų4149.9 Ų49.942%0.42326%0.264SS..THydrogen-bonded Turntrans71.512.2179.600000116.5M259 K268M259-G270 VanDerWaalsContact CE-O 3.27Å; M259-G270 WeakPolarHBondContact CE-O 3.28Å; K268-G270 PolarHBondContact O-N 3.05Å
271K80.9Confident82.6Confident158 Ų15849.8 Ų49.869%0.68726%0.264SS*.THydrogen-bonded Turntrans-111.7-22.2175.3-68.3-152173-154.30116.1M259 K268 T269M259-K271 WeakPolarHBondContact CE-O 3.47Å; K268-K271 PolarHBondContact O-N 2.72Å; T269-K271 VanDerWaalsContact C-N 3.32Å; T269-K271 PolarHBondContact O-N 3.43Å
272A85.5Confident82.3Confident11 Ų1150.9 Ų50.99%0.09127%0.269CS..SBendtrans-88136.9171.800000111.1C260 N267 C297C260-A272 HydrophobicContact CB-CB 4.46Å; C260-A272 PolarHBondContact N-O 2.89Å; N267-A272 HydrophobicContact CB-CB 3.81Å; A272-C297 HydrophobicContact CB-CB 3.5Å; A272-C297 VanDerWaalsContact CB-CB 3.5Å; A272-C297 VanDerWaalsContact CB-SG 3.58Å
273L88.7Confident82.3Confident74 Ų7450 Ų5039%0.38727%0.266SS..BIsolated β-bridgetrans-63.6139170.3-50179.8000109P257 M259 C297 L317P257-L273 HydrophobicContact CB-CD2 3.95Å; P257-L273 HydrophobicContact CG-CD2 4.15Å; M259-L273 HydrophobicContact CE-CD2 4.21Å; M259-L273 HydrophobicContact SD-CD2 3.88Å; L273-C297 VanDerWaalsContact O-CA 3.28Å; L273-C297 WeakPolarHBondContact O-CA 3.21Å; L273-C297 WeakPolarHBondContact O-CB 3.23Å; L273-L317 HydrophobicContact CB-CD2 4.41Å; L273-L317 HydrophobicContact CD1-CD1 4.27Å
274A89.3Confident82.6Confident0 Ų045.2 Ų45.20%024%0.24CC..PPolyproline II helixtrans-69.7143.1165.500000109.9I258 Y295 V296 I315 L317I258-A274 HydrophobicContact CB-CB 4.34Å; I258-A274 HydrophobicContact CG2-CB 4.2Å; I258-A274 WeakPolarHBondContact O-CB 3.26Å; I258-A274 PolarHBondContact O-N 3.41Å; A274-Y295 HydrophobicContact CB-CD1 4.21Å; A274-Y295 HydrophobicContact CB-CG 4.46Å; A274-V296 CarbonylContact C-O 3.58Å; A274-V296 WeakPolarHBondContact CA-O 3.41Å; A274-I315 HydrophobicContact CB-CD1 3.89Å; A274-L317 WeakPolarHBondContact O-CD2 3.35Å
275M87.8Confident82.7Confident51 Ų5141.6 Ų41.625%0.25122%0.221SC..  trans-130.9-21.1176.5-72.2171.55700111.9V296 L298 D314 I315 N353M275-V296 PolarHBondContact N-O 3.32Å; M275-L298 HydrophobicContact CE-CB 4.15Å; M275-L298 HydrophobicContact CE-CD2 4.28Å; M275-L298 HydrophobicContact SD-CB 4.03Å; M275-D314 WeakPolarHBondContact O-CA 3.39Å; M275-I315 VanDerWaalsContact C-CG1 3.44Å; M275-I315 WeakPolarHBondContact O-CG1 3.42Å; M275-I315 PolarHBondContact O-N 3Å; M275-N353 PolarHBondContact O-ND2 2.95Å
276K89.3Confident82.7Confident20 Ų2047 Ų479%0.08725%0.245CC..EExtended strand (participates in β ladder)trans-131.3150.2178.3-87.9-178.8176.6-620110.8V296 A301 F309 L312 I313 D314K276-V296 HydrophobicContact CB-CG2 3.97Å; K276-V296 PolarHBondContact N-O 3.28Å; K276-V296 WeakPolarHBondContact O-CG2 3.41Å; K276-V296 PolarHBondContact O-N 3.39Å; K276-A301 HydrophobicContact CD-CB 4.01Å; K276-F309 HydrophobicContact CD-CE2 4.39Å; K276-L312 HydrophobicContact CB-CB 4.04Å; K276-L312 HydrophobicContact CB-CD1 4.27Å; K276-L312 HydrophobicContact CB-CD2 4.32Å; K276-L312 HydrophobicContact CB-CG 4.49Å; K276-L312 HydrophobicContact CD-CB 3.81Å; K276-L312 HydrophobicContact CD-CD1 4Å; K276-L312 HydrophobicContact CG-CB 4.18Å; K276-L312 PolarHBondContact NZ-O 3.28Å; K276-L312 VanDerWaalsContact NZ-O 3.14Å; K276-I313 CarbonylContact C-O 3.58Å; K276-I313 WeakPolarHBondContact CA-O 3.22Å; K276-D314 WeakPolarHBondContact CE-OD1 3.47Å; K276-D314 WeakPolarHBondContact CG-OD1 3.5Å; K276-D314 IonicContact NZ-OD1 2.76Å; K276-D314 PolarHBondContact NZ-OD1 3.47Å; K276-D314 VanDerWaalsContact NZ-OD1 3.1Å; K276-D314 IonicContact NZ-OD2 3.7Å; K276-D314 PolarHBondContact NZ-OD2 2.7Å
277M88.6Confident82.8Confident9 Ų945.4 Ų45.44%0.04423%0.231CC..EExtended strand (participates in β ladder)trans-132.7142.2-179.9-178.5-169.470.500110.5P156 V279 P293 L294 Y295 L312 I313 I315P156-M277 HydrophobicContact CB-CE 3.93Å; P156-M277 HydrophobicContact CB-SD 4.23Å; M277-V279 HydrophobicContact CE-CG1 4.1Å; M277-P293 HydrophobicContact CG-CB 3.74Å; M277-P293 HydrophobicContact CG-CG 4.46Å; M277-P293 HydrophobicContact SD-CB 3.69Å; M277-P293 HydrophobicContact SD-CG 3.91Å; M277-L294 CarbonylContact C-O 3.53Å; M277-L294 VanDerWaalsContact CA-O 3.26Å; M277-L294 WeakPolarHBondContact CA-O 3.49Å; M277-Y295 HydrophobicContact CB-CD1 4.04Å; M277-Y295 HydrophobicContact CB-CE1 3.99Å; M277-Y295 HydrophobicContact CG-CD1 4.12Å; M277-Y295 HydrophobicContact CG-CE1 3.85Å; M277-Y295 HydrophobicContact CG-CE2 4.46Å; M277-Y295 HydrophobicContact SD-CE1 3.74Å; M277-Y295 HydrophobicContact SD-CE2 4.28Å; M277-Y295 VanDerWaalsContact SD-CZ 3.55Å; M277-Y295 PolarHBondContact SD-OH 3.48Å; M277-Y295 VanDerWaalsContact SD-OH 3.37Å; M277-L312 CarbonylContact O-C 3.26Å; M277-L312 WeakPolarHBondContact O-CA 3.36Å; M277-I313 PolarHBondContact N-O 3.27Å; M277-I313 PolarHBondContact O-N 2.88Å; M277-I315 HydrophobicContact CB-CG2 3.53Å
278T86.6Confident82.9Confident3 Ų342.6 Ų42.62%0.01822%0.217CC..EExtended strand (participates in β ladder)trans-124.4140.6163.2-174.90000111.8N280 I283 P293 L294 Q311 L312T278-N280 PolarHBondContact OG1-N 2.84Å; T278-I283 HydrophobicContact CG2-CB 3.94Å; T278-I283 HydrophobicContact CG2-CD1 4.37Å; T278-I283 HydrophobicContact CG2-CG2 3.87Å; T278-P293 CarbonylContact O-C 3.57Å; T278-P293 WeakPolarHBondContact O-CA 3.43Å; T278-P293 WeakPolarHBondContact O-CB 3.35Å; T278-L294 HydrophobicContact CG2-CB 3.92Å; T278-L294 HydrophobicContact CG2-CD2 4.08Å; T278-L294 PolarHBondContact N-O 3.31Å; T278-L294 PolarHBondContact O-N 3.42Å; T278-Q311 WeakPolarHBondContact CB-O 3.43Å; T278-Q311 PolarHBondContact OG1-O 2.99Å; T278-L312 HydrophobicContact CG2-CD2 3.95Å
279V84.7Confident83.2Confident10 Ų1037.4 Ų37.46%0.06121%0.206CC..  trans-88.1-13174.8-560000112.6L57 I59 L157 M277 P281 P292 P293L57-V279 HydrophobicContact CD2-CG2 4.38Å; L57-V279 HydrophobicContact CG-CG2 4.38Å; I59-V279 HydrophobicContact CD1-CG1 3.85Å; I59-V279 HydrophobicContact CD1-CG2 4.27Å; I59-V279 HydrophobicContact CG1-CB 4.47Å; I59-V279 HydrophobicContact CG1-CG1 4.03Å; I59-V279 HydrophobicContact CG1-CG2 3.63Å; L157-V279 HydrophobicContact CD2-CB 4.02Å; L157-V279 HydrophobicContact CD2-CG1 3.54Å; M277-V279 HydrophobicContact CE-CG1 4.1Å; V279-P281 WeakPolarHBondContact O-CD 3.46Å; V279-P292 WeakPolarHBondContact O-CB 3.36Å; V279-P293 HydrophobicContact CG1-CB 4.5Å
280N83.9Confident83.8Confident1 Ų137.9 Ų37.91%0.00520%0.202CC..  trans-66.7118.9-173.6-175-23.5000110.2Q55 T278 K282 I283 S284 Q311Q55-N280 PolarHBondContact O-ND2 3.26Å; T278-N280 PolarHBondContact OG1-N 2.84Å; N280-K282 PolarHBondContact O-N 2.93Å; N280-K282 VanDerWaalsContact OD1-CB 3.23Å; N280-K282 WeakPolarHBondContact OD1-CB 3.46Å; N280-K282 PolarHBondContact OD1-N 3.41Å; N280-I283 HydrophobicContact CB-CD1 4.12Å; N280-I283 HydrophobicContact CB-CG1 4.22Å; N280-I283 PolarHBondContact O-N 3.47Å; N280-S284 PolarHBondContact O-N 3.28Å; N280-S284 VanDerWaalsContact O-N 3.08Å; N280-Q311 PolarHBondContact ND2-OE1 3.41Å
281P81.6Confident84.2Confident1 Ų137.2 Ų37.21%0.00619%0.19CC..Hα-helixtrans-60.3-34.1-177.924.5-34.5000112.4L51 I54 V279 I283 S284 I285 P292L51-P281 HydrophobicContact CB-CB 4.14Å; L51-P281 WeakPolarHBondContact O-CB 3.46Å; L51-P281 WeakPolarHBondContact O-CG 3.16Å; I54-P281 HydrophobicContact CB-CG 4.05Å; I54-P281 HydrophobicContact CG2-CG 3.85Å; V279-P281 WeakPolarHBondContact O-CD 3.46Å; P281-I283 PolarHBondContact O-N 2.84Å; P281-S284 PolarHBondContact O-N 3.2Å; P281-I285 HydrophobicContact CB-CD1 4.28Å; P281-I285 WeakPolarHBondContact O-CB 3.47Å; P281-I285 WeakPolarHBondContact O-CD1 3.44Å; P281-I285 WeakPolarHBondContact O-CG1 3.36Å; P281-I285 PolarHBondContact O-N 2.87Å; P281-P292 HydrophobicContact CB-CG 3.99Å
282K81.9Confident84.3Confident77 Ų7729.7 Ų29.734%0.33516%0.157SC..Hα-helixtrans-55.9-51.6176.4178.4-165.2164.7-143.10111.1Q55 N280 Q286 D308Q55-K282 WeakPolarHBondContact O-CD 3.41Å; N280-K282 PolarHBondContact O-N 2.93Å; N280-K282 VanDerWaalsContact OD1-CB 3.23Å; N280-K282 WeakPolarHBondContact OD1-CB 3.46Å; N280-K282 PolarHBondContact OD1-N 3.41Å; K282-Q286 VanDerWaalsContact O-CB 3.29Å; K282-Q286 WeakPolarHBondContact O-CB 3.47Å; K282-Q286 WeakPolarHBondContact O-CG 3.19Å; K282-Q286 PolarHBondContact O-N 3.44Å; K282-Q286 VanDerWaalsContact O-N 3.07Å; K282-D308 IonicContact NZ-OD1 3.34Å
283I83.1Confident84.4Confident1 Ų129.5 Ų29.51%0.00516%0.155CC..Hα-helixtrans-69.8-44.6-177.3-52.8174000109.6T278 N280 P281 I285 Q286 Q287 L294 D308 Q311T278-I283 HydrophobicContact CG2-CB 3.94Å; T278-I283 HydrophobicContact CG2-CD1 4.37Å; T278-I283 HydrophobicContact CG2-CG2 3.87Å; N280-I283 HydrophobicContact CB-CD1 4.12Å; N280-I283 HydrophobicContact CB-CG1 4.22Å; N280-I283 PolarHBondContact O-N 3.47Å; P281-I283 PolarHBondContact O-N 2.84Å; I283-I285 PolarHBondContact O-N 2.97Å; I283-Q286 PolarHBondContact O-N 3.4Å; I283-Q287 HydrophobicContact CG2-CG 4.11Å; I283-Q287 WeakPolarHBondContact O-CB 3.24Å; I283-Q287 VanDerWaalsContact O-CG 3.31Å; I283-Q287 WeakPolarHBondContact O-CG 3.27Å; I283-Q287 PolarHBondContact O-N 2.72Å; I283-L294 HydrophobicContact CG2-CD2 4.02Å; I283-D308 HydrophobicContact CD1-CB 3.92Å; I283-D308 HydrophobicContact CG1-CB 4.39Å; I283-Q311 HydrophobicContact CD1-CB 3.94Å
284S85.4Confident84.3Confident0 Ų026 Ų260%014%0.137CC..Hα-helixtrans-58.1-49.6178.3-173.80000113.1N280 P281 Q287 S288 K290 P291 P292N280-S284 PolarHBondContact O-N 3.28Å; N280-S284 VanDerWaalsContact O-N 3.08Å; P281-S284 PolarHBondContact O-N 3.2Å; S284-Q287 PolarHBondContact O-N 3.12Å; S284-S288 PolarHBondContact O-N 3.34Å; S284-S288 PolarHBondContact O-OG 3.11Å; S284-K290 PolarHBondContact OG-O 2.68Å; S284-P291 PolarHBondContact OG-O 2.94Å; S284-P292 WeakPolarHBondContact OG-CA 3.44Å
285I83.9Confident84.4Confident21 Ų2126.3 Ų26.311%0.10814%0.138CC..Hα-helixtrans-67.4-38.1-178.2-69.5169.5000110.7Y48 L51 K52 P281 I283 G289Y48-I285 HydrophobicContact CD2-CD1 4.41Å; Y48-I285 HydrophobicContact CE2-CD1 4.01Å; Y48-I285 HydrophobicContact CE2-CG1 3.86Å; L51-I285 HydrophobicContact CB-CD1 4.37Å; K52-I285 HydrophobicContact CB-CD1 4.09Å; K52-I285 HydrophobicContact CG-CG2 4.47Å; P281-I285 HydrophobicContact CB-CD1 4.28Å; P281-I285 WeakPolarHBondContact O-CB 3.47Å; P281-I285 WeakPolarHBondContact O-CD1 3.44Å; P281-I285 WeakPolarHBondContact O-CG1 3.36Å; P281-I285 PolarHBondContact O-N 2.87Å; I283-I285 PolarHBondContact O-N 2.97Å; I285-G289 WeakPolarHBondContact O-CA 3.26Å; I285-G289 PolarHBondContact O-N 3.28Å
286Q83.3Confident84.5Confident121 Ų12123.9 Ų23.957%0.56513%0.126SC*.Hα-helixtrans-67.9-39.5177.3-75.4175.70.500113.3K282 I283K282-Q286 VanDerWaalsContact O-CB 3.29Å; K282-Q286 WeakPolarHBondContact O-CB 3.47Å; K282-Q286 WeakPolarHBondContact O-CG 3.19Å; K282-Q286 PolarHBondContact O-N 3.44Å; K282-Q286 VanDerWaalsContact O-N 3.07Å; I283-Q286 PolarHBondContact O-N 3.4Å
287Q82.5Confident84.5Confident50 Ų5023.1 Ų23.123%0.23412%0.123CC..Hα-helixtrans-95.6-24.1-170.2-63-64-24.100114.5R262 I283 S284 L294 L304R262-Q287 HydrophobicContact CG-CB 4.06Å; R262-Q287 WeakPolarHBondContact CG-O 3.27Å; I283-Q287 HydrophobicContact CG2-CG 4.11Å; I283-Q287 WeakPolarHBondContact O-CB 3.24Å; I283-Q287 VanDerWaalsContact O-CG 3.31Å; I283-Q287 WeakPolarHBondContact O-CG 3.27Å; I283-Q287 PolarHBondContact O-N 2.72Å; S284-Q287 PolarHBondContact O-N 3.12Å; Q287-L294 HydrophobicContact CB-CD1 4.39Å; Q287-L294 HydrophobicContact CB-CD2 3.74Å; Q287-L294 HydrophobicContact CG-CD2 4.19Å; Q287-L304 VanDerWaalsContact CD-CD2 3.48Å; Q287-L304 HydrophobicContact CG-CD2 3.91Å; Q287-L304 VanDerWaalsContact NE2-CD2 3.32Å
288S80.5Confident84.5Confident10 Ų1026 Ų267%0.0714%0.138CC..Hα-helixtrans-126.4-21.6-178.671.20000114.9Y261 N263 S284 K290Y261-S288 WeakPolarHBondContact O-CB 3.48Å; N263-S288 PolarHBondContact ND2-O 3.18Å; S284-S288 PolarHBondContact O-N 3.34Å; S284-S288 PolarHBondContact O-OG 3.11Å; S288-K290 PolarHBondContact O-N 3.06Å; S288-K290 WeakPolarHBondContact OG-CB 3.37Å; S288-K290 PolarHBondContact OG-N 2.95Å
289G80.3Confident84.6Confident44 Ų4429.8 Ų29.845%0.45416%0.158SC..SBendtrans69.99.6-168.200000114.4Y48 I285Y48-G289 PolarHBondContact OH-O 3.23Å; I285-G289 WeakPolarHBondContact O-CA 3.26Å; I285-G289 PolarHBondContact O-N 3.28Å
290K81Confident84.8Confident93 Ų9329.3 Ų29.340%0.40416%0.155SC..SBendtrans-99.8154174.9-61.2-176.8-179.6-178.20111.2Y261 S284 S288Y261-K290 HydrophobicContact CD2-CD 4.41Å; S284-K290 PolarHBondContact OG-O 2.68Å; S288-K290 PolarHBondContact O-N 3.06Å; S288-K290 WeakPolarHBondContact OG-CB 3.37Å; S288-K290 PolarHBondContact OG-N 2.95Å
291P79.8Confident84.9Confident27 Ų2729.2 Ų29.218%0.17516%0.155CC..SBendtrans-56.8154.7162.828.6-36.3000110.6S284S284-P291 PolarHBondContact OG-O 2.94Å
292P83Confident85.2Confident0 Ų034 Ų340%018%0.18CC..SBendtrans-60.9162.3175.324.2-32.4000113Q113 F117 V279 P281 S284Q113-P292 PolarHBondContact NE2-O 3.13Å; F117-P292 HydrophobicContact CD1-CG 4.15Å; F117-P292 HydrophobicContact CD2-CG 4.13Å; F117-P292 HydrophobicContact CE1-CB 4.09Å; F117-P292 HydrophobicContact CE1-CG 3.77Å; F117-P292 HydrophobicContact CE2-CB 4.32Å; F117-P292 HydrophobicContact CE2-CG 3.76Å; F117-P292 WeakPolarHBondContact CE2-O 3.49Å; F117-P292 HydrophobicContact CG-CG 4.32Å; F117-P292 HydrophobicContact CZ-CB 3.76Å; F117-P292 HydrophobicContact CZ-CG 3.56Å; V279-P292 WeakPolarHBondContact O-CB 3.36Å; P281-P292 HydrophobicContact CB-CG 3.99Å; S284-P292 WeakPolarHBondContact OG-CA 3.44Å
293P86.9Confident85.4Confident7 Ų733.5 Ų33.55%0.04519%0.19CC..PPolyproline II helixcis-84.1155.7-2.533.2-32.4000113.7S152 M277 T278 V279 Y295S152-P293 WeakPolarHBondContact O-CG 3.46Å; M277-P293 HydrophobicContact CG-CB 3.74Å; M277-P293 HydrophobicContact CG-CG 4.46Å; M277-P293 HydrophobicContact SD-CB 3.69Å; M277-P293 HydrophobicContact SD-CG 3.91Å; T278-P293 CarbonylContact O-C 3.57Å; T278-P293 WeakPolarHBondContact O-CA 3.43Å; T278-P293 WeakPolarHBondContact O-CB 3.35Å; V279-P293 HydrophobicContact CG1-CB 4.5Å; P293-Y295 HydrophobicContact CB-CE2 4.47Å; P293-Y295 HydrophobicContact CG-CE2 3.79Å
294L87.6Confident85.4Confident0 Ų034.5 Ų34.50%020%0.196CC..EExtended strand (participates in β ladder)trans-97.4121.6177.7175.473.6000110.7M277 T278 I283 Q287 V296M277-L294 CarbonylContact C-O 3.53Å; M277-L294 VanDerWaalsContact CA-O 3.26Å; M277-L294 WeakPolarHBondContact CA-O 3.49Å; T278-L294 HydrophobicContact CG2-CB 3.92Å; T278-L294 HydrophobicContact CG2-CD2 4.08Å; T278-L294 PolarHBondContact N-O 3.31Å; T278-L294 PolarHBondContact O-N 3.42Å; I283-L294 HydrophobicContact CG2-CD2 4.02Å; Q287-L294 HydrophobicContact CB-CD1 4.39Å; Q287-L294 HydrophobicContact CB-CD2 3.74Å; Q287-L294 HydrophobicContact CG-CD2 4.19Å; L294-V296 HydrophobicContact CD2-CG1 4.12Å; L294-V296 HydrophobicContact CG-CG1 4.12Å
295Y89.8Confident85.2Confident7 Ų739.8 Ų39.83%0.02722%0.224CC..EExtended strand (participates in β ladder)trans-99.2125.8175.7-71.6-85.5000112.1S152 I258 Y261 A274 M277 P293 I315S152-Y295 WeakPolarHBondContact CA-OH 3.22Å; S152-Y295 PolarHBondContact O-OH 3.46Å; I258-Y295 HydrophobicContact CB-CD1 4.43Å; I258-Y295 HydrophobicContact CD1-CD1 4Å; I258-Y295 HydrophobicContact CD1-CE1 3.51Å; I258-Y295 HydrophobicContact CD1-CE2 4.1Å; I258-Y295 HydrophobicContact CD1-CG 4.47Å; I258-Y295 HydrophobicContact CG2-CD1 3.9Å; I258-Y295 HydrophobicContact CG2-CD2 4.04Å; I258-Y295 HydrophobicContact CG2-CE1 4.47Å; I258-Y295 HydrophobicContact CG2-CG 3.64Å; Y261-Y295 AromaticContact CD2-CD2 4Å; Y261-Y295 HydrophobicContact CD2-CD2 4Å; Y261-Y295 AromaticContact CE2-CD2 3.6Å; Y261-Y295 HydrophobicContact CE2-CD2 3.6Å; Y261-Y295 HydrophobicContact CE2-CE2 4.39Å; Y261-Y295 HydrophobicContact CE2-CG 4.41Å; Y261-Y295 PolarHBondContact N-O 3.1Å; A274-Y295 HydrophobicContact CB-CD1 4.21Å; A274-Y295 HydrophobicContact CB-CG 4.46Å; M277-Y295 HydrophobicContact CB-CD1 4.04Å; M277-Y295 HydrophobicContact CB-CE1 3.99Å; M277-Y295 HydrophobicContact CG-CD1 4.12Å; M277-Y295 HydrophobicContact CG-CE1 3.85Å; M277-Y295 HydrophobicContact CG-CE2 4.46Å; M277-Y295 HydrophobicContact SD-CE1 3.74Å; M277-Y295 HydrophobicContact SD-CE2 4.28Å; M277-Y295 VanDerWaalsContact SD-CZ 3.55Å; M277-Y295 PolarHBondContact SD-OH 3.48Å; M277-Y295 VanDerWaalsContact SD-OH 3.37Å; P293-Y295 HydrophobicContact CB-CE2 4.47Å; P293-Y295 HydrophobicContact CG-CE2 3.79Å; Y295-I315 HydrophobicContact CD1-CD1 3.84Å; Y295-I315 HydrophobicContact CE1-CD1 4.02Å; Y295-I315 HydrophobicContact CE1-CG2 4.14Å
296V90.2Very high84.9Confident0 Ų048.9 Ų48.90%026%0.257CS..EExtended strand (participates in β ladder)trans-128.8144.6-177.9-72.10000113A274 M275 K276 L294 C300 A301 L312A274-V296 CarbonylContact C-O 3.58Å; A274-V296 WeakPolarHBondContact CA-O 3.41Å; M275-V296 PolarHBondContact N-O 3.32Å; K276-V296 HydrophobicContact CB-CG2 3.97Å; K276-V296 PolarHBondContact N-O 3.28Å; K276-V296 WeakPolarHBondContact O-CG2 3.41Å; K276-V296 PolarHBondContact O-N 3.39Å; L294-V296 HydrophobicContact CD2-CG1 4.12Å; L294-V296 HydrophobicContact CG-CG1 4.12Å; V296-C300 HydrophobicContact CB-CB 3.82Å; V296-C300 HydrophobicContact CG1-CB 3.99Å; V296-A301 HydrophobicContact CG2-CB 4.14Å; V296-L312 HydrophobicContact CG2-CD1 4.12Å; V296-L312 HydrophobicContact CG2-CD2 3.7Å
297C90.9Very high84.6Confident3 Ų349.5 Ų49.52%0.0226%0.264CS..  trans-76.1165.3165.268.50000110.6C260 A272 L273 D299 C300 A301C260-C297 HydrophobicContact CB-CB 4.14Å; A272-C297 HydrophobicContact CB-CB 3.5Å; A272-C297 VanDerWaalsContact CB-CB 3.5Å; A272-C297 VanDerWaalsContact CB-SG 3.58Å; L273-C297 VanDerWaalsContact O-CA 3.28Å; L273-C297 WeakPolarHBondContact O-CA 3.21Å; L273-C297 WeakPolarHBondContact O-CB 3.23Å; C297-D299 PolarHBondContact O-N 2.86Å; C297-C300 CarbonylContact O-C 3.57Å; C297-C300 WeakPolarHBondContact O-CA 3.09Å; C297-C300 WeakPolarHBondContact O-CB 3.47Å; C297-C300 PolarHBondContact O-N 3.4Å; C297-C300 VanDerWaalsContact SG-SG 3.64Å; C297-A301 PolarHBondContact O-N 2.68Å
298L87.1Confident84.6Confident70 Ų7047.7 Ų47.737%0.36626%0.256SS..Hα-helixtrans-55.3-49.2-178.2-167.165.5000112.4M275 C300 A301 D302M275-L298 HydrophobicContact CE-CB 4.15Å; M275-L298 HydrophobicContact CE-CD2 4.28Å; M275-L298 HydrophobicContact SD-CB 4.03Å; L298-C300 PolarHBondContact O-N 3.45Å; L298-A301 WeakPolarHBondContact O-CA 3.29Å; L298-A301 WeakPolarHBondContact O-CB 3.47Å; L298-A301 PolarHBondContact O-N 3.01Å; L298-D302 VanDerWaalsContact O-CG 3.28Å; L298-D302 PolarHBondContact O-N 3.12Å
299D88.3Confident84.7Confident82 Ų8250.4 Ų50.444%0.43927%0.266SS..Hα-helixtrans-62.2-19.1176.7-42.6-100.4000114.1P266 N267 C297 A303P266-D299 HydrophobicContact CG-CB 4.09Å; N267-D299 PolarHBondContact ND2-OD2 3Å; C297-D299 PolarHBondContact O-N 2.86Å; D299-A303 WeakPolarHBondContact O-CB 3.4Å
300C89Confident84.6Confident0 Ų053.7 Ų53.70%027%0.273CS..Hα-helixtrans-88.4-26.3173.7-85.40000112.7R262 V296 C297 L298R262-C300 PolarHBondContact NH1-O 3.23Å; R262-C300 VanDerWaalsContact NH1-O 3.14Å; V296-C300 HydrophobicContact CB-CB 3.82Å; V296-C300 HydrophobicContact CG1-CB 3.99Å; C297-C300 CarbonylContact O-C 3.57Å; C297-C300 WeakPolarHBondContact O-CA 3.09Å; C297-C300 WeakPolarHBondContact O-CB 3.47Å; C297-C300 PolarHBondContact O-N 3.4Å; C297-C300 VanDerWaalsContact SG-SG 3.64Å; L298-C300 PolarHBondContact O-N 3.45Å
301A87.2Confident84.6Confident0 Ų052.2 Ų52.20%027%0.268CS..Hα-helixtrans-75.1-52.6173.100000110.4K276 V296 C297 L298 A303 L304 F309 L312K276-A301 HydrophobicContact CD-CB 4.01Å; V296-A301 HydrophobicContact CG2-CB 4.14Å; C297-A301 PolarHBondContact O-N 2.68Å; L298-A301 WeakPolarHBondContact O-CA 3.29Å; L298-A301 WeakPolarHBondContact O-CB 3.47Å; L298-A301 PolarHBondContact O-N 3.01Å; A301-A303 PolarHBondContact O-N 2.97Å; A301-L304 WeakPolarHBondContact O-CB 3.44Å; A301-L304 PolarHBondContact O-N 3.31Å; A301-F309 HydrophobicContact CB-CD2 4.03Å; A301-F309 HydrophobicContact CB-CE2 4.01Å; A301-L312 HydrophobicContact CB-CD1 3.44Å; A301-L312 VanDerWaalsContact CB-CD1 3.44Å
302D86.6Confident84.8Confident101 Ų10151.3 Ų51.354%0.5426%0.262SS..THydrogen-bonded Turntrans-60.3-17.9-179.4-59.5-6000113.2L298L298-D302 VanDerWaalsContact O-CG 3.28Å; L298-D302 PolarHBondContact O-N 3.12Å
303A86.1Confident84.9Confident66 Ų6655.5 Ų55.555%0.54528%0.283SS..THydrogen-bonded Turntrans-91.21.8176.300000114.4D299 A301D299-A303 WeakPolarHBondContact O-CB 3.4Å; A301-A303 PolarHBondContact O-N 2.97Å
304L83.4Confident84.9Confident22 Ų2257.5 Ų57.512%0.11529%0.293CS..SBendtrans-89.6167172.5-65.2169.9000111.1Q287 A301 D308 L312Q287-L304 VanDerWaalsContact CD-CD2 3.48Å; Q287-L304 HydrophobicContact CG-CD2 3.91Å; Q287-L304 VanDerWaalsContact NE2-CD2 3.32Å; A301-L304 WeakPolarHBondContact O-CB 3.44Å; A301-L304 PolarHBondContact O-N 3.31Å; L304-D308 HydrophobicContact CB-CB 4.22Å; L304-L312 HydrophobicContact CD1-CD1 4.07Å
305N81.4Confident84.9Confident111 Ų11158.6 Ų58.659%0.59430%0.299SS*.  trans-67.9150.5170.3-49.1-74.2000109.1L307 D308 F309N305-L307 VanDerWaalsContact C-N 3.33Å; N305-L307 PolarHBondContact O-N 3.06Å; N305-D308 WeakPolarHBondContact CB-OD2 3.34Å; N305-D308 PolarHBondContact ND2-OD2 3.19Å; N305-D308 CarbonylContact O-C 3.56Å; N305-D308 WeakPolarHBondContact O-CA 3.42Å; N305-D308 PolarHBondContact O-N 2.99Å; N305-F309 PolarHBondContact O-N 3.21Å
306R78.6Confident84.8Confident212 Ų21259.7 Ų59.780%0.831%0.305SS*.Hα-helixtrans-47.4-54.3176.5-73.5-177172.8-175.9-7.5112.1D308 F309 D310R306-D308 PolarHBondContact O-N 2.88Å; R306-F309 CarbonylContact O-C 3.53Å; R306-F309 WeakPolarHBondContact O-CA 3.36Å; R306-F309 WeakPolarHBondContact O-CB 3.27Å; R306-F309 PolarHBondContact O-N 3.44Å; R306-D310 PolarHBondContact O-N 3.33Å; R306-D310 VanDerWaalsContact O-OD1 3.1Å
307L77.1Confident84.7Confident135 Ų13560.4 Ų60.471%0.70731%0.309SS*.Hα-helixtrans-53.1-26.1176.6-62.4174.4000115.4N305 D310 Q311N305-L307 VanDerWaalsContact C-N 3.33Å; N305-L307 PolarHBondContact O-N 3.06Å; L307-D310 WeakPolarHBondContact CA-OD2 3.35Å; L307-D310 PolarHBondContact N-OD2 3.37Å; L307-Q311 PolarHBondContact O-NE2 3.44Å
308D80.9Confident84.5Confident12 Ų1260.4 Ų60.46%0.06431%0.309CS..Hα-helixtrans-94-23.3175.8-56.9-53.2000112K282 I283 L304 N305 R306K282-D308 IonicContact NZ-OD1 3.34Å; I283-D308 HydrophobicContact CD1-CB 3.92Å; I283-D308 HydrophobicContact CG1-CB 4.39Å; L304-D308 HydrophobicContact CB-CB 4.22Å; N305-D308 WeakPolarHBondContact CB-OD2 3.34Å; N305-D308 PolarHBondContact ND2-OD2 3.19Å; N305-D308 CarbonylContact O-C 3.56Å; N305-D308 WeakPolarHBondContact O-CA 3.42Å; N305-D308 PolarHBondContact O-N 2.99Å; R306-D308 PolarHBondContact O-N 2.88Å
309F82.5Confident84.3Confident67 Ų6757.7 Ų57.729%0.29430%0.295SS..Hα-helixtrans-75.1-40.1171.8179.2-83.5000112K276 A301 N305 R306 Q311 L312K276-F309 HydrophobicContact CD-CE2 4.39Å; A301-F309 HydrophobicContact CB-CD2 4.03Å; A301-F309 HydrophobicContact CB-CE2 4.01Å; N305-F309 PolarHBondContact O-N 3.21Å; R306-F309 CarbonylContact O-C 3.53Å; R306-F309 WeakPolarHBondContact O-CA 3.36Å; R306-F309 WeakPolarHBondContact O-CB 3.27Å; R306-F309 PolarHBondContact O-N 3.44Å; F309-Q311 PolarHBondContact O-N 3.38Å; F309-Q311 VanDerWaalsContact O-N 3.08Å; F309-L312 HydrophobicContact CD2-CD1 4.1Å; F309-L312 HydrophobicContact CG-CD1 4.45Å; F309-L312 WeakPolarHBondContact O-CB 3.3Å; F309-L312 PolarHBondContact O-N 3.44Å
310D79.4Confident83.7Confident112 Ų11260.4 Ų60.460%0.59930%0.303SS*.THydrogen-bonded Turntrans-62.7-17.3178.1-47.4-29.6000111.4R306 L307R306-D310 PolarHBondContact O-N 3.33Å; R306-D310 VanDerWaalsContact O-OD1 3.1Å; L307-D310 WeakPolarHBondContact CA-OD2 3.35Å; L307-D310 PolarHBondContact N-OD2 3.37Å
311Q80.7Confident83.1Confident62 Ų6268.1 Ų68.129%0.2934%0.339SS..THydrogen-bonded Turntrans-94.614.9173.8-65.5176.366.300113.6T278 N280 I283 L307 F309T278-Q311 WeakPolarHBondContact CB-O 3.43Å; T278-Q311 PolarHBondContact OG1-O 2.99Å; N280-Q311 PolarHBondContact ND2-OE1 3.41Å; I283-Q311 HydrophobicContact CD1-CB 3.94Å; L307-Q311 PolarHBondContact O-NE2 3.44Å; F309-Q311 PolarHBondContact O-N 3.38Å; F309-Q311 VanDerWaalsContact O-N 3.08Å
312L84.7Confident82.9Confident9 Ų969 Ų695%0.04734%0.343CS..  trans-108.3114.5177.5-68.1171.8000112.8K276 M277 T278 V296 A301 L304 F309K276-L312 HydrophobicContact CB-CB 4.04Å; K276-L312 HydrophobicContact CB-CD1 4.27Å; K276-L312 HydrophobicContact CB-CD2 4.32Å; K276-L312 HydrophobicContact CB-CG 4.49Å; K276-L312 HydrophobicContact CD-CB 3.81Å; K276-L312 HydrophobicContact CD-CD1 4Å; K276-L312 HydrophobicContact CG-CB 4.18Å; K276-L312 PolarHBondContact NZ-O 3.28Å; K276-L312 VanDerWaalsContact NZ-O 3.14Å; M277-L312 CarbonylContact O-C 3.26Å; M277-L312 WeakPolarHBondContact O-CA 3.36Å; T278-L312 HydrophobicContact CG2-CD2 3.95Å; V296-L312 HydrophobicContact CG2-CD1 4.12Å; V296-L312 HydrophobicContact CG2-CD2 3.7Å; A301-L312 HydrophobicContact CB-CD1 3.44Å; A301-L312 VanDerWaalsContact CB-CD1 3.44Å; L304-L312 HydrophobicContact CD1-CD1 4.07Å; F309-L312 HydrophobicContact CD2-CD1 4.1Å; F309-L312 HydrophobicContact CG-CD1 4.45Å; F309-L312 WeakPolarHBondContact O-CB 3.3Å; F309-L312 PolarHBondContact O-N 3.44Å
313I84.9Confident82.7Confident87 Ų8765.5 Ų65.545%0.44633%0.327SS..EExtended strand (participates in β ladder)trans-89.9136.9175.4-64.8161.9000109.1I59 K276 M277I59-I313 HydrophobicContact CD1-CD1 3.39Å; I59-I313 HydrophobicContact CG1-CD1 4.35Å; K276-I313 CarbonylContact C-O 3.58Å; K276-I313 WeakPolarHBondContact CA-O 3.22Å; M277-I313 PolarHBondContact N-O 3.27Å; M277-I313 PolarHBondContact O-N 2.88Å
314D85.9Confident82.6Confident50 Ų5066 Ų6627%0.26732%0.32SS..EExtended strand (participates in β ladder)trans-68.1138.1176.3-66.8-75.3000111.5M275 K276 T345M275-D314 WeakPolarHBondContact O-CA 3.39Å; K276-D314 WeakPolarHBondContact CE-OD1 3.47Å; K276-D314 WeakPolarHBondContact CG-OD1 3.5Å; K276-D314 IonicContact NZ-OD1 2.76Å; K276-D314 PolarHBondContact NZ-OD1 3.47Å; K276-D314 VanDerWaalsContact NZ-OD1 3.1Å; K276-D314 IonicContact NZ-OD2 3.7Å; K276-D314 PolarHBondContact NZ-OD2 2.7Å; D314-T345 HydrophobicContact CB-CG2 3.95Å; D314-T345 WeakPolarHBondContact O-CG2 3.42Å
315I87.8Confident82.8Confident22 Ų2268.2 Ų68.211%0.11334%0.335CS..  trans-108.7152176.559.3145.4000111.2A274 M275 M277 Y295 N353A274-I315 HydrophobicContact CB-CD1 3.89Å; M275-I315 VanDerWaalsContact C-CG1 3.44Å; M275-I315 WeakPolarHBondContact O-CG1 3.42Å; M275-I315 PolarHBondContact O-N 3Å; M277-I315 HydrophobicContact CB-CG2 3.53Å; Y295-I315 HydrophobicContact CD1-CD1 3.84Å; Y295-I315 HydrophobicContact CE1-CD1 4.02Å; Y295-I315 HydrophobicContact CE1-CG2 4.14Å; I315-N353 WeakPolarHBondContact O-CB 3.41Å; I315-N353 PolarHBondContact O-ND2 2.68Å
316L88.2Confident83.3Confident31 Ų3163.7 Ų63.716%0.16231%0.312CS..PPolyproline II helixtrans-80.3148176.5-54.2-176000111.5W343 T345 T348 N353L316-W343 HydrophobicContact CD1-CB 4.2Å; L316-W343 HydrophobicContact CD1-CE3 3.71Å; L316-W343 WeakPolarHBondContact CD1-O 2.94Å; L316-T345 HydrophobicContact CD2-CG2 4.49Å; L316-T348 HydrophobicContact CD2-CG2 3.94Å; L316-T348 WeakPolarHBondContact CD2-OG1 3.29Å; L316-N353 CarbonylContact C-O 3.58Å; L316-N353 WeakPolarHBondContact CA-O 3.48Å
317L88.4Confident83.8Confident15 Ų1557 Ų578%0.07929%0.289CS..PPolyproline II helixtrans-103.1146.8172.8-66.8178.8000109.5P257 L273 A274 T319 N353 R354P257-L317 HydrophobicContact CB-CD2 4.39Å; L273-L317 HydrophobicContact CB-CD2 4.41Å; L273-L317 HydrophobicContact CD1-CD1 4.27Å; A274-L317 WeakPolarHBondContact O-CD2 3.35Å; L317-T319 PolarHBondContact O-N 3.17Å; L317-N353 HydrophobicContact CG-CB 4.35Å; L317-N353 PolarHBondContact N-O 3.01Å; L317-R354 HydrophobicContact CB-CG 4.27Å
318P86.6Confident84.2Confident3 Ų351 Ų512%0.01926%0.258CS..PPolyproline II helixtrans-49.9131-174.3-17.916.9000112.6E195 S254 W255 P257 R354E195-P318 WeakPolarHBondContact OE2-CA 3.29Å; S254-P318 WeakPolarHBondContact OG-CB 3.49Å; W255-P318 HydrophobicContact CD2-CB 4.07Å; W255-P318 HydrophobicContact CD2-CG 3.63Å; W255-P318 VanDerWaalsContact CE2-CG 3.46Å; W255-P318 HydrophobicContact CE3-CG 4.04Å; W255-P318 HydrophobicContact CG-CB 4.05Å; W255-P318 HydrophobicContact CG-CG 4.05Å; W255-P318 HydrophobicContact CH2-CG 4.11Å; W255-P318 HydrophobicContact CZ2-CB 4.27Å; W255-P318 HydrophobicContact CZ2-CG 3.73Å; W255-P318 HydrophobicContact CZ3-CG 4.26Å; W255-P318 WeakPolarHBondContact O-CG 3.49Å; P257-P318 HydrophobicContact CB-CG 4.25Å; P257-P318 HydrophobicContact CG-CG 3.79Å; P318-R354 VanDerWaalsContact O-CZ 3.3Å; P318-R354 PolarHBondContact O-NH1 2.9Å; P318-R354 PolarHBondContact O-NH2 2.83Å
319T83.4Confident84.5Confident12 Ų1259.1 Ų59.17%0.07429%0.293CS..PPolyproline II helixtrans-65.7151.9-179.7-43.40000110.3E195 S254 L317 I322 A355E195-T319 WeakPolarHBondContact OE1-CA 3.47Å; E195-T319 WeakPolarHBondContact OE1-CB 3.41Å; E195-T319 PolarHBondContact OE1-N 3.17Å; E195-T319 PolarHBondContact OE1-OG1 3.49Å; E195-T319 PolarHBondContact OE2-N 2.98Å; S254-T319 PolarHBondContact OG-O 3.34Å; S254-T319 VanDerWaalsContact OG-O 3.05Å; L317-T319 PolarHBondContact O-N 3.17Å; T319-I322 HydrophobicContact CG2-CG1 4.27Å; T319-A355 HydrophobicContact CG2-CB 4.23Å
320K75.1Confident84.6Confident139 Ų13960.8 Ų60.860%0.60431%0.309SS*.  trans-93.7-172.5172.9-89.7168.8-177.9-179.20109.2I322K320-I322 PolarHBondContact O-N 3.15Å
321Q75.8Confident85.1Confident162 Ų16257.3 Ų57.376%0.75729%0.293SS*.SBendtrans-44.1127.6165.1-177.9179.46.300110.9
322I83.2Confident85.4Confident18 Ų1865.7 Ų65.79%0.09232%0.322CS..  trans-83.5130-169.6-65.7-174.7000110.4H229 Y230 P232 T319 K320H229-I322 VanDerWaalsContact CD2-CD1 3.45Å; H229-I322 WeakPolarHBondContact CD2-CD1 3.46Å; Y230-I322 HydrophobicContact CD1-CD1 3.31Å; Y230-I322 HydrophobicContact CE1-CD1 3.68Å; Y230-I322 HydrophobicContact CG-CD1 4.12Å; P232-I322 HydrophobicContact CG-CG2 4.33Å; T319-I322 HydrophobicContact CG2-CG1 4.27Å; K320-I322 PolarHBondContact O-N 3.15Å
323S83.3Confident85.4Confident28 Ų2866.7 Ų66.720%0.19633%0.33CS..  trans-81.7125.3-175.6179.90000112.6T325 R357S323-T325 WeakPolarHBondContact CB-O 3.43Å; S323-T325 PolarHBondContact O-N 3.27Å; S323-T325 PolarHBondContact OG-N 2.98Å; S323-T325 PolarHBondContact OG-O 3.12Å; S323-T325 PolarHBondContact OG-OG1 3.45Å; S323-T325 VanDerWaalsContact OG-OG1 3.13Å; S323-R357 VanDerWaalsContact O-CD 3.31Å; S323-R357 WeakPolarHBondContact O-CD 3.34Å; S323-R357 PolarHBondContact O-NE 3.41Å
324L84Confident85.5Confident76 Ų7672.9 Ų72.940%0.39835%0.354SS..SBendtrans-66.7-15.2166.7-70172.1000113P232 Y240 S337 A338P232-L324 HydrophobicContact CB-CD2 3.97Å; P232-L324 HydrophobicContact CG-CD2 3.83Å; Y240-L324 HydrophobicContact CE1-CD1 4.23Å; Y240-L324 HydrophobicContact CE2-CD1 4.13Å; L324-S337 WeakPolarHBondContact O-CA 3.46Å; L324-A338 PolarHBondContact O-N 2.9Å
325T87.6Confident85.4Confident70 Ų7075.1 Ų75.143%0.42937%0.366SS..BIsolated β-bridgetrans-112.6148.4-179.3620000112.1S323 E327 N336S323-T325 WeakPolarHBondContact CB-O 3.43Å; S323-T325 PolarHBondContact O-N 3.27Å; S323-T325 PolarHBondContact OG-N 2.98Å; S323-T325 PolarHBondContact OG-O 3.12Å; S323-T325 PolarHBondContact OG-OG1 3.45Å; S323-T325 VanDerWaalsContact OG-OG1 3.13Å; T325-E327 PolarHBondContact O-N 3.48Å; T325-N336 CarbonylContact C-O 3.54Å; T325-N336 WeakPolarHBondContact CA-O 3.46Å
326C90.8Very high85.3Confident16 Ų1678.1 Ų78.111%0.10838%0.382CS..  trans-59.9120.9-179.8-178.10000112.2S328 N336 R357 C359C326-S328 VanDerWaalsContact C-N 3.27Å; C326-S328 PolarHBondContact O-N 2.73Å; C326-S328 VanDerWaalsContact SG-CB 3.53Å; C326-N336 PolarHBondContact N-O 3.29Å; C326-R357 WeakPolarHBondContact CA-O 3.44Å; C326-C359 HydrophobicContact CB-CB 3.87Å; C326-C359 PolarHBondContact SG-N 2.97Å; C326-C359 VanDerWaalsContact SG-N 3.36Å
327E89Confident85.2Confident71 Ų7179.1 Ų79.133%0.33239%0.392SS..  trans-83.4-4.1-176.9-58.2-179.2124.500113T325 K329 I356 R357T325-E327 PolarHBondContact O-N 3.48Å; E327-K329 PolarHBondContact O-N 2.91Å; E327-K329 VanDerWaalsContact O-N 3.11Å; E327-I356 HydrophobicContact CB-CG1 4.15Å; E327-R357 HydrophobicContact CG-CB 4.39Å; E327-R357 PolarHBondContact N-O 3.46Å; E327-R357 PolarHBondContact OE2-N 3.31Å
328S87Confident85.1Confident8 Ų878.8 Ų78.86%0.05639%0.391CS..  trans-64.3111.4175.8-177.20000110.5C326 T330 C331C326-S328 VanDerWaalsContact C-N 3.27Å; C326-S328 PolarHBondContact O-N 2.73Å; C326-S328 VanDerWaalsContact SG-CB 3.53Å; S328-T330 PolarHBondContact O-N 2.93Å; S328-T330 PolarHBondContact OG-OG1 3.43Å; S328-C331 VanDerWaalsContact O-CB 3.24Å; S328-C331 WeakPolarHBondContact O-CB 3.29Å; S328-C331 PolarHBondContact O-N 3.49Å
329K85.9Confident85.1Confident183 Ų18379.9 Ų79.980%0.79640%0.399SS*.THydrogen-bonded Turntrans-57-13.5175.8-64.7162.7-176.6155.60113.8E327 L350E327-K329 PolarHBondContact O-N 2.91Å; E327-K329 VanDerWaalsContact O-N 3.11Å; K329-L350 PolarHBondContact NZ-O 3.28Å
330T85.4Confident85.3Confident103 Ų10379.6 Ų79.663%0.63240%0.397SS*.THydrogen-bonded Turntrans-107.810.217761.30000113.5S328 R332S328-T330 PolarHBondContact O-N 2.93Å; S328-T330 PolarHBondContact OG-OG1 3.43Å; T330-R332 PolarHBondContact O-N 3.2Å
331C88.6Confident86.1Confident39 Ų3973.4 Ų73.426%0.26437%0.371SS..  trans-59.5130.2179.9-174.20000111.8S328 C359S328-C331 VanDerWaalsContact O-CB 3.24Å; S328-C331 WeakPolarHBondContact O-CB 3.29Å; S328-C331 PolarHBondContact O-N 3.49Å; C331-C359 VanDerWaalsContact SG-SG 3.66Å
332R86.9Confident86.8Confident237 Ų23765.7 Ų65.789%0.89434%0.335SS*.  trans-126.512175-64.4-177.1-179.9-179.31112.7T330T330-R332 PolarHBondContact O-N 3.2Å
333S86Confident87.1Confident31 Ų3165.1 Ų65.122%0.21733%0.332CS..  trans-68.1142.9179.2-171.40000111N335S333-N335 WeakPolarHBondContact CB-O 3.33Å; S333-N335 PolarHBondContact OG-N 3.37Å; S333-N335 PolarHBondContact OG-O 3.09Å
334K85.6Confident87.3Confident217 Ų21764.5 Ų64.594%0.94333%0.327SS*.SBendtrans-68.4-38169.4-68.8-178.4-179.4176.10111.4
335N84Confident87.3Confident96 Ų9663.6 Ų63.651%0.51333%0.325SS..  trans-96.7108.3168.3-176.813.7000109S333 S337S333-N335 WeakPolarHBondContact CB-O 3.33Å; S333-N335 PolarHBondContact OG-N 3.37Å; S333-N335 PolarHBondContact OG-O 3.09Å; N335-S337 VanDerWaalsContact CG-OG 3.3Å; N335-S337 PolarHBondContact ND2-OG 3.14Å; N335-S337 WeakPolarHBondContact OD1-CB 3.22Å; N335-S337 PolarHBondContact OD1-N 3.01Å; N335-S337 VanDerWaalsContact OD1-N 3.12Å; N335-S337 PolarHBondContact OD1-OG 3.28Å
336N86.3Confident87Confident85 Ų8562.9 Ų62.946%0.45533%0.331SS..  trans-9610.1-179.769.6-29.6000113.5T325 C326 A338T325-N336 CarbonylContact C-O 3.54Å; T325-N336 WeakPolarHBondContact CA-O 3.46Å; C326-N336 PolarHBondContact N-O 3.29Å; N336-A338 PolarHBondContact O-N 2.96Å
337S87.2Confident86.8Confident53 Ų5362.2 Ų62.237%0.37133%0.326SS..BIsolated β-bridgetrans-57.2128.3170.9630000110.6L324 N335 C359L324-S337 WeakPolarHBondContact O-CA 3.46Å; N335-S337 VanDerWaalsContact CG-OG 3.3Å; N335-S337 PolarHBondContact ND2-OG 3.14Å; N335-S337 WeakPolarHBondContact OD1-CB 3.22Å; N335-S337 PolarHBondContact OD1-N 3.01Å; N335-S337 VanDerWaalsContact OD1-N 3.12Å; N335-S337 PolarHBondContact OD1-OG 3.28Å; S337-C359 VanDerWaalsContact O-CA 3.24Å; S337-C359 WeakPolarHBondContact O-CA 3.4Å; S337-C359 WeakPolarHBondContact O-CB 3.28Å
338A86.2Confident86.7Confident7 Ų758.8 Ų58.86%0.05831%0.311CS..  trans-81.7124.8175.200000110.8L324 N336 R357 L358L324-A338 PolarHBondContact O-N 2.9Å; N336-A338 PolarHBondContact O-N 2.96Å; A338-R357 HydrophobicContact CB-CB 3.72Å; A338-R357 HydrophobicContact CB-CG 4.33Å; A338-R357 PolarHBondContact O-NH2 3.44Å; A338-L358 CarbonylContact C-O 3.6Å; A338-L358 WeakPolarHBondContact CA-O 3.24Å
339S85.2Confident86.5Confident27 Ų2766.5 Ų66.519%0.18934%0.34CS..  trans-112.2-22178.950.10000113.5L358 E360 S426S339-L358 PolarHBondContact N-O 3.29Å; S339-E360 PolarHBondContact OG-N 2.75Å; S339-S426 WeakPolarHBondContact O-CA 3.4Å; S339-S426 WeakPolarHBondContact O-CB 3.47Å; S339-S426 PolarHBondContact O-N 3.46Å
340V88.6Confident86.2Confident5 Ų561.1 Ų61.13%0.0332%0.319CS..EExtended strand (participates in β ladder)trans-126.3131.9-175177.20000110.6L358 H363 Y423 Q424V340-L358 PolarHBondContact N-O 3.39Å; V340-L358 PolarHBondContact O-N 2.74Å; V340-H363 HydrophobicContact CB-CB 4.18Å; V340-H363 HydrophobicContact CG1-CB 4.43Å; V340-H363 HydrophobicContact CG2-CB 4.3Å; V340-Y423 HydrophobicContact CG1-CD2 3.83Å; V340-Y423 HydrophobicContact CG1-CG 3.97Å; V340-Q424 WeakPolarHBondContact CA-O 3.1Å
341T90.7Very high86.1Confident9 Ų958.2 Ų58.26%0.05530%0.301CS..EExtended strand (participates in β ladder)trans-107.5112.4178.3-51.80000109.7W343 A355 R357 Y423 Q424T341-W343 HydrophobicContact CG2-CZ2 4.32Å; T341-A355 HydrophobicContact CG2-CB 3.92Å; T341-R357 HydrophobicContact CG2-CG 3.97Å; T341-R357 WeakPolarHBondContact OG1-CG 3.25Å; T341-R357 PolarHBondContact OG1-NH1 3Å; T341-R357 VanDerWaalsContact OG1-NH1 3.13Å; T341-Y423 CarbonylContact O-C 3.55Å; T341-Y423 VanDerWaalsContact O-CA 3.28Å; T341-Y423 WeakPolarHBondContact O-CA 3.43Å; T341-Q424 PolarHBondContact N-O 3.03Å; T341-Q424 PolarHBondContact O-N 3.49Å
342C91.3Very high85.8Confident0 Ų058.1 Ų58.10%031%0.307CS..EExtended strand (participates in β ladder)trans-91.5132.8178.9-166.10000111.8C347 T348 A355 I356 H367 I422C342-C347 HydrophobicContact CB-CB 4.09Å; C342-C347 VanDerWaalsContact SG-CB 3.59Å; C342-T348 WeakPolarHBondContact O-CG2 3.43Å; C342-A355 WeakPolarHBondContact O-CA 2.93Å; C342-I356 HydrophobicContact CB-CG2 3.87Å; C342-I356 PolarHBondContact N-O 2.93Å; C342-I356 PolarHBondContact O-N 3.32Å; C342-H367 PolarHBondContact SG-CE1 2.94Å; C342-H367 PolarHBondContact SG-NE2 3.13Å; C342-I422 PolarHBondContact SG-O 3.41Å; C342-I422 VanDerWaalsContact SG-O 3.34Å
343W90Very high85.8Confident7 Ų747 Ų473%0.02727%0.266CS..  trans-110-14.1178.1-62.379000112.6E195 M198 Y230 L316 T341 T345 A355 I422E195-W343 HydrophobicContact CB-CH2 4.17Å; E195-W343 HydrophobicContact CB-CZ3 3.9Å; E195-W343 HydrophobicContact CG-CH2 3.76Å; E195-W343 HydrophobicContact CG-CZ3 3.96Å; M198-W343 HydrophobicContact CB-CD2 3.77Å; M198-W343 HydrophobicContact CB-CE3 4.01Å; M198-W343 HydrophobicContact CB-CG 4.38Å; M198-W343 HydrophobicContact CB-CH2 4.07Å; M198-W343 HydrophobicContact CB-CZ2 3.77Å; M198-W343 HydrophobicContact CB-CZ3 4.16Å; M198-W343 HydrophobicContact CG-CH2 4.43Å; M198-W343 HydrophobicContact CG-CZ2 4.08Å; M198-W343 HydrophobicContact SD-CZ2 4.46Å; Y230-W343 HydrophobicContact CD1-CZ2 4.22Å; Y230-W343 HydrophobicContact CE1-CH2 4.09Å; Y230-W343 HydrophobicContact CE1-CZ2 4.19Å; L316-W343 HydrophobicContact CD1-CB 4.2Å; L316-W343 HydrophobicContact CD1-CE3 3.71Å; L316-W343 WeakPolarHBondContact CD1-O 2.94Å; T341-W343 HydrophobicContact CG2-CZ2 4.32Å; W343-T345 PolarHBondContact O-N 3.12Å; W343-A355 HydrophobicContact CD2-CB 3.72Å; W343-A355 HydrophobicContact CE3-CB 3.85Å; W343-A355 HydrophobicContact CG-CB 4.38Å; W343-A355 HydrophobicContact CH2-CB 3.82Å; W343-A355 HydrophobicContact CZ2-CB 3.75Å; W343-A355 HydrophobicContact CZ3-CB 3.89Å; W343-I422 PolarHBondContact N-O 3.36Å
344S87.2Confident85.9Confident14 Ų1448.1 Ų48.110%0.09827%0.265CS..  trans-53.7131.6172.8174.20000112.7G346 C347 T348 I422S344-G346 VanDerWaalsContact C-N 3.28Å; S344-G346 PolarHBondContact O-N 3.23Å; S344-C347 PolarHBondContact O-N 2.98Å; S344-T348 WeakPolarHBondContact O-CG2 3.39Å; S344-T348 PolarHBondContact O-N 3.17Å; S344-T348 PolarHBondContact O-OG1 3.05Å; S344-I422 PolarHBondContact N-O 2.98Å
345T83.4Confident86.1Confident58 Ų5838 Ų3836%0.35622%0.222SC..Hα-helixtrans-53.6-40.5-177.948.10000113.1D314 L316 W343 C347 T348 Y349D314-T345 HydrophobicContact CB-CG2 3.95Å; D314-T345 WeakPolarHBondContact O-CG2 3.42Å; L316-T345 HydrophobicContact CD2-CG2 4.49Å; W343-T345 PolarHBondContact O-N 3.12Å; T345-C347 PolarHBondContact O-N 3.09Å; T345-T348 WeakPolarHBondContact CA-OG1 3.27Å; T345-T348 PolarHBondContact O-N 2.96Å; T345-T348 PolarHBondContact O-OG1 3.37Å; T345-Y349 PolarHBondContact O-N 3.17Å; T345-Y349 VanDerWaalsContact O-N 3.11Å
346G82Confident86.3Confident54 Ų5433.5 Ų33.556%0.55720%0.198SC*.Hα-helixtrans-61.6-23.5177.100000114.2S344S344-G346 VanDerWaalsContact C-N 3.28Å; S344-G346 PolarHBondContact O-N 3.23Å
347C85.9Confident86.5Confident2 Ų229.7 Ų29.71%0.01418%0.177CC..Hα-helixtrans-95.4-41172.3-102.80000112.8C342 S344 T345 Y349 L350 I356 R366C342-C347 HydrophobicContact CB-CB 4.09Å; C342-C347 VanDerWaalsContact SG-CB 3.59Å; S344-C347 PolarHBondContact O-N 2.98Å; T345-C347 PolarHBondContact O-N 3.09Å; C347-Y349 VanDerWaalsContact C-N 3.27Å; C347-Y349 PolarHBondContact O-N 3.01Å; C347-L350 PolarHBondContact O-N 3.5Å; C347-I356 HydrophobicContact CB-CG2 3.85Å; C347-R366 PolarHBondContact SG-NH1 3.17Å
348T86.7Confident86.7Confident0 Ų027.1 Ų27.10%016%0.159CC..Hα-helixtrans-71.2-16.6-175.461.90000114.1L316 C342 S344 T345 L350 T351 G352 N353 R354L316-T348 HydrophobicContact CD2-CG2 3.94Å; L316-T348 WeakPolarHBondContact CD2-OG1 3.29Å; C342-T348 WeakPolarHBondContact O-CG2 3.43Å; S344-T348 WeakPolarHBondContact O-CG2 3.39Å; S344-T348 PolarHBondContact O-N 3.17Å; S344-T348 PolarHBondContact O-OG1 3.05Å; T345-T348 WeakPolarHBondContact CA-OG1 3.27Å; T345-T348 PolarHBondContact O-N 2.96Å; T345-T348 PolarHBondContact O-OG1 3.37Å; T348-L350 PolarHBondContact O-N 2.7Å; T348-T351 PolarHBondContact O-N 2.85Å; T348-T351 PolarHBondContact O-OG1 3.38Å; T348-G352 PolarHBondContact O-N 3.43Å; T348-N353 VanDerWaalsContact O-CA 3.32Å; T348-N353 WeakPolarHBondContact O-CA 3.2Å; T348-N353 PolarHBondContact O-N 3.47Å; T348-R354 WeakPolarHBondContact CA-O 3.49Å; T348-R354 WeakPolarHBondContact CB-O 3.19Å; T348-R354 VanDerWaalsContact CG2-O 3.22Å; T348-R354 WeakPolarHBondContact CG2-O 3.45Å; T348-R354 PolarHBondContact O-N 3.44Å
349Y82.9Confident86.9Confident170 Ų17026.9 Ų26.967%0.66716%0.157SC*.G310 helixtrans-52.3-38170.1-177.4-99.9000112.7T345 C347 T351 G352T345-Y349 PolarHBondContact O-N 3.17Å; T345-Y349 VanDerWaalsContact O-N 3.11Å; C347-Y349 VanDerWaalsContact C-N 3.27Å; C347-Y349 PolarHBondContact O-N 3.01Å; Y349-T351 PolarHBondContact O-N 2.91Å; Y349-G352 PolarHBondContact O-N 2.78Å
350L80.7Confident87Confident69 Ų6932.2 Ų32.236%0.36118%0.179SC..G310 helixtrans-67.5-21.7-175.8-62.7173000114.4K329 C347 T348 I356K329-L350 PolarHBondContact NZ-O 3.28Å; C347-L350 PolarHBondContact O-N 3.5Å; T348-L350 PolarHBondContact O-N 2.7Å; L350-I356 HydrophobicContact CB-CD1 4.31Å
351T83.2Confident87Confident43 Ų4335.7 Ų35.726%0.26420%0.197SC..G310 helixtrans-104.81.6177.232.70000112.3T348 Y349 R354 I356T348-T351 PolarHBondContact O-N 2.85Å; T348-T351 PolarHBondContact O-OG1 3.38Å; Y349-T351 PolarHBondContact O-N 2.91Å; T351-R354 PolarHBondContact OG1-O 3.47Å; T351-I356 HydrophobicContact CG2-CB 3.97Å; T351-I356 HydrophobicContact CG2-CD1 3.98Å; T351-I356 HydrophobicContact CG2-CG1 3.79Å
352G82.2Confident87Confident37 Ų3735.7 Ų35.738%0.38120%0.197SC..THydrogen-bonded Turntrans80.457.9-178.300000112.3T348 Y349 R354T348-G352 PolarHBondContact O-N 3.43Å; Y349-G352 PolarHBondContact O-N 2.78Å; G352-R354 VanDerWaalsContact C-N 3.28Å; G352-R354 PolarHBondContact O-N 3.21Å
353N85.5Confident86.8Confident4 Ų436.7 Ų36.72%0.02120%0.202CC..SBendtrans53.238.5-176-65.829000113.4M275 I315 L316 L317 T348M275-N353 PolarHBondContact O-ND2 2.95Å; I315-N353 WeakPolarHBondContact O-CB 3.41Å; I315-N353 PolarHBondContact O-ND2 2.68Å; L316-N353 CarbonylContact C-O 3.58Å; L316-N353 WeakPolarHBondContact CA-O 3.48Å; L317-N353 HydrophobicContact CG-CB 4.35Å; L317-N353 PolarHBondContact N-O 3.01Å; T348-N353 VanDerWaalsContact O-CA 3.32Å; T348-N353 WeakPolarHBondContact O-CA 3.2Å; T348-N353 PolarHBondContact O-N 3.47Å
354R88.8Confident86.7Confident53 Ų5337.6 Ų37.620%0.221%0.21CC..SBendtrans-119.5144.3178.6-71.5160.1176-71.8-23.9109.7L317 P318 T348 T351 G352 I356L317-R354 HydrophobicContact CB-CG 4.27Å; P318-R354 VanDerWaalsContact O-CZ 3.3Å; P318-R354 PolarHBondContact O-NH1 2.9Å; P318-R354 PolarHBondContact O-NH2 2.83Å; T348-R354 WeakPolarHBondContact CA-O 3.49Å; T348-R354 WeakPolarHBondContact CB-O 3.19Å; T348-R354 VanDerWaalsContact CG2-O 3.22Å; T348-R354 WeakPolarHBondContact CG2-O 3.45Å; T348-R354 PolarHBondContact O-N 3.44Å; T351-R354 PolarHBondContact OG1-O 3.47Å; G352-R354 VanDerWaalsContact C-N 3.28Å; G352-R354 PolarHBondContact O-N 3.21Å; R354-I356 PolarHBondContact O-N 3.07Å
355A89.2Confident86.6Confident6 Ų642 Ų425%0.0523%0.232CC..  trans-46.1131.8173.100000110.5T319 T341 C342 W343T319-A355 HydrophobicContact CG2-CB 4.23Å; T341-A355 HydrophobicContact CG2-CB 3.92Å; C342-A355 WeakPolarHBondContact O-CA 2.93Å; W343-A355 HydrophobicContact CD2-CB 3.72Å; W343-A355 HydrophobicContact CE3-CB 3.85Å; W343-A355 HydrophobicContact CG-CB 4.38Å; W343-A355 HydrophobicContact CH2-CB 3.82Å; W343-A355 HydrophobicContact CZ2-CB 3.75Å; W343-A355 HydrophobicContact CZ3-CB 3.89Å
356I90Very high86.6Confident1 Ų142.7 Ų42.71%0.00523%0.228CC..EExtended strand (participates in β ladder)trans-112.9126.1-174.1-175.9174.1000110.6E327 C342 C347 L350 T351 R354 L358E327-I356 HydrophobicContact CB-CG1 4.15Å; C342-I356 HydrophobicContact CB-CG2 3.87Å; C342-I356 PolarHBondContact N-O 2.93Å; C342-I356 PolarHBondContact O-N 3.32Å; C347-I356 HydrophobicContact CB-CG2 3.85Å; L350-I356 HydrophobicContact CB-CD1 4.31Å; T351-I356 HydrophobicContact CG2-CB 3.97Å; T351-I356 HydrophobicContact CG2-CD1 3.98Å; T351-I356 HydrophobicContact CG2-CG1 3.79Å; R354-I356 PolarHBondContact O-N 3.07Å; I356-L358 HydrophobicContact CD1-CD2 4.2Å; I356-L358 HydrophobicContact CG1-CD2 4.18Å
357R90.3Very high86.6Confident4 Ų440.8 Ų40.82%0.01520%0.204CC..EExtended strand (participates in β ladder)trans-91.4126178.5-93.3-172.185.4106.2-0.4112.8Y230 E233 S323 C326 E327 A338 T341Y230-R357 PolarHBondContact O-NH1 3.37Å; E233-R357 IonicContact OE2-CZ 2.7Å; E233-R357 IonicContact OE2-NH1 3.1Å; E233-R357 IonicContact OE2-NH2 3.79Å; E233-R357 PolarHBondContact OE2-NH2 3.18Å; S323-R357 VanDerWaalsContact O-CD 3.31Å; S323-R357 WeakPolarHBondContact O-CD 3.34Å; S323-R357 PolarHBondContact O-NE 3.41Å; C326-R357 WeakPolarHBondContact CA-O 3.44Å; E327-R357 HydrophobicContact CG-CB 4.39Å; E327-R357 PolarHBondContact N-O 3.46Å; E327-R357 PolarHBondContact OE2-N 3.31Å; A338-R357 HydrophobicContact CB-CB 3.72Å; A338-R357 HydrophobicContact CB-CG 4.33Å; A338-R357 PolarHBondContact O-NH2 3.44Å; T341-R357 HydrophobicContact CG2-CG 3.97Å; T341-R357 WeakPolarHBondContact OG1-CG 3.25Å; T341-R357 PolarHBondContact OG1-NH1 3Å; T341-R357 VanDerWaalsContact OG1-NH1 3.13Å
358L89.9Confident86Confident0 Ų044.2 Ų44.20%022%0.222CC..EExtended strand (participates in β ladder)trans-117.7140.9-174.8-58.2178.3000110.1A338 S339 V340 I356 C362 H363A338-L358 CarbonylContact C-O 3.6Å; A338-L358 WeakPolarHBondContact CA-O 3.24Å; S339-L358 PolarHBondContact N-O 3.29Å; V340-L358 PolarHBondContact N-O 3.39Å; V340-L358 PolarHBondContact O-N 2.74Å; I356-L358 HydrophobicContact CD1-CD2 4.2Å; I356-L358 HydrophobicContact CG1-CD2 4.18Å; L358-C362 HydrophobicContact CB-CB 4.22Å; L358-C362 HydrophobicContact CD2-CB 4.2Å; L358-H363 HydrophobicContact CB-CB 4.37Å
359C91.6Very high84.8Confident2 Ų250.3 Ų50.31%0.01425%0.245CC..  trans-74.5155.5160.465.80000109.4C326 C331 S337 L361 C362 H363C326-C359 HydrophobicContact CB-CB 3.87Å; C326-C359 PolarHBondContact SG-N 2.97Å; C326-C359 VanDerWaalsContact SG-N 3.36Å; C331-C359 VanDerWaalsContact SG-SG 3.66Å; S337-C359 VanDerWaalsContact O-CA 3.24Å; S337-C359 WeakPolarHBondContact O-CA 3.4Å; S337-C359 WeakPolarHBondContact O-CB 3.28Å; C359-L361 PolarHBondContact O-N 2.68Å; C359-C362 CarbonylContact O-C 3.56Å; C359-C362 WeakPolarHBondContact O-CA 3.2Å; C359-C362 WeakPolarHBondContact O-CB 3.4Å; C359-C362 PolarHBondContact O-N 3.26Å; C359-C362 VanDerWaalsContact SG-SG 3.63Å; C359-H363 PolarHBondContact O-N 3.24Å
360E87.1Confident83.6Confident138 Ų13845.3 Ų45.365%0.64523%0.234SC*.Hα-helixtrans-39.1-56.7178.6-171.9-174.6-176.200113.6S339 C362 H363 S364S339-E360 PolarHBondContact OG-N 2.75Å; E360-C362 VanDerWaalsContact C-N 3.27Å; E360-C362 PolarHBondContact O-N 3Å; E360-H363 CarbonylContact O-C 3.56Å; E360-H363 WeakPolarHBondContact O-CA 3.41Å; E360-H363 WeakPolarHBondContact O-CB 3.38Å; E360-H363 PolarHBondContact O-N 3.33Å; E360-S364 PolarHBondContact O-N 2.86Å; E360-S364 PolarHBondContact O-OG 3.31Å; E360-S364 VanDerWaalsContact O-OG 3.1Å
361L89.3Confident82.1Confident79 Ų7947.6 Ų47.641%0.41425%0.246SC..Hα-helixtrans-56.6-36.7177.9-18063.2000113.7C359 L365C359-L361 PolarHBondContact O-N 2.68Å; L361-L365 HydrophobicContact CD1-CD1 4.1Å; L361-L365 HydrophobicContact CD1-CG 4.34Å; L361-L365 HydrophobicContact CG-CD1 4.09Å; L361-L365 WeakPolarHBondContact O-CB 3.22Å; L361-L365 WeakPolarHBondContact O-CD1 3.19Å; L361-L365 WeakPolarHBondContact O-CG 3.42Å; L361-L365 PolarHBondContact O-N 2.75Å
362C89.7Confident80.2Confident8 Ų851 Ų515%0.05426%0.262CS..Hα-helixtrans-77.1-25.1176.2-71.40000112.6L358 C359 E360 R366L358-C362 HydrophobicContact CB-CB 4.22Å; L358-C362 HydrophobicContact CD2-CB 4.2Å; C359-C362 CarbonylContact O-C 3.56Å; C359-C362 WeakPolarHBondContact O-CA 3.2Å; C359-C362 WeakPolarHBondContact O-CB 3.4Å; C359-C362 PolarHBondContact O-N 3.26Å; C359-C362 VanDerWaalsContact SG-SG 3.63Å; E360-C362 VanDerWaalsContact C-N 3.27Å; E360-C362 PolarHBondContact O-N 3Å; C362-R366 WeakPolarHBondContact O-CB 3.46Å; C362-R366 VanDerWaalsContact O-CD 3.3Å; C362-R366 WeakPolarHBondContact O-CD 3.14Å; C362-R366 WeakPolarHBondContact O-CG 3.37Å
363H87.6Confident78Confident21 Ų2155 Ų5510%0.09727%0.274CS..Hα-helixtrans-72-50.3171162.941.5000110.8V340 L358 C359 E360 L365 R366 H367 Y423V340-H363 HydrophobicContact CB-CB 4.18Å; V340-H363 HydrophobicContact CG1-CB 4.43Å; V340-H363 HydrophobicContact CG2-CB 4.3Å; L358-H363 HydrophobicContact CB-CB 4.37Å; C359-H363 PolarHBondContact O-N 3.24Å; E360-H363 CarbonylContact O-C 3.56Å; E360-H363 WeakPolarHBondContact O-CA 3.41Å; E360-H363 WeakPolarHBondContact O-CB 3.38Å; E360-H363 PolarHBondContact O-N 3.33Å; H363-L365 VanDerWaalsContact C-N 3.35Å; H363-L365 PolarHBondContact O-N 3.49Å; H363-R366 PolarHBondContact O-N 3.19Å; H363-H367 AromaticContact CE1-ND1 3.56Å; H363-H367 AromaticContact ND1-CE1 3.91Å; H363-H367 AromaticContact ND1-CG 3.57Å; H363-H367 AromaticContact ND1-ND1 3Å; H363-H367 PolarHBondContact ND1-ND1 2.86Å; H363-H367 PolarHBondContact O-N 3.45Å; H363-Y423 AromaticContact CE1-CE1 3.87Å; H363-Y423 AromaticContact CE1-CE2 3.93Å; H363-Y423 AromaticContact CE1-CZ 3.74Å
364S87.1Confident75.3Confident27 Ų2760.1 Ų60.119%0.18930%0.298CS..Iπ-helixtrans-56.8-48.2178.8-41.80000111.5E360 R366 I368 Y369E360-S364 PolarHBondContact O-N 2.86Å; E360-S364 PolarHBondContact O-OG 3.31Å; E360-S364 VanDerWaalsContact O-OG 3.1Å; S364-R366 PolarHBondContact O-N 2.56Å; S364-R366 VanDerWaalsContact O-N 3.13Å; S364-I368 PolarHBondContact O-N 3.08Å; S364-I368 VanDerWaalsContact O-N 3.11Å; S364-Y369 VanDerWaalsContact O-CD2 3.31Å; S364-Y369 WeakPolarHBondContact O-CD2 3.33Å; S364-Y369 PolarHBondContact O-N 2.92Å
365L85.4Confident72.4Confident107 Ų10762.7 Ų62.756%0.5632%0.322SS*.Iπ-helixtrans-63.2-13177-72.1173.3000114.8L361 H363 Y369L361-L365 HydrophobicContact CD1-CD1 4.1Å; L361-L365 HydrophobicContact CD1-CG 4.34Å; L361-L365 HydrophobicContact CG-CD1 4.09Å; L361-L365 WeakPolarHBondContact O-CB 3.22Å; L361-L365 WeakPolarHBondContact O-CD1 3.19Å; L361-L365 WeakPolarHBondContact O-CG 3.42Å; L361-L365 PolarHBondContact O-N 2.75Å; H363-L365 VanDerWaalsContact C-N 3.35Å; H363-L365 PolarHBondContact O-N 3.49Å; L365-Y369 HydrophobicContact CD2-CD2 4.21Å; L365-Y369 HydrophobicContact CD2-CE2 4.47Å
366R82.5Confident69.6Low72 Ų7268.4 Ų68.427%0.27236%0.361SS..Iπ-helixtrans-113.5-34.5-177.4-76.3177.3165.9-88.1-9.2114.4C347 C362 H363 S364 P370C347-R366 PolarHBondContact SG-NH1 3.17Å; C362-R366 WeakPolarHBondContact O-CB 3.46Å; C362-R366 VanDerWaalsContact O-CD 3.3Å; C362-R366 WeakPolarHBondContact O-CD 3.14Å; C362-R366 WeakPolarHBondContact O-CG 3.37Å; H363-R366 PolarHBondContact O-N 3.19Å; S364-R366 PolarHBondContact O-N 2.56Å; S364-R366 VanDerWaalsContact O-N 3.13Å; R366-P370 WeakPolarHBondContact O-CG 3.41Å
367H82.6Confident66.8Low13 Ų1372.3 Ų72.36%0.0639%0.394CS..Iπ-helixtrans-123.7-12.4-171.2-46158.2000114.1C342 H363 H421 Y423C342-H367 PolarHBondContact SG-CE1 2.94Å; C342-H367 PolarHBondContact SG-NE2 3.13Å; H363-H367 AromaticContact CE1-ND1 3.56Å; H363-H367 AromaticContact ND1-CE1 3.91Å; H363-H367 AromaticContact ND1-CG 3.57Å; H363-H367 AromaticContact ND1-ND1 3Å; H363-H367 PolarHBondContact ND1-ND1 2.86Å; H363-H367 PolarHBondContact O-N 3.45Å; H367-H421 HydrophobicContact CB-CB 4.35Å; H367-H421 AromaticContact CD2-CG 3.58Å; H367-H421 AromaticContact CD2-ND1 3.3Å; H367-H421 PolarHBondContact CD2-ND1 3.21Å; H367-H421 VanDerWaalsContact CD2-ND1 3.3Å; H367-H421 AromaticContact NE2-CG 3.94Å; H367-H421 AromaticContact NE2-ND1 3.26Å; H367-H421 PolarHBondContact NE2-ND1 2.92Å; H367-Y423 HydrophobicContact CB-CD1 4.44Å; H367-Y423 HydrophobicContact CB-CE1 4.2Å; H367-Y423 AromaticContact ND1-CD1 3.39Å; H367-Y423 WeakPolarHBondContact ND1-CD1 3.29Å; H367-Y423 AromaticContact ND1-CE1 3.96Å; H367-Y423 AromaticContact ND1-CG 3.99Å
368I73.4Confident64.1Low75 Ų7578 Ų7839%0.38542%0.424SS..Iπ-helixtrans-106.9-44.8-179.1-55179.7000110.9S364S364-I368 PolarHBondContact O-N 3.08Å; S364-I368 VanDerWaalsContact O-N 3.11Å
369Y61.7Low61.5Low128 Ų12889.6 Ų89.650%0.50247%0.468SS..THydrogen-bonded Turntrans-70.7-19.8179-73.4-67.6000117S364 L365 I372 N373S364-Y369 VanDerWaalsContact O-CD2 3.31Å; S364-Y369 WeakPolarHBondContact O-CD2 3.33Å; S364-Y369 PolarHBondContact O-N 2.92Å; L365-Y369 HydrophobicContact CD2-CD2 4.21Å; L365-Y369 HydrophobicContact CD2-CE2 4.47Å; Y369-I372 HydrophobicContact CD1-CD1 4.45Å; Y369-N373 PolarHBondContact O-ND2 3.11Å
370P58.6Low58.6Low64 Ų6497.1 Ų97.142%0.41651%0.508SS..THydrogen-bonded Turntrans-61.5-51.1173-23.334.6000112.8R366 I372 N373R366-P370 WeakPolarHBondContact O-CG 3.41Å; P370-I372 PolarHBondContact O-N 3.24Å; P370-N373 PolarHBondContact O-N 3.45Å
371D47.6Very low56.1Low118 Ų11898.7 Ų98.763%0.63151%0.513SS*.G310 helixtrans-63.4-29.5-171.5-59.4-17000112.9N373D371-N373 VanDerWaalsContact C-N 3.27Å; D371-N373 PolarHBondContact O-N 3.01Å
372I44.6Very low53.5Low115 Ų115104.8 Ų104.859%0.5954%0.536SS*.G310 helixtrans-72.9-19178.1-59.3173.9000112.1Y369 P370Y369-I372 HydrophobicContact CD1-CD1 4.45Å; P370-I372 PolarHBondContact O-N 3.24Å
373N34.7Very low50.9Low119 Ų119113.2 Ų113.264%0.63658%0.575SS**G310 helixtrans-105.54.4-171.9-74.8-80.3000114.9Y369 P370 D371 P375Y369-N373 PolarHBondContact O-ND2 3.11Å; P370-N373 PolarHBondContact O-N 3.45Å; D371-N373 VanDerWaalsContact C-N 3.27Å; D371-N373 PolarHBondContact O-N 3.01Å; N373-P375 WeakPolarHBondContact O-CD 3.15Å
374Q28.8Very low48.3Very low112 Ų112120.6 Ų120.652%0.52361%0.611SS.*SBendtrans-78.1111.7164.1-77.1-166.9-15.900109.9
375P29.1Very low46Very low108 Ų108126.2 Ų126.270%0.70164%0.64SS**  trans-66.7138.4169.129.9-34.1000109.2N373 A377N373-P375 WeakPolarHBondContact O-CD 3.15Å; P375-A377 HydrophobicContact CB-CB 4.42Å; P375-A377 PolarHBondContact O-N 3.19Å
376S29.9Very low43.6Very low126 Ų126126.3 Ų126.388%0.88164%0.644SS**  trans-73.746.9-17447.40000114.4D378S376-D378 PolarHBondContact O-N 3.29Å
377A30.8Very low41.3Very low83 Ų83129.7 Ų129.769%0.68667%0.668SS**THydrogen-bonded Turntrans-95.618.2-155.200000116.6P375P375-A377 HydrophobicContact CB-CB 4.42Å; P375-A377 PolarHBondContact O-N 3.19Å
378D33.9Very low38.9Very low123 Ų123135.4 Ų135.466%0.65870%0.698SS**THydrogen-bonded Turntrans-137.62.1176-115.6-30.4000116.8S376 N380S376-D378 PolarHBondContact O-N 3.29Å; D378-N380 PolarHBondContact O-N 3.41Å
379R34.5Very low37Very low243 Ų243137 Ų13792%0.91771%0.711SS**THydrogen-bonded Turntrans-69.8-14.4176.7-85.2-170.5174.7-174.1-0.8114.8
380N31.4Very low35.8Very low161 Ų161138 Ų13886%0.86172%0.721SS**THydrogen-bonded Turntrans-113.339-168.3-70.7-13.6000115D378D378-N380 PolarHBondContact O-N 3.41Å
381K35.1Very low34.5Very low170 Ų170141.5 Ų141.574%0.73974%0.736SS**SBendtrans-117.615.2-176.2-146171.1-174171.60115.8
382K35.1Very low33.8Very low207 Ų207142.4 Ų142.490%0.975%0.746SS**SBendtrans-134.427.5-179.5-92.7-171.6178.7176.60116
383Q34.2Very low33.2Very low186 Ų186141.2 Ų141.287%0.86975%0.748SS**  trans-142.3121.1156.3-111.9164.5-7.500109.7
384M33.9Very low33.2Very low175 Ų175142.5 Ų142.586%0.86276%0.755SS**  trans-97.9156.5162.2-83.6-179.3158.100108
385D37.3Very low33.4Very low146 Ų146142.4 Ų142.478%0.78176%0.762SS**  trans67.1125.3179.9-49.5-33.6000113.4
386T35.8Very low33.7Very low108 Ų108143.9 Ų143.966%0.66377%0.769SS**  cis-159.81477.4-10000111.4
387N33.8Very low33.7Very low143 Ų143143.6 Ų143.677%0.76576%0.763SS**  trans62.6149.6148.1-64-24.3000119.9
388L32.9Very low33.7Very low134 Ų134147.3 Ų147.370%0.70277%0.77SS**  cis-172.4125.9-15.5175.572000109.7
389T33.9Very low33.5Very low107 Ų107150.1 Ų150.166%0.65678%0.776SS**  trans62.8160.6161.958.40000118.4
390Q35Very low33.1Very low150 Ų150146.1 Ų146.170%0.70177%0.768SS**  cis-161144.5-7.8-121.1163.825.500111.2
391N31.3Very low33.2Very low137 Ų137145.5 Ų145.573%0.73377%0.77SS**  trans62.6161.7155.4-47.9-27.4000116.9
392T34.7Very low32.8Very low137 Ų137141.8 Ų141.884%0.8476%0.762SS**  cis-144163.46.5-29.90000110.4
393S31.4Very low32.5Very low91 Ų91138.9 Ų138.964%0.63676%0.756SS**  trans-92.9152.917854.70000114
394D35Very low32.4Very low145 Ų145135.4 Ų135.478%0.77575%0.752SS**  -166.3126.1124.9-96.3-30.4000109.9
395T32.6Very low32.2Very low110 Ų110133.2 Ų133.268%0.67575%0.749SS**  82.1105.669-57.10000113.6
396T34.4Very low31.8Very low139 Ų139137.2 Ų137.285%0.85375%0.753SS**  -168.7143126.8-750000110.3
397T30.3Very low31.6Very low121 Ų121138.8 Ų138.874%0.74276%0.756SS**  trans-112.4149.3-171.453.80000113.6
398L31.5Very low31.3Very low160 Ų160138.3 Ų138.384%0.83875%0.754SS**  trans-175.2149.1149.2-124.169.5000108.1
399F30.3Very low31.1Very low182 Ų182138.2 Ų138.280%0.79875%0.754SS**  cis-148.8128.9-13.8-151.1-45.8000107.2
400E25.7Very low30.9Very low159 Ų159138.9 Ų138.974%0.74375%0.754SS**  trans-81.8146.9173.7-71.7-173.110500113.7T402E400-T402 HydrophobicContact CB-CG2 4.45Å
401V33.1Very low30.5Very low148.5 Ų148.5138.1 Ų138.190%0.975%0.754SS**  trans-135.3119.7152.6-178.30000108.6
402T26.7Very low30.4Very low91.5 Ų91.5139.3 Ų139.356%0.56176%0.76SS**  trans-108.6158.4-175.646.80000112.8E400E400-T402 HydrophobicContact CB-CG2 4.45Å
403N28.2Very low30.1Very low146 Ų146140.3 Ų140.378%0.78176%0.761SS**  trans68.3140.2162.9-52.7-43.2000117.5
404S32.8Very low30.1Very low114 Ų114145.3 Ų145.380%0.79777%0.774SS**  -160.1154.470.4-69.70000114.1
405T29.9Very low29.7Very low128.5 Ų128.5145.7 Ų145.779%0.78878%0.776SS**  trans-26122.2172.33.20000115.3
406R28Very low29.5Very low229 Ų229147.2 Ų147.286%0.86478%0.78SS**  147.5113.3100.6-141.1-172.1-173.5-178.93.5110.2
407I31.9Very low29.4Very low142 Ų142148.2 Ų148.273%0.72878%0.775SS**  128.7114.391.3-75.8161.3000110.8
408N27.5Very low29.6Very low133 Ų133146.8 Ų146.871%0.71177%0.77SS**  trans19138.2152.1-56.427.4000117.9
409N30Very low30.6Very low132 Ų132143.6 Ų143.671%0.70676%0.757SS**  -166.7159.753.9-112.45.4000113
410D29.3Very low32.3Very low122 Ų122139.7 Ų139.765%0.65275%0.748SS**  trans45.4114.6145.7-64.8-13.5000122.8
411N26.7Very low35Very low132 Ų132134.2 Ų134.271%0.70672%0.722SS**  trans48.4105.8131.6-43.9-48000119.9
412N29.4Very low37.4Very low162 Ų162129.7 Ų129.787%0.86669%0.692SS**  -167.5148115.6-87.7-39.6000110.1
413D27.1Very low40.2Very low159.5 Ų159.5129.4 Ų129.485%0.85368%0.682SS**  trans-79.5129.7170.8-46.5-89.3000110.6
414E30.8Very low43Very low195 Ų195123 Ų12391%0.91165%0.647SS**  trans-150.2148.9148.7-76.6-154.6155.600108.9
415D28.4Very low45.5Very low153 Ų153119.4 Ų119.482%0.81862%0.622SS**  trans-74.4131.6-164.6-63.5-74.6000114.9H417D415-H417 VanDerWaalsContact C-N 3.28Å; D415-H417 PolarHBondContact O-N 3.31Å
416D27Very low48.1Very low141.5 Ų141.5115.6 Ų115.676%0.75760%0.6SS**  trans-113.390.5163.7-158.75.9000112.3S418D416-S418 VanDerWaalsContact C-N 3.33Å; D416-S418 PolarHBondContact O-N 3.17Å
417H32.9Very low50.9Low161.5 Ų161.5104.9 Ų104.975%0.74856%0.56SS**  trans-76.882.2175.1-79.7-29.6000111.1D415 T419D415-H417 VanDerWaalsContact C-N 3.28Å; D415-H417 PolarHBondContact O-N 3.31Å; H417-T419 VanDerWaalsContact C-N 3.31Å; H417-T419 HydrophobicContact CB-CG2 4.15Å; H417-T419 PolarHBondContact O-N 3.18Å
418S34.6Very low53.4Low91 Ų91100.1 Ų100.164%0.63654%0.539SS*.  trans-67.377.6164.357.80000110.4D416 T420D416-S418 VanDerWaalsContact C-N 3.33Å; D416-S418 PolarHBondContact O-N 3.17Å; S418-T420 PolarHBondContact O-N 3.09Å
419T51.4Low56.2Low93.5 Ų93.595.3 Ų95.357%0.57451%0.513SS*.  trans-68.1102.9-174.455.30000111H417 H421H417-T419 VanDerWaalsContact C-N 3.31Å; H417-T419 HydrophobicContact CB-CG2 4.15Å; H417-T419 PolarHBondContact O-N 3.18Å; T419-H421 PolarHBondContact O-CD2 3.12Å; T419-H421 PolarHBondContact O-N 3.07Å
420T67.3Low58.9Low98.5 Ų98.589 Ų8960%0.60448%0.479SS*.PPolyproline II helixtrans-62.1115.2173.557.50000109.8S418 I422S418-T420 PolarHBondContact O-N 3.09Å; T420-I422 PolarHBondContact O-N 3.04Å
421H81.1Confident61.6Low43.5 Ų43.584.8 Ų84.820%0.20145%0.454CS..PPolyproline II helixtrans-66.6121.6-175.4-91.2-126.9000111H367 T419 Y423H367-H421 HydrophobicContact CB-CB 4.35Å; H367-H421 AromaticContact CD2-CG 3.58Å; H367-H421 AromaticContact CD2-ND1 3.3Å; H367-H421 PolarHBondContact CD2-ND1 3.21Å; H367-H421 VanDerWaalsContact CD2-ND1 3.3Å; H367-H421 AromaticContact NE2-CG 3.94Å; H367-H421 AromaticContact NE2-ND1 3.26Å; H367-H421 PolarHBondContact NE2-ND1 2.92Å; T419-H421 PolarHBondContact O-CD2 3.12Å; T419-H421 PolarHBondContact O-N 3.07Å; H421-Y423 HydrophobicContact CB-CD1 4.36Å; H421-Y423 WeakPolarHBondContact O-CD1 3.4Å; H421-Y423 WeakPolarHBondContact O-CE1 3.47Å; H421-Y423 PolarHBondContact O-N 3.17Å
422I84.1Confident64.4Low54 Ų5483.2 Ų83.228%0.27745%0.446SS..PPolyproline II helixtrans-76.8120.8169.1-59.1175000108.5S199 C342 W343 S344 T420S199-I422 VanDerWaalsContact O-CD1 3.25Å; S199-I422 WeakPolarHBondContact O-CD1 3.07Å; C342-I422 PolarHBondContact SG-O 3.41Å; C342-I422 VanDerWaalsContact SG-O 3.34Å; W343-I422 PolarHBondContact N-O 3.36Å; S344-I422 PolarHBondContact N-O 2.98Å; T420-I422 PolarHBondContact O-N 3.04Å
423Y85.7Confident67Low85 Ų8576.3 Ų76.333%0.33341%0.408SS..EExtended strand (participates in β ladder)trans-140.9158.3176.258.7-98.6000111.1V340 T341 H363 H367 H421V340-Y423 HydrophobicContact CG1-CD2 3.83Å; V340-Y423 HydrophobicContact CG1-CG 3.97Å; T341-Y423 CarbonylContact O-C 3.55Å; T341-Y423 VanDerWaalsContact O-CA 3.28Å; T341-Y423 WeakPolarHBondContact O-CA 3.43Å; H363-Y423 AromaticContact CE1-CE1 3.87Å; H363-Y423 AromaticContact CE1-CE2 3.93Å; H363-Y423 AromaticContact CE1-CZ 3.74Å; H367-Y423 HydrophobicContact CB-CD1 4.44Å; H367-Y423 HydrophobicContact CB-CE1 4.2Å; H367-Y423 AromaticContact ND1-CD1 3.39Å; H367-Y423 WeakPolarHBondContact ND1-CD1 3.29Å; H367-Y423 AromaticContact ND1-CE1 3.96Å; H367-Y423 AromaticContact ND1-CG 3.99Å; H421-Y423 HydrophobicContact CB-CD1 4.36Å; H421-Y423 WeakPolarHBondContact O-CD1 3.4Å; H421-Y423 WeakPolarHBondContact O-CE1 3.47Å; H421-Y423 PolarHBondContact O-N 3.17Å
424Q87.6Confident69.8Low13.5 Ų13.571.3 Ų71.36%0.06339%0.386CS..EExtended strand (participates in β ladder)trans-112.6113.9176.7-121.1-103.5-32.100107.3M198 K201 W231 V340 T341M198-Q424 PolarHBondContact O-NE2 3.32Å; M198-Q424 VanDerWaalsContact O-NE2 3.08Å; M198-Q424 HydrophobicContact SD-CG 3.66Å; K201-Q424 PolarHBondContact O-NE2 3.19Å; W231-Q424 HydrophobicContact CZ2-CB 3.89Å; W231-Q424 HydrophobicContact CZ2-CG 4.24Å; V340-Q424 WeakPolarHBondContact CA-O 3.1Å; T341-Q424 PolarHBondContact N-O 3.03Å; T341-Q424 PolarHBondContact O-N 3.49Å
425S84.9Confident72.2Confident38 Ų3868.8 Ų68.827%0.26638%0.377SS..PPolyproline II helixtrans-74166.3176.460.50000111.6D203 Y205 W231D203-S425 PolarHBondContact OD1-OG 2.86Å; Y205-S425 WeakPolarHBondContact CE1-OG 3.46Å; W231-S425 PolarHBondContact NE1-O 3.49Å
426S83.9Confident74.8Confident47.5 Ų47.566.8 Ų66.833%0.33237%0.366SS..PPolyproline II helixtrans-61.7146.616054.20000110.4E233 S339 P428E233-S426 WeakPolarHBondContact OE1-CA 3.24Å; E233-S426 WeakPolarHBondContact OE1-CB 3.45Å; S339-S426 WeakPolarHBondContact O-CA 3.4Å; S339-S426 WeakPolarHBondContact O-CB 3.47Å; S339-S426 PolarHBondContact O-N 3.46Å; S426-P428 WeakPolarHBondContact O-CD 3.4Å
427L86.6Confident77.5Confident5 Ų560.4 Ų60.43%0.02633%0.333CS..PPolyproline II helixtrans-72.8131.3177.7-117.8120.9000110.6Y205 L209 F227 M441 L599 K603Y205-L427 HydrophobicContact CD2-CD1 3.24Å; Y205-L427 HydrophobicContact CE2-CD1 3.52Å; Y205-L427 HydrophobicContact CG-CD1 3.8Å; L209-L427 HydrophobicContact CD1-CD1 4.17Å; F227-L427 HydrophobicContact CE2-CD2 4.34Å; F227-L427 HydrophobicContact CZ-CD2 3.71Å; L427-M441 HydrophobicContact CD1-CE 3.86Å; L427-M441 HydrophobicContact CD2-CE 3.58Å; L427-M441 HydrophobicContact CG-CE 3.68Å; L427-L599 HydrophobicContact CD2-CD2 4.38Å; L427-K603 HydrophobicContact CD2-CD 4.4Å; L427-K603 HydrophobicContact CD2-CG 4.2Å; L427-K603 PolarHBondContact O-NZ 3.31Å
428P85.3Confident80.1Confident42 Ų4254.2 Ų54.227%0.27330%0.304SS..PPolyproline II helixtrans-63166.71723.5-0.8000112.3S426 D432 M433S426-P428 WeakPolarHBondContact O-CD 3.4Å; P428-D432 HydrophobicContact CB-CB 4.19Å; P428-M433 HydrophobicContact CB-CG 4Å; P428-M433 HydrophobicContact CG-CB 3.82Å; P428-M433 HydrophobicContact CG-CG 4.16Å; P428-M433 HydrophobicContact CG-SD 4.41Å
429D85.8Confident82.7Confident30.5 Ų30.552.5 Ų52.516%0.16329%0.291CS..PPolyproline II helixtrans-64.6154.3162.5-73.90.1000109.4W431 D432 M433 R607D429-W431 PolarHBondContact O-N 3.11Å; D429-D432 PolarHBondContact O-N 2.9Å; D429-M433 PolarHBondContact O-N 3Å; D429-R607 IonicContact OD2-CZ 3.32Å; D429-R607 IonicContact OD2-NE 2.71Å; D429-R607 IonicContact OD2-NH2 3.64Å; D429-R607 PolarHBondContact OD2-NH2 2.9Å
430V86.1Confident84.6Confident0 Ų051.5 Ų51.50%028%0.277CS..G310 helixtrans-54.1-34.4-176.5-178.50000112.3D432 Q438 M441 I442 K603 C604V430-D432 VanDerWaalsContact C-N 3.35Å; V430-Q438 HydrophobicContact CG1-CG 4.02Å; V430-Q438 PolarHBondContact O-NE2 3.44Å; V430-M441 HydrophobicContact CB-SD 4.15Å; V430-M441 HydrophobicContact CG2-CG 4.15Å; V430-M441 HydrophobicContact CG2-SD 3.48Å; V430-M441 WeakPolarHBondContact CG2-SD 3.23Å; V430-I442 HydrophobicContact CG1-CD1 3.87Å; V430-I442 HydrophobicContact CG1-CG1 3.79Å; V430-K603 HydrophobicContact CG2-CB 4.24Å; V430-K603 VanDerWaalsContact CG2-O 3.29Å; V430-K603 WeakPolarHBondContact CG2-O 3.23Å; V430-K603 PolarHBondContact N-O 3.07Å; V430-K603 VanDerWaalsContact N-O 3.11Å; V430-C604 HydrophobicContact CG2-CB 4.25Å; V430-C604 VanDerWaalsContact CG2-SG 3.54Å; V430-C604 WeakPolarHBondContact CG2-SG 3.31Å
431W86.9Confident85.7Confident35 Ų3546.9 Ų46.913%0.13325%0.249CC..G310 helixtrans-78.5-18-177.1-42120000114.2D429 R605 I610 L614 L615D429-W431 PolarHBondContact O-N 3.11Å; W431-R605 PolarHBondContact NE1-O 3.24Å; W431-I610 HydrophobicContact CD2-CB 4.15Å; W431-I610 HydrophobicContact CD2-CG2 3.61Å; W431-I610 HydrophobicContact CE3-CB 4.07Å; W431-I610 HydrophobicContact CE3-CG2 4.05Å; W431-I610 HydrophobicContact CG-CG2 3.94Å; W431-I610 HydrophobicContact CH2-CB 4.15Å; W431-I610 HydrophobicContact CH2-CD1 4.4Å; W431-I610 HydrophobicContact CH2-CG2 4.39Å; W431-I610 HydrophobicContact CZ2-CB 4.23Å; W431-I610 HydrophobicContact CZ2-CD1 4.22Å; W431-I610 HydrophobicContact CZ2-CG2 3.99Å; W431-I610 HydrophobicContact CZ3-CB 4.07Å; W431-I610 HydrophobicContact CZ3-CG2 4.41Å; W431-L614 HydrophobicContact CZ3-CB 4.24Å; W431-L615 HydrophobicContact CH2-CB 4.12Å
432D85.9Confident86.2Confident98 Ų9845 Ų4552%0.52424%0.24SC..G310 helixtrans-102.21.3179.5-57-37.6000112.5P428 D429 V430 R607P428-D432 HydrophobicContact CB-CB 4.19Å; D429-D432 PolarHBondContact O-N 2.9Å; V430-D432 VanDerWaalsContact C-N 3.35Å; D432-R607 VanDerWaalsContact CG-NH1 3.35Å; D432-R607 IonicContact OD1-CZ 3.36Å; D432-R607 IonicContact OD1-NH1 3.1Å; D432-R607 PolarHBondContact OD1-NH1 3.34Å; D432-R607 IonicContact OD1-NH2 2.89Å; D432-R607 IonicContact OD2-CZ 3.36Å; D432-R607 IonicContact OD2-NH1 2.75Å; D432-R607 PolarHBondContact OD2-NH1 3.25Å; D432-R607 IonicContact OD2-NH2 3.21Å; D432-R607 PolarHBondContact OD2-NH2 2.94Å
433M84.2Confident86.5Confident17 Ų1744.3 Ų44.38%0.08424%0.236CC..SBendtrans-81.7154178.3-115.5172.158.500111.7L209 P428 D429 S437 M441L209-M433 HydrophobicContact CD1-CE 4.5Å; P428-M433 HydrophobicContact CB-CG 4Å; P428-M433 HydrophobicContact CG-CB 3.82Å; P428-M433 HydrophobicContact CG-CG 4.16Å; P428-M433 HydrophobicContact CG-SD 4.41Å; D429-M433 PolarHBondContact O-N 3Å; M433-S437 VanDerWaalsContact CE-C 3.47Å; M433-S437 VanDerWaalsContact CE-O 3.31Å; M433-S437 WeakPolarHBondContact CE-O 3.34Å; M433-M441 HydrophobicContact CE-CB 3.88Å; M433-M441 HydrophobicContact CE-CE 3.87Å; M433-M441 HydrophobicContact CE-CG 4.34Å; M433-M441 HydrophobicContact CE-SD 3.95Å; M433-M441 HydrophobicContact SD-CB 4.04Å; M433-M441 HydrophobicContact SD-CE 3.63Å; M433-M441 WeakPolarHBondContact SD-CE 3.34Å; M433-M441 HydrophobicContact SD-CG 4.48Å; M433-M441 HydrophobicContact SD-SD 3.67Å; M433-M441 VanDerWaalsContact SD-SD 3.67Å
434S84.4Confident86.8Confident54 Ų5440.2 Ų40.238%0.37822%0.22SC..  trans-57.2144.7171.667.40000111.4D436 S437 Q438S434-D436 WeakPolarHBondContact CB-OD2 3.42Å; S434-D436 PolarHBondContact O-N 3.11Å; S434-D436 VanDerWaalsContact O-N 3.12Å; S434-D436 PolarHBondContact OG-OD2 2.9Å; S434-S437 PolarHBondContact O-N 3.05Å; S434-S437 PolarHBondContact OG-N 2.91Å; S434-S437 PolarHBondContact OG-OG 3.17Å; S434-Q438 PolarHBondContact O-N 3.02Å; S434-Q438 VanDerWaalsContact O-N 3.11Å
435I83.2Confident87.1Confident142 Ų14239.6 Ų39.673%0.72822%0.217SC*.THydrogen-bonded Turntrans-52.5-39.5-176.2-62.8171.9000111.4S437 Q438 P439I435-S437 PolarHBondContact O-N 2.9Å; I435-S437 VanDerWaalsContact O-N 3.1Å; I435-Q438 PolarHBondContact O-N 3.28Å; I435-P439 WeakPolarHBondContact O-CD 3.23Å
436D82.7Confident87.4Confident111.5 Ų111.538 Ų3860%0.59621%0.206SC*.THydrogen-bonded Turntrans-67.3-28.5179-21.8-68.5000113.4S434 P439 Y440S434-D436 WeakPolarHBondContact CB-OD2 3.42Å; S434-D436 PolarHBondContact O-N 3.11Å; S434-D436 VanDerWaalsContact O-N 3.12Å; S434-D436 PolarHBondContact OG-OD2 2.9Å; D436-P439 WeakPolarHBondContact O-CD 3.45Å; D436-P439 WeakPolarHBondContact O-CG 3.24Å; D436-Y440 WeakPolarHBondContact O-CD2 3.47Å; D436-Y440 WeakPolarHBondContact O-CE2 3.36Å
437S83.1Confident87.6Confident6.5 Ų6.536.4 Ų36.45%0.04519%0.194CC..THydrogen-bonded Turntrans-96.8-22.8-176.9-57.80000113.5M433 S434 I435 Y440 M441M433-S437 VanDerWaalsContact CE-C 3.47Å; M433-S437 VanDerWaalsContact CE-O 3.31Å; M433-S437 WeakPolarHBondContact CE-O 3.34Å; S434-S437 PolarHBondContact O-N 3.05Å; S434-S437 PolarHBondContact OG-N 2.91Å; S434-S437 PolarHBondContact OG-OG 3.17Å; I435-S437 PolarHBondContact O-N 2.9Å; I435-S437 VanDerWaalsContact O-N 3.1Å; S437-Y440 PolarHBondContact O-N 3.09Å; S437-M441 PolarHBondContact O-N 3.02Å
438Q88.2Confident87.8Confident31.5 Ų31.536.2 Ų36.215%0.14719%0.193CC..Hα-helixtrans-54.4-48.3174.7-174.2169.984.500113.8V430 S434 I435 Y440 M441 I442 L614V430-Q438 HydrophobicContact CG1-CG 4.02Å; V430-Q438 PolarHBondContact O-NE2 3.44Å; S434-Q438 PolarHBondContact O-N 3.02Å; S434-Q438 VanDerWaalsContact O-N 3.11Å; I435-Q438 PolarHBondContact O-N 3.28Å; Q438-Y440 VanDerWaalsContact C-N 3.3Å; Q438-Y440 PolarHBondContact O-N 3.06Å; Q438-M441 PolarHBondContact O-N 3.34Å; Q438-I442 HydrophobicContact CG-CD1 3.85Å; Q438-I442 WeakPolarHBondContact O-CG1 3.16Å; Q438-I442 PolarHBondContact O-N 2.98Å; Q438-I442 VanDerWaalsContact O-N 3.14Å; Q438-L614 HydrophobicContact CG-CD1 4.15Å
439P89.3Confident87.9Confident57 Ų5734.2 Ų34.237%0.3718%0.18SC..Hα-helixtrans-64.3-32.7178.425.4-34.8000112.6I435 D436 M441 I442 Q443I435-P439 WeakPolarHBondContact O-CD 3.23Å; D436-P439 WeakPolarHBondContact O-CD 3.45Å; D436-P439 WeakPolarHBondContact O-CG 3.24Å; P439-M441 PolarHBondContact O-N 2.89Å; P439-I442 PolarHBondContact O-N 3.16Å; P439-Q443 VanDerWaalsContact O-CB 3.29Å; P439-Q443 WeakPolarHBondContact O-CB 3.39Å; P439-Q443 PolarHBondContact O-N 3.11Å
440Y89.6Confident87.9Confident72 Ų7234.2 Ų34.228%0.28218%0.18SC..Hα-helixtrans-64.1-41.7176.8-54-31.7000111.9M210 Y214 D436 S437 Q438 A444M210-Y440 HydrophobicContact CG-CD1 4.46Å; M210-Y440 HydrophobicContact SD-CE1 4.22Å; M210-Y440 HydrophobicContact SD-CE2 4.43Å; Y214-Y440 AromaticContact CE2-CD1 3.91Å; Y214-Y440 HydrophobicContact CE2-CD1 3.91Å; Y214-Y440 HydrophobicContact CE2-CE1 4.39Å; D436-Y440 WeakPolarHBondContact O-CD2 3.47Å; D436-Y440 WeakPolarHBondContact O-CE2 3.36Å; S437-Y440 PolarHBondContact O-N 3.09Å; Q438-Y440 VanDerWaalsContact C-N 3.3Å; Q438-Y440 PolarHBondContact O-N 3.06Å; Y440-A444 WeakPolarHBondContact O-CB 3.4Å; Y440-A444 PolarHBondContact O-N 3.12Å
441M91.1Very high87.6Confident1.5 Ų1.534.6 Ų34.61%0.00718%0.182CC..Hα-helixtrans-68.3-41.1177.1-175.6169.3-68.800112L209 L427 V430 M433 S437 Q438 P439 A444 I445 K603L209-M441 HydrophobicContact CD1-CB 4.27Å; L209-M441 HydrophobicContact CD1-CE 3.76Å; L427-M441 HydrophobicContact CD1-CE 3.86Å; L427-M441 HydrophobicContact CD2-CE 3.58Å; L427-M441 HydrophobicContact CG-CE 3.68Å; V430-M441 HydrophobicContact CB-SD 4.15Å; V430-M441 HydrophobicContact CG2-CG 4.15Å; V430-M441 HydrophobicContact CG2-SD 3.48Å; V430-M441 WeakPolarHBondContact CG2-SD 3.23Å; M433-M441 HydrophobicContact CE-CB 3.88Å; M433-M441 HydrophobicContact CE-CE 3.87Å; M433-M441 HydrophobicContact CE-CG 4.34Å; M433-M441 HydrophobicContact CE-SD 3.95Å; M433-M441 HydrophobicContact SD-CB 4.04Å; M433-M441 HydrophobicContact SD-CE 3.63Å; M433-M441 WeakPolarHBondContact SD-CE 3.34Å; M433-M441 HydrophobicContact SD-CG 4.48Å; M433-M441 HydrophobicContact SD-SD 3.67Å; M433-M441 VanDerWaalsContact SD-SD 3.67Å; S437-M441 PolarHBondContact O-N 3.02Å; Q438-M441 PolarHBondContact O-N 3.34Å; P439-M441 PolarHBondContact O-N 2.89Å; M441-A444 PolarHBondContact O-N 3.18Å; M441-I445 HydrophobicContact CG-CD1 4.15Å; M441-I445 WeakPolarHBondContact O-CB 3.49Å; M441-I445 VanDerWaalsContact O-CG1 3.28Å; M441-I445 WeakPolarHBondContact O-CG1 3.22Å; M441-I445 PolarHBondContact O-N 3.16Å; M441-K603 HydrophobicContact SD-CB 4.31Å
442I91.5Very high87Confident2.5 Ų2.533.5 Ų33.51%0.01318%0.179CC..Hα-helixtrans-68.4-45.2-179.6-66.1174000110.7V430 Q438 P439 A444 I445 I446 L614 I618V430-I442 HydrophobicContact CG1-CD1 3.87Å; V430-I442 HydrophobicContact CG1-CG1 3.79Å; Q438-I442 HydrophobicContact CG-CD1 3.85Å; Q438-I442 WeakPolarHBondContact O-CG1 3.16Å; Q438-I442 PolarHBondContact O-N 2.98Å; Q438-I442 VanDerWaalsContact O-N 3.14Å; P439-I442 PolarHBondContact O-N 3.16Å; I442-A444 VanDerWaalsContact C-N 3.35Å; I442-A444 PolarHBondContact O-N 3.2Å; I442-I445 WeakPolarHBondContact O-CB 3.37Å; I442-I445 PolarHBondContact O-N 3.04Å; I442-I446 HydrophobicContact CG2-CD1 3.71Å; I442-I446 WeakPolarHBondContact O-CD1 3.33Å; I442-I446 VanDerWaalsContact O-CG1 3.26Å; I442-I446 WeakPolarHBondContact O-CG1 3.33Å; I442-I446 PolarHBondContact O-N 3.27Å; I442-L614 HydrophobicContact CD1-CB 3.84Å; I442-L614 HydrophobicContact CD1-CD1 3.74Å; I442-L614 HydrophobicContact CD1-CD2 3.78Å; I442-L614 HydrophobicContact CD1-CG 3.98Å; I442-I618 HydrophobicContact CG1-CD1 4.24Å; I442-I618 HydrophobicContact CG2-CG1 4.11Å
443Q91.1Very high86Confident40 Ų4029.6 Ų29.619%0.18716%0.158CC..Hα-helixtrans-68.6-32.9176.4-172.56129.500112.1A213 Y214 P439 I446 S447A213-Q443 HydrophobicContact CB-CB 3.87Å; A213-Q443 HydrophobicContact CB-CG 3.91Å; Y214-Q443 HydrophobicContact CD1-CG 4.37Å; Y214-Q443 HydrophobicContact CE1-CG 3.83Å; P439-Q443 VanDerWaalsContact O-CB 3.29Å; P439-Q443 WeakPolarHBondContact O-CB 3.39Å; P439-Q443 PolarHBondContact O-N 3.11Å; Q443-I446 PolarHBondContact O-N 2.81Å; Q443-S447 PolarHBondContact NE2-OG 3.14Å; Q443-S447 VanDerWaalsContact NE2-OG 3.08Å; Q443-S447 VanDerWaalsContact O-CB 3.23Å; Q443-S447 WeakPolarHBondContact O-CB 3.39Å; Q443-S447 PolarHBondContact O-N 2.87Å; Q443-S447 PolarHBondContact O-OG 3.11Å
444A92.4Very high84.7Confident0 Ų030.7 Ų30.70%017%0.166CC..Hα-helixtrans-62.6-45170.900000111.8L209 I212 A213 Y440 M441 I442 L448L209-A444 HydrophobicContact CD2-CB 3.98Å; I212-A444 HydrophobicContact CB-CB 3.96Å; I212-A444 HydrophobicContact CG2-CB 3.69Å; A213-A444 HydrophobicContact CB-CB 4.22Å; Y440-A444 WeakPolarHBondContact O-CB 3.4Å; Y440-A444 PolarHBondContact O-N 3.12Å; M441-A444 PolarHBondContact O-N 3.18Å; I442-A444 VanDerWaalsContact C-N 3.35Å; I442-A444 PolarHBondContact O-N 3.2Å; A444-L448 WeakPolarHBondContact O-CB 3.42Å; A444-L448 VanDerWaalsContact O-CG 3.23Å; A444-L448 WeakPolarHBondContact O-CG 3.36Å; A444-L448 PolarHBondContact O-N 3.14Å
445I92.5Very high83Confident1 Ų133 Ų331%0.00517%0.167CC..Hα-helixtrans-58.6-52.3174.6-76.8168.2000110.9M441 I442 S447 L448 T449 L599 V600 C604 I618M441-I445 HydrophobicContact CG-CD1 4.15Å; M441-I445 WeakPolarHBondContact O-CB 3.49Å; M441-I445 VanDerWaalsContact O-CG1 3.28Å; M441-I445 WeakPolarHBondContact O-CG1 3.22Å; M441-I445 PolarHBondContact O-N 3.16Å; I442-I445 WeakPolarHBondContact O-CB 3.37Å; I442-I445 PolarHBondContact O-N 3.04Å; I445-S447 PolarHBondContact O-N 3.01Å; I445-L448 PolarHBondContact O-N 3.2Å; I445-T449 PolarHBondContact O-N 3.04Å; I445-T449 PolarHBondContact O-OG1 3.39Å; I445-L599 HydrophobicContact CD1-CB 4.01Å; I445-L599 HydrophobicContact CG1-CB 3.74Å; I445-L599 HydrophobicContact CG1-CD1 4.12Å; I445-V600 HydrophobicContact CD1-CG2 4.3Å; I445-V600 HydrophobicContact CG1-CG2 4.46Å; I445-V600 HydrophobicContact CG2-CG2 3.4Å; I445-V600 VanDerWaalsContact CG2-CG2 3.41Å; I445-C604 WeakPolarHBondContact CD1-SG 3.42Å; I445-I618 HydrophobicContact CG2-CG2 4.41Å
446I90.8Very high81.1Confident4.5 Ų4.533.9 Ų33.92%0.02316%0.161CC..Hα-helixtrans-60.5-50.3-177.9-68.4159.2000110.7I442 Q443 L448 T449 L450 R617 V692I442-I446 HydrophobicContact CG2-CD1 3.71Å; I442-I446 WeakPolarHBondContact O-CD1 3.33Å; I442-I446 VanDerWaalsContact O-CG1 3.26Å; I442-I446 WeakPolarHBondContact O-CG1 3.33Å; I442-I446 PolarHBondContact O-N 3.27Å; Q443-I446 PolarHBondContact O-N 2.81Å; I446-L448 VanDerWaalsContact C-N 3.27Å; I446-L448 PolarHBondContact O-N 3.2Å; I446-T449 WeakPolarHBondContact CA-OG1 3.33Å; I446-T449 PolarHBondContact O-N 3.09Å; I446-T449 PolarHBondContact O-OG1 3.05Å; I446-L450 HydrophobicContact CG2-CD1 3.77Å; I446-L450 HydrophobicContact CG2-CG 4.41Å; I446-L450 WeakPolarHBondContact O-CG 3.42Å; I446-L450 PolarHBondContact O-N 2.86Å; I446-R617 HydrophobicContact CD1-CG 3.59Å; I446-R617 VanDerWaalsContact CD1-NE 3.26Å; I446-V692 HydrophobicContact CG2-CG1 3.57Å
447S89.1Confident79.5Confident12 Ų1230.4 Ų30.48%0.08414%0.139CC..Hα-helixtrans-61-34.8-179-54.50000111.7A213 Q443 I445A213-S447 PolarHBondContact O-OG 3.03Å; Q443-S447 PolarHBondContact NE2-OG 3.14Å; Q443-S447 VanDerWaalsContact NE2-OG 3.08Å; Q443-S447 VanDerWaalsContact O-CB 3.23Å; Q443-S447 WeakPolarHBondContact O-CB 3.39Å; Q443-S447 PolarHBondContact O-N 2.87Å; Q443-S447 PolarHBondContact O-OG 3.11Å; I445-S447 PolarHBondContact O-N 3.01Å
448L90.1Very high78Confident1 Ų133.7 Ų33.71%0.00515%0.154CC..Hα-helixtrans-69.5-46.3172-72.1173.7000112.7I212 R220 V224 A444 I445 I446 L450 E451 L592 A593 L599I212-L448 HydrophobicContact CG2-CD1 3.63Å; I212-L448 HydrophobicContact CG2-CD2 4.08Å; I212-L448 HydrophobicContact CG2-CG 3.67Å; R220-L448 HydrophobicContact CG-CD2 4.08Å; V224-L448 HydrophobicContact CG2-CD1 4.13Å; V224-L448 HydrophobicContact CG2-CD2 3.58Å; V224-L448 HydrophobicContact CG2-CG 4.42Å; A444-L448 WeakPolarHBondContact O-CB 3.42Å; A444-L448 VanDerWaalsContact O-CG 3.23Å; A444-L448 WeakPolarHBondContact O-CG 3.36Å; A444-L448 PolarHBondContact O-N 3.14Å; I445-L448 PolarHBondContact O-N 3.2Å; I446-L448 VanDerWaalsContact C-N 3.27Å; I446-L448 PolarHBondContact O-N 3.2Å; L448-L450 PolarHBondContact O-N 3.26Å; L448-E451 WeakPolarHBondContact O-CB 3.38Å; L448-E451 PolarHBondContact O-N 3Å; L448-E451 VanDerWaalsContact O-N 3.12Å; L448-L592 HydrophobicContact CD2-CB 4.05Å; L448-L592 HydrophobicContact CD2-CD2 3.87Å; L448-L592 HydrophobicContact CD2-CG 4.48Å; L448-A593 WeakPolarHBondContact O-CA 3.45Å; L448-A593 VanDerWaalsContact O-CB 3.3Å; L448-A593 WeakPolarHBondContact O-CB 3.28Å; L448-L599 HydrophobicContact CD1-CD1 4.15Å
449T87.9Confident75.7Confident1 Ų136.5 Ų36.51%0.00617%0.173CC..Hα-helixtrans-62.6-24.9179.550.70000113.3I445 I446 T452 I622I445-T449 PolarHBondContact O-N 3.04Å; I445-T449 PolarHBondContact O-OG1 3.39Å; I446-T449 WeakPolarHBondContact CA-OG1 3.33Å; I446-T449 PolarHBondContact O-N 3.09Å; I446-T449 PolarHBondContact O-OG1 3.05Å; T449-T452 PolarHBondContact O-OG1 2.85Å; T449-I622 HydrophobicContact CG2-CD1 3.96Å
450L85Confident73.4Confident30.5 Ų30.539.8 Ų39.816%0.1619%0.187CC..G310 helixtrans-85.9-9.4177.2-63.6173.4000114.2I446 L448 T452 M453 N624 V692I446-L450 HydrophobicContact CG2-CD1 3.77Å; I446-L450 HydrophobicContact CG2-CG 4.41Å; I446-L450 WeakPolarHBondContact O-CG 3.42Å; I446-L450 PolarHBondContact O-N 2.86Å; L448-L450 PolarHBondContact O-N 3.26Å; L450-T452 PolarHBondContact O-N 3.22Å; L450-T452 VanDerWaalsContact O-N 3.13Å; L450-M453 HydrophobicContact CD2-CE 3.93Å; L450-M453 WeakPolarHBondContact O-CB 3.34Å; L450-M453 VanDerWaalsContact O-CG 3.24Å; L450-M453 WeakPolarHBondContact O-CG 3.3Å; L450-M453 PolarHBondContact O-N 3.03Å; L450-M453 VanDerWaalsContact O-N 3.1Å; L450-N624 HydrophobicContact CD2-CB 4.36Å; L450-V692 HydrophobicContact CD1-CG1 4.29Å
451E81.2Confident71.2Confident7.5 Ų7.539.9 Ų39.94%0.03519%0.192CC..G310 helixtrans-60.5-23.8177.8-77.6-76.2161.600113T217 R220 L448 M453 H589 L592T217-E451 VanDerWaalsContact CG2-OE1 3.31Å; T217-E451 WeakPolarHBondContact CG2-OE1 3.35Å; T217-E451 VanDerWaalsContact CG2-OE2 3.23Å; T217-E451 WeakPolarHBondContact CG2-OE2 3.19Å; T217-E451 PolarHBondContact OG1-OE1 3.04Å; R220-E451 WeakPolarHBondContact CD-OE1 3.38Å; R220-E451 IonicContact CZ-OE1 3.25Å; R220-E451 IonicContact NE-OE1 3.96Å; R220-E451 IonicContact NH1-OE1 3.7Å; R220-E451 PolarHBondContact NH1-OE1 3.47Å; L448-E451 WeakPolarHBondContact O-CB 3.38Å; L448-E451 PolarHBondContact O-N 3Å; L448-E451 VanDerWaalsContact O-N 3.12Å; E451-M453 PolarHBondContact O-N 3.06Å; E451-M453 VanDerWaalsContact O-N 3.14Å; E451-H589 HydrophobicContact CB-CB 4.47Å; E451-H589 WeakPolarHBondContact O-CB 3.46Å; E451-H589 IonicContact OE2-CE1 2.84Å; E451-H589 IonicContact OE2-CG 3.39Å; E451-H589 IonicContact OE2-ND1 2.87Å; E451-H589 PolarHBondContact OE2-ND1 2.95Å; E451-L592 HydrophobicContact CB-CB 4.06Å; E451-L592 HydrophobicContact CB-CD1 4.34Å; E451-L592 HydrophobicContact CG-CB 4.05Å; E451-L592 HydrophobicContact CG-CD1 3.92Å; E451-L592 HydrophobicContact CG-CG 4.48Å
452T73.9Confident68.4Low11.5 Ų11.542.6 Ų42.67%0.07122%0.22CC..G310 helixtrans-71.5-2.1174.9390000115.3T449 L450 P454 R590 A593 W625 T629T449-T452 PolarHBondContact O-OG1 2.85Å; L450-T452 PolarHBondContact O-N 3.22Å; L450-T452 VanDerWaalsContact O-N 3.13Å; T452-P454 WeakPolarHBondContact O-CD 3.48Å; T452-P454 VanDerWaalsContact O-N 3.12Å; T452-R590 HydrophobicContact CG2-CB 4.46Å; T452-R590 HydrophobicContact CG2-CG 4.16Å; T452-A593 HydrophobicContact CG2-CB 3.58Å; T452-W625 VanDerWaalsContact OG1-CD1 3.31Å; T452-T629 HydrophobicContact CG2-CG2 3.85Å
453M65.7Low65.6Low18 Ų1844.6 Ų44.69%0.08924%0.241CC..SBendtrans-52.2122.7176.3-84.1-122.2171.100111.4L450 E451 R455 R457 Q458 L461 N624 D628 S694L450-M453 HydrophobicContact CD2-CE 3.93Å; L450-M453 WeakPolarHBondContact O-CB 3.34Å; L450-M453 VanDerWaalsContact O-CG 3.24Å; L450-M453 WeakPolarHBondContact O-CG 3.3Å; L450-M453 PolarHBondContact O-N 3.03Å; L450-M453 VanDerWaalsContact O-N 3.1Å; E451-M453 PolarHBondContact O-N 3.06Å; E451-M453 VanDerWaalsContact O-N 3.14Å; M453-R455 PolarHBondContact O-N 3.21Å; M453-R457 PolarHBondContact SD-NH1 2.82Å; M453-Q458 HydrophobicContact CB-CG 4.33Å; M453-L461 HydrophobicContact SD-CD1 4.47Å; M453-N624 WeakPolarHBondContact CE-ND2 3.29Å; M453-D628 WeakPolarHBondContact CG-OD2 3.46Å; M453-S694 VanDerWaalsContact CE-N 3.27Å
454P55.7Low62.9Low39 Ų3947.7 Ų47.725%0.25326%0.263SS..  trans-60.5132-179.90-0.3000110.7T452 W456 R457 Q458T452-P454 WeakPolarHBondContact O-CD 3.48Å; T452-P454 VanDerWaalsContact O-N 3.12Å; P454-W456 HydrophobicContact CB-CG 4.28Å; P454-W456 VanDerWaalsContact CB-NE1 3.29Å; P454-W456 HydrophobicContact CG-CZ2 4.31Å; P454-W456 PolarHBondContact O-N 3.02Å; P454-R457 HydrophobicContact CG-CG 4.37Å; P454-R457 WeakPolarHBondContact O-CA 3.46Å; P454-R457 WeakPolarHBondContact O-CB 3.22Å; P454-R457 PolarHBondContact O-N 3.07Å; P454-Q458 PolarHBondContact O-N 3.42Å
455R48.2Very low60Low103.5 Ų103.554.6 Ų54.639%0.39130%0.295SS..Hα-helixtrans-54.4-26.3-171.6-71.3-178.7118.2-178.61.1114.8M453 R457 Q458 V459 Y584 D586 H589M453-R455 PolarHBondContact O-N 3.21Å; R455-R457 VanDerWaalsContact C-N 3.3Å; R455-R457 PolarHBondContact O-N 3.2Å; R455-Q458 WeakPolarHBondContact O-CB 3.36Å; R455-Q458 PolarHBondContact O-N 3.2Å; R455-Q458 VanDerWaalsContact O-N 3.13Å; R455-V459 WeakPolarHBondContact O-CG2 3.35Å; R455-V459 PolarHBondContact O-N 3.25Å; R455-Y584 PolarHBondContact NH2-O 3.28Å; R455-D586 WeakPolarHBondContact CD-OD1 3.34Å; R455-D586 IonicContact CZ-OD1 2.83Å; R455-D586 IonicContact NE-OD1 3.67Å; R455-H589 PolarHBondContact NH2-NE2 3.39Å
456W45.1Very low57Low159.5 Ų159.562 Ų6260%0.60433%0.334SS*.Hα-helixtrans-64.8-31.3173.667.2-100.6000113.1P454 L460P454-W456 HydrophobicContact CB-CG 4.28Å; P454-W456 VanDerWaalsContact CB-NE1 3.29Å; P454-W456 HydrophobicContact CG-CZ2 4.31Å; P454-W456 PolarHBondContact O-N 3.02Å; W456-L460 HydrophobicContact CE3-CD1 3.77Å; W456-L460 HydrophobicContact CZ3-CD1 3.94Å; W456-L460 WeakPolarHBondContact O-CG 3.41Å; W456-L460 PolarHBondContact O-N 2.93Å; W456-L460 VanDerWaalsContact O-N 3.08Å
457R48.1Very low54Low39 Ų3965 Ų6515%0.14737%0.367CS..Hα-helixtrans-68.6-45.6168.7-72.8-172.8174.4168.5-5.5110.9M453 P454 R455 V459 L460 L461 D628 S694 H708M453-R457 PolarHBondContact SD-NH1 2.82Å; P454-R457 HydrophobicContact CG-CG 4.37Å; P454-R457 WeakPolarHBondContact O-CA 3.46Å; P454-R457 WeakPolarHBondContact O-CB 3.22Å; P454-R457 PolarHBondContact O-N 3.07Å; R455-R457 VanDerWaalsContact C-N 3.3Å; R455-R457 PolarHBondContact O-N 3.2Å; R457-V459 PolarHBondContact O-N 3.13Å; R457-V459 VanDerWaalsContact O-N 3.17Å; R457-L460 CarbonylContact O-C 3.54Å; R457-L460 WeakPolarHBondContact O-CA 3.38Å; R457-L460 PolarHBondContact O-N 3.15Å; R457-L460 VanDerWaalsContact O-N 3.14Å; R457-L461 HydrophobicContact CB-CD1 4.02Å; R457-L461 WeakPolarHBondContact O-CB 3.49Å; R457-L461 WeakPolarHBondContact O-CG 3.38Å; R457-L461 PolarHBondContact O-N 3.09Å; R457-D628 IonicContact CZ-OD1 2.73Å; R457-D628 IonicContact NH1-OD1 3.66Å; R457-D628 PolarHBondContact NH1-OD1 3.19Å; R457-D628 IonicContact NH2-OD1 2.8Å; R457-S694 PolarHBondContact NH1-OG 3.21Å; R457-H708 PolarHBondContact NH2-CD2 2.98Å; R457-H708 PolarHBondContact NH2-NE2 3.27Å
458Q51.1Low51.3Low75 Ų7570.2 Ų70.235%0.3539%0.394SS..Hα-helixtrans-58.8-33.9178.8-64.6172.7-20.200112.4M453 P454 R455 G463M453-Q458 HydrophobicContact CB-CG 4.33Å; P454-Q458 PolarHBondContact O-N 3.42Å; R455-Q458 WeakPolarHBondContact O-CB 3.36Å; R455-Q458 PolarHBondContact O-N 3.2Å; R455-Q458 VanDerWaalsContact O-N 3.13Å; Q458-G463 PolarHBondContact O-N 2.68Å
459V40.4Very low48.6Very low90.5 Ų90.578.9 Ų78.955%0.54843%0.434SS..Hα-helixtrans-70.6-42.4172.3172.50000112.2R455 R457 L461 G463R455-V459 WeakPolarHBondContact O-CG2 3.35Å; R455-V459 PolarHBondContact O-N 3.25Å; R457-V459 PolarHBondContact O-N 3.13Å; R457-V459 VanDerWaalsContact O-N 3.17Å; V459-L461 VanDerWaalsContact C-N 3.27Å; V459-L461 PolarHBondContact O-N 2.88Å; V459-G463 PolarHBondContact O-N 3.43Å
460L40.9Very low46.1Very low127 Ų12782.9 Ų82.967%0.66546%0.462SS*.Hα-helixtrans-69.8-29.3177.4-72173.8000113.6W456 R457 G462W456-L460 HydrophobicContact CE3-CD1 3.77Å; W456-L460 HydrophobicContact CZ3-CD1 3.94Å; W456-L460 WeakPolarHBondContact O-CG 3.41Å; W456-L460 PolarHBondContact O-N 2.93Å; W456-L460 VanDerWaalsContact O-N 3.08Å; R457-L460 CarbonylContact O-C 3.54Å; R457-L460 WeakPolarHBondContact O-CA 3.38Å; R457-L460 PolarHBondContact O-N 3.15Å; R457-L460 VanDerWaalsContact O-N 3.14Å; L460-G462 PolarHBondContact O-N 3.09Å; L460-G462 VanDerWaalsContact O-N 3.15Å
461L43.1Very low43.8Very low72.5 Ų72.585.2 Ų85.238%0.3848%0.478SS..THydrogen-bonded Turntrans-86.834.7-176.8-62.6172.1000113.1M453 R457 V459 A698M453-L461 HydrophobicContact SD-CD1 4.47Å; R457-L461 HydrophobicContact CB-CD1 4.02Å; R457-L461 WeakPolarHBondContact O-CB 3.49Å; R457-L461 WeakPolarHBondContact O-CG 3.38Å; R457-L461 PolarHBondContact O-N 3.09Å; V459-L461 VanDerWaalsContact C-N 3.27Å; V459-L461 PolarHBondContact O-N 2.88Å; L461-A698 HydrophobicContact CD2-CB 3.38Å
462G33.3Very low41.5Very low58.5 Ų58.589.8 Ų89.860%0.60350%0.503SS*.THydrogen-bonded Turntrans9623.8171.300000116.5L460 V464L460-G462 PolarHBondContact O-N 3.09Å; L460-G462 VanDerWaalsContact O-N 3.15Å; G462-V464 PolarHBondContact O-N 3.02Å
463G32.6Very low39.4Very low44.5 Ų44.599.9 Ų99.946%0.45954%0.539SS..  trans-70.978.5168.900000112.4Q458 V459 E465Q458-G463 PolarHBondContact O-N 2.68Å; V459-G463 PolarHBondContact O-N 3.43Å; G463-E465 PolarHBondContact O-N 3.18Å
464V32.9Very low37.8Very low105 Ų105105.5 Ų105.564%0.63657%0.568SS**  trans-73.586.5-175.3-173.80000111.9G462 N466G462-V464 PolarHBondContact O-N 3.02Å; V464-N466 VanDerWaalsContact C-N 3.33Å; V464-N466 HydrophobicContact CG1-CB 3.99Å; V464-N466 WeakPolarHBondContact CG1-ND2 3.41Å; V464-N466 WeakPolarHBondContact CG1-OD1 3.3Å; V464-N466 PolarHBondContact O-N 2.97Å
465E33.3Very low36.8Very low146.5 Ų146.5108.5 Ų108.569%0.68559%0.585SS**  trans-74.377.9163.2-70.6-165.3161.600110.6G463 G467G463-E465 PolarHBondContact O-N 3.18Å; E465-G467 PolarHBondContact O-N 3.16Å
466N29.3Very low35.9Very low155 Ų155107 Ų10783%0.82960%0.596SS**  trans-68.593.2172.6-84-29.9000111V464V464-N466 VanDerWaalsContact C-N 3.33Å; V464-N466 HydrophobicContact CG1-CB 3.99Å; V464-N466 WeakPolarHBondContact CG1-ND2 3.41Å; V464-N466 WeakPolarHBondContact CG1-OD1 3.3Å; V464-N466 PolarHBondContact O-N 2.97Å
467G27.8Very low35.1Very low68.5 Ų68.5102 Ų10271%0.70659%0.594SS**  trans12478.4158.900000116.7E465E465-G467 PolarHBondContact O-N 3.16Å
468D31.4Very low34.2Very low121 Ų121107.2 Ų107.265%0.64762%0.624SS**  -164130.4124.1-126.7-9000112S470D468-S470 PolarHBondContact O-N 3.23Å
469E33.3Very low33Very low183 Ų183109.2 Ų109.286%0.85564%0.641SS**THydrogen-bonded Turntrans-73.54.8-172.8-108.3-173.8127.800114.2
470S36Very low32.4Very low85.5 Ų85.5110.8 Ų110.860%0.59866%0.655SS**THydrogen-bonded Turntrans-94-30.5-173690000114.1D468 N472D468-S470 PolarHBondContact O-N 3.23Å; S470-N472 PolarHBondContact O-N 3.25Å
471T36.4Very low31.6Very low78.5 Ų78.5110 Ų11048%0.48266%0.657SS.*THydrogen-bonded Turntrans-81.3-24.5-176.54.80000113.6R473 I474T471-R473 PolarHBondContact O-N 3.18Å; T471-I474 WeakPolarHBondContact O-CB 3.36Å; T471-I474 PolarHBondContact O-N 3.25Å; T471-I474 VanDerWaalsContact O-N 3.15Å
472N32.7Very low30.8Very low104 Ų104111.4 Ų111.456%0.55667%0.673SS**Hα-helixtrans-61.2-10.5-176.8-79.7-22000115.1S470 I474 A476S470-N472 PolarHBondContact O-N 3.25Å; N472-I474 VanDerWaalsContact C-N 3.35Å; N472-A476 VanDerWaalsContact O-CB 3.29Å; N472-A476 WeakPolarHBondContact O-CB 3.43Å; N472-A476 PolarHBondContact O-N 2.86Å; N472-A476 VanDerWaalsContact O-N 3.11Å
473R30.6Very low30.5Very low223 Ų223114 Ų11484%0.84268%0.682SS**Hα-helixtrans-82.1-12.2173.4-61.5-172.6-168.6-127.2-1.1114.4T471T471-R473 PolarHBondContact O-N 3.18Å
474I32.4Very low30.2Very low136.5 Ų136.5117.5 Ų117.570%0.770%0.699SS**Hα-helixtrans-91.8-36.6177.3-57.5-179.6000110.5T471 N472 G477T471-I474 WeakPolarHBondContact O-CB 3.36Å; T471-I474 PolarHBondContact O-N 3.25Å; T471-I474 VanDerWaalsContact O-N 3.15Å; N472-I474 VanDerWaalsContact C-N 3.35Å; I474-G477 PolarHBondContact O-N 2.97Å; I474-G477 VanDerWaalsContact O-N 3.13Å
475V33.9Very low30Very low101 Ų101117.2 Ų117.261%0.61271%0.708SS**Hα-helixtrans-74.2-38.5177.5-173.60000111.7G477 L478V475-G477 PolarHBondContact O-N 3.01Å; V475-G477 VanDerWaalsContact O-N 3.08Å; V475-L478 PolarHBondContact O-N 2.68Å
476A30Very low29.8Very low74 Ų74116.5 Ų116.561%0.61272%0.716SS**G310 helixtrans-67.52.5175.100000114.6N472 L478N472-A476 VanDerWaalsContact O-CB 3.29Å; N472-A476 WeakPolarHBondContact O-CB 3.43Å; N472-A476 PolarHBondContact O-N 2.86Å; N472-A476 VanDerWaalsContact O-N 3.11Å; A476-L478 VanDerWaalsContact C-N 3.34Å
477G27.3Very low29.7Very low54 Ų54112.5 Ų112.556%0.55771%0.711SS**THydrogen-bonded Turntrans-93.5-2.7177.500000115I474 V475I474-G477 PolarHBondContact O-N 2.97Å; I474-G477 VanDerWaalsContact O-N 3.13Å; V475-G477 PolarHBondContact O-N 3.01Å; V475-G477 VanDerWaalsContact O-N 3.08Å
478L28.9Very low29.6Very low148.5 Ų148.5112 Ų11278%0.77771%0.707SS**  trans-114.835.2-178.8-67.7176.7000113.4V475 A476 C480V475-L478 PolarHBondContact O-N 2.68Å; A476-L478 VanDerWaalsContact C-N 3.34Å; L478-C480 PolarHBondContact O-N 2.92Å
479T26.9Very low29.5Very low117 Ų117112.1 Ų112.172%0.71871%0.713SS**SBendtrans-64104.8152.146.30000107.9P481T479-P481 VanDerWaalsContact O-CD 3.22Å; T479-P481 WeakPolarHBondContact O-CD 3.35Å
480C27Very low29.2Very low122.5 Ų122.5109.9 Ų109.983%0.82871%0.713SS**  trans-58.6114.2178-72.30000110.4L478 S482L478-C480 PolarHBondContact O-N 2.92Å; C480-S482 PolarHBondContact O-N 2.88Å
481P24.8Very low29Very low111 Ų111111.4 Ų111.472%0.72172%0.718SS**  trans-72.6135.4167.912.1-2.7000108.4T479 S483T479-P481 VanDerWaalsContact O-CD 3.22Å; T479-P481 WeakPolarHBondContact O-CD 3.35Å; P481-S483 PolarHBondContact O-N 3.3Å
482S26Very low28.5Very low101 Ų101113.9 Ų113.971%0.70673%0.734SS**SBendtrans-2118.915757.50000115.1C480 S484C480-S482 PolarHBondContact O-N 2.88Å; S482-S484 PolarHBondContact O-N 2.87Å
483S27.1Very low28.4Very low114.5 Ų114.5116.2 Ų116.280%0.80175%0.746SS**SBendtrans5068.1145.649.70000118.3P481P481-S483 PolarHBondContact O-N 3.3Å
484S27.3Very low28.4Very low117 Ų117113.9 Ų113.982%0.81875%0.745SS**  trans-160.7124.1150.1-830000112.4S482 P486S482-S484 PolarHBondContact O-N 2.87Å; S484-P486 WeakPolarHBondContact O-CD 3.21Å
485A28.3Very low28.1Very low98.5 Ų98.5115.9 Ų115.981%0.81475%0.753SS**  trans-78125.1171.300000110.6G487A485-G487 PolarHBondContact O-N 3.25Å
486P28.3Very low27.8Very low133.5 Ų133.5116.9 Ų116.987%0.86776%0.759SS**SBendtrans-80.5100-178.230.5-32.6000112.3S484S484-P486 WeakPolarHBondContact O-CD 3.21Å
487G27.9Very low27.6Very low70 Ų70121.1 Ų121.172%0.72277%0.769SS**  trans92.242.9147.900000118.8A485A485-G487 PolarHBondContact O-N 3.25Å
488G25.9Very low27.6Very low59 Ų59125.9 Ų125.961%0.60878%0.78SS**  trans-59.4137.3152.500000110.1T490G488-T490 PolarHBondContact O-N 2.97Å
489P28Very low27.5Very low121.5 Ų121.5121.8 Ų121.879%0.78977%0.773SS**PPolyproline II helixtrans-68123.1-174.626.5-33.8000111.3T491P489-T491 PolarHBondContact O-N 3.01Å
490T27.2Very low27.6Very low136.5 Ų136.5123.8 Ų123.884%0.83778%0.779SS**PPolyproline II helixtrans-71.2108.3178.546.90000111.4G488G488-T490 PolarHBondContact O-N 2.97Å
491T31.5Very low27.6Very low117.5 Ų117.5123.5 Ų123.572%0.72178%0.778SS**  trans-98.4118.6175.146.60000109.9P489 N493P489-T491 PolarHBondContact O-N 3.01Å; T491-N493 PolarHBondContact O-N 3.42Å; T491-N493 VanDerWaalsContact O-N 3.16Å
492T27.7Very low27.8Very low130.5 Ų130.5122.2 Ų122.280%0.80179%0.785SS**  trans-23.194132.152.90000112
493N30.4Very low27.9Very low152.5 Ų152.5121.2 Ų121.282%0.81679%0.791SS**PPolyproline II helixtrans3.8152.5160.3-69.4-21.1000115.7T491T491-N493 PolarHBondContact O-N 3.42Å; T491-N493 VanDerWaalsContact O-N 3.16Å
494E29.4Very low27.9Very low174.5 Ų174.5121.1 Ų121.182%0.81579%0.79SS**PPolyproline II helixtrans7.5125.7-176.6-62.5-176.2146.700117.5
495M26.1Very low28Very low179 Ų179122.9 Ų122.988%0.88279%0.789SS**  trans-56.1162165.6-107.2176.6-133.300112.1
496V28.1Very low28.1Very low122 Ų122125.7 Ų125.774%0.73979%0.789SS**  154.5123.5125.6163.50000114.5I498V496-I498 PolarHBondContact O-N 3.01Å
497M26.1Very low28.1Very low163 Ų163124.7 Ų124.780%0.80379%0.785SS**  trans5115.1157.5-122.8-101.6-77.600117.2G499M497-G499 VanDerWaalsContact C-N 3.35Å; M497-G499 PolarHBondContact O-N 2.92Å
498I27.4Very low28.2Very low155 Ų155126.9 Ų126.980%0.79579%0.79SS**  trans-7.1107.8157.1-58.7179.7000114.9V496V496-I498 PolarHBondContact O-N 3.01Å
499G27Very low28.3Very low62 Ų62131.3 Ų131.364%0.63980%0.799SS**  trans-13457.116000000115.9M497M497-G499 VanDerWaalsContact C-N 3.35Å; M497-G499 PolarHBondContact O-N 2.92Å
500L27.7Very low28.5Very low159.5 Ų159.5133.2 Ų133.284%0.83580%0.802SS**  trans39108.4162.8-69.3167.1000119.6
501S28Very low28.6Very low115 Ų115132.3 Ų132.380%0.80480%0.801SS**  98.1111.9128.92.90000119.9
502G28.3Very low28.7Very low84 Ų84130.4 Ų130.487%0.86680%0.804SS**  trans108.7133.4132.500000119.3
503G28.3Very low28.8Very low81 Ų81131.6 Ų131.684%0.83581%0.806SS**  trans10093.1161.100000115.9
504S27.5Very low28.8Very low112 Ų112131.4 Ų131.478%0.78380%0.804SS**  -161.3123.689.1177.60000110.9
505L29.4Very low28.9Very low153.5 Ų153.5130.3 Ų130.380%0.80480%0.801SS**  trans132.1138.1158.1-79.1171.8000114.3
506I30Very low29.2Very low159 Ų159128.5 Ų128.582%0.81580%0.795SS**  139.4156.285.310.2176.4000117.1
507S27.7Very low29.3Very low111.5 Ų111.5127.6 Ų127.678%0.7879%0.794SS**  trans-102.1160-173.6-260000113.5
508S31.4Very low29.6Very low116.5 Ų116.5124.9 Ų124.982%0.81579%0.787SS**  trans-165121140.645.30000114.2
509N27.5Very low29.9Very low150.5 Ų150.5124.3 Ų124.381%0.80579%0.785SS**  trans-35.1148151.8-69.7-7.5000117.3
510L30.9Very low30Very low162.5 Ų162.5126.8 Ų126.885%0.85179%0.788SS**  trans148.6137.1153.1-11379.4000115.3
511S30.1Very low30.1Very low117 Ų117124.9 Ų124.982%0.81878%0.783SS**  trans129.5129157.3-50.50000116.8
512G33.5Very low30.2Very low77 Ų77127.4 Ų127.479%0.79478%0.782SS**  trans-157.7148.2169.700000112.4
513N30.2Very low30.3Very low156.5 Ų156.5129.8 Ų129.884%0.83778%0.779SS**  trans-113.8173.1-175-93.8-28.5000112.6
514L30.4Very low30.3Very low147.5 Ų147.5129.6 Ų129.677%0.77278%0.777SS**  trans84.7125.1166.9-84.777.2000117.8
515M30.4Very low30.4Very low151.5 Ų151.5128 Ų12875%0.74678%0.779SS**  134.6146.859.9-105.3-175.4173.200118.6
516N32.5Very low30.4Very low141.5 Ų141.5125.9 Ų125.976%0.75778%0.777SS**  trans65.8120.4152.7-62.3-6.5000120.3
517S31.4Very low30.4Very low103.5 Ų103.5124.7 Ų124.772%0.72478%0.777SS**  152.7146.168.5-163.50000117.7
518T32.8Very low30.5Very low105.5 Ų105.5126.3 Ų126.365%0.64778%0.782SS**  trans9.2133.6161.748.30000120
519N32.2Very low30.5Very low143 Ų143124.3 Ų124.377%0.76578%0.78SS**  151.2135.669.4-67-37.4000117
520V29.9Very low30.5Very low115.5 Ų115.5126.4 Ų126.470%0.779%0.785SS**  82.1103.595.4174.20000116.9
521V30.2Very low30.5Very low119.5 Ų119.5126.1 Ų126.172%0.72478%0.783SS**  144.6142.889.7167.70000116.8
522Q30.2Very low30.3Very low166.5 Ų166.5125.1 Ų125.178%0.77878%0.776SS**  93.3148.176.3-122.6174.9-65.800119.4
523V29.4Very low30.1Very low134.5 Ų134.5130.6 Ų130.682%0.81578%0.778SS**  140.1134.8-109.3153.10000113.8
524G29.1Very low30.1Very low77 Ų77128 Ų12879%0.79477%0.772SS**  89.6146.796.700000116.1
525G29.9Very low30.1Very low79 Ų79127.4 Ų127.481%0.81477%0.77SS**  173.5109.184.100000118.7
526S28.7Very low30Very low109 Ų109129 Ų12976%0.76277%0.773SS**  trans-27.5143.5170.857.70000121.5
527T30.9Very low29.8Very low134 Ų134125.1 Ų125.182%0.82277%0.766SS**  136.6148.8127.537.90000121.4
528T28.1Very low29.9Very low145 Ų145126.2 Ų126.289%0.8977%0.768SS**  trans24.1140.2162.6-120000119.6
529G32.6Very low29.7Very low75 Ų75128.4 Ų128.477%0.77378%0.776SS**  trans173.6132.8156.400000115.3
530Q27.9Very low29.9Very low194 Ų194126.7 Ų126.791%0.90777%0.773SS**  trans-104.8159.7169-66.6177-51.600109.8
531I29.4Very low29.9Very low157 Ų157128.5 Ų128.581%0.80578%0.777SS**  -154.4155.9103.1-36.9178.9000110.5F533I531-F533 HydrophobicContact CG2-CE2 4.31Å
532S26Very low30Very low96 Ų96129.5 Ų129.567%0.67178%0.784SS**  trans-72.9162173.3-47.10000114.6
533F29.8Very low30.2Very low192.5 Ų192.5124.8 Ų124.884%0.84478%0.78SS**  -150.3145.398.2-74.7-78.9000111.6I531I531-F533 HydrophobicContact CG2-CE2 4.31Å
534S29.7Very low30.4Very low101.5 Ų101.5125.4 Ų125.471%0.7178%0.784SS**  126.9139.6116.172.10000111.8
535D31.1Very low30.7Very low135 Ų135125.5 Ų125.572%0.72278%0.778SS**  -174162.787.4-127.4-17.1000114.4
536F28.2Very low30.8Very low185.5 Ų185.5128.3 Ų128.381%0.81478%0.779SS**  trans50.6151.2159.9-74.5-98.6000121.9
537G29.2Very low30.9Very low58 Ų58133.6 Ų133.660%0.59878%0.782SS**  cis160.3146.8-11.300000115.8
538T32.1Very low30.9Very low127.5 Ų127.5132.8 Ų132.878%0.78277%0.773SS**  trans61.2146.3148.559.10000122.2
539N28.5Very low31.1Very low151.5 Ų151.5133.8 Ų133.881%0.8177%0.768SS**  -133.5-179.597.3-79.1-37000111.6
540P36.4Very low31Very low108 Ų108135.4 Ų135.470%0.70176%0.762SS**  -125.9176.5-9342.3-29.4000116.9
541I31.7Very low31Very low151.5 Ų151.5132.2 Ų132.278%0.77776%0.756SS**  trans132.4134.2141-94.5160.7000120.1
542T31.6Very low31.1Very low141.5 Ų141.5130.5 Ų130.587%0.86876%0.758SS**  trans62.2139.8162.545.20000123
543G33.8Very low31.2Very low67.5 Ų67.5129.8 Ų129.870%0.69677%0.766SS**  trans166.717.2162.100000120.7
544T34.5Very low31.1Very low147 Ų147126.1 Ų126.190%0.90277%0.765SS**  trans47.1138.3161.650.70000122.1
545A33.8Very low31Very low80.5 Ų80.5126.6 Ų126.667%0.66577%0.767SS**  145.6130.578.600000117.5
546T34Very low30.8Very low137.5 Ų137.5127.4 Ų127.484%0.84478%0.776SS**  trans63.1147.5157.5650000118.6
547R29.6Very low30.8Very low219 Ų219121.9 Ų121.983%0.82677%0.772SS**  cis-160.9143.7-8.2-176.4174.4179-179.8-1.1108.3
548N31.7Very low30.7Very low118 Ų118126.8 Ų126.863%0.63178%0.784SS**  128.4134.9-105.5-80.913.3000111.6
549Q32.2Very low30.5Very low166.5 Ų166.5126.8 Ų126.878%0.77879%0.789SS**  -170.8150.260.5-108.1-179.7-20.100109.2
550T30.2Very low30.4Very low107 Ų107122.7 Ų122.766%0.65678%0.783SS**  129.6153.174.527.60000116.6
551T28.1Very low30.2Very low128 Ų128125.7 Ų125.779%0.78579%0.792SS**  trans50.6142.9156.868.40000119.1
552S29.9Very low30.1Very low121 Ų121122.9 Ų122.985%0.84679%0.791SS**  cis-173.9159.5-7.442.80000110.5
553G29.5Very low29.8Very low81 Ų81119.7 Ų119.784%0.83579%0.786SS**  trans169.4129.4169.600000115.3
554S27.5Very low29.8Very low116 Ų116124.6 Ų124.681%0.81179%0.794SS**  trans-100.6142.1-172.1-173.80000118
555C27.1Very low29.4Very low112 Ų112124.4 Ų124.476%0.75779%0.788SS**  trans126.1125.7149.858.80000115.3
556V27.5Very low29.2Very low150.5 Ų150.5127.1 Ų127.191%0.91279%0.791SS**  68.3101.596.9-1750000115.4
557G27.6Very low28.9Very low70.5 Ų70.5130.2 Ų130.273%0.72779%0.793SS**  trans174.6146.5171.300000113
558N26.9Very low28.9Very low160.5 Ų160.5123.5 Ų123.586%0.85879%0.785SS**  trans-86.7152-170-63.37.3000114.9
559S27.6Very low28.7Very low127 Ų127124.7 Ų124.789%0.88879%0.791SS**  trans155.7142.6143-67.30000113.1
560G28.2Very low28.5Very low66 Ų66123.7 Ų123.768%0.6879%0.791SS**  13089.586.800000112.4
561I30.3Very low28.4Very low172 Ų172125.3 Ų125.388%0.88280%0.801SS**  148.7115.5122.5-57.6173.6000108.8
562A29.6Very low28.4Very low92 Ų92122.3 Ų122.376%0.7680%0.796SS**  cis137.2115.412.200000112.9
563G26.7Very low28.3Very low73.5 Ų73.5123.4 Ų123.476%0.75880%0.797SS**  trans79.9126.614400000117.9
564I33.8Very low28.3Very low171 Ų171127.8 Ų127.888%0.87780%0.796SS**  -127.6127.475.1-54.4177.7000108
565N26.5Very low28.4Very low143 Ų143128.3 Ų128.377%0.76580%0.795SS**  trans-85.9151.8170.3-70.1-1.3000110.7
566D28.4Very low28.5Very low138 Ų138127.4 Ų127.474%0.73880%0.804SS**  trans-115.9144.5143.4-70.6-50000113.9
567F28.7Very low28.5Very low201 Ų201124.6 Ų124.688%0.88280%0.797SS**  trans-60.5108.8148.7-78.9-79.4000115.7N569F567-N569 PolarHBondContact O-N 3.4Å
568A28.2Very low28.5Very low78.5 Ų78.5127.7 Ų127.765%0.64980%0.795SS**  -121142.296.600000112.1
569N27.4Very low28.8Very low143.5 Ų143.5126 Ų12677%0.76779%0.791SS**  trans104.2131.5135.9-72.6-25.7000115.9F567F567-N569 PolarHBondContact O-N 3.4Å
570N29.1Very low29.3Very low145.5 Ų145.5123.5 Ų123.578%0.77877%0.767SS**  139.9139112.2-76.3-32000117.2
571T28.4Very low30Very low141 Ų141127.6 Ų127.687%0.86577%0.772SS**  trans-4.5113.4158.355.20000117.2
572G27.6Very low31.2Very low65.5 Ų65.5121.6 Ų121.668%0.67575%0.753SS**  trans-170.9109.1166.800000111.3E574G572-E574 VanDerWaalsContact C-N 3.3Å; G572-E574 PolarHBondContact O-N 3.13Å
573T27.5Very low32.7Very low143 Ų143123 Ų12388%0.87774%0.739SS**  trans-64.240.4-18045.60000119.2
574E29.5Very low34.8Very low173.5 Ų173.5121 Ų12181%0.81171%0.708SS**  trans-128.6148.9-171.9-67.2174.9-122.500114.3G572G572-E574 VanDerWaalsContact C-N 3.3Å; G572-E574 PolarHBondContact O-N 3.13Å
575T30.1Very low36.6Very low127 Ų127117.3 Ų117.378%0.77968%0.684SS**  trans-26.698.3-172.448.70000117.9A577T575-A577 VanDerWaalsContact C-N 3.32Å; T575-A577 PolarHBondContact O-N 3.19Å
576G28.5Very low38.8Very low93 Ų93114.6 Ų114.696%0.95967%0.669SS**  trans-1119.6147.900000119.5
577A28.2Very low41Very low91 Ų91109.9 Ų109.975%0.75264%0.643SS**  trans-110.722.8-169.500000114.7T575T575-A577 VanDerWaalsContact C-N 3.32Å; T575-A577 PolarHBondContact O-N 3.19Å
578I28.4Very low43.4Very low136.5 Ų136.5100.4 Ų100.470%0.760%0.601SS**  trans-120.495.8-164-52.7178.2000112.4
579T33Very low46Very low124 Ų12497.6 Ų97.676%0.76158%0.575SS**SBendtrans125.946.2162.3-28.90000119.6
580L37.6Very low48.6Very low74.5 Ų74.593.7 Ų93.739%0.3955%0.549SS..  trans-106.1-21.5169.8-75.8-179000115.2Q182 E218 G582 R583Q182-L580 HydrophobicContact CG-CD1 4.3Å; E218-L580 HydrophobicContact CG-CB 4.4Å; L580-G582 PolarHBondContact O-N 3.1Å; L580-G582 VanDerWaalsContact O-N 3.1Å; L580-R583 PolarHBondContact O-N 2.94Å
581L42.9Very low51.3Low152 Ų15286.9 Ų86.980%0.79651%0.513SS*.THydrogen-bonded Turntrans-58124.8174.2-76.683.3000110
582G54.6Low54.1Low46 Ų4680.3 Ų80.347%0.47447%0.472SS..THydrogen-bonded Turntrans110.37.7175.100000116.8L580 Y584L580-G582 PolarHBondContact O-N 3.1Å; L580-G582 VanDerWaalsContact O-N 3.1Å; G582-Y584 PolarHBondContact O-N 3.06Å
583R61.8Low57Low121 Ų12177.1 Ų77.146%0.45744%0.44SS..SBendtrans-66.6-22.9174.3-81.3-170.7171.2-179.13.6115.4Q182 E185 L580Q182-R583 PolarHBondContact O-NH1 3.23Å; E185-R583 IonicContact OE1-CZ 3.98Å; E185-R583 IonicContact OE1-NE 3.86Å; E185-R583 IonicContact OE1-NH2 2.76Å; E185-R583 PolarHBondContact OE1-NH2 3.33Å; L580-R583 PolarHBondContact O-N 2.94Å
584Y71Confident59.9Low32 Ų3270.4 Ų70.413%0.12540%0.398CS..SBendtrans-108.5160.2-179.3-54.9-58000111.3E218 L221 H249 R455 G582 D588E218-Y584 WeakPolarHBondContact O-CE2 3.49Å; E218-Y584 PolarHBondContact O-OH 2.84Å; L221-Y584 HydrophobicContact CB-CD2 3.89Å; L221-Y584 HydrophobicContact CB-CE2 3.49Å; L221-Y584 VanDerWaalsContact CB-CE2 3.49Å; L221-Y584 HydrophobicContact CD2-CD1 3.65Å; L221-Y584 HydrophobicContact CD2-CD2 3.63Å; L221-Y584 HydrophobicContact CD2-CE1 3.75Å; L221-Y584 HydrophobicContact CD2-CE2 3.73Å; L221-Y584 HydrophobicContact CD2-CG 3.6Å; L221-Y584 HydrophobicContact CG-CD2 4.4Å; L221-Y584 HydrophobicContact CG-CE2 4.21Å; H249-Y584 HydrophobicContact CB-CD1 3.95Å; H249-Y584 HydrophobicContact CB-CE1 4.42Å; R455-Y584 PolarHBondContact NH2-O 3.28Å; G582-Y584 PolarHBondContact O-N 3.06Å; Y584-D588 HydrophobicContact CD1-CB 4.47Å
585R71.5Confident62.8Low94.5 Ų94.563.1 Ų63.136%0.35736%0.363SS..  trans-102.4160175.9-67.6-168.5-43.7-107.913.4110.6I248 H249 E587 D588 H589I248-R585 VanDerWaalsContact CD1-NH2 3.26Å; H249-R585 VanDerWaalsContact CE1-CG 3.49Å; H249-R585 WeakPolarHBondContact CE1-CG 3.38Å; H249-R585 PolarHBondContact CE1-NH1 2.9Å; H249-R585 PolarHBondContact NE2-NH1 2.8Å; R585-E587 IonicContact CZ-OE2 3.17Å; R585-E587 VanDerWaalsContact CZ-OE2 3.23Å; R585-E587 IonicContact NE-OE2 3.15Å; R585-E587 PolarHBondContact NE-OE2 3.18Å; R585-E587 IonicContact NH2-OE2 3Å; R585-E587 PolarHBondContact NH2-OE2 2.81Å; R585-E587 PolarHBondContact O-N 3.29Å; R585-D588 PolarHBondContact N-OD2 3.04Å; R585-D588 WeakPolarHBondContact O-CA 3.29Å; R585-D588 WeakPolarHBondContact O-CB 3.48Å; R585-D588 PolarHBondContact O-N 3.31Å; R585-H589 PolarHBondContact O-CD2 3.15Å; R585-H589 PolarHBondContact O-N 3.24Å
586D71.6Confident65.6Low85.5 Ų85.557 Ų5746%0.45733%0.326SS..Hα-helixtrans-53.5-25.5175.2-40.2-37000112.7R455 R590R455-D586 WeakPolarHBondContact CD-OD1 3.34Å; R455-D586 IonicContact CZ-OD1 2.83Å; R455-D586 IonicContact NE-OD1 3.67Å; D586-R590 WeakPolarHBondContact O-CB 3.45Å; D586-R590 WeakPolarHBondContact O-CD 3.42Å; D586-R590 WeakPolarHBondContact O-CG 3.18Å; D586-R590 PolarHBondContact O-N 3.19Å
587E75.3Confident68.6Low39 Ų3952.6 Ų52.618%0.18228%0.281CS..Hα-helixtrans-63.4-39.9171.8-66.9167.3149.200112.5I248 R585 V591 R648 L651I248-E587 HydrophobicContact CD1-CB 4.03Å; R585-E587 IonicContact CZ-OE2 3.17Å; R585-E587 VanDerWaalsContact CZ-OE2 3.23Å; R585-E587 IonicContact NE-OE2 3.15Å; R585-E587 PolarHBondContact NE-OE2 3.18Å; R585-E587 IonicContact NH2-OE2 3Å; R585-E587 PolarHBondContact NH2-OE2 2.81Å; R585-E587 PolarHBondContact O-N 3.29Å; E587-V591 WeakPolarHBondContact O-CG2 3.42Å; E587-V591 PolarHBondContact O-N 3.33Å; E587-R648 VanDerWaalsContact CD-NH1 3.26Å; E587-R648 IonicContact OE1-CZ 2.93Å; E587-R648 VanDerWaalsContact OE1-CZ 3.25Å; E587-R648 IonicContact OE1-NE 3.6Å; E587-R648 PolarHBondContact OE1-NE 3.03Å; E587-R648 IonicContact OE1-NH1 3.19Å; E587-R648 PolarHBondContact OE1-NH1 3.03Å; E587-R648 IonicContact OE1-NH2 2.77Å; E587-R648 PolarHBondContact OE1-NH2 3.11Å; E587-R648 IonicContact OE2-NH1 3.71Å; E587-R648 PolarHBondContact OE2-NH1 2.97Å; E587-L651 HydrophobicContact CB-CD2 4.29Å
588D80.1Confident71.6Confident1.5 Ų1.548.3 Ų48.31%0.00825%0.245CC..Hα-helixtrans-72.7-40.8177.2-50.1-77.2000111.5L221 I248 H249 Y584 R585 R590 V591 L592L221-D588 HydrophobicContact CD2-CB 4.21Å; I248-D588 PolarHBondContact N-OD1 2.98Å; H249-D588 IonicContact CE1-OD2 3.14Å; H249-D588 PolarHBondContact CE1-OD2 3.43Å; H249-D588 IonicContact CG-OD2 2.88Å; H249-D588 IonicContact ND1-OD1 2.7Å; H249-D588 PolarHBondContact ND1-OD1 3.1Å; H249-D588 IonicContact ND1-OD2 3.7Å; H249-D588 PolarHBondContact ND1-OD2 2.85Å; Y584-D588 HydrophobicContact CD1-CB 4.47Å; R585-D588 PolarHBondContact N-OD2 3.04Å; R585-D588 WeakPolarHBondContact O-CA 3.29Å; R585-D588 WeakPolarHBondContact O-CB 3.48Å; R585-D588 PolarHBondContact O-N 3.31Å; D588-R590 VanDerWaalsContact C-N 3.31Å; D588-R590 PolarHBondContact O-N 3.1Å; D588-V591 CarbonylContact O-C 3.56Å; D588-V591 WeakPolarHBondContact O-CA 3.28Å; D588-V591 WeakPolarHBondContact O-CB 3.46Å; D588-V591 PolarHBondContact O-N 2.91Å; D588-V591 VanDerWaalsContact O-N 3.14Å; D588-L592 PolarHBondContact O-N 2.8Å
589H81.3Confident74.6Confident20.5 Ų20.541.9 Ų41.910%0.09521%0.212CC..Hα-helixtrans-62.1-39176.5-65.2-80.8000112T217 E451 R455 R585 V591 L592 A593T217-H589 VanDerWaalsContact CG2-CE1 3.49Å; T217-H589 WeakPolarHBondContact CG2-CE1 3.3Å; E451-H589 HydrophobicContact CB-CB 4.47Å; E451-H589 WeakPolarHBondContact O-CB 3.46Å; E451-H589 IonicContact OE2-CE1 2.84Å; E451-H589 IonicContact OE2-CG 3.39Å; E451-H589 IonicContact OE2-ND1 2.87Å; E451-H589 PolarHBondContact OE2-ND1 2.95Å; R455-H589 PolarHBondContact NH2-NE2 3.39Å; R585-H589 PolarHBondContact O-CD2 3.15Å; R585-H589 PolarHBondContact O-N 3.24Å; H589-V591 VanDerWaalsContact C-N 3.34Å; H589-V591 PolarHBondContact O-N 3.02Å; H589-L592 WeakPolarHBondContact O-CB 3.46Å; H589-L592 PolarHBondContact O-N 3.06Å; H589-A593 PolarHBondContact O-N 3.43Å; H589-A593 VanDerWaalsContact O-N 3.15Å
590R83.1Confident77.4Confident61.5 Ų61.536 Ų3623%0.23218%0.176CC..Hα-helixtrans-61.1-41.1170.6-72.2166.1-168.9-144.82.3112.2T452 D586 D588 A593 I594 T632 L651T452-R590 HydrophobicContact CG2-CB 4.46Å; T452-R590 HydrophobicContact CG2-CG 4.16Å; D586-R590 WeakPolarHBondContact O-CB 3.45Å; D586-R590 WeakPolarHBondContact O-CD 3.42Å; D586-R590 WeakPolarHBondContact O-CG 3.18Å; D586-R590 PolarHBondContact O-N 3.19Å; D588-R590 VanDerWaalsContact C-N 3.31Å; D588-R590 PolarHBondContact O-N 3.1Å; R590-A593 PolarHBondContact O-N 3.11Å; R590-I594 WeakPolarHBondContact O-CG1 3.36Å; R590-I594 PolarHBondContact O-N 3.06Å; R590-I594 VanDerWaalsContact O-N 3.08Å; R590-T632 PolarHBondContact NH1-O 3.17Å; R590-L651 HydrophobicContact CB-CD2 4.01Å
591V85.3Confident79.7Confident3 Ų332.9 Ų32.92%0.01816%0.163CC..Hα-helixtrans-67.3-37.6176.8170.50000111.6L245 P247 E587 D588 H589 A593 I594 Y595 L651L245-V591 HydrophobicContact CD2-CG2 4.49Å; P247-V591 HydrophobicContact CG-CG1 3.86Å; E587-V591 WeakPolarHBondContact O-CG2 3.42Å; E587-V591 PolarHBondContact O-N 3.33Å; D588-V591 CarbonylContact O-C 3.56Å; D588-V591 WeakPolarHBondContact O-CA 3.28Å; D588-V591 WeakPolarHBondContact O-CB 3.46Å; D588-V591 PolarHBondContact O-N 2.91Å; D588-V591 VanDerWaalsContact O-N 3.14Å; H589-V591 VanDerWaalsContact C-N 3.34Å; H589-V591 PolarHBondContact O-N 3.02Å; V591-A593 PolarHBondContact O-N 2.92Å; V591-I594 PolarHBondContact O-N 3.05Å; V591-Y595 HydrophobicContact CG1-CD2 3.84Å; V591-Y595 HydrophobicContact CG1-CE2 3.48Å; V591-Y595 VanDerWaalsContact CG1-CE2 3.46Å; V591-Y595 VanDerWaalsContact O-CD2 3.22Å; V591-Y595 WeakPolarHBondContact O-CD2 3.36Å; V591-Y595 PolarHBondContact O-N 3.36Å; V591-L651 HydrophobicContact CG2-CD1 3.9Å; V591-L651 HydrophobicContact CG2-CD2 4.01Å
592L87.4Confident81.9Confident1 Ų128.3 Ų28.31%0.00514%0.137CC..Hα-helixtrans-58.5-46.2172.5-76.3177000112.6R220 L221 V224 L448 E451 D588 H589 I594 Y595 G596R220-L592 HydrophobicContact CG-CD1 4.5Å; L221-L592 HydrophobicContact CB-CD1 4.25Å; L221-L592 HydrophobicContact CD1-CD1 4.16Å; L221-L592 HydrophobicContact CD1-CD2 3.62Å; L221-L592 HydrophobicContact CD1-CG 3.83Å; V224-L592 HydrophobicContact CB-CD2 3.79Å; V224-L592 HydrophobicContact CG1-CD2 3.9Å; V224-L592 HydrophobicContact CG2-CD2 3.84Å; L448-L592 HydrophobicContact CD2-CB 4.05Å; L448-L592 HydrophobicContact CD2-CD2 3.87Å; L448-L592 HydrophobicContact CD2-CG 4.48Å; E451-L592 HydrophobicContact CB-CB 4.06Å; E451-L592 HydrophobicContact CB-CD1 4.34Å; E451-L592 HydrophobicContact CG-CB 4.05Å; E451-L592 HydrophobicContact CG-CD1 3.92Å; E451-L592 HydrophobicContact CG-CG 4.48Å; D588-L592 PolarHBondContact O-N 2.8Å; H589-L592 WeakPolarHBondContact O-CB 3.46Å; H589-L592 PolarHBondContact O-N 3.06Å; L592-I594 VanDerWaalsContact C-N 3.3Å; L592-I594 PolarHBondContact O-N 3.22Å; L592-Y595 WeakPolarHBondContact O-CB 3.41Å; L592-Y595 PolarHBondContact O-N 3.28Å; L592-Y595 VanDerWaalsContact O-N 3.11Å; L592-G596 PolarHBondContact O-N 3.21Å
593A87.7Confident83.4Confident0 Ų027.7 Ų27.70%012%0.121CC..Hα-helixtrans-67.9-32.2178.900000113L448 T452 H589 R590 V591 G596 A597 W625L448-A593 WeakPolarHBondContact O-CA 3.45Å; L448-A593 VanDerWaalsContact O-CB 3.3Å; L448-A593 WeakPolarHBondContact O-CB 3.28Å; T452-A593 HydrophobicContact CG2-CB 3.58Å; H589-A593 PolarHBondContact O-N 3.43Å; H589-A593 VanDerWaalsContact O-N 3.15Å; R590-A593 PolarHBondContact O-N 3.11Å; V591-A593 PolarHBondContact O-N 2.92Å; A593-G596 PolarHBondContact O-N 3.3Å; A593-A597 PolarHBondContact O-N 3.05Å; A593-W625 VanDerWaalsContact CB-NE1 3.32Å
594I88.9Confident84.6Confident0.5 Ų0.521.9 Ų21.90%0.00310%0.099CC..Hα-helixtrans-63.8-40.6169.9-69.3167.1000111.3L245 R590 V591 L592 G596 A597 F598 W625 L651 L655 I658L245-I594 HydrophobicContact CD2-CB 4.33Å; L245-I594 HydrophobicContact CD2-CD1 3.76Å; L245-I594 HydrophobicContact CD2-CG2 3.78Å; R590-I594 WeakPolarHBondContact O-CG1 3.36Å; R590-I594 PolarHBondContact O-N 3.06Å; R590-I594 VanDerWaalsContact O-N 3.08Å; V591-I594 PolarHBondContact O-N 3.05Å; L592-I594 VanDerWaalsContact C-N 3.3Å; L592-I594 PolarHBondContact O-N 3.22Å; I594-G596 VanDerWaalsContact C-N 3.31Å; I594-G596 PolarHBondContact O-N 2.9Å; I594-A597 PolarHBondContact O-N 2.89Å; I594-F598 HydrophobicContact CG2-CD1 4.35Å; I594-F598 HydrophobicContact CG2-CD2 4.36Å; I594-F598 HydrophobicContact CG2-CE1 3.98Å; I594-F598 HydrophobicContact CG2-CE2 3.91Å; I594-F598 HydrophobicContact CG2-CZ 3.7Å; I594-F598 WeakPolarHBondContact O-CG 3.36Å; I594-F598 PolarHBondContact O-N 3.03Å; I594-W625 HydrophobicContact CG1-CZ2 4.34Å; I594-L651 HydrophobicContact CD1-CD1 3.75Å; I594-L655 HydrophobicContact CD1-CB 4.45Å; I594-L655 HydrophobicContact CD1-CD1 4.07Å; I594-L655 HydrophobicContact CG1-CD1 3.85Å; I594-I658 HydrophobicContact CD1-CD1 4.4Å; I594-I658 HydrophobicContact CG1-CD1 4.38Å; I594-I658 HydrophobicContact CG2-CD1 3.62Å
595Y89.8Confident85.4Confident20.5 Ų20.526.3 Ų26.38%0.0812%0.116CC..Hα-helixtrans-62-37.9172.6-77.5-59.9000112.2V224 F228 Y235 L245 P247 V591 L592 F598 L599V224-Y595 HydrophobicContact CG1-CD1 4.42Å; V224-Y595 HydrophobicContact CG1-CD2 3.68Å; V224-Y595 HydrophobicContact CG1-CE2 4.42Å; V224-Y595 HydrophobicContact CG1-CG 3.7Å; F228-Y595 HydrophobicContact CB-CD1 4.43Å; F228-Y595 HydrophobicContact CB-CE1 4.02Å; F228-Y595 AromaticContact CD1-CD1 3.8Å; F228-Y595 HydrophobicContact CD1-CD1 3.8Å; F228-Y595 AromaticContact CD1-CE1 3.89Å; F228-Y595 HydrophobicContact CD1-CE1 3.89Å; F228-Y595 AromaticContact CD2-CD1 3.4Å; F228-Y595 HydrophobicContact CD2-CD1 3.4Å; F228-Y595 VanDerWaalsContact CD2-CD1 3.4Å; F228-Y595 AromaticContact CD2-CE1 3.87Å; F228-Y595 HydrophobicContact CD2-CE1 3.87Å; F228-Y595 AromaticContact CD2-CG 3.98Å; F228-Y595 HydrophobicContact CD2-CG 3.98Å; F228-Y595 AromaticContact CE1-CD1 3.78Å; F228-Y595 HydrophobicContact CE1-CD1 3.78Å; F228-Y595 HydrophobicContact CE1-CE1 4.3Å; F228-Y595 AromaticContact CE2-CD1 3.43Å; F228-Y595 HydrophobicContact CE2-CD1 3.43Å; F228-Y595 VanDerWaalsContact CE2-CD1 3.43Å; F228-Y595 HydrophobicContact CE2-CE1 4.32Å; F228-Y595 AromaticContact CE2-CG 3.86Å; F228-Y595 HydrophobicContact CE2-CG 3.86Å; F228-Y595 AromaticContact CG-CD1 3.6Å; F228-Y595 HydrophobicContact CG-CD1 3.6Å; F228-Y595 AromaticContact CG-CE1 3.65Å; F228-Y595 HydrophobicContact CG-CE1 3.65Å; F228-Y595 AromaticContact CZ-CD1 3.6Å; F228-Y595 HydrophobicContact CZ-CD1 3.6Å; F228-Y595 HydrophobicContact CZ-CG 4.31Å; Y235-Y595 AromaticContact CD2-CE1 3.94Å; Y235-Y595 HydrophobicContact CD2-CE1 3.94Å; Y235-Y595 AromaticContact CE2-CE1 3.72Å; Y235-Y595 HydrophobicContact CE2-CE1 3.72Å; L245-Y595 PolarHBondContact O-OH 3.22Å; P247-Y595 HydrophobicContact CG-CE2 4.44Å; V591-Y595 HydrophobicContact CG1-CD2 3.84Å; V591-Y595 HydrophobicContact CG1-CE2 3.48Å; V591-Y595 VanDerWaalsContact CG1-CE2 3.46Å; V591-Y595 VanDerWaalsContact O-CD2 3.22Å; V591-Y595 WeakPolarHBondContact O-CD2 3.36Å; V591-Y595 PolarHBondContact O-N 3.36Å; L592-Y595 WeakPolarHBondContact O-CB 3.41Å; L592-Y595 PolarHBondContact O-N 3.28Å; L592-Y595 VanDerWaalsContact O-N 3.11Å; Y595-F598 HydrophobicContact CD1-CD2 4.38Å; Y595-F598 PolarHBondContact O-N 3.02Å; Y595-L599 WeakPolarHBondContact O-CG 3.33Å; Y595-L599 PolarHBondContact O-N 2.99Å
596G90.6Very high86Confident0 Ų022.7 Ų22.70%010%0.104CC..Hα-helixtrans-60.3-46.4170.900000112.8L592 A593 I594 F598 L599 V600L592-G596 PolarHBondContact O-N 3.21Å; A593-G596 PolarHBondContact O-N 3.3Å; I594-G596 VanDerWaalsContact C-N 3.31Å; I594-G596 PolarHBondContact O-N 2.9Å; G596-F598 VanDerWaalsContact C-N 3.33Å; G596-F598 PolarHBondContact O-N 3.16Å; G596-L599 WeakPolarHBondContact O-CB 3.39Å; G596-L599 PolarHBondContact O-N 2.9Å; G596-L599 VanDerWaalsContact O-N 3.16Å; G596-V600 PolarHBondContact O-N 3.21Å
597A90.8Very high86.6Confident0 Ų022.5 Ų22.50%010%0.097CC..Hα-helixtrans-62.4-36.317700000112.9A593 I594 V600 G601 W625 I663A593-A597 PolarHBondContact O-N 3.05Å; I594-A597 PolarHBondContact O-N 2.89Å; A597-V600 PolarHBondContact O-N 3.14Å; A597-G601 PolarHBondContact O-N 3.09Å; A597-G601 VanDerWaalsContact O-N 3.14Å; A597-W625 HydrophobicContact CB-CH2 3.84Å; A597-W625 HydrophobicContact CB-CZ2 4.07Å; A597-W625 HydrophobicContact CB-CZ3 4.18Å; A597-I663 HydrophobicContact CB-CD1 3.82Å; A597-I663 HydrophobicContact CB-CG1 4.16Å; A597-I663 VanDerWaalsContact O-CD1 3.27Å; A597-I663 WeakPolarHBondContact O-CD1 3.41Å
598F91.1Very high86.8Confident0 Ų028.2 Ų28.20%012%0.124CC..Hα-helixtrans-64.7-39.3173.3-70.7-13.6000112.9F228 Y235 P236 F239 L245 I594 Y595 G596 V600 G601 E602 I658 Y662F228-F598 HydrophobicContact CE1-CB 4.49Å; F228-F598 HydrophobicContact CZ-CB 4.45Å; Y235-F598 HydrophobicContact CE1-CE2 4.18Å; Y235-F598 HydrophobicContact CE2-CE2 4.18Å; Y235-F598 AromaticContact CZ-CE2 3.99Å; P236-F598 HydrophobicContact CG-CB 4.12Å; P236-F598 HydrophobicContact CG-CD1 3.75Å; P236-F598 HydrophobicContact CG-CD2 4.3Å; P236-F598 HydrophobicContact CG-CE1 4.18Å; P236-F598 HydrophobicContact CG-CG 3.81Å; F239-F598 HydrophobicContact CB-CZ 4.1Å; F239-F598 AromaticContact CD2-CE1 3.58Å; F239-F598 HydrophobicContact CD2-CE1 3.58Å; F239-F598 AromaticContact CD2-CZ 3.53Å; F239-F598 HydrophobicContact CD2-CZ 3.53Å; F239-F598 AromaticContact CE2-CE1 3.85Å; F239-F598 HydrophobicContact CE2-CE1 3.85Å; F239-F598 HydrophobicContact CE2-CZ 4.25Å; F239-F598 HydrophobicContact CG-CE1 4.41Å; F239-F598 AromaticContact CG-CZ 3.97Å; F239-F598 HydrophobicContact CG-CZ 3.97Å; L245-F598 HydrophobicContact CD1-CE2 3.93Å; L245-F598 HydrophobicContact CD1-CZ 3.81Å; I594-F598 HydrophobicContact CG2-CD1 4.35Å; I594-F598 HydrophobicContact CG2-CD2 4.36Å; I594-F598 HydrophobicContact CG2-CE1 3.98Å; I594-F598 HydrophobicContact CG2-CE2 3.91Å; I594-F598 HydrophobicContact CG2-CZ 3.7Å; I594-F598 WeakPolarHBondContact O-CG 3.36Å; I594-F598 PolarHBondContact O-N 3.03Å; Y595-F598 HydrophobicContact CD1-CD2 4.38Å; Y595-F598 PolarHBondContact O-N 3.02Å; G596-F598 VanDerWaalsContact C-N 3.33Å; G596-F598 PolarHBondContact O-N 3.16Å; F598-V600 VanDerWaalsContact C-N 3.32Å; F598-V600 PolarHBondContact O-N 3.11Å; F598-G601 PolarHBondContact O-N 3.16Å; F598-E602 PolarHBondContact O-N 3.38Å; F598-I658 HydrophobicContact CE1-CD1 3.79Å; F598-I658 HydrophobicContact CE1-CG1 4.16Å; F598-I658 HydrophobicContact CE1-CG2 4.12Å; F598-I658 HydrophobicContact CZ-CD1 3.82Å; F598-Y662 HydrophobicContact CD1-CD1 4.44Å; F598-Y662 HydrophobicContact CD1-CE1 4.13Å
599L91.1Very high86.8Confident2 Ų239.2 Ų39.21%0.0117%0.165CC..Hα-helixtrans-61.7-40174.2-70.7175.2000111.8F227 F228 L427 I445 L448 Y595 G596 K603F227-L599 HydrophobicContact CE1-CD2 3.89Å; F227-L599 HydrophobicContact CZ-CD2 4.03Å; F228-L599 HydrophobicContact CE2-CG 4.48Å; F228-L599 HydrophobicContact CZ-CD2 4.36Å; F228-L599 HydrophobicContact CZ-CG 4.05Å; L427-L599 HydrophobicContact CD2-CD2 4.38Å; I445-L599 HydrophobicContact CD1-CB 4.01Å; I445-L599 HydrophobicContact CG1-CB 3.74Å; I445-L599 HydrophobicContact CG1-CD1 4.12Å; L448-L599 HydrophobicContact CD1-CD1 4.15Å; Y595-L599 WeakPolarHBondContact O-CG 3.33Å; Y595-L599 PolarHBondContact O-N 2.99Å; G596-L599 WeakPolarHBondContact O-CB 3.39Å; G596-L599 PolarHBondContact O-N 2.9Å; G596-L599 VanDerWaalsContact O-N 3.16Å; L599-K603 WeakPolarHBondContact O-CB 3.46Å; L599-K603 PolarHBondContact O-N 3.22Å
600V91.8Very high87Confident0 Ų039.8 Ų39.80%017%0.169CC..Hα-helixtrans-60.1-53.7175174.90000111.2I445 G596 A597 F598 E602 C604 I618 I622 W666I445-V600 HydrophobicContact CD1-CG2 4.3Å; I445-V600 HydrophobicContact CG1-CG2 4.46Å; I445-V600 HydrophobicContact CG2-CG2 3.4Å; I445-V600 VanDerWaalsContact CG2-CG2 3.41Å; G596-V600 PolarHBondContact O-N 3.21Å; A597-V600 PolarHBondContact O-N 3.14Å; F598-V600 VanDerWaalsContact C-N 3.32Å; F598-V600 PolarHBondContact O-N 3.11Å; V600-E602 PolarHBondContact O-N 3.36Å; V600-C604 HydrophobicContact CG1-CB 4.18Å; V600-C604 WeakPolarHBondContact O-CA 3.27Å; V600-C604 VanDerWaalsContact O-CB 3.26Å; V600-C604 WeakPolarHBondContact O-CB 3.47Å; V600-C604 PolarHBondContact O-N 3.07Å; V600-I618 HydrophobicContact CG1-CG2 4.1Å; V600-I618 HydrophobicContact CG2-CG2 3.79Å; V600-I622 HydrophobicContact CB-CD1 4.44Å; V600-I622 HydrophobicContact CG1-CD1 4.49Å; V600-I622 HydrophobicContact CG1-CG1 4.39Å; V600-I622 HydrophobicContact CG2-CD1 4.07Å; V600-I622 HydrophobicContact CG2-CG1 4.26Å; V600-W666 HydrophobicContact CG1-CD2 3.61Å; V600-W666 HydrophobicContact CG1-CE3 3.93Å; V600-W666 HydrophobicContact CG1-CG 4.21Å; V600-W666 HydrophobicContact CG1-CH2 3.93Å; V600-W666 HydrophobicContact CG1-CZ2 3.57Å; V600-W666 HydrophobicContact CG1-CZ3 4.09Å
601G87Confident87.1Confident11.3333 Ų11.333340 Ų4012%0.11718%0.175CC..Hα-helixtrans-64.7-37-176.600000114.3A597 F598 R605 Y662A597-G601 PolarHBondContact O-N 3.09Å; A597-G601 VanDerWaalsContact O-N 3.14Å; F598-G601 PolarHBondContact O-N 3.16Å; G601-R605 WeakPolarHBondContact O-CG 3.46Å; G601-Y662 VanDerWaalsContact C-OH 3.25Å; G601-Y662 VanDerWaalsContact CA-OH 3.31Å; G601-Y662 WeakPolarHBondContact CA-OH 3.44Å
602E87.4Confident87.2Confident53.6667 Ų53.666742.3 Ų42.325%0.25119%0.186SC..Hα-helixtrans-87.5-32.8-178.9-69.4-51.8150.500114.4P236 F598 V600 R605 Y662P236-E602 HydrophobicContact CG-CG 4.04Å; F598-E602 PolarHBondContact O-N 3.38Å; V600-E602 PolarHBondContact O-N 3.36Å; E602-R605 PolarHBondContact O-NE 3.12Å; E602-R605 VanDerWaalsContact O-NE 3.1Å; E602-R605 IonicContact OE2-CZ 3.48Å; E602-R605 IonicContact OE2-NH2 3.22Å; E602-R605 PolarHBondContact OE2-NH2 2.95Å; E602-Y662 VanDerWaalsContact CD-OH 3.31Å; E602-Y662 WeakPolarHBondContact CG-OH 3.3Å; E602-Y662 PolarHBondContact N-OH 2.93Å; E602-Y662 PolarHBondContact OE1-OH 3.05Å
603K87.4Confident87.2Confident34 Ų3447 Ų4715%0.14821%0.208CC..Hα-helixtrans-113.6-21.9-171-58.2-63.2176.6-176.30115.2N234 L427 V430 M441 L599 R605N234-K603 WeakPolarHBondContact OD1-CE 3.49Å; L427-K603 HydrophobicContact CD2-CD 4.4Å; L427-K603 HydrophobicContact CD2-CG 4.2Å; L427-K603 PolarHBondContact O-NZ 3.31Å; V430-K603 HydrophobicContact CG2-CB 4.24Å; V430-K603 VanDerWaalsContact CG2-O 3.29Å; V430-K603 WeakPolarHBondContact CG2-O 3.23Å; V430-K603 PolarHBondContact N-O 3.07Å; V430-K603 VanDerWaalsContact N-O 3.11Å; M441-K603 HydrophobicContact SD-CB 4.31Å; L599-K603 WeakPolarHBondContact O-CB 3.46Å; L599-K603 PolarHBondContact O-N 3.22Å; K603-R605 VanDerWaalsContact C-N 3.3Å; K603-R605 PolarHBondContact O-N 3.15Å
604C87.5Confident87.3Confident0 Ų048.3 Ų48.30%022%0.215CC..  trans-99.539.7177.7-55.80000111.7V430 I445 V600 P606 I618 W666V430-C604 HydrophobicContact CG2-CB 4.25Å; V430-C604 VanDerWaalsContact CG2-SG 3.54Å; V430-C604 WeakPolarHBondContact CG2-SG 3.31Å; I445-C604 WeakPolarHBondContact CD1-SG 3.42Å; V600-C604 HydrophobicContact CG1-CB 4.18Å; V600-C604 WeakPolarHBondContact O-CA 3.27Å; V600-C604 VanDerWaalsContact O-CB 3.26Å; V600-C604 WeakPolarHBondContact O-CB 3.47Å; V600-C604 PolarHBondContact O-N 3.07Å; C604-P606 WeakPolarHBondContact O-CD 3.45Å; C604-I618 HydrophobicContact CB-CD1 4.23Å; C604-W666 HydrophobicContact CB-CZ2 4.35Å; C604-W666 PolarHBondContact O-NE1 3.32Å
605R86.1Confident87.4Confident123.333 Ų123.33348.3 Ų48.347%0.46522%0.215SC..  trans-61.2124.2-177.8-67.9-179.1-179.2178.72.2110.2W431 G601 E602 K603W431-R605 PolarHBondContact NE1-O 3.24Å; G601-R605 WeakPolarHBondContact O-CG 3.46Å; E602-R605 PolarHBondContact O-NE 3.12Å; E602-R605 VanDerWaalsContact O-NE 3.1Å; E602-R605 IonicContact OE2-CZ 3.48Å; E602-R605 IonicContact OE2-NH2 3.22Å; E602-R605 PolarHBondContact OE2-NH2 2.95Å; K603-R605 VanDerWaalsContact C-N 3.3Å; K603-R605 PolarHBondContact O-N 3.15Å
606P84.8Confident87.4Confident18.6667 Ų18.666747.3 Ų47.312%0.12121%0.211CC..  trans-62143.9-179.7-23.235.7000111.2C604 E669 V670 L673C604-P606 WeakPolarHBondContact O-CD 3.45Å; P606-E669 HydrophobicContact CB-CG 4.31Å; P606-E669 HydrophobicContact CG-CB 4.41Å; P606-E669 HydrophobicContact CG-CG 4.21Å; P606-V670 HydrophobicContact CB-CG2 4.34Å; P606-V670 HydrophobicContact CG-CB 4.46Å; P606-V670 HydrophobicContact CG-CG2 3.5Å; P606-V670 VanDerWaalsContact CG-CG2 3.41Å; P606-L673 HydrophobicContact CB-CD1 3.86Å
607R85Confident87.4Confident82 Ų8251.6 Ų51.631%0.30923%0.228SC..  trans-139.5152.9177.3-55.4177.6180179.6-0.4108.1D429 D432 R609 I610 H674D429-R607 IonicContact OD2-CZ 3.32Å; D429-R607 IonicContact OD2-NE 2.71Å; D429-R607 IonicContact OD2-NH2 3.64Å; D429-R607 PolarHBondContact OD2-NH2 2.9Å; D432-R607 VanDerWaalsContact CG-NH1 3.35Å; D432-R607 IonicContact OD1-CZ 3.36Å; D432-R607 IonicContact OD1-NH1 3.1Å; D432-R607 PolarHBondContact OD1-NH1 3.34Å; D432-R607 IonicContact OD1-NH2 2.89Å; D432-R607 IonicContact OD2-CZ 3.36Å; D432-R607 IonicContact OD2-NH1 2.75Å; D432-R607 PolarHBondContact OD2-NH1 3.25Å; D432-R607 IonicContact OD2-NH2 3.21Å; D432-R607 PolarHBondContact OD2-NH2 2.94Å; R607-R609 PolarHBondContact O-N 2.88Å; R607-R609 VanDerWaalsContact O-N 3.15Å; R607-I610 HydrophobicContact CB-CG2 3.9Å; R607-I610 HydrophobicContact CG-CG2 4.47Å; R607-I610 WeakPolarHBondContact O-CG1 3.26Å; R607-H674 PolarHBondContact O-NE2 3.31Å; R607-H674 VanDerWaalsContact O-NE2 3.07Å
608E79.5Confident87.4Confident158 Ų15851.7 Ų51.774%0.73823%0.228SC*.SBendtrans-57.6-19.5-177.8-62.8174.9178.300115.2L673 H674E608-L673 HydrophobicContact CG-CD2 3.86Å; E608-H674 PolarHBondContact O-CE1 3.11Å
609R79.4Confident87.4Confident232.667 Ų232.66751.7 Ų51.788%0.87823%0.228SC*.SBendtrans-134106.2177.1-64.2-175-178-150.4-2.8109.4R607R607-R609 PolarHBondContact O-N 2.88Å; R607-R609 VanDerWaalsContact O-N 3.15Å
610I85.7Confident87.4Confident33.3333 Ų33.333351.6 Ų51.617%0.17123%0.228CC..SBendtrans-145.3166.7-179.655.5-177.6000109.4W431 R607 L612 L615 H674W431-I610 HydrophobicContact CD2-CB 4.15Å; W431-I610 HydrophobicContact CD2-CG2 3.61Å; W431-I610 HydrophobicContact CE3-CB 4.07Å; W431-I610 HydrophobicContact CE3-CG2 4.05Å; W431-I610 HydrophobicContact CG-CG2 3.94Å; W431-I610 HydrophobicContact CH2-CB 4.15Å; W431-I610 HydrophobicContact CH2-CD1 4.4Å; W431-I610 HydrophobicContact CH2-CG2 4.39Å; W431-I610 HydrophobicContact CZ2-CB 4.23Å; W431-I610 HydrophobicContact CZ2-CD1 4.22Å; W431-I610 HydrophobicContact CZ2-CG2 3.99Å; W431-I610 HydrophobicContact CZ3-CB 4.07Å; W431-I610 HydrophobicContact CZ3-CG2 4.41Å; R607-I610 HydrophobicContact CB-CG2 3.9Å; R607-I610 HydrophobicContact CG-CG2 4.47Å; R607-I610 WeakPolarHBondContact O-CG1 3.26Å; I610-L612 PolarHBondContact O-N 3.4Å; I610-L612 VanDerWaalsContact O-N 3.11Å; I610-L615 HydrophobicContact CD1-CB 3.98Å; I610-L615 HydrophobicContact CD1-CD1 4.01Å; I610-L615 HydrophobicContact CD1-CD2 3.48Å; I610-L615 VanDerWaalsContact CD1-CD2 3.46Å; I610-L615 HydrophobicContact CD1-CG 4.14Å; I610-L615 HydrophobicContact CG1-CD2 4.49Å; I610-H674 VanDerWaalsContact CD1-CD2 3.48Å; I610-H674 WeakPolarHBondContact CD1-CD2 3.26Å
611N85.4Confident87.2Confident65.6667 Ų65.666751.6 Ų51.635%0.35123%0.228SC..  trans-73.4111.8166.8-179.7-37.3000108.7E613 L614 L615N611-E613 VanDerWaalsContact C-N 3.29Å; N611-E613 PolarHBondContact O-N 3.23Å; N611-E613 WeakPolarHBondContact OD1-CA 3.45Å; N611-E613 VanDerWaalsContact OD1-CB 3.27Å; N611-E613 WeakPolarHBondContact OD1-CB 3.27Å; N611-E613 PolarHBondContact OD1-N 3.14Å; N611-L614 HydrophobicContact CB-CB 4.13Å; N611-L614 HydrophobicContact CB-CD1 3.96Å; N611-L614 HydrophobicContact CB-CG 4.1Å; N611-L614 PolarHBondContact O-N 3.13Å; N611-L614 PolarHBondContact OD1-N 3.24Å; N611-L614 VanDerWaalsContact OD1-N 3.09Å; N611-L615 PolarHBondContact O-N 3.14Å; N611-L615 VanDerWaalsContact O-N 3.12Å
612L86.8Confident87.5Confident50.6667 Ų50.666751.1 Ų51.127%0.26522%0.222SC..Hα-helixtrans-64.1-36.9-177.6178.361.4000112.6I610 L614 L615 T616 H674 E676 A677I610-L612 PolarHBondContact O-N 3.4Å; I610-L612 VanDerWaalsContact O-N 3.11Å; L612-L614 VanDerWaalsContact C-N 3.32Å; L612-L614 PolarHBondContact O-N 3.03Å; L612-L615 PolarHBondContact O-N 3.24Å; L612-T616 VanDerWaalsContact O-CB 3.31Å; L612-T616 WeakPolarHBondContact O-CB 3.39Å; L612-T616 PolarHBondContact O-N 3.36Å; L612-T616 PolarHBondContact O-OG1 2.94Å; L612-H674 HydrophobicContact CD1-CB 4.27Å; L612-E676 HydrophobicContact CD1-CG 3.86Å; L612-E676 HydrophobicContact CD2-CG 3.64Å; L612-E676 HydrophobicContact CG-CG 4.42Å; L612-A677 HydrophobicContact CD1-CB 3.75Å
613E87.9Confident87.6Confident100 Ų10048.6 Ų48.647%0.46721%0.211SC..Hα-helixtrans-61.2-45178.7-49.1-173.8141.200110.8N611 T616 R617 Y689N611-E613 VanDerWaalsContact C-N 3.29Å; N611-E613 PolarHBondContact O-N 3.23Å; N611-E613 WeakPolarHBondContact OD1-CA 3.45Å; N611-E613 VanDerWaalsContact OD1-CB 3.27Å; N611-E613 WeakPolarHBondContact OD1-CB 3.27Å; N611-E613 PolarHBondContact OD1-N 3.14Å; E613-T616 PolarHBondContact O-N 2.98Å; E613-R617 WeakPolarHBondContact O-CB 3.35Å; E613-R617 PolarHBondContact O-N 2.94Å; E613-Y689 HydrophobicContact CB-CD1 3.8Å; E613-Y689 HydrophobicContact CB-CD2 4Å; E613-Y689 HydrophobicContact CB-CE1 4.06Å; E613-Y689 HydrophobicContact CB-CE2 4.24Å; E613-Y689 HydrophobicContact CB-CG 3.75Å; E613-Y689 HydrophobicContact CG-CD1 3.79Å; E613-Y689 HydrophobicContact CG-CE1 3.65Å; E613-Y689 HydrophobicContact CG-CE2 4.46Å; E613-Y689 HydrophobicContact CG-CG 4.26Å; E613-Y689 WeakPolarHBondContact OE1-CE1 3.35Å
614L88.6Confident87.6Confident27.6667 Ų27.666747 Ų4715%0.14520%0.204CC..Hα-helixtrans-67.1-41.2179.1-70-175000112.1W431 Q438 I442 N611 L612 R617 I618W431-L614 HydrophobicContact CZ3-CB 4.24Å; Q438-L614 HydrophobicContact CG-CD1 4.15Å; I442-L614 HydrophobicContact CD1-CB 3.84Å; I442-L614 HydrophobicContact CD1-CD1 3.74Å; I442-L614 HydrophobicContact CD1-CD2 3.78Å; I442-L614 HydrophobicContact CD1-CG 3.98Å; N611-L614 HydrophobicContact CB-CB 4.13Å; N611-L614 HydrophobicContact CB-CD1 3.96Å; N611-L614 HydrophobicContact CB-CG 4.1Å; N611-L614 PolarHBondContact O-N 3.13Å; N611-L614 PolarHBondContact OD1-N 3.24Å; N611-L614 VanDerWaalsContact OD1-N 3.09Å; L612-L614 VanDerWaalsContact C-N 3.32Å; L612-L614 PolarHBondContact O-N 3.03Å; L614-R617 PolarHBondContact O-N 3.48Å; L614-I618 WeakPolarHBondContact O-CD1 3.37Å; L614-I618 VanDerWaalsContact O-CG1 3.3Å; L614-I618 WeakPolarHBondContact O-CG1 3.38Å; L614-I618 PolarHBondContact O-N 3.14Å; L614-I618 VanDerWaalsContact O-N 3.14Å
615L90.9Very high87.7Confident0 Ų047 Ų470%020%0.204CC..Hα-helixtrans-62.1-47.3172.2178.365.1000111.3W431 I610 N611 L612 R617 I618 T619 W666 V670 H674 A677W431-L615 HydrophobicContact CH2-CB 4.12Å; I610-L615 HydrophobicContact CD1-CB 3.98Å; I610-L615 HydrophobicContact CD1-CD1 4.01Å; I610-L615 HydrophobicContact CD1-CD2 3.48Å; I610-L615 VanDerWaalsContact CD1-CD2 3.46Å; I610-L615 HydrophobicContact CD1-CG 4.14Å; I610-L615 HydrophobicContact CG1-CD2 4.49Å; N611-L615 PolarHBondContact O-N 3.14Å; N611-L615 VanDerWaalsContact O-N 3.12Å; L612-L615 PolarHBondContact O-N 3.24Å; L615-R617 VanDerWaalsContact C-N 3.31Å; L615-R617 PolarHBondContact O-N 3.24Å; L615-I618 WeakPolarHBondContact O-CB 3.42Å; L615-I618 PolarHBondContact O-N 3.12Å; L615-I618 VanDerWaalsContact O-N 3.14Å; L615-T619 WeakPolarHBondContact O-CB 3.43Å; L615-T619 PolarHBondContact O-N 3.12Å; L615-T619 PolarHBondContact O-OG1 3.09Å; L615-W666 HydrophobicContact CD1-CH2 4.15Å; L615-W666 HydrophobicContact CD1-CZ2 3.88Å; L615-V670 HydrophobicContact CD1-CG2 4.1Å; L615-V670 HydrophobicContact CD2-CG1 4.1Å; L615-V670 HydrophobicContact CD2-CG2 4.44Å; L615-H674 HydrophobicContact CD2-CB 3.84Å; L615-A677 HydrophobicContact CD2-CB 3.97Å; L615-A677 HydrophobicContact CG-CB 4.29Å
616T90.5Very high87.8Confident0.333333 Ų0.33333341.1 Ų41.10%0.00218%0.182CC..Hα-helixtrans-61-40.1-178.6-53.40000110.8L612 E613 I618 T619 A620 A680 V681 Y689 A690L612-T616 VanDerWaalsContact O-CB 3.31Å; L612-T616 WeakPolarHBondContact O-CB 3.39Å; L612-T616 PolarHBondContact O-N 3.36Å; L612-T616 PolarHBondContact O-OG1 2.94Å; E613-T616 PolarHBondContact O-N 2.98Å; T616-I618 PolarHBondContact O-N 3.21Å; T616-T619 PolarHBondContact O-N 3.38Å; T616-A620 WeakPolarHBondContact O-CB 3.28Å; T616-A620 PolarHBondContact O-N 3.04Å; T616-A680 HydrophobicContact CG2-CB 3.82Å; T616-V681 HydrophobicContact CG2-CG2 3.52Å; T616-V681 VanDerWaalsContact CG2-CG2 3.5Å; T616-V681 WeakPolarHBondContact O-CG2 3.32Å; T616-Y689 HydrophobicContact CG2-CD2 4.04Å; T616-Y689 HydrophobicContact CG2-CE2 3.77Å; T616-A690 HydrophobicContact CG2-CB 3.68Å
617R90.9Very high87.8Confident91 Ų9140.8 Ų40.834%0.34318%0.178SC..Hα-helixtrans-62.3-41.1174.7-165.9-177.4175138.7-3.6112.7I446 E613 L614 L615 A620 G621 Y689 V692I446-R617 HydrophobicContact CD1-CG 3.59Å; I446-R617 VanDerWaalsContact CD1-NE 3.26Å; E613-R617 WeakPolarHBondContact O-CB 3.35Å; E613-R617 PolarHBondContact O-N 2.94Å; L614-R617 PolarHBondContact O-N 3.48Å; L615-R617 VanDerWaalsContact C-N 3.31Å; L615-R617 PolarHBondContact O-N 3.24Å; R617-A620 PolarHBondContact O-N 3.2Å; R617-G621 PolarHBondContact O-N 3.22Å; R617-G621 VanDerWaalsContact O-N 3.11Å; R617-Y689 WeakPolarHBondContact CA-O 3.37Å; R617-Y689 VanDerWaalsContact CB-O 3.26Å; R617-Y689 WeakPolarHBondContact CB-O 3.34Å; R617-Y689 VanDerWaalsContact CG-O 3.28Å; R617-Y689 WeakPolarHBondContact CG-O 3.48Å; R617-V692 HydrophobicContact CG-CG2 3.62Å
618I91.1Very high87.6Confident1 Ų137.1 Ų37.11%0.00517%0.165CC..Hα-helixtrans-65.5-45.6174.2-63.8159.4000110.5I442 I445 V600 C604 L614 L615 T616 A620 G621 I622 W666I442-I618 HydrophobicContact CG1-CD1 4.24Å; I442-I618 HydrophobicContact CG2-CG1 4.11Å; I445-I618 HydrophobicContact CG2-CG2 4.41Å; V600-I618 HydrophobicContact CG1-CG2 4.1Å; V600-I618 HydrophobicContact CG2-CG2 3.79Å; C604-I618 HydrophobicContact CB-CD1 4.23Å; L614-I618 WeakPolarHBondContact O-CD1 3.37Å; L614-I618 VanDerWaalsContact O-CG1 3.3Å; L614-I618 WeakPolarHBondContact O-CG1 3.38Å; L614-I618 PolarHBondContact O-N 3.14Å; L614-I618 VanDerWaalsContact O-N 3.14Å; L615-I618 WeakPolarHBondContact O-CB 3.42Å; L615-I618 PolarHBondContact O-N 3.12Å; L615-I618 VanDerWaalsContact O-N 3.14Å; T616-I618 PolarHBondContact O-N 3.21Å; I618-A620 VanDerWaalsContact C-N 3.31Å; I618-A620 PolarHBondContact O-N 3.25Å; I618-G621 PolarHBondContact O-N 3.3Å; I618-G621 VanDerWaalsContact O-N 3.12Å; I618-I622 HydrophobicContact CG2-CG1 4.49Å; I618-I622 PolarHBondContact O-N 3.39Å; I618-W666 HydrophobicContact CG2-CH2 3.95Å; I618-W666 HydrophobicContact CG2-CZ2 4.15Å
619T91Very high87.7Confident0.666667 Ų0.66666729.6 Ų29.60%0.00413%0.13CC..Hα-helixtrans-60.2-40.5178.5-57.20000111.4L615 T616 I622 F623 I678 V681L615-T619 WeakPolarHBondContact O-CB 3.43Å; L615-T619 PolarHBondContact O-N 3.12Å; L615-T619 PolarHBondContact O-OG1 3.09Å; T616-T619 PolarHBondContact O-N 3.38Å; T619-I622 PolarHBondContact O-N 2.78Å; T619-F623 HydrophobicContact CG2-CD1 4.36Å; T619-F623 HydrophobicContact CG2-CD2 4.39Å; T619-F623 HydrophobicContact CG2-CE1 4.03Å; T619-F623 HydrophobicContact CG2-CE2 4.05Å; T619-F623 HydrophobicContact CG2-CG 4.47Å; T619-F623 HydrophobicContact CG2-CZ 3.84Å; T619-F623 WeakPolarHBondContact O-CG 3.46Å; T619-F623 PolarHBondContact O-N 3.03Å; T619-I678 HydrophobicContact CG2-CD1 3.79Å; T619-I678 HydrophobicContact CG2-CG1 4.38Å; T619-V681 HydrophobicContact CG2-CG2 4.13Å
620A90.6Very high87.3Confident0 Ų021.6 Ų21.60%010%0.104CC..Hα-helixtrans-61.2-45.3173.600000112.7T616 R617 I618 I622 F623 N624 V681 A690 V692T616-A620 WeakPolarHBondContact O-CB 3.28Å; T616-A620 PolarHBondContact O-N 3.04Å; R617-A620 PolarHBondContact O-N 3.2Å; I618-A620 VanDerWaalsContact C-N 3.31Å; I618-A620 PolarHBondContact O-N 3.25Å; A620-I622 VanDerWaalsContact C-N 3.35Å; A620-I622 PolarHBondContact O-N 3.17Å; A620-F623 PolarHBondContact O-N 2.76Å; A620-N624 WeakPolarHBondContact O-CB 3.37Å; A620-N624 PolarHBondContact O-N 3.22Å; A620-V681 HydrophobicContact CB-CG1 3.96Å; A620-V681 HydrophobicContact CB-CG2 3.97Å; A620-A690 VanDerWaalsContact CB-O 3.29Å; A620-A690 WeakPolarHBondContact CB-O 3.36Å; A620-V692 HydrophobicContact CB-CB 3.82Å; A620-V692 HydrophobicContact CB-CG2 3.84Å
621G88.9Confident86.3Confident0.333333 Ų0.33333327.2 Ų27.20%0.00312%0.124CC..Hα-helixtrans-59.7-43.3174.500000112.7R617 I618 N624 W625R617-G621 PolarHBondContact O-N 3.22Å; R617-G621 VanDerWaalsContact O-N 3.11Å; I618-G621 PolarHBondContact O-N 3.3Å; I618-G621 VanDerWaalsContact O-N 3.12Å; G621-N624 PolarHBondContact O-N 3.21Å; G621-W625 WeakPolarHBondContact O-CB 3.31Å; G621-W625 PolarHBondContact O-N 3.22Å
622I91.3Very high85.2Confident0.666667 Ų0.66666724.9 Ų24.90%0.00311%0.112CC..Hα-helixtrans-65.1-45.4176-70.2-67.5000111.8T449 V600 I618 T619 A620 N624 W625 F626 I663 W666 I667T449-I622 HydrophobicContact CG2-CD1 3.96Å; V600-I622 HydrophobicContact CB-CD1 4.44Å; V600-I622 HydrophobicContact CG1-CD1 4.49Å; V600-I622 HydrophobicContact CG1-CG1 4.39Å; V600-I622 HydrophobicContact CG2-CD1 4.07Å; V600-I622 HydrophobicContact CG2-CG1 4.26Å; I618-I622 HydrophobicContact CG2-CG1 4.49Å; I618-I622 PolarHBondContact O-N 3.39Å; T619-I622 PolarHBondContact O-N 2.78Å; A620-I622 VanDerWaalsContact C-N 3.35Å; A620-I622 PolarHBondContact O-N 3.17Å; I622-N624 VanDerWaalsContact C-N 3.28Å; I622-N624 PolarHBondContact O-N 3.28Å; I622-W625 HydrophobicContact CD1-CE3 4.46Å; I622-W625 WeakPolarHBondContact O-CA 3.38Å; I622-W625 VanDerWaalsContact O-CB 3.31Å; I622-W625 WeakPolarHBondContact O-CB 3.37Å; I622-W625 PolarHBondContact O-N 3.08Å; I622-F626 HydrophobicContact CG2-CD2 3.97Å; I622-F626 HydrophobicContact CG2-CE2 3.9Å; I622-F626 WeakPolarHBondContact O-CD2 3.37Å; I622-F626 PolarHBondContact O-N 3.11Å; I622-I663 HydrophobicContact CG2-CG2 3.85Å; I622-W666 HydrophobicContact CG1-CZ3 4.42Å; I622-I667 HydrophobicContact CG2-CD1 4.17Å
623F91.2Very high83.5Confident0 Ų025.7 Ų25.70%013%0.126CC..Hα-helixtrans-66-31.8177.7-72.53.1000112.2T619 A620 F626 M627 I667 I678 V681 L682 R712 L716 I721T619-F623 HydrophobicContact CG2-CD1 4.36Å; T619-F623 HydrophobicContact CG2-CD2 4.39Å; T619-F623 HydrophobicContact CG2-CE1 4.03Å; T619-F623 HydrophobicContact CG2-CE2 4.05Å; T619-F623 HydrophobicContact CG2-CG 4.47Å; T619-F623 HydrophobicContact CG2-CZ 3.84Å; T619-F623 WeakPolarHBondContact O-CG 3.46Å; T619-F623 PolarHBondContact O-N 3.03Å; A620-F623 PolarHBondContact O-N 2.76Å; F623-F626 PolarHBondContact O-N 3.13Å; F623-M627 PolarHBondContact O-N 3.36Å; F623-I667 HydrophobicContact CE1-CD1 4.05Å; F623-I667 HydrophobicContact CE1-CG1 4.4Å; F623-I667 HydrophobicContact CE1-CG2 4.22Å; F623-I667 HydrophobicContact CZ-CG2 4.45Å; F623-I678 HydrophobicContact CE2-CD1 4.45Å; F623-I678 HydrophobicContact CE2-CG2 4.33Å; F623-I678 HydrophobicContact CZ-CD1 3.74Å; F623-I678 HydrophobicContact CZ-CG1 4.37Å; F623-I678 HydrophobicContact CZ-CG2 4.33Å; F623-V681 HydrophobicContact CB-CG1 4.33Å; F623-V681 HydrophobicContact CD2-CB 4.26Å; F623-V681 HydrophobicContact CD2-CG1 3.51Å; F623-V681 HydrophobicContact CE2-CB 4.46Å; F623-V681 HydrophobicContact CE2-CG1 4.18Å; F623-V681 HydrophobicContact CG-CG1 4.26Å; F623-L682 HydrophobicContact CD2-CD2 3.75Å; F623-L682 HydrophobicContact CD2-CG 4.3Å; F623-L682 HydrophobicContact CE2-CD1 4.21Å; F623-L682 HydrophobicContact CE2-CD2 3.76Å; F623-L682 HydrophobicContact CE2-CG 3.89Å; F623-R712 HydrophobicContact CB-CG 4.32Å; F623-L716 HydrophobicContact CB-CD1 4.3Å; F623-L716 HydrophobicContact CD1-CD1 4.2Å; F623-L716 HydrophobicContact CD1-CD2 3.87Å; F623-L716 HydrophobicContact CD2-CD1 3.62Å; F623-L716 HydrophobicContact CE1-CD1 4.42Å; F623-L716 HydrophobicContact CE1-CD2 4.24Å; F623-L716 HydrophobicContact CE2-CD1 3.92Å; F623-L716 HydrophobicContact CG-CD1 3.79Å; F623-L716 HydrophobicContact CG-CD2 4.15Å; F623-L716 HydrophobicContact CZ-CD1 4.32Å; F623-I721 HydrophobicContact CE1-CG2 4.25Å; F623-I721 HydrophobicContact CZ-CG2 4Å
624N87Confident81.6Confident0.333333 Ų0.33333327.5 Ų27.50%0.00214%0.135CC..Hα-helixtrans-67.9-40.4171.5-151.977.3000111.9L450 M453 A620 G621 I622 F626 M627 D628 S694 H708 R712L450-N624 HydrophobicContact CD2-CB 4.36Å; M453-N624 WeakPolarHBondContact CE-ND2 3.29Å; A620-N624 WeakPolarHBondContact O-CB 3.37Å; A620-N624 PolarHBondContact O-N 3.22Å; G621-N624 PolarHBondContact O-N 3.21Å; I622-N624 VanDerWaalsContact C-N 3.28Å; I622-N624 PolarHBondContact O-N 3.28Å; N624-F626 VanDerWaalsContact C-N 3.34Å; N624-F626 PolarHBondContact O-N 3.27Å; N624-M627 WeakPolarHBondContact O-CB 3.28Å; N624-M627 PolarHBondContact O-N 3.12Å; N624-M627 VanDerWaalsContact O-N 3.12Å; N624-D628 PolarHBondContact ND2-OD1 3.44Å; N624-D628 PolarHBondContact ND2-OD2 2.97Å; N624-D628 PolarHBondContact O-N 3.28Å; N624-S694 WeakPolarHBondContact OD1-CB 3.32Å; N624-H708 PolarHBondContact OD1-CE1 3.39Å; N624-R712 PolarHBondContact OD1-NH2 3.06Å
625W88.8Confident79.2Confident0 Ų029 Ų290%015%0.151CC..Hα-helixtrans-60.7-41.2173.4176.971.4000112.8T452 A593 I594 A597 G621 I622 M627 D628 T629 L655 I658 K659 I663T452-W625 VanDerWaalsContact OG1-CD1 3.31Å; A593-W625 VanDerWaalsContact CB-NE1 3.32Å; I594-W625 HydrophobicContact CG1-CZ2 4.34Å; A597-W625 HydrophobicContact CB-CH2 3.84Å; A597-W625 HydrophobicContact CB-CZ2 4.07Å; A597-W625 HydrophobicContact CB-CZ3 4.18Å; G621-W625 WeakPolarHBondContact O-CB 3.31Å; G621-W625 PolarHBondContact O-N 3.22Å; I622-W625 HydrophobicContact CD1-CE3 4.46Å; I622-W625 WeakPolarHBondContact O-CA 3.38Å; I622-W625 VanDerWaalsContact O-CB 3.31Å; I622-W625 WeakPolarHBondContact O-CB 3.37Å; I622-W625 PolarHBondContact O-N 3.08Å; W625-M627 VanDerWaalsContact C-N 3.3Å; W625-M627 PolarHBondContact O-N 3.01Å; W625-D628 PolarHBondContact O-N 3.2Å; W625-T629 HydrophobicContact CG-CG2 4.5Å; W625-T629 WeakPolarHBondContact O-CB 3.4Å; W625-T629 VanDerWaalsContact O-CG2 3.26Å; W625-T629 WeakPolarHBondContact O-CG2 3.29Å; W625-T629 PolarHBondContact O-N 3.16Å; W625-T629 VanDerWaalsContact O-N 3.15Å; W625-T629 PolarHBondContact O-OG1 2.96Å; W625-L655 HydrophobicContact CH2-CD1 3.92Å; W625-L655 HydrophobicContact CZ2-CD1 3.29Å; W625-I658 HydrophobicContact CH2-CG2 4.29Å; W625-K659 HydrophobicContact CH2-CG 3.86Å; W625-K659 HydrophobicContact CZ3-CG 3.74Å; W625-I663 HydrophobicContact CH2-CG1 4.45Å; W625-I663 HydrophobicContact CZ3-CG1 4.14Å
626F88.8Confident76.9Confident0.666667 Ų0.66666732.2 Ų32.20%0.00317%0.173CC..Hα-helixtrans-57.2-42.3171.7-92.5-105.6000111.8I622 F623 N624 T629 K659 I663 I667 L716 Y719 I721I622-F626 HydrophobicContact CG2-CD2 3.97Å; I622-F626 HydrophobicContact CG2-CE2 3.9Å; I622-F626 WeakPolarHBondContact O-CD2 3.37Å; I622-F626 PolarHBondContact O-N 3.11Å; F623-F626 PolarHBondContact O-N 3.13Å; N624-F626 VanDerWaalsContact C-N 3.34Å; N624-F626 PolarHBondContact O-N 3.27Å; F626-T629 PolarHBondContact O-OG1 3.15Å; F626-T629 VanDerWaalsContact O-OG1 3.13Å; F626-K659 HydrophobicContact CD1-CD 4.22Å; F626-K659 HydrophobicContact CD1-CG 4.48Å; F626-K659 HydrophobicContact CE1-CB 3.98Å; F626-K659 HydrophobicContact CE1-CD 4.07Å; F626-K659 HydrophobicContact CE1-CG 4.07Å; F626-K659 HydrophobicContact CE2-CB 4.44Å; F626-K659 HydrophobicContact CE2-CG 4.22Å; F626-K659 HydrophobicContact CZ-CB 3.86Å; F626-K659 HydrophobicContact CZ-CD 4.42Å; F626-K659 HydrophobicContact CZ-CG 3.97Å; F626-I663 HydrophobicContact CE2-CB 4.49Å; F626-I663 HydrophobicContact CE2-CG2 3.85Å; F626-I663 HydrophobicContact CZ-CG2 4.33Å; F626-I667 HydrophobicContact CE2-CD1 3.91Å; F626-I667 HydrophobicContact CZ-CD1 4.02Å; F626-L716 HydrophobicContact CB-CD2 3.97Å; F626-L716 HydrophobicContact CD1-CD2 4.08Å; F626-L716 HydrophobicContact CD2-CD2 4.37Å; F626-L716 HydrophobicContact CG-CD2 4.01Å; F626-Y719 AromaticContact CD1-CD2 3.75Å; F626-Y719 HydrophobicContact CD1-CD2 3.75Å; F626-Y719 HydrophobicContact CD1-CE1 4.32Å; F626-Y719 AromaticContact CD1-CE2 3.58Å; F626-Y719 HydrophobicContact CD1-CE2 3.58Å; F626-Y719 HydrophobicContact CD1-CG 4.35Å; F626-Y719 AromaticContact CD1-CZ 3.87Å; F626-Y719 AromaticContact CE1-CD1 3.78Å; F626-Y719 HydrophobicContact CE1-CD1 3.96Å; F626-Y719 AromaticContact CE1-CD2 3.66Å; F626-Y719 HydrophobicContact CE1-CD2 3.66Å; F626-Y719 AromaticContact CE1-CE1 3.78Å; F626-Y719 HydrophobicContact CE1-CE1 4.02Å; F626-Y719 AromaticContact CE1-CE2 3.74Å; F626-Y719 HydrophobicContact CE1-CE2 3.74Å; F626-Y719 AromaticContact CE1-CG 3.78Å; F626-Y719 HydrophobicContact CE1-CG 3.78Å; F626-Y719 AromaticContact CE1-CZ 3.91Å; F626-I721 HydrophobicContact CD1-CD1 4.48Å; F626-I721 HydrophobicContact CE1-CD1 4.01Å; F626-I721 HydrophobicContact CZ-CD1 4.24Å
627M83.8Confident74.5Confident11.3333 Ų11.333338 Ų386%0.05620%0.203CC..Hα-helixtrans-70.7-47.5179.4-176.5-169.5-165.200113.3F623 N624 W625 T629 I630 H708 S711 R712F623-M627 PolarHBondContact O-N 3.36Å; N624-M627 WeakPolarHBondContact O-CB 3.28Å; N624-M627 PolarHBondContact O-N 3.12Å; N624-M627 VanDerWaalsContact O-N 3.12Å; W625-M627 VanDerWaalsContact C-N 3.3Å; W625-M627 PolarHBondContact O-N 3.01Å; M627-T629 PolarHBondContact O-N 3.19Å; M627-T629 VanDerWaalsContact O-N 3.17Å; M627-I630 HydrophobicContact CG-CD1 4.32Å; M627-I630 WeakPolarHBondContact O-CD1 3.33Å; M627-I630 VanDerWaalsContact O-CG1 3.26Å; M627-I630 WeakPolarHBondContact O-CG1 3.34Å; M627-I630 PolarHBondContact O-N 3.1Å; M627-H708 HydrophobicContact CE-CB 4.43Å; M627-H708 VanDerWaalsContact CE-CD2 3.47Å; M627-H708 WeakPolarHBondContact CE-CD2 3.34Å; M627-H708 VanDerWaalsContact CE-NE2 3.33Å; M627-H708 WeakPolarHBondContact CE-NE2 3.3Å; M627-H708 WeakPolarHBondContact CE-O 3.43Å; M627-H708 PolarHBondContact SD-CE1 3.05Å; M627-H708 PolarHBondContact SD-NE2 3.03Å; M627-H708 VanDerWaalsContact SD-NE2 3.41Å; M627-S711 VanDerWaalsContact CE-CB 3.4Å; M627-R712 HydrophobicContact CE-CB 3.62Å; M627-R712 HydrophobicContact CE-CG 4.32Å; M627-R712 VanDerWaalsContact SD-CA 3.59Å; M627-R712 HydrophobicContact SD-CB 3.73Å; M627-R712 PolarHBondContact SD-N 3.36Å; M627-R712 VanDerWaalsContact SD-N 3.41Å
628D81.3Confident72.1Confident5.66667 Ų5.6666736.5 Ų36.53%0.0320%0.204CC..Hα-helixtrans-63.7-25.8-179.1-73.4-37.9000111.9M453 R457 N624 W625M453-D628 WeakPolarHBondContact CG-OD2 3.46Å; R457-D628 IonicContact CZ-OD1 2.73Å; R457-D628 IonicContact NH1-OD1 3.66Å; R457-D628 PolarHBondContact NH1-OD1 3.19Å; R457-D628 IonicContact NH2-OD1 2.8Å; N624-D628 PolarHBondContact ND2-OD1 3.44Å; N624-D628 PolarHBondContact ND2-OD2 2.97Å; N624-D628 PolarHBondContact O-N 3.28Å; W625-D628 PolarHBondContact O-N 3.2Å
629T81Confident69.8Low0 Ų043.3 Ų43.30%023%0.234CC..THydrogen-bonded Turntrans-90.7-4.2-17756.50000115.3T452 W625 F626 M627 Y631 T632 L655 K659T452-T629 HydrophobicContact CG2-CG2 3.85Å; W625-T629 HydrophobicContact CG-CG2 4.5Å; W625-T629 WeakPolarHBondContact O-CB 3.4Å; W625-T629 VanDerWaalsContact O-CG2 3.26Å; W625-T629 WeakPolarHBondContact O-CG2 3.29Å; W625-T629 PolarHBondContact O-N 3.16Å; W625-T629 VanDerWaalsContact O-N 3.15Å; W625-T629 PolarHBondContact O-OG1 2.96Å; F626-T629 PolarHBondContact O-OG1 3.15Å; F626-T629 VanDerWaalsContact O-OG1 3.13Å; M627-T629 PolarHBondContact O-N 3.19Å; M627-T629 VanDerWaalsContact O-N 3.17Å; T629-Y631 VanDerWaalsContact C-N 3.32Å; T629-Y631 PolarHBondContact O-N 3.26Å; T629-T632 HydrophobicContact CG2-CG2 4.39Å; T629-T632 WeakPolarHBondContact O-CB 3.24Å; T629-T632 PolarHBondContact O-N 3.19Å; T629-T632 VanDerWaalsContact O-N 3.13Å; T629-T632 PolarHBondContact O-OG1 3Å; T629-L655 HydrophobicContact CG2-CD1 4.36Å; T629-L655 HydrophobicContact CG2-CD2 3.98Å; T629-K659 WeakPolarHBondContact OG1-CE 3.31Å; T629-K659 PolarHBondContact OG1-NZ 3.14Å
630I72.3Confident67.7Low65 Ų6545.8 Ų45.833%0.33325%0.247SC..G310 helixtrans-52.5-49.5179.5-59.1165.9000111.5M627 T632 S715M627-I630 HydrophobicContact CG-CD1 4.32Å; M627-I630 WeakPolarHBondContact O-CD1 3.33Å; M627-I630 VanDerWaalsContact O-CG1 3.26Å; M627-I630 WeakPolarHBondContact O-CG1 3.34Å; M627-I630 PolarHBondContact O-N 3.1Å; I630-T632 VanDerWaalsContact C-N 3.33Å; I630-T632 PolarHBondContact O-N 3.11Å; I630-S715 VanDerWaalsContact CD1-CB 3.42Å
631Y65.1Low65.7Low150.667 Ų150.66750.2 Ų50.259%0.59129%0.293SS*.G310 helixtrans-79.7-3.3-176.3-55.7-77.2000113.5T629 A633 E634T629-Y631 VanDerWaalsContact C-N 3.32Å; T629-Y631 PolarHBondContact O-N 3.26Å; Y631-A633 VanDerWaalsContact C-N 3.27Å; Y631-A633 PolarHBondContact O-N 3.26Å; Y631-E634 PolarHBondContact O-N 3.04Å
632T62.1Low63.8Low17 Ų1760.7 Ų60.710%0.10433%0.332CS..G310 helixtrans-77.4-13.6-175.8660000113.7R590 T629 I630 E634 L655R590-T632 PolarHBondContact NH1-O 3.17Å; T629-T632 HydrophobicContact CG2-CG2 4.39Å; T629-T632 WeakPolarHBondContact O-CB 3.24Å; T629-T632 PolarHBondContact O-N 3.19Å; T629-T632 VanDerWaalsContact O-N 3.13Å; T629-T632 PolarHBondContact O-OG1 3Å; I630-T632 VanDerWaalsContact C-N 3.33Å; I630-T632 PolarHBondContact O-N 3.11Å; T632-E634 VanDerWaalsContact C-N 3.31Å; T632-L655 VanDerWaalsContact OG1-CD2 3.31Å; T632-L655 WeakPolarHBondContact OG1-CD2 3.42Å
633A51.3Low61.5Low66.6667 Ų66.666763.2 Ų63.255%0.55136%0.357SS*.G310 helixtrans-76.1-13.1173.500000113.7Y631 A635Y631-A633 VanDerWaalsContact C-N 3.27Å; Y631-A633 PolarHBondContact O-N 3.26Å; A633-A635 PolarHBondContact O-N 2.99Å
634E47Very low59.2Low139 Ų13967.6 Ų67.665%0.6538%0.381SS*.SBendtrans-70.6125.1-179.6-68.8-169.4170.300111.8Y631 T632 S636Y631-E634 PolarHBondContact O-N 3.04Å; T632-E634 VanDerWaalsContact C-N 3.31Å; E634-S636 PolarHBondContact O-N 3.12Å
635A38.6Very low56.8Low59.6667 Ų59.666773 Ų7349%0.49341%0.409SS..  trans-72.3100.1-171.900000111.8A633 I637 Y649A633-A635 PolarHBondContact O-N 2.99Å; A635-I637 VanDerWaalsContact C-N 3.34Å; A635-I637 WeakPolarHBondContact O-CG1 3.23Å; A635-I637 PolarHBondContact O-N 3.1Å; A635-Y649 HydrophobicContact CB-CE1 4.23Å
636S41.8Very low54.5Low67 Ų6781.9 Ų81.947%0.46944%0.443SS..  trans-65.899.5167.364.30000110.1E634 T638 R648E634-S636 PolarHBondContact O-N 3.12Å; S636-T638 VanDerWaalsContact C-N 3.32Å; S636-T638 PolarHBondContact O-N 3.07Å; S636-T638 VanDerWaalsContact O-N 3.13Å; S636-R648 WeakPolarHBondContact OG-CD 3.43Å; S636-R648 PolarHBondContact OG-NH1 3.29Å; S636-R648 PolarHBondContact OG-NH2 2.96Å
637I40.6Very low52.2Low121.667 Ų121.66790.7 Ų90.762%0.62448%0.476SS*.  trans-71.892.1174.9-55.1177.8000108.4A635 F639 L645A635-I637 VanDerWaalsContact C-N 3.34Å; A635-I637 WeakPolarHBondContact O-CG1 3.23Å; A635-I637 PolarHBondContact O-N 3.1Å; I637-F639 HydrophobicContact CG2-CE2 4.27Å; I637-F639 HydrophobicContact CG2-CZ 4.4Å; I637-L645 HydrophobicContact CG2-CD1 3.98Å
638T40.6Very low50.6Low59 Ų5995.8 Ų95.836%0.36250%0.495SS..  trans-103.8119.4171.151.10000109.7S636 R648S636-T638 VanDerWaalsContact C-N 3.32Å; S636-T638 PolarHBondContact O-N 3.07Å; S636-T638 VanDerWaalsContact O-N 3.13Å; T638-R648 PolarHBondContact OG1-NH2 3.19Å
639F42.3Very low49.3Very low143.667 Ų143.667101 Ų10163%0.6352%0.515SS*.BIsolated β-bridgetrans-71.1134.2165.2-68.7-90.3000108.5I637I637-F639 HydrophobicContact CG2-CE2 4.27Å; I637-F639 HydrophobicContact CG2-CZ 4.4Å
640D46.6Very low48.6Very low53.3333 Ų53.3333108 Ų10829%0.28555%0.548SS..  trans-70163.7164.874.15.3000110.3R642 G643 N644 R646D640-R642 PolarHBondContact O-N 3.12Å; D640-R642 VanDerWaalsContact OD1-C 3.25Å; D640-R642 VanDerWaalsContact OD1-CA 3.29Å; D640-R642 WeakPolarHBondContact OD1-CA 3.42Å; D640-R642 WeakPolarHBondContact OD1-CB 3.33Å; D640-R642 PolarHBondContact OD1-N 3.19Å; D640-G643 PolarHBondContact O-N 3.34Å; D640-G643 PolarHBondContact OD1-N 3.14Å; D640-G643 VanDerWaalsContact OD1-N 3.13Å; D640-N644 PolarHBondContact N-O 2.99Å; D640-N644 VanDerWaalsContact N-O 3.14Å; D640-N644 PolarHBondContact OD1-N 3.11Å; D640-N644 PolarHBondContact OD1-ND2 3.28Å; D640-N644 PolarHBondContact OD2-ND2 3.21Å; D640-R646 HydrophobicContact CB-CG 4.44Å
641G48.9Very low48.6Very low92.6667 Ų92.6667106.4 Ų106.496%0.95554%0.539SS*.THydrogen-bonded Turntrans-6413.2176.800000115.2
642R50.2Low49Very low221.333 Ų221.33399.9 Ų99.984%0.83552%0.519SS*.THydrogen-bonded Turntrans-124.55.6173.1-59.1-175.4-172.6-136.31.4112.7D640 N644D640-R642 PolarHBondContact O-N 3.12Å; D640-R642 VanDerWaalsContact OD1-C 3.25Å; D640-R642 VanDerWaalsContact OD1-CA 3.29Å; D640-R642 WeakPolarHBondContact OD1-CA 3.42Å; D640-R642 WeakPolarHBondContact OD1-CB 3.33Å; D640-R642 PolarHBondContact OD1-N 3.19Å; R642-N644 VanDerWaalsContact C-N 3.31Å; R642-N644 PolarHBondContact O-N 3.2Å
643G43.3Very low49.7Very low51.6667 Ų51.6667104 Ų10453%0.53354%0.54SS..SBendtrans78.612.617700000115D640D640-G643 PolarHBondContact O-N 3.34Å; D640-G643 PolarHBondContact OD1-N 3.14Å; D640-G643 VanDerWaalsContact OD1-N 3.13Å
644N41.7Very low51.1Low94 Ų94102.4 Ų102.450%0.50352%0.522SS..  trans-84.8136.6176.6-60.1-58.7000111D640 R642 R646D640-N644 PolarHBondContact N-O 2.99Å; D640-N644 VanDerWaalsContact N-O 3.14Å; D640-N644 PolarHBondContact OD1-N 3.11Å; D640-N644 PolarHBondContact OD1-ND2 3.28Å; D640-N644 PolarHBondContact OD2-ND2 3.21Å; R642-N644 VanDerWaalsContact C-N 3.31Å; R642-N644 PolarHBondContact O-N 3.2Å; N644-R646 PolarHBondContact O-N 2.95Å; N644-R646 VanDerWaalsContact O-N 3.1Å
645L37.3Very low52.9Low113 Ų11396 Ų9659%0.59249%0.492SS*.BIsolated β-bridgetrans-72.893.3171.6-174.373.6000109.8I637 R647I637-L645 HydrophobicContact CG2-CD1 3.98Å; L645-R647 PolarHBondContact O-N 3.2Å
646R40.3Very low55Low186 Ų18695.8 Ų95.870%0.70248%0.481SS*.  trans-81.2110.4169.3-106.2-174.4175.9-139.2-2.6109.5D640 N644 R648D640-R646 HydrophobicContact CB-CG 4.44Å; N644-R646 PolarHBondContact O-N 2.95Å; N644-R646 VanDerWaalsContact O-N 3.1Å; R646-R648 PolarHBondContact O-N 3.08Å; R646-R648 VanDerWaalsContact O-N 3.11Å
647R40.5Very low57.1Low185.333 Ų185.33398.8 Ų98.870%0.69948%0.482SS*.  trans-69.1109.4169.8-69-167.5-163.2178.36.2109.5L645 Y649L645-R647 PolarHBondContact O-N 3.2Å; R647-Y649 HydrophobicContact CB-CD2 3.81Å; R647-Y649 HydrophobicContact CB-CE2 3.72Å; R647-Y649 WeakPolarHBondContact CD-OH 3.21Å; R647-Y649 HydrophobicContact CG-CD2 4.07Å; R647-Y649 HydrophobicContact CG-CE2 4.12Å; R647-Y649 PolarHBondContact NH1-OH 3.26Å; R647-Y649 PolarHBondContact O-N 3.27Å
648R49.6Very low59.3Low120.333 Ų120.33393.1 Ų93.145%0.45445%0.453SS..  trans-87.748.4174-98.7-169.5-144.3179.45.8112.3E587 S636 T638 R646E587-R648 VanDerWaalsContact CD-NH1 3.26Å; E587-R648 IonicContact OE1-CZ 2.93Å; E587-R648 VanDerWaalsContact OE1-CZ 3.25Å; E587-R648 IonicContact OE1-NE 3.6Å; E587-R648 PolarHBondContact OE1-NE 3.03Å; E587-R648 IonicContact OE1-NH1 3.19Å; E587-R648 PolarHBondContact OE1-NH1 3.03Å; E587-R648 IonicContact OE1-NH2 2.77Å; E587-R648 PolarHBondContact OE1-NH2 3.11Å; E587-R648 IonicContact OE2-NH1 3.71Å; E587-R648 PolarHBondContact OE2-NH1 2.97Å; S636-R648 WeakPolarHBondContact OG-CD 3.43Å; S636-R648 PolarHBondContact OG-NH1 3.29Å; S636-R648 PolarHBondContact OG-NH2 2.96Å; T638-R648 PolarHBondContact OG1-NH2 3.19Å; R646-R648 PolarHBondContact O-N 3.08Å; R646-R648 VanDerWaalsContact O-N 3.11Å
649Y53.6Low61.6Low113.667 Ų113.66790.3 Ų90.345%0.44644%0.435SS..  trans-84.2-29.1-178.1-65.9-76.2000114A635 R647 L651 G652 D653A635-Y649 HydrophobicContact CB-CE1 4.23Å; R647-Y649 HydrophobicContact CB-CD2 3.81Å; R647-Y649 HydrophobicContact CB-CE2 3.72Å; R647-Y649 WeakPolarHBondContact CD-OH 3.21Å; R647-Y649 HydrophobicContact CG-CD2 4.07Å; R647-Y649 HydrophobicContact CG-CE2 4.12Å; R647-Y649 PolarHBondContact NH1-OH 3.26Å; R647-Y649 PolarHBondContact O-N 3.27Å; Y649-L651 VanDerWaalsContact C-N 3.29Å; Y649-L651 PolarHBondContact O-N 3.25Å; Y649-L651 VanDerWaalsContact O-N 3.12Å; Y649-G652 PolarHBondContact O-N 3.13Å; Y649-D653 WeakPolarHBondContact CB-OD2 3.31Å; Y649-D653 VanDerWaalsContact O-CG 3.26Å; Y649-D653 PolarHBondContact O-N 3.13Å
650E66.8Low63.6Low147.667 Ų147.66786 Ų8669%0.6942%0.424SS*.Hα-helixtrans-57.7-34.2-163.1-64.2176.6-170.500115.4L654E650-L654 VanDerWaalsContact O-CB 3.28Å; E650-L654 WeakPolarHBondContact O-CB 3.34Å; E650-L654 PolarHBondContact O-N 3.13Å
651L72Confident65.5Low31 Ų3187.7 Ų87.716%0.16243%0.43CS..Hα-helixtrans-82.9-33.2178.1-175.560.6000112.9L245 E587 R590 V591 I594 Y649 L655L245-L651 HydrophobicContact CD2-CD1 4.22Å; E587-L651 HydrophobicContact CB-CD2 4.29Å; R590-L651 HydrophobicContact CB-CD2 4.01Å; V591-L651 HydrophobicContact CG2-CD1 3.9Å; V591-L651 HydrophobicContact CG2-CD2 4.01Å; I594-L651 HydrophobicContact CD1-CD1 3.75Å; Y649-L651 VanDerWaalsContact C-N 3.29Å; Y649-L651 PolarHBondContact O-N 3.25Å; Y649-L651 VanDerWaalsContact O-N 3.12Å; L651-L655 VanDerWaalsContact O-CB 3.27Å; L651-L655 WeakPolarHBondContact O-CB 3.4Å; L651-L655 PolarHBondContact O-N 3.16Å
652G74.5Confident67.3Low14.6667 Ų14.666785.5 Ų85.515%0.15139%0.393CS..Hα-helixtrans-70.9-46.9176.600000111.7Y649 L654 L655 E656Y649-G652 PolarHBondContact O-N 3.13Å; G652-L654 PolarHBondContact O-N 3.09Å; G652-L655 WeakPolarHBondContact O-CB 3.36Å; G652-L655 PolarHBondContact O-N 2.88Å; G652-L655 VanDerWaalsContact O-N 3.12Å; G652-E656 PolarHBondContact O-N 2.99Å
653D77.1Confident69.3Low103.333 Ų103.33375 Ų7555%0.55335%0.353SS*.Hα-helixtrans-59.7-39.2175.2-62.5-13000111.2Y649 R657Y649-D653 WeakPolarHBondContact CB-OD2 3.31Å; Y649-D653 VanDerWaalsContact O-CG 3.26Å; Y649-D653 PolarHBondContact O-N 3.13Å; D653-R657 VanDerWaalsContact O-CB 3.27Å; D653-R657 WeakPolarHBondContact O-CB 3.23Å; D653-R657 PolarHBondContact O-N 2.99Å; D653-R657 VanDerWaalsContact O-N 3.13Å
654L80.5Confident71.5Confident32.6667 Ų32.666773.7 Ų73.717%0.17133%0.334CS..Hα-helixtrans-68-41.1176179.163000112.3F239 N242 A244 L245 E650 G652 R657 I658F239-L654 HydrophobicContact CD1-CD1 3.99Å; F239-L654 HydrophobicContact CE1-CD1 4.13Å; N242-L654 WeakPolarHBondContact ND2-CD2 3.42Å; A244-L654 HydrophobicContact CB-CD2 4.02Å; L245-L654 HydrophobicContact CD1-CD2 3.88Å; L245-L654 HydrophobicContact CD2-CD2 3.7Å; L245-L654 HydrophobicContact CG-CD2 3.58Å; E650-L654 VanDerWaalsContact O-CB 3.28Å; E650-L654 WeakPolarHBondContact O-CB 3.34Å; E650-L654 PolarHBondContact O-N 3.13Å; G652-L654 PolarHBondContact O-N 3.09Å; L654-R657 WeakPolarHBondContact O-CB 3.45Å; L654-R657 PolarHBondContact O-N 3.14Å; L654-I658 HydrophobicContact CD1-CD1 3.96Å; L654-I658 HydrophobicContact CD1-CG1 4.23Å; L654-I658 HydrophobicContact CG-CD1 3.84Å; L654-I658 HydrophobicContact CG-CG1 4.47Å; L654-I658 WeakPolarHBondContact O-CB 3.36Å; L654-I658 VanDerWaalsContact O-CG1 3.25Å; L654-I658 WeakPolarHBondContact O-CG1 3.35Å; L654-I658 PolarHBondContact O-N 3.07Å
655L83.8Confident73.8Confident4.33333 Ų4.3333375.7 Ų75.72%0.02334%0.338CS..Hα-helixtrans-60.9-49.7177.4176.165.8000111.1I594 W625 T629 T632 L651 G652 R657 I658 K659I594-L655 HydrophobicContact CD1-CB 4.45Å; I594-L655 HydrophobicContact CD1-CD1 4.07Å; I594-L655 HydrophobicContact CG1-CD1 3.85Å; W625-L655 HydrophobicContact CH2-CD1 3.92Å; W625-L655 HydrophobicContact CZ2-CD1 3.29Å; T629-L655 HydrophobicContact CG2-CD1 4.36Å; T629-L655 HydrophobicContact CG2-CD2 3.98Å; T632-L655 VanDerWaalsContact OG1-CD2 3.31Å; T632-L655 WeakPolarHBondContact OG1-CD2 3.42Å; L651-L655 VanDerWaalsContact O-CB 3.27Å; L651-L655 WeakPolarHBondContact O-CB 3.4Å; L651-L655 PolarHBondContact O-N 3.16Å; G652-L655 WeakPolarHBondContact O-CB 3.36Å; G652-L655 PolarHBondContact O-N 2.88Å; G652-L655 VanDerWaalsContact O-N 3.12Å; L655-R657 VanDerWaalsContact C-N 3.3Å; L655-R657 PolarHBondContact O-N 3.08Å; L655-I658 PolarHBondContact O-N 3.14Å; L655-I658 VanDerWaalsContact O-N 3.13Å; L655-K659 WeakPolarHBondContact O-CG 3.11Å; L655-K659 PolarHBondContact O-N 3.25Å
656E83.3Confident76.5Confident54.6667 Ų54.666771 Ų7126%0.25531%0.313SS..Hα-helixtrans-64.1-35.7176.7-67.6-50.7130.100112.3G652 K659 S660 Y719G652-E656 PolarHBondContact O-N 2.99Å; E656-K659 PolarHBondContact O-N 3.14Å; E656-K659 WeakPolarHBondContact OE1-CE 3.26Å; E656-K659 IonicContact OE1-NZ 2.89Å; E656-K659 PolarHBondContact OE1-NZ 3.08Å; E656-K659 WeakPolarHBondContact OE2-CD 3.31Å; E656-K659 IonicContact OE2-NZ 3.51Å; E656-K659 PolarHBondContact OE2-NZ 2.97Å; E656-S660 WeakPolarHBondContact O-CB 3.38Å; E656-S660 PolarHBondContact O-N 3.43Å; E656-S660 PolarHBondContact O-OG 3.21Å; E656-Y719 VanDerWaalsContact CD-OH 3.31Å; E656-Y719 PolarHBondContact OE1-OH 3.35Å; E656-Y719 WeakPolarHBondContact OE2-CE1 3.35Å; E656-Y719 PolarHBondContact OE2-OH 3.03Å
657R84.6Confident78.9Confident130.333 Ų130.33362.3 Ų62.349%0.49228%0.28SS..Hα-helixtrans-64.1-41.1172.4-171.4177.8-179.3176.21.2112.5D653 L654 L655 E661D653-R657 VanDerWaalsContact O-CB 3.27Å; D653-R657 WeakPolarHBondContact O-CB 3.23Å; D653-R657 PolarHBondContact O-N 2.99Å; D653-R657 VanDerWaalsContact O-N 3.13Å; L654-R657 WeakPolarHBondContact O-CB 3.45Å; L654-R657 PolarHBondContact O-N 3.14Å; L655-R657 VanDerWaalsContact C-N 3.3Å; L655-R657 PolarHBondContact O-N 3.08Å; R657-E661 HydrophobicContact CG-CB 4.47Å; R657-E661 VanDerWaalsContact CG-CD 3.49Å; R657-E661 HydrophobicContact CG-CG 4.01Å; R657-E661 WeakPolarHBondContact CG-OE1 3.49Å; R657-E661 WeakPolarHBondContact CG-OE2 3.31Å; R657-E661 IonicContact CZ-OE1 3.29Å; R657-E661 IonicContact CZ-OE2 3.65Å; R657-E661 VanDerWaalsContact CZ-OE2 3.23Å; R657-E661 IonicContact NE-OE1 3.14Å; R657-E661 PolarHBondContact NE-OE1 3.04Å; R657-E661 VanDerWaalsContact NE-OE1 3.1Å; R657-E661 IonicContact NE-OE2 2.75Å; R657-E661 PolarHBondContact NE-OE2 3.2Å; R657-E661 VanDerWaalsContact NE-OE2 3.14Å; R657-E661 IonicContact NH2-OE1 3.18Å; R657-E661 PolarHBondContact NH2-OE1 3.24Å; R657-E661 VanDerWaalsContact NH2-OE1 3.16Å; R657-E661 IonicContact NH2-OE2 2.93Å; R657-E661 PolarHBondContact NH2-OE2 2.97Å; R657-E661 VanDerWaalsContact O-CB 3.27Å; R657-E661 WeakPolarHBondContact O-CB 3.34Å; R657-E661 PolarHBondContact O-N 3.2Å
658I86.9Confident81.3Confident2.33333 Ų2.3333358.5 Ų58.51%0.01227%0.27CS..Hα-helixtrans-68-41.1178.2-70.7167.3000110.7F239 I594 F598 W625 L654 L655 Y662 I663F239-I658 HydrophobicContact CD1-CG1 4.46Å; F239-I658 HydrophobicContact CE1-CG1 3.86Å; F239-I658 HydrophobicContact CE2-CG1 4.01Å; F239-I658 HydrophobicContact CZ-CG1 3.62Å; I594-I658 HydrophobicContact CD1-CD1 4.4Å; I594-I658 HydrophobicContact CG1-CD1 4.38Å; I594-I658 HydrophobicContact CG2-CD1 3.62Å; F598-I658 HydrophobicContact CE1-CD1 3.79Å; F598-I658 HydrophobicContact CE1-CG1 4.16Å; F598-I658 HydrophobicContact CE1-CG2 4.12Å; F598-I658 HydrophobicContact CZ-CD1 3.82Å; W625-I658 HydrophobicContact CH2-CG2 4.29Å; L654-I658 HydrophobicContact CD1-CD1 3.96Å; L654-I658 HydrophobicContact CD1-CG1 4.23Å; L654-I658 HydrophobicContact CG-CD1 3.84Å; L654-I658 HydrophobicContact CG-CG1 4.47Å; L654-I658 WeakPolarHBondContact O-CB 3.36Å; L654-I658 VanDerWaalsContact O-CG1 3.25Å; L654-I658 WeakPolarHBondContact O-CG1 3.35Å; L654-I658 PolarHBondContact O-N 3.07Å; L655-I658 PolarHBondContact O-N 3.14Å; L655-I658 VanDerWaalsContact O-N 3.13Å; I658-Y662 HydrophobicContact CG2-CD1 4.4Å; I658-Y662 WeakPolarHBondContact O-CA 3.49Å; I658-Y662 WeakPolarHBondContact O-CB 3.37Å; I658-Y662 PolarHBondContact O-N 3.42Å; I658-Y662 VanDerWaalsContact O-N 3.13Å; I658-I663 HydrophobicContact CG2-CG1 4.12Å; I658-I663 PolarHBondContact O-N 3.18Å
659K88.7Confident83.2Confident0 Ų056.1 Ų56.10%026%0.264CS..Iπ-helixtrans-57.5-56.5172.5-70.5176.4-176.6174.30111.6W625 F626 T629 L655 E656 I663 L664 Y719W625-K659 HydrophobicContact CH2-CG 3.86Å; W625-K659 HydrophobicContact CZ3-CG 3.74Å; F626-K659 HydrophobicContact CD1-CD 4.22Å; F626-K659 HydrophobicContact CD1-CG 4.48Å; F626-K659 HydrophobicContact CE1-CB 3.98Å; F626-K659 HydrophobicContact CE1-CD 4.07Å; F626-K659 HydrophobicContact CE1-CG 4.07Å; F626-K659 HydrophobicContact CE2-CB 4.44Å; F626-K659 HydrophobicContact CE2-CG 4.22Å; F626-K659 HydrophobicContact CZ-CB 3.86Å; F626-K659 HydrophobicContact CZ-CD 4.42Å; F626-K659 HydrophobicContact CZ-CG 3.97Å; T629-K659 WeakPolarHBondContact OG1-CE 3.31Å; T629-K659 PolarHBondContact OG1-NZ 3.14Å; L655-K659 WeakPolarHBondContact O-CG 3.11Å; L655-K659 PolarHBondContact O-N 3.25Å; E656-K659 PolarHBondContact O-N 3.14Å; E656-K659 WeakPolarHBondContact OE1-CE 3.26Å; E656-K659 IonicContact OE1-NZ 2.89Å; E656-K659 PolarHBondContact OE1-NZ 3.08Å; E656-K659 WeakPolarHBondContact OE2-CD 3.31Å; E656-K659 IonicContact OE2-NZ 3.51Å; E656-K659 PolarHBondContact OE2-NZ 2.97Å; K659-I663 PolarHBondContact O-N 3.28Å; K659-L664 VanDerWaalsContact O-CB 3.32Å; K659-L664 WeakPolarHBondContact O-CB 3.34Å; K659-L664 PolarHBondContact O-N 2.98Å; K659-Y719 HydrophobicContact CB-CE1 4.01Å; K659-Y719 HydrophobicContact CD-CE1 4.07Å; K659-Y719 VanDerWaalsContact CD-OH 3.27Å; K659-Y719 WeakPolarHBondContact CD-OH 3.35Å; K659-Y719 PolarHBondContact NZ-OH 3.23Å; K659-Y719 VanDerWaalsContact NZ-OH 3.11Å
660S85.8Confident85Confident54.6667 Ų54.666750.7 Ų50.738%0.38224%0.243SC..Iπ-helixtrans-77.5-39-170.556.50000114.6E656 L664E656-S660 WeakPolarHBondContact O-CB 3.38Å; E656-S660 PolarHBondContact O-N 3.43Å; E656-S660 PolarHBondContact O-OG 3.21Å; S660-L664 WeakPolarHBondContact O-CB 3.23Å
661E85.2Confident86.1Confident88 Ų8845.8 Ų45.841%0.41122%0.22SC..Iπ-helixtrans-91.2-24.5-177.3-65.5-173.5-172.500114.1R657 K665R657-E661 HydrophobicContact CG-CB 4.47Å; R657-E661 VanDerWaalsContact CG-CD 3.49Å; R657-E661 HydrophobicContact CG-CG 4.01Å; R657-E661 WeakPolarHBondContact CG-OE1 3.49Å; R657-E661 WeakPolarHBondContact CG-OE2 3.31Å; R657-E661 IonicContact CZ-OE1 3.29Å; R657-E661 IonicContact CZ-OE2 3.65Å; R657-E661 VanDerWaalsContact CZ-OE2 3.23Å; R657-E661 IonicContact NE-OE1 3.14Å; R657-E661 PolarHBondContact NE-OE1 3.04Å; R657-E661 VanDerWaalsContact NE-OE1 3.1Å; R657-E661 IonicContact NE-OE2 2.75Å; R657-E661 PolarHBondContact NE-OE2 3.2Å; R657-E661 VanDerWaalsContact NE-OE2 3.14Å; R657-E661 IonicContact NH2-OE1 3.18Å; R657-E661 PolarHBondContact NH2-OE1 3.24Å; R657-E661 VanDerWaalsContact NH2-OE1 3.16Å; R657-E661 IonicContact NH2-OE2 2.93Å; R657-E661 PolarHBondContact NH2-OE2 2.97Å; R657-E661 VanDerWaalsContact O-CB 3.27Å; R657-E661 WeakPolarHBondContact O-CB 3.34Å; R657-E661 PolarHBondContact O-N 3.2Å; E661-K665 VanDerWaalsContact O-CD 3.25Å; E661-K665 WeakPolarHBondContact O-CD 3.45Å; E661-K665 VanDerWaalsContact O-CE 3.24Å; E661-K665 WeakPolarHBondContact O-CE 3.18Å; E661-K665 PolarHBondContact O-NZ 3.07Å
662Y88.2Confident87Confident47 Ų4751.3 Ų51.318%0.18424%0.238CC..Iπ-helixtrans-119-61.6-169.4-175.6-103.9000112.5P236 F239 F598 G601 E602 I658 L664 K665 W666P236-Y662 HydrophobicContact CB-CE2 4.13Å; P236-Y662 HydrophobicContact CG-CE1 4.22Å; P236-Y662 HydrophobicContact CG-CE2 4.15Å; P236-Y662 WeakPolarHBondContact CG-OH 3.48Å; F239-Y662 HydrophobicContact CE2-CG 4.31Å; F598-Y662 HydrophobicContact CD1-CD1 4.44Å; F598-Y662 HydrophobicContact CD1-CE1 4.13Å; G601-Y662 VanDerWaalsContact C-OH 3.25Å; G601-Y662 VanDerWaalsContact CA-OH 3.31Å; G601-Y662 WeakPolarHBondContact CA-OH 3.44Å; E602-Y662 VanDerWaalsContact CD-OH 3.31Å; E602-Y662 WeakPolarHBondContact CG-OH 3.3Å; E602-Y662 PolarHBondContact N-OH 2.93Å; E602-Y662 PolarHBondContact OE1-OH 3.05Å; I658-Y662 HydrophobicContact CG2-CD1 4.4Å; I658-Y662 WeakPolarHBondContact O-CA 3.49Å; I658-Y662 WeakPolarHBondContact O-CB 3.37Å; I658-Y662 PolarHBondContact O-N 3.42Å; I658-Y662 VanDerWaalsContact O-N 3.13Å; Y662-L664 PolarHBondContact O-N 3.26Å; Y662-K665 PolarHBondContact O-N 3.23Å; Y662-W666 PolarHBondContact O-N 3.33Å
663I91.2Very high87.8Confident0 Ų052.2 Ų52.20%024%0.239CC..Iπ-helixtrans-69.3-35.9-176.7-58.2-62.1000112A597 I622 W625 F626 I658 K659 K665 W666 I667A597-I663 HydrophobicContact CB-CD1 3.82Å; A597-I663 HydrophobicContact CB-CG1 4.16Å; A597-I663 VanDerWaalsContact O-CD1 3.27Å; A597-I663 WeakPolarHBondContact O-CD1 3.41Å; I622-I663 HydrophobicContact CG2-CG2 3.85Å; W625-I663 HydrophobicContact CH2-CG1 4.45Å; W625-I663 HydrophobicContact CZ3-CG1 4.14Å; F626-I663 HydrophobicContact CE2-CB 4.49Å; F626-I663 HydrophobicContact CE2-CG2 3.85Å; F626-I663 HydrophobicContact CZ-CG2 4.33Å; I658-I663 HydrophobicContact CG2-CG1 4.12Å; I658-I663 PolarHBondContact O-N 3.18Å; K659-I663 PolarHBondContact O-N 3.28Å; I663-K665 VanDerWaalsContact C-N 3.28Å; I663-K665 PolarHBondContact O-N 3.19Å; I663-W666 WeakPolarHBondContact O-CA 3.42Å; I663-W666 WeakPolarHBondContact O-CB 3.45Å; I663-W666 PolarHBondContact O-N 3.15Å; I663-W666 VanDerWaalsContact O-N 3.08Å; I663-I667 HydrophobicContact CG2-CD1 3.92Å; I663-I667 HydrophobicContact CG2-CG1 4.2Å; I663-I667 WeakPolarHBondContact O-CG1 3.39Å; I663-I667 PolarHBondContact O-N 3.08Å
664L89.9Confident88.4Confident25 Ų2548.1 Ų48.113%0.13122%0.217CC..Hα-helixtrans-56.9-37.1175.7-178.558.5000112.6K659 S660 Y662 W666 I667 Q668 Y719 I721K659-L664 VanDerWaalsContact O-CB 3.32Å; K659-L664 WeakPolarHBondContact O-CB 3.34Å; K659-L664 PolarHBondContact O-N 2.98Å; S660-L664 WeakPolarHBondContact O-CB 3.23Å; Y662-L664 PolarHBondContact O-N 3.26Å; L664-W666 VanDerWaalsContact C-N 3.33Å; L664-W666 PolarHBondContact O-N 2.97Å; L664-I667 PolarHBondContact O-N 3.36Å; L664-Q668 HydrophobicContact CD1-CG 4.43Å; L664-Q668 WeakPolarHBondContact O-CB 3.42Å; L664-Q668 VanDerWaalsContact O-CG 3.26Å; L664-Q668 WeakPolarHBondContact O-CG 3.4Å; L664-Q668 PolarHBondContact O-N 3.17Å; L664-Y719 WeakPolarHBondContact CD1-O 3.24Å; L664-I721 HydrophobicContact CD1-CD1 4.2Å; L664-I721 HydrophobicContact CD1-CG1 3.57Å
665K89.9Confident88.9Confident136 Ų13648.5 Ų48.559%0.59122%0.222SC*.Hα-helixtrans-67.5-35.8175.9-67.1175.1-176.7152.50112.3E661 Y662 I663 Q668 E669E661-K665 VanDerWaalsContact O-CD 3.25Å; E661-K665 WeakPolarHBondContact O-CD 3.45Å; E661-K665 VanDerWaalsContact O-CE 3.24Å; E661-K665 WeakPolarHBondContact O-CE 3.18Å; E661-K665 PolarHBondContact O-NZ 3.07Å; Y662-K665 PolarHBondContact O-N 3.23Å; I663-K665 VanDerWaalsContact C-N 3.28Å; I663-K665 PolarHBondContact O-N 3.19Å; K665-Q668 PolarHBondContact O-N 3.36Å; K665-E669 PolarHBondContact O-N 3.27Å; K665-E669 VanDerWaalsContact O-N 3.1Å
666W93Very high89.1Confident14 Ų1451.4 Ų51.45%0.05324%0.235CC..Hα-helixtrans-66.3-44.6173.3179.490.5000110.8V600 C604 L615 I618 I622 Y662 I663 L664 Q668 E669 V670V600-W666 HydrophobicContact CG1-CD2 3.61Å; V600-W666 HydrophobicContact CG1-CE3 3.93Å; V600-W666 HydrophobicContact CG1-CG 4.21Å; V600-W666 HydrophobicContact CG1-CH2 3.93Å; V600-W666 HydrophobicContact CG1-CZ2 3.57Å; V600-W666 HydrophobicContact CG1-CZ3 4.09Å; C604-W666 HydrophobicContact CB-CZ2 4.35Å; C604-W666 PolarHBondContact O-NE1 3.32Å; L615-W666 HydrophobicContact CD1-CH2 4.15Å; L615-W666 HydrophobicContact CD1-CZ2 3.88Å; I618-W666 HydrophobicContact CG2-CH2 3.95Å; I618-W666 HydrophobicContact CG2-CZ2 4.15Å; I622-W666 HydrophobicContact CG1-CZ3 4.42Å; Y662-W666 PolarHBondContact O-N 3.33Å; I663-W666 WeakPolarHBondContact O-CA 3.42Å; I663-W666 WeakPolarHBondContact O-CB 3.45Å; I663-W666 PolarHBondContact O-N 3.15Å; I663-W666 VanDerWaalsContact O-N 3.08Å; L664-W666 VanDerWaalsContact C-N 3.33Å; L664-W666 PolarHBondContact O-N 2.97Å; W666-Q668 VanDerWaalsContact C-N 3.34Å; W666-Q668 PolarHBondContact O-N 3Å; W666-E669 PolarHBondContact O-N 3.22Å; W666-V670 HydrophobicContact CD2-CG2 4.12Å; W666-V670 HydrophobicContact CE3-CG2 4.15Å; W666-V670 HydrophobicContact CH2-CG2 3.83Å; W666-V670 HydrophobicContact CZ2-CG2 3.81Å; W666-V670 HydrophobicContact CZ3-CG2 4.01Å; W666-V670 WeakPolarHBondContact O-CG2 3.46Å; W666-V670 PolarHBondContact O-N 3.12Å
667I92.2Very high89.4Confident4.33333 Ų4.3333348.8 Ų48.82%0.02222%0.223CC..Hα-helixtrans-62-41.1176.2-62.7169000111.2I622 F623 F626 I663 L664 E669 V670 H671 I678 I721I622-I667 HydrophobicContact CG2-CD1 4.17Å; F623-I667 HydrophobicContact CE1-CD1 4.05Å; F623-I667 HydrophobicContact CE1-CG1 4.4Å; F623-I667 HydrophobicContact CE1-CG2 4.22Å; F623-I667 HydrophobicContact CZ-CG2 4.45Å; F626-I667 HydrophobicContact CE2-CD1 3.91Å; F626-I667 HydrophobicContact CZ-CD1 4.02Å; I663-I667 HydrophobicContact CG2-CD1 3.92Å; I663-I667 HydrophobicContact CG2-CG1 4.2Å; I663-I667 WeakPolarHBondContact O-CG1 3.39Å; I663-I667 PolarHBondContact O-N 3.08Å; L664-I667 PolarHBondContact O-N 3.36Å; I667-E669 VanDerWaalsContact C-N 3.28Å; I667-E669 PolarHBondContact O-N 3.04Å; I667-V670 WeakPolarHBondContact O-CB 3.44Å; I667-V670 PolarHBondContact O-N 3.32Å; I667-H671 WeakPolarHBondContact O-CB 3.31Å; I667-H671 PolarHBondContact O-N 3Å; I667-I678 HydrophobicContact CG2-CD1 4.29Å; I667-I721 HydrophobicContact CD1-CD1 3.74Å; I667-I721 HydrophobicContact CD1-CG1 4.24Å; I667-I721 HydrophobicContact CG2-CD1 4.46Å; I667-I721 HydrophobicContact CG2-CG1 4.21Å; I667-I721 HydrophobicContact CG2-CG2 3.89Å
668Q90.5Very high89.7Confident105 Ų10542.6 Ų42.649%0.49120%0.2SC..Hα-helixtrans-63.1-38.3175.9-75.5169.9-1100112.4L664 K665 W666 H671 R672L664-Q668 HydrophobicContact CD1-CG 4.43Å; L664-Q668 WeakPolarHBondContact O-CB 3.42Å; L664-Q668 VanDerWaalsContact O-CG 3.26Å; L664-Q668 WeakPolarHBondContact O-CG 3.4Å; L664-Q668 PolarHBondContact O-N 3.17Å; K665-Q668 PolarHBondContact O-N 3.36Å; W666-Q668 VanDerWaalsContact C-N 3.34Å; W666-Q668 PolarHBondContact O-N 3Å; Q668-H671 PolarHBondContact O-N 3.17Å; Q668-R672 WeakPolarHBondContact O-CB 3.38Å; Q668-R672 PolarHBondContact O-N 2.92Å
669E90.4Very high89.9Confident69.6667 Ų69.666744.7 Ų44.733%0.32621%0.208SC..Hα-helixtrans-71.9-32.9175.3-172.965179.200112.2P606 K665 W666 I667 R672 L673P606-E669 HydrophobicContact CB-CG 4.31Å; P606-E669 HydrophobicContact CG-CB 4.41Å; P606-E669 HydrophobicContact CG-CG 4.21Å; K665-E669 PolarHBondContact O-N 3.27Å; K665-E669 VanDerWaalsContact O-N 3.1Å; W666-E669 PolarHBondContact O-N 3.22Å; I667-E669 VanDerWaalsContact C-N 3.28Å; I667-E669 PolarHBondContact O-N 3.04Å; E669-R672 PolarHBondContact O-N 3.42Å; E669-R672 IonicContact OE1-CZ 3.12Å; E669-R672 IonicContact OE1-NE 3.32Å; E669-R672 PolarHBondContact OE1-NE 3.2Å; E669-R672 IonicContact OE1-NH2 2.81Å; E669-R672 PolarHBondContact OE1-NH2 2.95Å; E669-R672 IonicContact OE2-CZ 3.07Å; E669-R672 IonicContact OE2-NE 3.33Å; E669-R672 PolarHBondContact OE2-NE 2.95Å; E669-R672 IonicContact OE2-NH2 3.17Å; E669-L673 HydrophobicContact CG-CD1 4.21Å; E669-L673 PolarHBondContact O-N 3.24Å
670V91.1Very high89.9Confident0.333333 Ų0.33333345.1 Ų45.10%0.00221%0.211CC..Hα-helixtrans-62.7-48.8168.3172.10000110.6P606 L615 W666 I667 R672 L673 H674 A677 I678P606-V670 HydrophobicContact CB-CG2 4.34Å; P606-V670 HydrophobicContact CG-CB 4.46Å; P606-V670 HydrophobicContact CG-CG2 3.5Å; P606-V670 VanDerWaalsContact CG-CG2 3.41Å; L615-V670 HydrophobicContact CD1-CG2 4.1Å; L615-V670 HydrophobicContact CD2-CG1 4.1Å; L615-V670 HydrophobicContact CD2-CG2 4.44Å; W666-V670 HydrophobicContact CD2-CG2 4.12Å; W666-V670 HydrophobicContact CE3-CG2 4.15Å; W666-V670 HydrophobicContact CH2-CG2 3.83Å; W666-V670 HydrophobicContact CZ2-CG2 3.81Å; W666-V670 HydrophobicContact CZ3-CG2 4.01Å; W666-V670 WeakPolarHBondContact O-CG2 3.46Å; W666-V670 PolarHBondContact O-N 3.12Å; I667-V670 WeakPolarHBondContact O-CB 3.44Å; I667-V670 PolarHBondContact O-N 3.32Å; V670-R672 PolarHBondContact O-N 3.06Å; V670-L673 PolarHBondContact O-N 2.89Å; V670-L673 VanDerWaalsContact O-N 3.15Å; V670-H674 CarbonylContact O-C 3.39Å; V670-H674 VanDerWaalsContact O-C 3.31Å; V670-H674 WeakPolarHBondContact O-CA 3.38Å; V670-H674 PolarHBondContact O-N 2.9Å; V670-A677 HydrophobicContact CG1-CB 4.4Å; V670-I678 HydrophobicContact CB-CD1 4.49Å; V670-I678 HydrophobicContact CG1-CD1 4.05Å; V670-I678 HydrophobicContact CG1-CG1 4.04Å
671H89.8Confident90.1Very high44 Ų4442.6 Ų42.620%0.20419%0.194CC..Hα-helixtrans-58.6-35.9177.3-170.9-78.7000112.1I667 Q668 L673 P675 I678 T723 T726I667-H671 WeakPolarHBondContact O-CB 3.31Å; I667-H671 PolarHBondContact O-N 3Å; Q668-H671 PolarHBondContact O-N 3.17Å; H671-L673 PolarHBondContact O-N 3.47Å; H671-P675 WeakPolarHBondContact O-CD 3.45Å; H671-I678 HydrophobicContact CB-CD1 3.6Å; H671-I678 HydrophobicContact CB-CG1 4.37Å; H671-T723 PolarHBondContact NE2-OG1 3.25Å; H671-T726 PolarHBondContact NE2-OG1 3.38Å
672R90.2Very high90.4Very high146.667 Ų146.66738.6 Ų38.655%0.55318%0.175SC*.Hα-helixtrans-73.5-26.5179.1-163-163.162.269-10.4114.4Q668 E669 V670Q668-R672 WeakPolarHBondContact O-CB 3.38Å; Q668-R672 PolarHBondContact O-N 2.92Å; E669-R672 PolarHBondContact O-N 3.42Å; E669-R672 IonicContact OE1-CZ 3.12Å; E669-R672 IonicContact OE1-NE 3.32Å; E669-R672 PolarHBondContact OE1-NE 3.2Å; E669-R672 IonicContact OE1-NH2 2.81Å; E669-R672 PolarHBondContact OE1-NH2 2.95Å; E669-R672 IonicContact OE2-CZ 3.07Å; E669-R672 IonicContact OE2-NE 3.33Å; E669-R672 PolarHBondContact OE2-NE 2.95Å; E669-R672 IonicContact OE2-NH2 3.17Å; V670-R672 PolarHBondContact O-N 3.06Å
673L90.7Very high90.6Very high33 Ų3338 Ų3817%0.17318%0.175CC..Hα-helixtrans-108.1-39.2-175.2-77.1171.3000113.4P606 E608 E669 V670 H671P606-L673 HydrophobicContact CB-CD1 3.86Å; E608-L673 HydrophobicContact CG-CD2 3.86Å; E669-L673 HydrophobicContact CG-CD1 4.21Å; E669-L673 PolarHBondContact O-N 3.24Å; V670-L673 PolarHBondContact O-N 2.89Å; V670-L673 VanDerWaalsContact O-N 3.15Å; H671-L673 PolarHBondContact O-N 3.47Å
674H90.5Very high90.4Very high19 Ų1938.6 Ų38.69%0.08818%0.179CC..  trans-140.464.3-173.4-66.4-66.9000111R607 E608 I610 L612 L615 V670 E676 A677R607-H674 PolarHBondContact O-NE2 3.31Å; R607-H674 VanDerWaalsContact O-NE2 3.07Å; E608-H674 PolarHBondContact O-CE1 3.11Å; I610-H674 VanDerWaalsContact CD1-CD2 3.48Å; I610-H674 WeakPolarHBondContact CD1-CD2 3.26Å; L612-H674 HydrophobicContact CD1-CB 4.27Å; L615-H674 HydrophobicContact CD2-CB 3.84Å; V670-H674 CarbonylContact O-C 3.39Å; V670-H674 VanDerWaalsContact O-C 3.31Å; V670-H674 WeakPolarHBondContact O-CA 3.38Å; V670-H674 PolarHBondContact O-N 2.9Å; H674-E676 VanDerWaalsContact C-OE2 3.26Å; H674-E676 WeakPolarHBondContact CA-OE1 3.35Å; H674-E676 VanDerWaalsContact CA-OE2 3.24Å; H674-E676 WeakPolarHBondContact CA-OE2 3.39Å; H674-E676 WeakPolarHBondContact CB-OE1 3.43Å; H674-E676 IonicContact CE1-OE1 3.33Å; H674-E676 IonicContact CG-OE1 3.27Å; H674-E676 IonicContact ND1-OE1 3.14Å; H674-E676 PolarHBondContact ND1-OE1 3.18Å; H674-E676 PolarHBondContact O-N 3.06Å; H674-A677 HydrophobicContact CB-CB 4.25Å; H674-A677 VanDerWaalsContact O-CB 3.3Å; H674-A677 WeakPolarHBondContact O-CB 3.38Å; H674-A677 PolarHBondContact O-N 3.16Å
675P89.9Confident90.2Very high40.3333 Ų40.333340.7 Ų40.726%0.26219%0.188SC..Hα-helixtrans-57.3-29.1176.225.7-35000112.6H671 A677 I678 Y679H671-P675 WeakPolarHBondContact O-CD 3.45Å; P675-A677 PolarHBondContact O-N 3.08Å; P675-I678 WeakPolarHBondContact O-CB 3.36Å; P675-I678 PolarHBondContact O-N 3.2Å; P675-Y679 HydrophobicContact CB-CE2 4.08Å; P675-Y679 WeakPolarHBondContact O-CD2 3.32Å; P675-Y679 PolarHBondContact O-N 3.19Å
676E89.5Confident89.9Confident65.6667 Ų65.666734.3 Ų34.331%0.30716%0.16SC..Hα-helixtrans-58.6-31.5174.868.6-76.7-179.900113.1L612 H674 I678 Y679 A680 L933L612-E676 HydrophobicContact CD1-CG 3.86Å; L612-E676 HydrophobicContact CD2-CG 3.64Å; L612-E676 HydrophobicContact CG-CG 4.42Å; H674-E676 VanDerWaalsContact C-OE2 3.26Å; H674-E676 WeakPolarHBondContact CA-OE1 3.35Å; H674-E676 VanDerWaalsContact CA-OE2 3.24Å; H674-E676 WeakPolarHBondContact CA-OE2 3.39Å; H674-E676 WeakPolarHBondContact CB-OE1 3.43Å; H674-E676 IonicContact CE1-OE1 3.33Å; H674-E676 IonicContact CG-OE1 3.27Å; H674-E676 IonicContact ND1-OE1 3.14Å; H674-E676 PolarHBondContact ND1-OE1 3.18Å; H674-E676 PolarHBondContact O-N 3.06Å; E676-I678 VanDerWaalsContact C-N 3.32Å; E676-I678 PolarHBondContact O-N 3.23Å; E676-Y679 PolarHBondContact O-N 2.96Å; E676-A680 VanDerWaalsContact O-CB 3.27Å; E676-A680 WeakPolarHBondContact O-CB 3.41Å; E676-A680 PolarHBondContact O-N 3.1Å; E676-L933 HydrophobicContact CB-CD2 4.15Å
677A89.4Confident89.4Confident0 Ų036.5 Ų36.50%017%0.173CC..Hα-helixtrans-67.9-33.4174.100000112L612 L615 V670 H674 P675 V681L612-A677 HydrophobicContact CD1-CB 3.75Å; L615-A677 HydrophobicContact CD2-CB 3.97Å; L615-A677 HydrophobicContact CG-CB 4.29Å; V670-A677 HydrophobicContact CG1-CB 4.4Å; H674-A677 HydrophobicContact CB-CB 4.25Å; H674-A677 VanDerWaalsContact O-CB 3.3Å; H674-A677 WeakPolarHBondContact O-CB 3.38Å; H674-A677 PolarHBondContact O-N 3.16Å; P675-A677 PolarHBondContact O-N 3.08Å; A677-V681 VanDerWaalsContact O-CG2 3.28Å; A677-V681 WeakPolarHBondContact O-CG2 3.36Å; A677-V681 PolarHBondContact O-N 2.96Å
678I90.9Very high88.9Confident0.333333 Ų0.33333342.3 Ų42.30%0.00220%0.204CC..Hα-helixtrans-74.8-44.1177.5-65.8-153.6000109.7T619 F623 I667 V670 H671 P675 E676 A680 V681 L682 T726T619-I678 HydrophobicContact CG2-CD1 3.79Å; T619-I678 HydrophobicContact CG2-CG1 4.38Å; F623-I678 HydrophobicContact CE2-CD1 4.45Å; F623-I678 HydrophobicContact CE2-CG2 4.33Å; F623-I678 HydrophobicContact CZ-CD1 3.74Å; F623-I678 HydrophobicContact CZ-CG1 4.37Å; F623-I678 HydrophobicContact CZ-CG2 4.33Å; I667-I678 HydrophobicContact CG2-CD1 4.29Å; V670-I678 HydrophobicContact CB-CD1 4.49Å; V670-I678 HydrophobicContact CG1-CD1 4.05Å; V670-I678 HydrophobicContact CG1-CG1 4.04Å; H671-I678 HydrophobicContact CB-CD1 3.6Å; H671-I678 HydrophobicContact CB-CG1 4.37Å; P675-I678 WeakPolarHBondContact O-CB 3.36Å; P675-I678 PolarHBondContact O-N 3.2Å; E676-I678 VanDerWaalsContact C-N 3.32Å; E676-I678 PolarHBondContact O-N 3.23Å; I678-A680 PolarHBondContact O-N 3.15Å; I678-V681 PolarHBondContact O-N 3.16Å; I678-L682 HydrophobicContact CG2-CD1 3.7Å; I678-L682 HydrophobicContact CG2-CG 4.38Å; I678-L682 WeakPolarHBondContact O-CB 3.44Å; I678-L682 VanDerWaalsContact O-CG 3.31Å; I678-L682 WeakPolarHBondContact O-CG 3.34Å; I678-L682 PolarHBondContact O-N 3.34Å; I678-T726 HydrophobicContact CG2-CG2 4.37Å
679Y90.8Very high88.5Confident45 Ų4539.8 Ų39.818%0.17619%0.19CC..Hα-helixtrans-60.8-45.8176.8-56.8-27.4000111.6P675 E676 V681 L682 L683 T726 F729 V730P675-Y679 HydrophobicContact CB-CE2 4.08Å; P675-Y679 WeakPolarHBondContact O-CD2 3.32Å; P675-Y679 PolarHBondContact O-N 3.19Å; E676-Y679 PolarHBondContact O-N 2.96Å; Y679-V681 PolarHBondContact O-N 3.16Å; Y679-V681 VanDerWaalsContact O-N 3.16Å; Y679-L682 PolarHBondContact O-N 2.86Å; Y679-L682 VanDerWaalsContact O-N 3.08Å; Y679-L683 WeakPolarHBondContact O-CG 3.31Å; Y679-L683 PolarHBondContact O-N 3.19Å; Y679-L683 VanDerWaalsContact O-N 3.09Å; Y679-T726 HydrophobicContact CD1-CG2 4.21Å; Y679-T726 HydrophobicContact CE1-CG2 4.06Å; Y679-F729 AromaticContact CD1-CD1 3.98Å; Y679-F729 HydrophobicContact CD1-CD1 4.2Å; Y679-F729 HydrophobicContact CD2-CD1 4.25Å; Y679-F729 HydrophobicContact CD2-CE1 4.27Å; Y679-F729 HydrophobicContact CE1-CD1 4.47Å; Y679-F729 AromaticContact CG-CD1 3.88Å; Y679-F729 HydrophobicContact CG-CD1 3.97Å; Y679-F729 AromaticContact CG-CE1 4Å; Y679-F729 HydrophobicContact CG-CE1 4.11Å; Y679-V730 HydrophobicContact CD1-CG2 4.43Å
680A89.2Confident88.2Confident10 Ų1036.5 Ų36.58%0.08318%0.175CC..Hα-helixtrans-61.2-25.1179.500000114.6T616 E676 I678 P686 L687T616-A680 HydrophobicContact CG2-CB 3.82Å; E676-A680 VanDerWaalsContact O-CB 3.27Å; E676-A680 WeakPolarHBondContact O-CB 3.41Å; E676-A680 PolarHBondContact O-N 3.1Å; I678-A680 PolarHBondContact O-N 3.15Å; A680-P686 WeakPolarHBondContact O-CA 3.27Å; A680-P686 VanDerWaalsContact O-CB 3.26Å; A680-P686 WeakPolarHBondContact O-CB 3.24Å; A680-L687 HydrophobicContact CB-CD1 4.49Å
681V90.2Very high87.8Confident2 Ų241.3 Ų41.31%0.01219%0.193CC..Hα-helixtrans-85.9-28.6175.3177.30000112.7T616 T619 A620 F623 A677 I678 Y679 A690T616-V681 HydrophobicContact CG2-CG2 3.52Å; T616-V681 VanDerWaalsContact CG2-CG2 3.5Å; T616-V681 WeakPolarHBondContact O-CG2 3.32Å; T619-V681 HydrophobicContact CG2-CG2 4.13Å; A620-V681 HydrophobicContact CB-CG1 3.96Å; A620-V681 HydrophobicContact CB-CG2 3.97Å; F623-V681 HydrophobicContact CB-CG1 4.33Å; F623-V681 HydrophobicContact CD2-CB 4.26Å; F623-V681 HydrophobicContact CD2-CG1 3.51Å; F623-V681 HydrophobicContact CE2-CB 4.46Å; F623-V681 HydrophobicContact CE2-CG1 4.18Å; F623-V681 HydrophobicContact CG-CG1 4.26Å; A677-V681 VanDerWaalsContact O-CG2 3.28Å; A677-V681 WeakPolarHBondContact O-CG2 3.36Å; A677-V681 PolarHBondContact O-N 2.96Å; I678-V681 PolarHBondContact O-N 3.16Å; Y679-V681 PolarHBondContact O-N 3.16Å; Y679-V681 VanDerWaalsContact O-N 3.16Å; V681-A690 HydrophobicContact CG2-CB 4.32Å
682L91.1Very high87.2Confident4 Ų439.7 Ų39.72%0.02119%0.186CC..Hα-helixtrans-94.3-11.4-173.7-66.2178.8000114.2F623 I678 Y679 I713 L716 I722 T726 V730 W734F623-L682 HydrophobicContact CD2-CD2 3.75Å; F623-L682 HydrophobicContact CD2-CG 4.3Å; F623-L682 HydrophobicContact CE2-CD1 4.21Å; F623-L682 HydrophobicContact CE2-CD2 3.76Å; F623-L682 HydrophobicContact CE2-CG 3.89Å; I678-L682 HydrophobicContact CG2-CD1 3.7Å; I678-L682 HydrophobicContact CG2-CG 4.38Å; I678-L682 WeakPolarHBondContact O-CB 3.44Å; I678-L682 VanDerWaalsContact O-CG 3.31Å; I678-L682 WeakPolarHBondContact O-CG 3.34Å; I678-L682 PolarHBondContact O-N 3.34Å; Y679-L682 PolarHBondContact O-N 2.86Å; Y679-L682 VanDerWaalsContact O-N 3.08Å; L682-I713 HydrophobicContact CD2-CG1 4.29Å; L682-L716 HydrophobicContact CD2-CD1 3.69Å; L682-I722 HydrophobicContact CD1-CD1 3.64Å; L682-I722 HydrophobicContact CD2-CD1 4.29Å; L682-T726 HydrophobicContact CD1-CG2 3.64Å; L682-V730 HydrophobicContact CB-CG1 4.11Å; L682-V730 HydrophobicContact CB-CG2 4.09Å; L682-V730 VanDerWaalsContact O-CG1 3.31Å; L682-V730 WeakPolarHBondContact O-CG1 3.42Å; L682-W734 PolarHBondContact O-NE1 2.98Å
683L91.8Very high86.3Confident32.6667 Ų32.666732.7 Ų32.717%0.17116%0.16CC..SBendtrans-65.3153.2172.3-74.7169.6000112.2Y679 H685 P686 F729 Y733Y679-L683 WeakPolarHBondContact O-CG 3.31Å; Y679-L683 PolarHBondContact O-N 3.19Å; Y679-L683 VanDerWaalsContact O-N 3.09Å; L683-H685 VanDerWaalsContact C-N 3.29Å; L683-H685 PolarHBondContact O-N 3.03Å; L683-P686 WeakPolarHBondContact O-CD 3.4Å; L683-F729 HydrophobicContact CD2-CE1 4.46Å; L683-Y733 HydrophobicContact CD2-CD1 4.26Å; L683-Y733 HydrophobicContact CD2-CD2 3.45Å; L683-Y733 VanDerWaalsContact CD2-CD2 3.42Å; L683-Y733 HydrophobicContact CD2-CE2 4.02Å; L683-Y733 HydrophobicContact CD2-CG 3.59Å
684P87Confident85.5Confident12.6667 Ų12.666731.5 Ų31.58%0.08215%0.154CC..SBendtrans-64-33.2176.511.7-15000113.6P686 Y733 W734 S737P684-P686 VanDerWaalsContact C-CD 3.41Å; P684-P686 WeakPolarHBondContact O-CD 3.25Å; P684-Y733 WeakPolarHBondContact CG-O 3.46Å; P684-W734 VanDerWaalsContact CA-CH2 3.5Å; P684-W734 VanDerWaalsContact CA-CZ2 3.44Å; P684-W734 HydrophobicContact CB-CD2 4Å; P684-W734 HydrophobicContact CB-CE3 3.9Å; P684-W734 HydrophobicContact CB-CH2 3.92Å; P684-W734 HydrophobicContact CB-CZ2 4.07Å; P684-W734 HydrophobicContact CB-CZ3 3.83Å; P684-W734 HydrophobicContact CG-CB 4.42Å; P684-W734 HydrophobicContact CG-CD2 4.2Å; P684-W734 HydrophobicContact CG-CE3 3.95Å; P684-W734 HydrophobicContact CG-CG 3.88Å; P684-W734 HydrophobicContact CG-CZ2 4.31Å; P684-W734 HydrophobicContact CG-CZ3 4.33Å; P684-S737 WeakPolarHBondContact CB-OG 3.39Å; P684-S737 VanDerWaalsContact CG-OG 3.24Å; P684-S737 WeakPolarHBondContact CG-OG 3.33Å
685H85.8Confident84.7Confident69 Ų6931.1 Ų31.132%0.31915%0.154SC..SBendtrans-111.176.4173.5-55.8-30000109.4L683 H702 S737 E741L683-H685 VanDerWaalsContact C-N 3.29Å; L683-H685 PolarHBondContact O-N 3.03Å; H685-H702 AromaticContact NE2-NE2 4Å; H685-S737 PolarHBondContact NE2-OG 2.94Å; H685-E741 VanDerWaalsContact CE1-CD 3.42Å; H685-E741 IonicContact CE1-OE1 3.36Å; H685-E741 PolarHBondContact CE1-OE1 2.98Å; H685-E741 IonicContact CE1-OE2 3.14Å; H685-E741 PolarHBondContact CE1-OE2 3.31Å; H685-E741 IonicContact NE2-OE1 3.04Å; H685-E741 PolarHBondContact NE2-OE1 3.43Å; H685-E741 IonicContact NE2-OE2 3.21Å; H685-E741 PolarHBondContact NE2-OE2 2.98Å; H685-E741 VanDerWaalsContact NE2-OE2 3.13Å
686P84Confident84.1Confident3 Ų332.3 Ų32.32%0.01915%0.153CC..  trans-63145.6175.128.2-33.6000109.6A680 L683 P684 A690 R691 W696A680-P686 WeakPolarHBondContact O-CA 3.27Å; A680-P686 VanDerWaalsContact O-CB 3.26Å; A680-P686 WeakPolarHBondContact O-CB 3.24Å; L683-P686 WeakPolarHBondContact O-CD 3.4Å; P684-P686 VanDerWaalsContact C-CD 3.41Å; P684-P686 WeakPolarHBondContact O-CD 3.25Å; P686-A690 HydrophobicContact CB-CB 3.87Å; P686-R691 HydrophobicContact CG-CG 3.96Å; P686-R691 PolarHBondContact O-NE 3.09Å; P686-R691 PolarHBondContact O-NH2 3.17Å; P686-W696 HydrophobicContact CG-CH2 4.19Å; P686-W696 HydrophobicContact CG-CZ2 3.5Å; P686-W696 VanDerWaalsContact CG-CZ2 3.47Å
687L83.3Confident83.3Confident60.6667 Ų60.666733.8 Ų33.832%0.31816%0.163SC..  trans-59155.9175-65.6170.4000110.4A680 Y689 A690 R691 K930 L933A680-L687 HydrophobicContact CB-CD1 4.49Å; L687-Y689 HydrophobicContact CB-CD1 4.39Å; L687-Y689 HydrophobicContact CB-CE1 4Å; L687-Y689 HydrophobicContact CB-CE2 4.17Å; L687-Y689 HydrophobicContact CD1-CE1 4.13Å; L687-Y689 HydrophobicContact CD1-CE2 4.31Å; L687-Y689 VanDerWaalsContact CD1-OH 3.22Å; L687-Y689 WeakPolarHBondContact CD1-OH 3.28Å; L687-Y689 PolarHBondContact O-N 2.83Å; L687-Y689 VanDerWaalsContact O-N 3.08Å; L687-A690 WeakPolarHBondContact O-CA 3.37Å; L687-A690 WeakPolarHBondContact O-CB 3.37Å; L687-A690 PolarHBondContact O-N 2.93Å; L687-R691 PolarHBondContact O-N 3.1Å; L687-K930 HydrophobicContact CD2-CG 4.5Å; L687-L933 HydrophobicContact CD1-CD1 4.32Å
688N81.5Confident82.3Confident124.667 Ų124.66735.5 Ų35.567%0.66718%0.177SC*.G310 helixtrans-55-35.4-170.4-69.7-19.9000113.9A690 R691N688-A690 VanDerWaalsContact C-N 3.32Å; N688-A690 PolarHBondContact O-N 3.38Å; N688-R691 PolarHBondContact O-N 3.26Å; N688-R691 PolarHBondContact OD1-NE 2.93Å; N688-R691 PolarHBondContact OD1-NH1 3.23Å
689Y81.8Confident81.5Confident53 Ų5344.3 Ų44.321%0.20822%0.222CC..G310 helixtrans-74.1-17175.853.3-106.4000114.5E613 T616 R617 L687E613-Y689 HydrophobicContact CB-CD1 3.8Å; E613-Y689 HydrophobicContact CB-CD2 4Å; E613-Y689 HydrophobicContact CB-CE1 4.06Å; E613-Y689 HydrophobicContact CB-CE2 4.24Å; E613-Y689 HydrophobicContact CB-CG 3.75Å; E613-Y689 HydrophobicContact CG-CD1 3.79Å; E613-Y689 HydrophobicContact CG-CE1 3.65Å; E613-Y689 HydrophobicContact CG-CE2 4.46Å; E613-Y689 HydrophobicContact CG-CG 4.26Å; E613-Y689 WeakPolarHBondContact OE1-CE1 3.35Å; T616-Y689 HydrophobicContact CG2-CD2 4.04Å; T616-Y689 HydrophobicContact CG2-CE2 3.77Å; R617-Y689 WeakPolarHBondContact CA-O 3.37Å; R617-Y689 VanDerWaalsContact CB-O 3.26Å; R617-Y689 WeakPolarHBondContact CB-O 3.34Å; R617-Y689 VanDerWaalsContact CG-O 3.28Å; R617-Y689 WeakPolarHBondContact CG-O 3.48Å; L687-Y689 HydrophobicContact CB-CD1 4.39Å; L687-Y689 HydrophobicContact CB-CE1 4Å; L687-Y689 HydrophobicContact CB-CE2 4.17Å; L687-Y689 HydrophobicContact CD1-CE1 4.13Å; L687-Y689 HydrophobicContact CD1-CE2 4.31Å; L687-Y689 VanDerWaalsContact CD1-OH 3.22Å; L687-Y689 WeakPolarHBondContact CD1-OH 3.28Å; L687-Y689 PolarHBondContact O-N 2.83Å; L687-Y689 VanDerWaalsContact O-N 3.08Å
690A83Confident80.7Confident0 Ų043.3 Ų43.30%022%0.222CC..G310 helixtrans-92.5-7.7176.200000113T616 A620 V681 P686 L687 N688 V692T616-A690 HydrophobicContact CG2-CB 3.68Å; A620-A690 VanDerWaalsContact CB-O 3.29Å; A620-A690 WeakPolarHBondContact CB-O 3.36Å; V681-A690 HydrophobicContact CG2-CB 4.32Å; P686-A690 HydrophobicContact CB-CB 3.87Å; L687-A690 WeakPolarHBondContact O-CA 3.37Å; L687-A690 WeakPolarHBondContact O-CB 3.37Å; L687-A690 PolarHBondContact O-N 2.93Å; N688-A690 VanDerWaalsContact C-N 3.32Å; N688-A690 PolarHBondContact O-N 3.38Å; A690-V692 VanDerWaalsContact C-N 3.31Å; A690-V692 PolarHBondContact O-N 3.1Å
691R83.3Confident80.4Confident101.667 Ų101.66748.1 Ų48.138%0.38425%0.246SC..  trans-77.178.1174.4-66.3176.5-168.1-172.11.4110.3P686 L687 N688 W696P686-R691 HydrophobicContact CG-CG 3.96Å; P686-R691 PolarHBondContact O-NE 3.09Å; P686-R691 PolarHBondContact O-NH2 3.17Å; L687-R691 PolarHBondContact O-N 3.1Å; N688-R691 PolarHBondContact O-N 3.26Å; N688-R691 PolarHBondContact OD1-NE 2.93Å; N688-R691 PolarHBondContact OD1-NH1 3.23Å; R691-W696 HydrophobicContact CB-CB 4.1Å; R691-W696 HydrophobicContact CB-CD2 3.91Å; R691-W696 HydrophobicContact CB-CE3 4.3Å; R691-W696 HydrophobicContact CB-CG 3.8Å; R691-W696 HydrophobicContact CG-CD2 3.75Å; R691-W696 HydrophobicContact CG-CE3 3.87Å; R691-W696 HydrophobicContact CG-CG 4.18Å; R691-W696 HydrophobicContact CG-CH2 4.41Å; R691-W696 HydrophobicContact CG-CZ2 4.38Å; R691-W696 HydrophobicContact CG-CZ3 4.22Å
692V76.7Confident80.2Confident9.33333 Ų9.3333349.7 Ų49.76%0.05725%0.253CS..  trans-114.5119.4179.3-178.80000110I446 L450 R617 A620 A690 R712I446-V692 HydrophobicContact CG2-CG1 3.57Å; L450-V692 HydrophobicContact CD1-CG1 4.29Å; R617-V692 HydrophobicContact CG-CG2 3.62Å; A620-V692 HydrophobicContact CB-CB 3.82Å; A620-V692 HydrophobicContact CB-CG2 3.84Å; A690-V692 VanDerWaalsContact C-N 3.31Å; A690-V692 PolarHBondContact O-N 3.1Å; V692-R712 PolarHBondContact O-NH2 3.15Å
693G73Confident79.9Confident1.33333 Ų1.3333350.6 Ų50.61%0.01426%0.258CS..SBendtrans80.616216800000115.6C695 W696 D697G693-C695 PolarHBondContact O-N 3.03Å; G693-W696 PolarHBondContact O-N 3.37Å; G693-D697 VanDerWaalsContact C-OD2 3.3Å; G693-D697 WeakPolarHBondContact CA-OD1 3.47Å; G693-D697 VanDerWaalsContact CA-OD2 3.23Å; G693-D697 WeakPolarHBondContact CA-OD2 3.41Å; G693-D697 PolarHBondContact N-OD1 3.34Å
694S72.5Confident79.5Confident6.66667 Ų6.6666751.1 Ų51.15%0.04726%0.264CS..G310 helixtrans67.6-113.8167-167.40000113.8M453 R457 N624 W696 D697 H708M453-S694 VanDerWaalsContact CE-N 3.27Å; R457-S694 PolarHBondContact NH1-OG 3.21Å; N624-S694 WeakPolarHBondContact OD1-CB 3.32Å; S694-W696 VanDerWaalsContact C-N 3.27Å; S694-W696 PolarHBondContact O-N 3.17Å; S694-W696 VanDerWaalsContact O-N 3.07Å; S694-D697 PolarHBondContact N-OD2 3.19Å; S694-D697 PolarHBondContact O-N 3.35Å; S694-H708 VanDerWaalsContact CB-CE1 3.47Å; S694-H708 WeakPolarHBondContact CB-CE1 3.47Å; S694-H708 WeakPolarHBondContact CB-NE2 3.27Å; S694-H708 PolarHBondContact OG-CD2 3.22Å; S694-H708 VanDerWaalsContact OG-CD2 3.26Å; S694-H708 PolarHBondContact OG-CE1 3.41Å; S694-H708 VanDerWaalsContact OG-CE1 3.32Å; S694-H708 PolarHBondContact OG-NE2 3.17Å
695C73.3Confident79.4Confident12 Ų1254.4 Ų54.48%0.08128%0.275CS..G310 helixtrans-72.3-10.8-176.556.70000113.4G693 A698 S700 R705 H708G693-C695 PolarHBondContact O-N 3.03Å; C695-A698 VanDerWaalsContact O-O 3.09Å; C695-S700 PolarHBondContact O-OG 3.37Å; C695-R705 HydrophobicContact CB-CG 4.18Å; C695-H708 HydrophobicContact CB-CB 4.34Å
696W77.3Confident79.5Confident64 Ų6451.2 Ų51.224%0.24226%0.26CS..G310 helixtrans-87.8-17.3176-55.7110.5000113.3P686 R691 G693 S694P686-W696 HydrophobicContact CG-CH2 4.19Å; P686-W696 HydrophobicContact CG-CZ2 3.5Å; P686-W696 VanDerWaalsContact CG-CZ2 3.47Å; R691-W696 HydrophobicContact CB-CB 4.1Å; R691-W696 HydrophobicContact CB-CD2 3.91Å; R691-W696 HydrophobicContact CB-CE3 4.3Å; R691-W696 HydrophobicContact CB-CG 3.8Å; R691-W696 HydrophobicContact CG-CD2 3.75Å; R691-W696 HydrophobicContact CG-CE3 3.87Å; R691-W696 HydrophobicContact CG-CG 4.18Å; R691-W696 HydrophobicContact CG-CH2 4.41Å; R691-W696 HydrophobicContact CG-CZ2 4.38Å; R691-W696 HydrophobicContact CG-CZ3 4.22Å; G693-W696 PolarHBondContact O-N 3.37Å; S694-W696 VanDerWaalsContact C-N 3.27Å; S694-W696 PolarHBondContact O-N 3.17Å; S694-W696 VanDerWaalsContact O-N 3.07Å
697D72.9Confident79.7Confident98 Ų9853.3 Ų53.352%0.52427%0.269SS..SBendtrans-87.7-4.4177.1-51.3-33.7000112.1G693 S694G693-D697 VanDerWaalsContact C-OD2 3.3Å; G693-D697 WeakPolarHBondContact CA-OD1 3.47Å; G693-D697 VanDerWaalsContact CA-OD2 3.23Å; G693-D697 WeakPolarHBondContact CA-OD2 3.41Å; G693-D697 PolarHBondContact N-OD1 3.34Å; S694-D697 PolarHBondContact N-OD2 3.19Å; S694-D697 PolarHBondContact O-N 3.35Å
698A70Confident79.7Confident35 Ų3551.6 Ų51.629%0.28926%0.26SS..SBendtrans-137.1153.6-17400000112.1L461 C695 S700L461-A698 HydrophobicContact CD2-CB 3.38Å; C695-A698 VanDerWaalsContact O-O 3.09Å; A698-S700 PolarHBondContact O-N 3.04Å
699I73Confident80Confident186.667 Ų186.66746.2 Ų46.296%0.95723%0.233SC*.  trans-68.6100.5167.7-54.9173.4000107.2
700S74.9Confident80.3Confident23.6667 Ų23.666743.7 Ų43.717%0.16622%0.223CC..  trans-121.2137.3-177.464.50000111.6C695 A698 R705C695-S700 PolarHBondContact O-OG 3.37Å; A698-S700 PolarHBondContact O-N 3.04Å; S700-R705 PolarHBondContact O-NH1 3.18Å; S700-R705 VanDerWaalsContact OG-CG 3.24Å; S700-R705 WeakPolarHBondContact OG-CG 3.38Å
701D82.8Confident80.5Confident110.333 Ų110.33345 Ų4559%0.5923%0.233SC*.  trans-59.3155.4173.8-22.2-53.3000111.5L703 S704 R705D701-L703 VanDerWaalsContact C-N 3.31Å; D701-L703 PolarHBondContact O-N 2.91Å; D701-L703 WeakPolarHBondContact OD2-CB 3.2Å; D701-L703 PolarHBondContact OD2-N 3.12Å; D701-S704 VanDerWaalsContact CG-OG 3.24Å; D701-S704 WeakPolarHBondContact O-CA 3.44Å; D701-S704 WeakPolarHBondContact O-CB 3.46Å; D701-S704 PolarHBondContact O-N 3.26Å; D701-S704 VanDerWaalsContact O-N 3.15Å; D701-S704 WeakPolarHBondContact OD1-CB 3.1Å; D701-S704 PolarHBondContact OD1-OG 2.84Å; D701-S704 WeakPolarHBondContact OD2-CB 3.45Å; D701-S704 PolarHBondContact OD2-N 3.16Å; D701-S704 PolarHBondContact OD2-OG 3.41Å; D701-R705 PolarHBondContact O-N 3.1Å; D701-R705 VanDerWaalsContact O-N 3.13Å
702H84.4Confident80.7Confident36 Ų3640.7 Ų40.717%0.16722%0.216CC..Hα-helixtrans-56.8-47.2-177.5-162-69.5000112.5H685 S704 R705 V706 E741H685-H702 AromaticContact NE2-NE2 4Å; H702-S704 VanDerWaalsContact C-N 3.26Å; H702-S704 PolarHBondContact O-N 3.23Å; H702-R705 PolarHBondContact CD2-NH2 2.95Å; H702-R705 VanDerWaalsContact CD2-NH2 3.27Å; H702-R705 WeakPolarHBondContact O-CA 3.29Å; H702-R705 WeakPolarHBondContact O-CB 3.34Å; H702-R705 PolarHBondContact O-N 3.25Å; H702-R705 VanDerWaalsContact O-N 3.09Å; H702-V706 VanDerWaalsContact CE1-CG2 3.43Å; H702-V706 WeakPolarHBondContact CE1-CG2 3.4Å; H702-V706 WeakPolarHBondContact ND1-CG2 3.34Å; H702-V706 WeakPolarHBondContact O-CG2 3.39Å; H702-V706 PolarHBondContact O-N 3.37Å; H702-E741 VanDerWaalsContact CD2-CB 3.43Å; H702-E741 WeakPolarHBondContact CD2-CB 3.26Å; H702-E741 IonicContact CD2-OE1 3.26Å; H702-E741 IonicContact CD2-OE2 3.4Å; H702-E741 VanDerWaalsContact CE1-CB 3.45Å; H702-E741 WeakPolarHBondContact CE1-CB 3.39Å; H702-E741 VanDerWaalsContact CE1-CD 3.44Å; H702-E741 IonicContact CE1-OE1 3.53Å; H702-E741 IonicContact CE1-OE2 2.9Å; H702-E741 PolarHBondContact CE1-OE2 3.03Å; H702-E741 VanDerWaalsContact ND1-CB 3.33Å; H702-E741 WeakPolarHBondContact ND1-CB 3.46Å; H702-E741 WeakPolarHBondContact NE2-CB 3.38Å; H702-E741 IonicContact NE2-OE1 3.04Å; H702-E741 PolarHBondContact NE2-OE1 3.2Å; H702-E741 VanDerWaalsContact NE2-OE1 3.1Å; H702-E741 IonicContact NE2-OE2 3.22Å; H702-E741 PolarHBondContact NE2-OE2 3.21Å
703L85.7Confident81.3Confident22.3333 Ų22.333340.5 Ų40.512%0.11722%0.215CC..Hα-helixtrans-54.1-39.7175.7179.369.2000112.4D701 V706 K707 V742 D746 E749 L750D701-L703 VanDerWaalsContact C-N 3.31Å; D701-L703 PolarHBondContact O-N 2.91Å; D701-L703 WeakPolarHBondContact OD2-CB 3.2Å; D701-L703 PolarHBondContact OD2-N 3.12Å; L703-V706 PolarHBondContact O-N 3.09Å; L703-K707 VanDerWaalsContact CD2-NZ 3.32Å; L703-K707 HydrophobicContact CG-CD 4.21Å; L703-K707 WeakPolarHBondContact O-CB 3.34Å; L703-K707 WeakPolarHBondContact O-CD 3.4Å; L703-K707 VanDerWaalsContact O-CG 3.24Å; L703-K707 WeakPolarHBondContact O-CG 3.35Å; L703-K707 PolarHBondContact O-N 3.12Å; L703-V742 HydrophobicContact CD1-CG1 3.82Å; L703-D746 HydrophobicContact CD1-CB 4.08Å; L703-D746 HydrophobicContact CD2-CB 3.89Å; L703-D746 HydrophobicContact CG-CB 4.49Å; L703-E749 HydrophobicContact CD2-CB 4.42Å; L703-E749 WeakPolarHBondContact CD2-OE2 3.24Å; L703-L750 HydrophobicContact CD1-CD1 4.33Å; L703-L750 HydrophobicContact CD1-CD2 3.86Å; L703-L750 HydrophobicContact CD1-CG 4.06Å
704S84.1Confident81.9Confident43.3333 Ų43.333341.4 Ų41.430%0.30323%0.225SC..Hα-helixtrans-68.1-38.1176.6-69.20000112.3D701 H702 K707 H708D701-S704 VanDerWaalsContact CG-OG 3.24Å; D701-S704 WeakPolarHBondContact O-CA 3.44Å; D701-S704 WeakPolarHBondContact O-CB 3.46Å; D701-S704 PolarHBondContact O-N 3.26Å; D701-S704 VanDerWaalsContact O-N 3.15Å; D701-S704 WeakPolarHBondContact OD1-CB 3.1Å; D701-S704 PolarHBondContact OD1-OG 2.84Å; D701-S704 WeakPolarHBondContact OD2-CB 3.45Å; D701-S704 PolarHBondContact OD2-N 3.16Å; D701-S704 PolarHBondContact OD2-OG 3.41Å; H702-S704 VanDerWaalsContact C-N 3.26Å; H702-S704 PolarHBondContact O-N 3.23Å; S704-K707 PolarHBondContact O-N 3.25Å; S704-H708 VanDerWaalsContact O-CB 3.31Å; S704-H708 WeakPolarHBondContact O-CB 3.38Å; S704-H708 PolarHBondContact O-CD2 3.06Å; S704-H708 PolarHBondContact O-N 3.1Å; S704-H708 VanDerWaalsContact O-N 3.1Å
705R84.9Confident82.4Confident82 Ų8241.4 Ų41.431%0.30922%0.224SC..Hα-helixtrans-62.6-44.2172.2-61.1-166.2-64.2-113.516.7111.3C695 S700 D701 H702 H708 G709C695-R705 HydrophobicContact CB-CG 4.18Å; S700-R705 PolarHBondContact O-NH1 3.18Å; S700-R705 VanDerWaalsContact OG-CG 3.24Å; S700-R705 WeakPolarHBondContact OG-CG 3.38Å; D701-R705 PolarHBondContact O-N 3.1Å; D701-R705 VanDerWaalsContact O-N 3.13Å; H702-R705 PolarHBondContact CD2-NH2 2.95Å; H702-R705 VanDerWaalsContact CD2-NH2 3.27Å; H702-R705 WeakPolarHBondContact O-CA 3.29Å; H702-R705 WeakPolarHBondContact O-CB 3.34Å; H702-R705 PolarHBondContact O-N 3.25Å; H702-R705 VanDerWaalsContact O-N 3.09Å; R705-H708 PolarHBondContact O-N 3.1Å; R705-G709 PolarHBondContact O-N 2.83Å
706V87.4Confident83.1Confident2 Ų240.8 Ų40.81%0.01222%0.22CC..Hα-helixtrans-63.4-49.5177.4171.50000111.9H702 L703 H708 G709 L710 W734 I738 V742 L750H702-V706 VanDerWaalsContact CE1-CG2 3.43Å; H702-V706 WeakPolarHBondContact CE1-CG2 3.4Å; H702-V706 WeakPolarHBondContact ND1-CG2 3.34Å; H702-V706 WeakPolarHBondContact O-CG2 3.39Å; H702-V706 PolarHBondContact O-N 3.37Å; L703-V706 PolarHBondContact O-N 3.09Å; V706-H708 VanDerWaalsContact C-N 3.27Å; V706-H708 PolarHBondContact O-N 3.18Å; V706-G709 PolarHBondContact O-N 3.03Å; V706-L710 HydrophobicContact CG1-CD1 3.84Å; V706-L710 HydrophobicContact CG1-CG 4.23Å; V706-L710 WeakPolarHBondContact O-CB 3.33Å; V706-L710 WeakPolarHBondContact O-CG 3.35Å; V706-L710 PolarHBondContact O-N 2.96Å; V706-W734 HydrophobicContact CG1-CZ3 4.43Å; V706-W734 HydrophobicContact CG2-CZ3 4.47Å; V706-I738 HydrophobicContact CG1-CD1 4.23Å; V706-I738 HydrophobicContact CG1-CG1 3.81Å; V706-V742 HydrophobicContact CB-CG2 4.42Å; V706-V742 HydrophobicContact CG1-CG2 4.46Å; V706-V742 HydrophobicContact CG2-CG2 3.91Å; V706-L750 HydrophobicContact CG1-CD1 4.15Å; V706-L750 HydrophobicContact CG1-CD2 4.09Å
707K86.8Confident83.5Confident47 Ų4738.4 Ų38.420%0.20421%0.212CC..Hα-helixtrans-54.3-41.4174.5-76.3169.5178.31680111.8L703 S704 S711 E749 L750 L753L703-K707 VanDerWaalsContact CD2-NZ 3.32Å; L703-K707 HydrophobicContact CG-CD 4.21Å; L703-K707 WeakPolarHBondContact O-CB 3.34Å; L703-K707 WeakPolarHBondContact O-CD 3.4Å; L703-K707 VanDerWaalsContact O-CG 3.24Å; L703-K707 WeakPolarHBondContact O-CG 3.35Å; L703-K707 PolarHBondContact O-N 3.12Å; S704-K707 PolarHBondContact O-N 3.25Å; K707-S711 VanDerWaalsContact O-CB 3.26Å; K707-S711 WeakPolarHBondContact O-CB 3.37Å; K707-S711 PolarHBondContact O-N 3.36Å; K707-S711 VanDerWaalsContact O-N 3.07Å; K707-S711 PolarHBondContact O-OG 2.79Å; K707-E749 WeakPolarHBondContact CE-O 3.28Å; K707-E749 IonicContact NZ-OE2 3.23Å; K707-E749 PolarHBondContact NZ-OE2 3.24Å; K707-L750 HydrophobicContact CG-CD2 3.57Å; K707-L753 HydrophobicContact CB-CD1 3.96Å; K707-L753 HydrophobicContact CG-CD1 4Å; K707-L753 WeakPolarHBondContact O-CD1 3.22Å
708H84.7Confident83.9Confident25.3333 Ų25.333337.3 Ų37.312%0.11721%0.21CC..Hα-helixtrans-68.5-47.1178.9-138.2-73.1000112.4R457 N624 M627 S694 C695 S704 R705 V706 S711 R712R457-H708 PolarHBondContact NH2-CD2 2.98Å; R457-H708 PolarHBondContact NH2-NE2 3.27Å; N624-H708 PolarHBondContact OD1-CE1 3.39Å; M627-H708 HydrophobicContact CE-CB 4.43Å; M627-H708 VanDerWaalsContact CE-CD2 3.47Å; M627-H708 WeakPolarHBondContact CE-CD2 3.34Å; M627-H708 VanDerWaalsContact CE-NE2 3.33Å; M627-H708 WeakPolarHBondContact CE-NE2 3.3Å; M627-H708 WeakPolarHBondContact CE-O 3.43Å; M627-H708 PolarHBondContact SD-CE1 3.05Å; M627-H708 PolarHBondContact SD-NE2 3.03Å; M627-H708 VanDerWaalsContact SD-NE2 3.41Å; S694-H708 VanDerWaalsContact CB-CE1 3.47Å; S694-H708 WeakPolarHBondContact CB-CE1 3.47Å; S694-H708 WeakPolarHBondContact CB-NE2 3.27Å; S694-H708 PolarHBondContact OG-CD2 3.22Å; S694-H708 VanDerWaalsContact OG-CD2 3.26Å; S694-H708 PolarHBondContact OG-CE1 3.41Å; S694-H708 VanDerWaalsContact OG-CE1 3.32Å; S694-H708 PolarHBondContact OG-NE2 3.17Å; C695-H708 HydrophobicContact CB-CB 4.34Å; S704-H708 VanDerWaalsContact O-CB 3.31Å; S704-H708 WeakPolarHBondContact O-CB 3.38Å; S704-H708 PolarHBondContact O-CD2 3.06Å; S704-H708 PolarHBondContact O-N 3.1Å; S704-H708 VanDerWaalsContact O-N 3.1Å; R705-H708 PolarHBondContact O-N 3.1Å; V706-H708 VanDerWaalsContact C-N 3.27Å; V706-H708 PolarHBondContact O-N 3.18Å; H708-S711 CarbonylContact O-C 3.56Å; H708-S711 WeakPolarHBondContact O-CB 3.37Å; H708-S711 PolarHBondContact O-N 3.12Å; H708-S711 VanDerWaalsContact O-N 3.16Å; H708-R712 PolarHBondContact O-N 2.94Å
709G87.5Confident84.5Confident10 Ų1037.4 Ų37.410%0.10320%0.204CC..Hα-helixtrans-64.7-43.3178.500000113.8R705 V706 S711 R712 I713 W734R705-G709 PolarHBondContact O-N 2.83Å; V706-G709 PolarHBondContact O-N 3.03Å; G709-S711 VanDerWaalsContact C-N 3.32Å; G709-S711 PolarHBondContact O-N 3.33Å; G709-R712 VanDerWaalsContact O-CB 3.27Å; G709-R712 WeakPolarHBondContact O-CB 3.41Å; G709-R712 PolarHBondContact O-N 3.05Å; G709-R712 VanDerWaalsContact O-N 3.14Å; G709-I713 PolarHBondContact O-N 2.99Å; G709-W734 VanDerWaalsContact CA-CH2 3.41Å
710L88.9Confident85Confident1 Ų133 Ų331%0.00518%0.182CC..Hα-helixtrans-60.8-42.2172-69.8178.8000111.5V706 R712 I713 G714 W734 I738 L750 L754 I757V706-L710 HydrophobicContact CG1-CD1 3.84Å; V706-L710 HydrophobicContact CG1-CG 4.23Å; V706-L710 WeakPolarHBondContact O-CB 3.33Å; V706-L710 WeakPolarHBondContact O-CG 3.35Å; V706-L710 PolarHBondContact O-N 2.96Å; L710-R712 VanDerWaalsContact C-N 3.3Å; L710-R712 PolarHBondContact O-N 3.08Å; L710-I713 PolarHBondContact O-N 2.88Å; L710-G714 PolarHBondContact O-N 3.2Å; L710-W734 HydrophobicContact CD2-CB 4.48Å; L710-W734 HydrophobicContact CD2-CD2 4.22Å; L710-W734 HydrophobicContact CD2-CE3 4.08Å; L710-W734 HydrophobicContact CD2-CG 4.42Å; L710-W734 HydrophobicContact CG-CE3 4.27Å; L710-W734 HydrophobicContact CG-CZ3 4.41Å; L710-I738 HydrophobicContact CD1-CD1 4.26Å; L710-L750 HydrophobicContact CD1-CD2 4.37Å; L710-L754 HydrophobicContact CD1-CD2 3.91Å; L710-L754 HydrophobicContact CD1-CG 4.2Å; L710-L754 HydrophobicContact CD2-CD2 4.31Å; L710-I757 HydrophobicContact CB-CD1 3.79Å; L710-I757 HydrophobicContact CD2-CD1 4.33Å; L710-I757 HydrophobicContact CG-CD1 4.44Å; L710-I757 VanDerWaalsContact O-CD1 3.29Å; L710-I757 WeakPolarHBondContact O-CD1 3.46Å
711S86.4Confident85.5Confident28 Ų2832.3 Ų32.320%0.19618%0.176CC..Hα-helixtrans-64.3-33.9174.9-61.50000112.7M627 K707 H708 G709 G714 S715 L753M627-S711 VanDerWaalsContact CE-CB 3.4Å; K707-S711 VanDerWaalsContact O-CB 3.26Å; K707-S711 WeakPolarHBondContact O-CB 3.37Å; K707-S711 PolarHBondContact O-N 3.36Å; K707-S711 VanDerWaalsContact O-N 3.07Å; K707-S711 PolarHBondContact O-OG 2.79Å; H708-S711 CarbonylContact O-C 3.56Å; H708-S711 WeakPolarHBondContact O-CB 3.37Å; H708-S711 PolarHBondContact O-N 3.12Å; H708-S711 VanDerWaalsContact O-N 3.16Å; G709-S711 VanDerWaalsContact C-N 3.32Å; G709-S711 PolarHBondContact O-N 3.33Å; S711-G714 PolarHBondContact O-N 3.3Å; S711-S715 WeakPolarHBondContact O-CB 3.24Å; S711-S715 PolarHBondContact O-N 3Å; S711-L753 WeakPolarHBondContact OG-CD2 3.29Å
712R87.3Confident85.6Confident11.6667 Ų11.666727.5 Ų27.54%0.04415%0.15CC..Hα-helixtrans-63.3-48.3173.2-173.1-175.5-74.1179.3-8.2110.2F623 N624 M627 V692 H708 G709 L710 G714 S715 L716F623-R712 HydrophobicContact CB-CG 4.32Å; N624-R712 PolarHBondContact OD1-NH2 3.06Å; M627-R712 HydrophobicContact CE-CB 3.62Å; M627-R712 HydrophobicContact CE-CG 4.32Å; M627-R712 VanDerWaalsContact SD-CA 3.59Å; M627-R712 HydrophobicContact SD-CB 3.73Å; M627-R712 PolarHBondContact SD-N 3.36Å; M627-R712 VanDerWaalsContact SD-N 3.41Å; V692-R712 PolarHBondContact O-NH2 3.15Å; H708-R712 PolarHBondContact O-N 2.94Å; G709-R712 VanDerWaalsContact O-CB 3.27Å; G709-R712 WeakPolarHBondContact O-CB 3.41Å; G709-R712 PolarHBondContact O-N 3.05Å; G709-R712 VanDerWaalsContact O-N 3.14Å; L710-R712 VanDerWaalsContact C-N 3.3Å; L710-R712 PolarHBondContact O-N 3.08Å; R712-G714 VanDerWaalsContact C-N 3.32Å; R712-G714 PolarHBondContact O-N 2.87Å; R712-S715 WeakPolarHBondContact O-CB 3.35Å; R712-S715 PolarHBondContact O-N 3.15Å; R712-S715 VanDerWaalsContact O-N 3.11Å; R712-S715 PolarHBondContact O-OG 3.01Å; R712-L716 HydrophobicContact CG-CD1 4.48Å; R712-L716 WeakPolarHBondContact O-CG 3.32Å; R712-L716 PolarHBondContact O-N 3.38Å
713I88.9Confident85.7Confident3.33333 Ų3.3333327.5 Ų27.52%0.01715%0.153CC..Hα-helixtrans-58.4-48.9174.3-70.4170.1000110.6L682 G709 L710 S715 L716 I717 I722 W727 V730 M731 W734 I757L682-I713 HydrophobicContact CD2-CG1 4.29Å; G709-I713 PolarHBondContact O-N 2.99Å; L710-I713 PolarHBondContact O-N 2.88Å; I713-S715 PolarHBondContact O-N 3.27Å; I713-S715 VanDerWaalsContact O-N 3.15Å; I713-L716 PolarHBondContact O-N 3.22Å; I713-I717 HydrophobicContact CG2-CD1 4.25Å; I713-I717 WeakPolarHBondContact O-CG1 3.46Å; I713-I717 PolarHBondContact O-N 3.06Å; I713-I722 HydrophobicContact CB-CD1 4.28Å; I713-I722 HydrophobicContact CG1-CD1 4.46Å; I713-I722 HydrophobicContact CG2-CD1 3.74Å; I713-W727 HydrophobicContact CG2-CZ3 4.27Å; I713-V730 HydrophobicContact CD1-CG1 4.32Å; I713-M731 HydrophobicContact CD1-CE 4.02Å; I713-M731 HydrophobicContact CG2-CE 3.95Å; I713-W734 HydrophobicContact CD1-CD2 4.37Å; I713-W734 HydrophobicContact CD1-CG 4.36Å; I713-W734 HydrophobicContact CD1-CZ2 4.34Å; I713-W734 VanDerWaalsContact CD1-NE1 3.31Å; I713-I757 HydrophobicContact CG2-CG2 4.47Å
714G85.6Confident85.7Confident21.6667 Ų21.666728.3 Ų28.322%0.22316%0.156CC..Hα-helixtrans-57.2-25.8175.900000114.5L710 S711 R712 P718L710-G714 PolarHBondContact O-N 3.2Å; S711-G714 PolarHBondContact O-N 3.3Å; R712-G714 VanDerWaalsContact C-N 3.32Å; R712-G714 PolarHBondContact O-N 2.87Å; G714-P718 WeakPolarHBondContact O-CD 3.41Å
715S84.3Confident85.8Confident5.33333 Ų5.3333332.1 Ų32.14%0.03717%0.169CC..Hα-helixtrans-79-21.8175.982.50000114.2I630 S711 R712 I713 Y719I630-S715 VanDerWaalsContact CD1-CB 3.42Å; S711-S715 WeakPolarHBondContact O-CB 3.24Å; S711-S715 PolarHBondContact O-N 3Å; R712-S715 WeakPolarHBondContact O-CB 3.35Å; R712-S715 PolarHBondContact O-N 3.15Å; R712-S715 VanDerWaalsContact O-N 3.11Å; R712-S715 PolarHBondContact O-OG 3.01Å; I713-S715 PolarHBondContact O-N 3.27Å; I713-S715 VanDerWaalsContact O-N 3.15Å; S715-Y719 VanDerWaalsContact O-CD2 3.32Å; S715-Y719 WeakPolarHBondContact O-CD2 3.42Å; S715-Y719 VanDerWaalsContact O-CE2 3.24Å; S715-Y719 WeakPolarHBondContact O-CE2 3.38Å
716L87.8Confident86Confident0 Ų028.3 Ų28.30%015%0.154CC..Hα-helixtrans-97.4-24.6-174-63.1170.1000112.8F623 F626 L682 R712 I713 P718 Y719 I721 I722F623-L716 HydrophobicContact CB-CD1 4.3Å; F623-L716 HydrophobicContact CD1-CD1 4.2Å; F623-L716 HydrophobicContact CD1-CD2 3.87Å; F623-L716 HydrophobicContact CD2-CD1 3.62Å; F623-L716 HydrophobicContact CE1-CD1 4.42Å; F623-L716 HydrophobicContact CE1-CD2 4.24Å; F623-L716 HydrophobicContact CE2-CD1 3.92Å; F623-L716 HydrophobicContact CG-CD1 3.79Å; F623-L716 HydrophobicContact CG-CD2 4.15Å; F623-L716 HydrophobicContact CZ-CD1 4.32Å; F626-L716 HydrophobicContact CB-CD2 3.97Å; F626-L716 HydrophobicContact CD1-CD2 4.08Å; F626-L716 HydrophobicContact CD2-CD2 4.37Å; F626-L716 HydrophobicContact CG-CD2 4.01Å; L682-L716 HydrophobicContact CD2-CD1 3.69Å; R712-L716 HydrophobicContact CG-CD1 4.48Å; R712-L716 WeakPolarHBondContact O-CG 3.32Å; R712-L716 PolarHBondContact O-N 3.38Å; I713-L716 PolarHBondContact O-N 3.22Å; L716-P718 VanDerWaalsContact C-CD 3.46Å; L716-P718 VanDerWaalsContact C-N 3.34Å; L716-Y719 PolarHBondContact O-N 3Å; L716-I721 HydrophobicContact CB-CB 4.31Å; L716-I721 HydrophobicContact CB-CG2 4.47Å; L716-I721 HydrophobicContact CD2-CD1 3.73Å; L716-I722 HydrophobicContact CB-CD1 4.05Å; L716-I722 HydrophobicContact CB-CG1 3.94Å; L716-I722 HydrophobicContact CD1-CD1 4.28Å
717I85.4Confident86Confident13.3333 Ų13.333328.3 Ų28.37%0.06815%0.154CC..G310 helixtrans-52.2-45.3176.6-64.7166.4000112.8I713 Y719 D720 I722 I757 P764 F765I713-I717 HydrophobicContact CG2-CD1 4.25Å; I713-I717 WeakPolarHBondContact O-CG1 3.46Å; I713-I717 PolarHBondContact O-N 3.06Å; I717-Y719 PolarHBondContact O-N 3.14Å; I717-D720 PolarHBondContact O-N 3.03Å; I717-D720 VanDerWaalsContact O-N 3.13Å; I717-I722 HydrophobicContact CG1-CB 4.41Å; I717-I722 HydrophobicContact CG1-CD1 3.99Å; I717-I722 HydrophobicContact CG1-CG1 4.17Å; I717-I757 HydrophobicContact CD1-CG2 4.37Å; I717-P764 HydrophobicContact CG2-CG 4.15Å; I717-F765 HydrophobicContact CD1-CD2 4.29Å; I717-F765 HydrophobicContact CD1-CE1 4.4Å; I717-F765 HydrophobicContact CD1-CE2 3.87Å; I717-F765 HydrophobicContact CD1-CZ 3.72Å; I717-F765 HydrophobicContact CG1-CE2 4.07Å; I717-F765 HydrophobicContact CG1-CZ 4.31Å; I717-F765 HydrophobicContact CG2-CD1 4.04Å; I717-F765 HydrophobicContact CG2-CD2 3.88Å; I717-F765 HydrophobicContact CG2-CE1 3.96Å; I717-F765 HydrophobicContact CG2-CE2 4.11Å; I717-F765 HydrophobicContact CG2-CG 4.31Å; I717-F765 HydrophobicContact CG2-CZ 4Å
718P81.7Confident86.1Confident75.6667 Ų75.666727.5 Ų27.549%0.49115%0.152SC..G310 helixtrans-65.7-7.8-177.7-2234.6000115.9G714 L716 P764G714-P718 WeakPolarHBondContact O-CD 3.41Å; L716-P718 VanDerWaalsContact C-CD 3.46Å; L716-P718 VanDerWaalsContact C-N 3.34Å; P718-P764 HydrophobicContact CB-CB 4.5Å; P718-P764 HydrophobicContact CB-CG 4.19Å; P718-P764 HydrophobicContact CG-CG 4.02Å
719Y83.1Confident86.4Confident37.3333 Ų37.333330 Ų3015%0.14616%0.162CC..G310 helixtrans-111.510.5-177.2-56.2-86.3000112.9F626 E656 K659 L664 S715 L716 I717 I721F626-Y719 AromaticContact CD1-CD2 3.75Å; F626-Y719 HydrophobicContact CD1-CD2 3.75Å; F626-Y719 HydrophobicContact CD1-CE1 4.32Å; F626-Y719 AromaticContact CD1-CE2 3.58Å; F626-Y719 HydrophobicContact CD1-CE2 3.58Å; F626-Y719 HydrophobicContact CD1-CG 4.35Å; F626-Y719 AromaticContact CD1-CZ 3.87Å; F626-Y719 AromaticContact CE1-CD1 3.78Å; F626-Y719 HydrophobicContact CE1-CD1 3.96Å; F626-Y719 AromaticContact CE1-CD2 3.66Å; F626-Y719 HydrophobicContact CE1-CD2 3.66Å; F626-Y719 AromaticContact CE1-CE1 3.78Å; F626-Y719 HydrophobicContact CE1-CE1 4.02Å; F626-Y719 AromaticContact CE1-CE2 3.74Å; F626-Y719 HydrophobicContact CE1-CE2 3.74Å; F626-Y719 AromaticContact CE1-CG 3.78Å; F626-Y719 HydrophobicContact CE1-CG 3.78Å; F626-Y719 AromaticContact CE1-CZ 3.91Å; E656-Y719 VanDerWaalsContact CD-OH 3.31Å; E656-Y719 PolarHBondContact OE1-OH 3.35Å; E656-Y719 WeakPolarHBondContact OE2-CE1 3.35Å; E656-Y719 PolarHBondContact OE2-OH 3.03Å; K659-Y719 HydrophobicContact CB-CE1 4.01Å; K659-Y719 HydrophobicContact CD-CE1 4.07Å; K659-Y719 VanDerWaalsContact CD-OH 3.27Å; K659-Y719 WeakPolarHBondContact CD-OH 3.35Å; K659-Y719 PolarHBondContact NZ-OH 3.23Å; K659-Y719 VanDerWaalsContact NZ-OH 3.11Å; L664-Y719 WeakPolarHBondContact CD1-O 3.24Å; S715-Y719 VanDerWaalsContact O-CD2 3.32Å; S715-Y719 WeakPolarHBondContact O-CD2 3.42Å; S715-Y719 VanDerWaalsContact O-CE2 3.24Å; S715-Y719 WeakPolarHBondContact O-CE2 3.38Å; L716-Y719 PolarHBondContact O-N 3Å; I717-Y719 PolarHBondContact O-N 3.14Å; Y719-I721 HydrophobicContact CG-CD1 4.41Å; Y719-I721 PolarHBondContact O-N 3.15Å; Y719-I721 VanDerWaalsContact O-N 3.11Å
720D82.8Confident86.6Confident94.3333 Ų94.333329.7 Ų29.750%0.50416%0.159SC..THydrogen-bonded Turntrans55.524-176.6-93.3-19.5000114.2I717 P766I717-D720 PolarHBondContact O-N 3.03Å; I717-D720 VanDerWaalsContact O-N 3.13Å; D720-P766 WeakPolarHBondContact OD1-CB 3.13Å; D720-P766 VanDerWaalsContact OD1-CG 3.29Å; D720-P766 WeakPolarHBondContact OD1-CG 3.36Å
721I85Confident86.7Confident8.33333 Ų8.3333329.8 Ų29.84%0.04316%0.159CC..  trans-73.7-35.2176.6-65.7165.6000110.5F623 F626 L664 I667 L716 Y719 T723F623-I721 HydrophobicContact CE1-CG2 4.25Å; F623-I721 HydrophobicContact CZ-CG2 4Å; F626-I721 HydrophobicContact CD1-CD1 4.48Å; F626-I721 HydrophobicContact CE1-CD1 4.01Å; F626-I721 HydrophobicContact CZ-CD1 4.24Å; L664-I721 HydrophobicContact CD1-CD1 4.2Å; L664-I721 HydrophobicContact CD1-CG1 3.57Å; I667-I721 HydrophobicContact CD1-CD1 3.74Å; I667-I721 HydrophobicContact CD1-CG1 4.24Å; I667-I721 HydrophobicContact CG2-CD1 4.46Å; I667-I721 HydrophobicContact CG2-CG1 4.21Å; I667-I721 HydrophobicContact CG2-CG2 3.89Å; L716-I721 HydrophobicContact CB-CB 4.31Å; L716-I721 HydrophobicContact CB-CG2 4.47Å; L716-I721 HydrophobicContact CD2-CD1 3.73Å; Y719-I721 HydrophobicContact CG-CD1 4.41Å; Y719-I721 PolarHBondContact O-N 3.15Å; Y719-I721 VanDerWaalsContact O-N 3.11Å; I721-T723 PolarHBondContact O-N 2.8Å; I721-T723 VanDerWaalsContact O-N 3.14Å
722I86.1Confident87Confident9.33333 Ų9.3333329 Ų295%0.04815%0.153CC..SBendtrans-84.388.1177.8-54.3-89.4000108.4L682 I713 L716 I717 T726 W727 F767L682-I722 HydrophobicContact CD1-CD1 3.64Å; L682-I722 HydrophobicContact CD2-CD1 4.29Å; I713-I722 HydrophobicContact CB-CD1 4.28Å; I713-I722 HydrophobicContact CG1-CD1 4.46Å; I713-I722 HydrophobicContact CG2-CD1 3.74Å; L716-I722 HydrophobicContact CB-CD1 4.05Å; L716-I722 HydrophobicContact CB-CG1 3.94Å; L716-I722 HydrophobicContact CD1-CD1 4.28Å; I717-I722 HydrophobicContact CG1-CB 4.41Å; I717-I722 HydrophobicContact CG1-CD1 3.99Å; I717-I722 HydrophobicContact CG1-CG1 4.17Å; I722-T726 HydrophobicContact CD1-CG2 4.39Å; I722-T726 HydrophobicContact CG2-CG2 4.44Å; I722-W727 HydrophobicContact CG2-CB 4.04Å; I722-W727 HydrophobicContact CG2-CE3 4.08Å; I722-F767 WeakPolarHBondContact O-CE2 3.47Å; I722-F767 WeakPolarHBondContact O-CZ 3.33Å
723T84.6Confident87.3Confident35.3333 Ų35.333332.7 Ų32.722%0.21717%0.168CC..  trans-67166.4173.769.90000111.3H671 I721 E725 T726 W727 F767H671-T723 PolarHBondContact NE2-OG1 3.25Å; I721-T723 PolarHBondContact O-N 2.8Å; I721-T723 VanDerWaalsContact O-N 3.14Å; T723-E725 VanDerWaalsContact C-N 3.28Å; T723-E725 PolarHBondContact O-N 3.27Å; T723-T726 WeakPolarHBondContact O-CB 3.38Å; T723-T726 PolarHBondContact O-N 3.11Å; T723-T726 VanDerWaalsContact O-N 3.14Å; T723-T726 WeakPolarHBondContact OG1-CB 3.05Å; T723-T726 PolarHBondContact OG1-N 3.17Å; T723-T726 VanDerWaalsContact OG1-N 3.17Å; T723-T726 PolarHBondContact OG1-OG1 3.03Å; T723-W727 WeakPolarHBondContact O-CB 3.36Å; T723-W727 PolarHBondContact O-N 3.15Å; T723-F767 VanDerWaalsContact C-CZ 3.41Å
724F85.8Confident87.5Confident40.6667 Ų40.666733.1 Ų33.118%0.17817%0.169CC..Hα-helixtrans-59-45176.9168.1-108.2000111T726 W727 D728 F767 K771 H774F724-T726 VanDerWaalsContact C-N 3.32Å; F724-T726 PolarHBondContact O-N 3.19Å; F724-W727 PolarHBondContact O-N 3.44Å; F724-D728 HydrophobicContact CE2-CB 4.42Å; F724-D728 HydrophobicContact CZ-CB 4.45Å; F724-D728 VanDerWaalsContact O-CB 3.29Å; F724-D728 WeakPolarHBondContact O-CB 3.35Å; F724-D728 PolarHBondContact O-N 3.01Å; F724-F767 HydrophobicContact CB-CD1 4.28Å; F724-F767 HydrophobicContact CB-CD2 4.38Å; F724-F767 HydrophobicContact CB-CE1 3.87Å; F724-F767 HydrophobicContact CB-CE2 4.07Å; F724-F767 HydrophobicContact CB-CG 4.33Å; F724-F767 HydrophobicContact CB-CZ 3.79Å; F724-K771 HydrophobicContact CD2-CB 3.8Å; F724-K771 HydrophobicContact CD2-CD 3.91Å; F724-K771 HydrophobicContact CD2-CG 3.99Å; F724-K771 HydrophobicContact CE2-CB 3.76Å; F724-K771 HydrophobicContact CE2-CD 4.22Å; F724-K771 HydrophobicContact CE2-CG 3.85Å; F724-K771 WeakPolarHBondContact CE2-O 3.35Å; F724-K771 HydrophobicContact CG-CD 4.25Å; F724-K771 HydrophobicContact CZ-CG 4.47Å; F724-H774 HydrophobicContact CE2-CB 3.85Å; F724-H774 HydrophobicContact CZ-CB 3.99Å; F724-H774 AromaticContact CZ-CG 3.76Å; F724-H774 AromaticContact CZ-ND1 3.79Å
725E86.6Confident87.9Confident123 Ų12332.1 Ų32.158%0.57516%0.159SC*.Hα-helixtrans-61-40.5177.4-64132.6-163.200111.6T723 F729T723-E725 VanDerWaalsContact C-N 3.28Å; T723-E725 PolarHBondContact O-N 3.27Å; E725-F729 VanDerWaalsContact O-CB 3.31Å; E725-F729 WeakPolarHBondContact O-CB 3.36Å; E725-F729 PolarHBondContact O-N 3.2Å; E725-F729 VanDerWaalsContact O-N 3.16Å
726T88.9Confident88.3Confident1 Ų133.3 Ų33.31%0.00616%0.164CC..Hα-helixtrans-66.5-43175.4-53.70000112H671 I678 Y679 L682 I722 T723 F724 F729 V730H671-T726 PolarHBondContact NE2-OG1 3.38Å; I678-T726 HydrophobicContact CG2-CG2 4.37Å; Y679-T726 HydrophobicContact CD1-CG2 4.21Å; Y679-T726 HydrophobicContact CE1-CG2 4.06Å; L682-T726 HydrophobicContact CD1-CG2 3.64Å; I722-T726 HydrophobicContact CD1-CG2 4.39Å; I722-T726 HydrophobicContact CG2-CG2 4.44Å; T723-T726 WeakPolarHBondContact O-CB 3.38Å; T723-T726 PolarHBondContact O-N 3.11Å; T723-T726 VanDerWaalsContact O-N 3.14Å; T723-T726 WeakPolarHBondContact OG1-CB 3.05Å; T723-T726 PolarHBondContact OG1-N 3.17Å; T723-T726 VanDerWaalsContact OG1-N 3.17Å; T723-T726 PolarHBondContact OG1-OG1 3.03Å; F724-T726 VanDerWaalsContact C-N 3.32Å; F724-T726 PolarHBondContact O-N 3.19Å; T726-F729 PolarHBondContact O-N 3.29Å; T726-V730 HydrophobicContact CG2-CG2 4.31Å; T726-V730 VanDerWaalsContact O-CB 3.32Å; T726-V730 WeakPolarHBondContact O-CB 3.38Å; T726-V730 VanDerWaalsContact O-CG2 3.31Å; T726-V730 WeakPolarHBondContact O-CG2 3.36Å; T726-V730 PolarHBondContact O-N 3.38Å; T726-V730 VanDerWaalsContact O-N 3.12Å
727W88.5Confident88.5Confident2 Ų233.6 Ų33.61%0.00817%0.166CC..Hα-helixtrans-63.7-50.7178.8175.8-93.5000111.9I713 I722 T723 F724 F729 V730 M731 I757 F758 F765 V772I713-W727 HydrophobicContact CG2-CZ3 4.27Å; I722-W727 HydrophobicContact CG2-CB 4.04Å; I722-W727 HydrophobicContact CG2-CE3 4.08Å; T723-W727 WeakPolarHBondContact O-CB 3.36Å; T723-W727 PolarHBondContact O-N 3.15Å; F724-W727 PolarHBondContact O-N 3.44Å; W727-F729 VanDerWaalsContact C-N 3.31Å; W727-F729 PolarHBondContact O-N 2.98Å; W727-V730 PolarHBondContact O-N 3.17Å; W727-M731 HydrophobicContact CD2-CB 4.38Å; W727-M731 HydrophobicContact CD2-CE 4.22Å; W727-M731 HydrophobicContact CD2-CG 3.66Å; W727-M731 HydrophobicContact CD2-SD 4.48Å; W727-M731 HydrophobicContact CE3-CE 3.88Å; W727-M731 HydrophobicContact CE3-CG 3.83Å; W727-M731 HydrophobicContact CE3-SD 4.11Å; W727-M731 HydrophobicContact CG-CG 4.27Å; W727-M731 HydrophobicContact CH2-CE 3.82Å; W727-M731 HydrophobicContact CH2-CG 4.05Å; W727-M731 HydrophobicContact CH2-SD 3.96Å; W727-M731 HydrophobicContact CZ2-CB 4.4Å; W727-M731 HydrophobicContact CZ2-CE 3.9Å; W727-M731 HydrophobicContact CZ2-CG 3.8Å; W727-M731 HydrophobicContact CZ2-SD 4.23Å; W727-M731 HydrophobicContact CZ3-CE 3.48Å; W727-M731 HydrophobicContact CZ3-CG 4Å; W727-M731 HydrophobicContact CZ3-SD 4.17Å; W727-M731 VanDerWaalsContact O-CB 3.23Å; W727-M731 WeakPolarHBondContact O-CB 3.37Å; W727-M731 WeakPolarHBondContact O-CG 3.13Å; W727-M731 PolarHBondContact O-N 3.2Å; W727-I757 HydrophobicContact CH2-CG2 3.71Å; W727-I757 HydrophobicContact CZ3-CG2 3.91Å; W727-F758 HydrophobicContact CH2-CD1 4.44Å; W727-F758 HydrophobicContact CH2-CE1 4.23Å; W727-F758 HydrophobicContact CH2-CE2 4.38Å; W727-F758 HydrophobicContact CH2-CZ 4.15Å; W727-F758 HydrophobicContact CZ2-CD1 4.16Å; W727-F758 AromaticContact CZ2-CE1 3.71Å; W727-F758 HydrophobicContact CZ2-CE1 3.71Å; W727-F758 AromaticContact CZ2-CZ 3.97Å; W727-F758 HydrophobicContact CZ2-CZ 3.97Å; W727-F765 HydrophobicContact CD2-CE1 4.3Å; W727-F765 AromaticContact CD2-CZ 3.9Å; W727-F765 HydrophobicContact CD2-CZ 3.9Å; W727-F765 AromaticContact CE3-CE1 3.86Å; W727-F765 HydrophobicContact CE3-CE1 3.86Å; W727-F765 HydrophobicContact CE3-CE2 4.42Å; W727-F765 AromaticContact CE3-CZ 3.78Å; W727-F765 HydrophobicContact CE3-CZ 3.9Å; W727-F765 HydrophobicContact CH2-CE1 4.22Å; W727-F765 HydrophobicContact CH2-CE2 4.22Å; W727-F765 AromaticContact CH2-CZ 3.84Å; W727-F765 HydrophobicContact CH2-CZ 3.91Å; W727-F765 HydrophobicContact CZ2-CZ 4.21Å; W727-F765 AromaticContact CZ3-CE1 3.81Å; W727-F765 HydrophobicContact CZ3-CE1 3.81Å; W727-F765 HydrophobicContact CZ3-CE2 4.18Å; W727-F765 AromaticContact CZ3-CZ 3.74Å; W727-F765 HydrophobicContact CZ3-CZ 3.74Å; W727-V772 HydrophobicContact CZ2-CG1 3.87Å; W727-V772 PolarHBondContact NE1-O 3.13Å
728D89.1Confident88.7Confident30 Ų3033 Ų3316%0.1616%0.163CC..Hα-helixtrans-65.1-32.8-175.6-14855000111.9F724 P732 H774 F775F724-D728 HydrophobicContact CE2-CB 4.42Å; F724-D728 HydrophobicContact CZ-CB 4.45Å; F724-D728 VanDerWaalsContact O-CB 3.29Å; F724-D728 WeakPolarHBondContact O-CB 3.35Å; F724-D728 PolarHBondContact O-N 3.01Å; D728-P732 VanDerWaalsContact O-CD 3.23Å; D728-P732 WeakPolarHBondContact O-CD 3.33Å; D728-P732 WeakPolarHBondContact O-CG 3.36Å; D728-H774 VanDerWaalsContact CG-ND1 3.29Å; D728-H774 WeakPolarHBondContact OD1-CB 3.45Å; D728-H774 IonicContact OD1-CG 2.92Å; D728-H774 IonicContact OD1-ND1 3.43Å; D728-H774 PolarHBondContact OD1-ND1 3.21Å; D728-H774 VanDerWaalsContact OD1-ND1 3.12Å; D728-H774 IonicContact OD2-CE1 3.33Å; D728-H774 PolarHBondContact OD2-CE1 3.36Å; D728-H774 IonicContact OD2-CG 3.09Å; D728-H774 IonicContact OD2-ND1 2.71Å; D728-H774 PolarHBondContact OD2-ND1 3.08Å; D728-F775 VanDerWaalsContact OD1-CA 3.26Å; D728-F775 WeakPolarHBondContact OD1-CA 3.24Å; D728-F775 WeakPolarHBondContact OD1-CB 3.37Å; D728-F775 PolarHBondContact OD1-N 3.16Å
729F90.7Very high89.2Confident77.6667 Ų77.666734 Ų3434%0.34116%0.157SC..Hα-helixtrans-75.6-45.8173.3-176.3-98.5000113.2Y679 L683 E725 T726 W727 Y733Y679-F729 AromaticContact CD1-CD1 3.98Å; Y679-F729 HydrophobicContact CD1-CD1 4.2Å; Y679-F729 HydrophobicContact CD2-CD1 4.25Å; Y679-F729 HydrophobicContact CD2-CE1 4.27Å; Y679-F729 HydrophobicContact CE1-CD1 4.47Å; Y679-F729 AromaticContact CG-CD1 3.88Å; Y679-F729 HydrophobicContact CG-CD1 3.97Å; Y679-F729 AromaticContact CG-CE1 4Å; Y679-F729 HydrophobicContact CG-CE1 4.11Å; L683-F729 HydrophobicContact CD2-CE1 4.46Å; E725-F729 VanDerWaalsContact O-CB 3.31Å; E725-F729 WeakPolarHBondContact O-CB 3.36Å; E725-F729 PolarHBondContact O-N 3.2Å; E725-F729 VanDerWaalsContact O-N 3.16Å; T726-F729 PolarHBondContact O-N 3.29Å; W727-F729 VanDerWaalsContact C-N 3.31Å; W727-F729 PolarHBondContact O-N 2.98Å; F729-Y733 HydrophobicContact CD1-CE2 4.41Å; F729-Y733 AromaticContact CE1-CE2 3.98Å; F729-Y733 HydrophobicContact CE1-CE2 4.12Å; F729-Y733 HydrophobicContact CE2-CE2 4.28Å; F729-Y733 AromaticContact CZ-CE2 3.96Å; F729-Y733 HydrophobicContact CZ-CE2 3.99Å; F729-Y733 VanDerWaalsContact O-CD2 3.22Å; F729-Y733 WeakPolarHBondContact O-CD2 3.31Å; F729-Y733 VanDerWaalsContact O-CE2 3.24Å; F729-Y733 WeakPolarHBondContact O-CE2 3.33Å
730V91.8Very high89.5Confident4.33333 Ų4.3333336 Ų363%0.02617%0.173CC..Hα-helixtrans-83-37.1-168.9170.20000113.1Y679 L682 I713 T726 W727 Y733 W734Y679-V730 HydrophobicContact CD1-CG2 4.43Å; L682-V730 HydrophobicContact CB-CG1 4.11Å; L682-V730 HydrophobicContact CB-CG2 4.09Å; L682-V730 VanDerWaalsContact O-CG1 3.31Å; L682-V730 WeakPolarHBondContact O-CG1 3.42Å; I713-V730 HydrophobicContact CD1-CG1 4.32Å; T726-V730 HydrophobicContact CG2-CG2 4.31Å; T726-V730 VanDerWaalsContact O-CB 3.32Å; T726-V730 WeakPolarHBondContact O-CB 3.38Å; T726-V730 VanDerWaalsContact O-CG2 3.31Å; T726-V730 WeakPolarHBondContact O-CG2 3.36Å; T726-V730 PolarHBondContact O-N 3.38Å; T726-V730 VanDerWaalsContact O-N 3.12Å; W727-V730 PolarHBondContact O-N 3.17Å; V730-Y733 PolarHBondContact O-N 3.13Å; V730-W734 VanDerWaalsContact CG1-CD1 3.45Å; V730-W734 PolarHBondContact O-N 2.91Å
731M91.4Very high89.7Confident2.66667 Ų2.6666734.7 Ų34.71%0.01316%0.164CC..Hα-helixtrans-62.7-38.8-173.8-105.8-35107.600115.5I713 W727 Y733 W734 L735 I757 F758 F775I713-M731 HydrophobicContact CD1-CE 4.02Å; I713-M731 HydrophobicContact CG2-CE 3.95Å; W727-M731 HydrophobicContact CD2-CB 4.38Å; W727-M731 HydrophobicContact CD2-CE 4.22Å; W727-M731 HydrophobicContact CD2-CG 3.66Å; W727-M731 HydrophobicContact CD2-SD 4.48Å; W727-M731 HydrophobicContact CE3-CE 3.88Å; W727-M731 HydrophobicContact CE3-CG 3.83Å; W727-M731 HydrophobicContact CE3-SD 4.11Å; W727-M731 HydrophobicContact CG-CG 4.27Å; W727-M731 HydrophobicContact CH2-CE 3.82Å; W727-M731 HydrophobicContact CH2-CG 4.05Å; W727-M731 HydrophobicContact CH2-SD 3.96Å; W727-M731 HydrophobicContact CZ2-CB 4.4Å; W727-M731 HydrophobicContact CZ2-CE 3.9Å; W727-M731 HydrophobicContact CZ2-CG 3.8Å; W727-M731 HydrophobicContact CZ2-SD 4.23Å; W727-M731 HydrophobicContact CZ3-CE 3.48Å; W727-M731 HydrophobicContact CZ3-CG 4Å; W727-M731 HydrophobicContact CZ3-SD 4.17Å; W727-M731 VanDerWaalsContact O-CB 3.23Å; W727-M731 WeakPolarHBondContact O-CB 3.37Å; W727-M731 WeakPolarHBondContact O-CG 3.13Å; W727-M731 PolarHBondContact O-N 3.2Å; M731-Y733 VanDerWaalsContact C-N 3.29Å; M731-Y733 PolarHBondContact O-N 3.07Å; M731-W734 PolarHBondContact O-N 3.07Å; M731-W734 VanDerWaalsContact O-N 3.12Å; M731-W734 HydrophobicContact SD-CB 4.34Å; M731-L735 HydrophobicContact CG-CD1 4.17Å; M731-L735 PolarHBondContact O-N 3.1Å; M731-L735 HydrophobicContact SD-CG 4.49Å; M731-I757 HydrophobicContact CE-CG2 4.25Å; M731-F758 HydrophobicContact CG-CZ 3.93Å; M731-F758 HydrophobicContact SD-CE2 4.3Å; M731-F758 HydrophobicContact SD-CZ 3.97Å; M731-F775 HydrophobicContact CB-CD1 4.33Å; M731-F775 HydrophobicContact CB-CE1 4.18Å; M731-F775 HydrophobicContact CB-CZ 4.4Å; M731-F775 HydrophobicContact CG-CE1 3.9Å; M731-F775 HydrophobicContact CG-CZ 4.06Å
732P92.3Very high89.9Confident11.6667 Ų11.666734.8 Ų34.88%0.07617%0.165CC..Hα-helixtrans-51.6-45.7172.4-31.738.4000113.3D728 W734 L735 E736 F775 W794D728-P732 VanDerWaalsContact O-CD 3.23Å; D728-P732 WeakPolarHBondContact O-CD 3.33Å; D728-P732 WeakPolarHBondContact O-CG 3.36Å; P732-W734 VanDerWaalsContact C-N 3.34Å; P732-W734 PolarHBondContact O-N 3.16Å; P732-L735 PolarHBondContact O-N 2.98Å; P732-E736 VanDerWaalsContact O-CB 3.29Å; P732-E736 WeakPolarHBondContact O-CB 3.39Å; P732-E736 PolarHBondContact O-N 3.15Å; P732-F775 HydrophobicContact CG-CB 3.79Å; P732-F775 HydrophobicContact CG-CD2 3.87Å; P732-F775 HydrophobicContact CG-CG 4.03Å; P732-W794 HydrophobicContact CB-CH2 3.72Å; P732-W794 HydrophobicContact CB-CZ2 4.22Å; P732-W794 HydrophobicContact CB-CZ3 4.12Å; P732-W794 HydrophobicContact CG-CH2 4.48Å; P732-W794 HydrophobicContact CG-CZ3 4.48Å
733Y93.1Very high89.9Confident89 Ų8936.8 Ų36.835%0.34918%0.18SC..Hα-helixtrans-64.7-39.2179.2-64.7-81.6000112L683 P684 F729 V730 M731 E736 S737 L933L683-Y733 HydrophobicContact CD2-CD1 4.26Å; L683-Y733 HydrophobicContact CD2-CD2 3.45Å; L683-Y733 VanDerWaalsContact CD2-CD2 3.42Å; L683-Y733 HydrophobicContact CD2-CE2 4.02Å; L683-Y733 HydrophobicContact CD2-CG 3.59Å; P684-Y733 WeakPolarHBondContact CG-O 3.46Å; F729-Y733 HydrophobicContact CD1-CE2 4.41Å; F729-Y733 AromaticContact CE1-CE2 3.98Å; F729-Y733 HydrophobicContact CE1-CE2 4.12Å; F729-Y733 HydrophobicContact CE2-CE2 4.28Å; F729-Y733 AromaticContact CZ-CE2 3.96Å; F729-Y733 HydrophobicContact CZ-CE2 3.99Å; F729-Y733 VanDerWaalsContact O-CD2 3.22Å; F729-Y733 WeakPolarHBondContact O-CD2 3.31Å; F729-Y733 VanDerWaalsContact O-CE2 3.24Å; F729-Y733 WeakPolarHBondContact O-CE2 3.33Å; V730-Y733 PolarHBondContact O-N 3.13Å; M731-Y733 VanDerWaalsContact C-N 3.29Å; M731-Y733 PolarHBondContact O-N 3.07Å; Y733-E736 PolarHBondContact O-N 3.31Å; Y733-S737 WeakPolarHBondContact O-CB 3.33Å; Y733-S737 PolarHBondContact O-N 3.12Å; Y733-S737 PolarHBondContact O-OG 3.23Å; Y733-L933 HydrophobicContact CD1-CD1 4.09Å; Y733-L933 HydrophobicContact CE1-CD1 3.57Å; Y733-L933 HydrophobicContact CE2-CD1 4.4Å
734W93.5Very high89.9Confident12.3333 Ų12.333342.3 Ų42.35%0.04720%0.197CC..Hα-helixtrans-65-45.1176.8-81.396000112.9L682 P684 V706 G709 L710 I713 V730 M731 P732 E736 S737 I738L682-W734 PolarHBondContact O-NE1 2.98Å; P684-W734 VanDerWaalsContact CA-CH2 3.5Å; P684-W734 VanDerWaalsContact CA-CZ2 3.44Å; P684-W734 HydrophobicContact CB-CD2 4Å; P684-W734 HydrophobicContact CB-CE3 3.9Å; P684-W734 HydrophobicContact CB-CH2 3.92Å; P684-W734 HydrophobicContact CB-CZ2 4.07Å; P684-W734 HydrophobicContact CB-CZ3 3.83Å; P684-W734 HydrophobicContact CG-CB 4.42Å; P684-W734 HydrophobicContact CG-CD2 4.2Å; P684-W734 HydrophobicContact CG-CE3 3.95Å; P684-W734 HydrophobicContact CG-CG 3.88Å; P684-W734 HydrophobicContact CG-CZ2 4.31Å; P684-W734 HydrophobicContact CG-CZ3 4.33Å; V706-W734 HydrophobicContact CG1-CZ3 4.43Å; V706-W734 HydrophobicContact CG2-CZ3 4.47Å; G709-W734 VanDerWaalsContact CA-CH2 3.41Å; L710-W734 HydrophobicContact CD2-CB 4.48Å; L710-W734 HydrophobicContact CD2-CD2 4.22Å; L710-W734 HydrophobicContact CD2-CE3 4.08Å; L710-W734 HydrophobicContact CD2-CG 4.42Å; L710-W734 HydrophobicContact CG-CE3 4.27Å; L710-W734 HydrophobicContact CG-CZ3 4.41Å; I713-W734 HydrophobicContact CD1-CD2 4.37Å; I713-W734 HydrophobicContact CD1-CG 4.36Å; I713-W734 HydrophobicContact CD1-CZ2 4.34Å; I713-W734 VanDerWaalsContact CD1-NE1 3.31Å; V730-W734 VanDerWaalsContact CG1-CD1 3.45Å; V730-W734 PolarHBondContact O-N 2.91Å; M731-W734 PolarHBondContact O-N 3.07Å; M731-W734 VanDerWaalsContact O-N 3.12Å; M731-W734 HydrophobicContact SD-CB 4.34Å; P732-W734 VanDerWaalsContact C-N 3.34Å; P732-W734 PolarHBondContact O-N 3.16Å; W734-E736 VanDerWaalsContact C-N 3.28Å; W734-E736 PolarHBondContact O-N 3.35Å; W734-S737 PolarHBondContact O-N 3.17Å; W734-I738 WeakPolarHBondContact O-CD1 3.39Å; W734-I738 VanDerWaalsContact O-CG1 3.23Å; W734-I738 WeakPolarHBondContact O-CG1 3.29Å; W734-I738 PolarHBondContact O-N 3.28Å
735L92.7Very high89.9Confident1.33333 Ų1.3333344.6 Ų44.61%0.00722%0.218CC..Hα-helixtrans-68.6-32.3178.9-67.4167.7000111.2M731 P732 I738 R739 F758 F775 W794 L798M731-L735 HydrophobicContact CG-CD1 4.17Å; M731-L735 PolarHBondContact O-N 3.1Å; M731-L735 HydrophobicContact SD-CG 4.49Å; P732-L735 PolarHBondContact O-N 2.98Å; L735-I738 HydrophobicContact CD2-CD1 4.39Å; L735-I738 PolarHBondContact O-N 2.86Å; L735-R739 WeakPolarHBondContact O-CB 3.32Å; L735-R739 PolarHBondContact O-N 3.08Å; L735-F758 HydrophobicContact CD1-CZ 4.4Å; L735-F775 HydrophobicContact CD1-CE2 3.57Å; L735-F775 HydrophobicContact CD1-CZ 3.51Å; L735-W794 HydrophobicContact CB-CB 4.01Å; L735-W794 HydrophobicContact CB-CD2 4.27Å; L735-W794 HydrophobicContact CB-CG 3.73Å; L735-W794 HydrophobicContact CD1-CB 4.13Å; L735-W794 HydrophobicContact CD1-CG 4.35Å; L735-L798 HydrophobicContact CD1-CD1 4.45Å; L735-L798 HydrophobicContact CD2-CD2 4.09Å; L735-L798 HydrophobicContact CD2-CG 4.26Å
736E92.7Very high90Very high29.6667 Ų29.666741 Ų4114%0.13920%0.203CC..Hα-helixtrans-68-45.7172.3-168.864.1-175.600112.6P732 Y733 W734 I738 R739 T740 Q790 W794 L932P732-E736 VanDerWaalsContact O-CB 3.29Å; P732-E736 WeakPolarHBondContact O-CB 3.39Å; P732-E736 PolarHBondContact O-N 3.15Å; Y733-E736 PolarHBondContact O-N 3.31Å; W734-E736 VanDerWaalsContact C-N 3.28Å; W734-E736 PolarHBondContact O-N 3.35Å; E736-I738 VanDerWaalsContact C-N 3.31Å; E736-I738 PolarHBondContact O-N 3.09Å; E736-R739 VanDerWaalsContact CD-NE 3.31Å; E736-R739 CarbonylContact O-C 3.59Å; E736-R739 WeakPolarHBondContact O-CA 3.28Å; E736-R739 VanDerWaalsContact O-CB 3.26Å; E736-R739 WeakPolarHBondContact O-CB 3.26Å; E736-R739 PolarHBondContact O-N 3.22Å; E736-R739 VanDerWaalsContact O-N 3.09Å; E736-R739 IonicContact OE1-CZ 3.32Å; E736-R739 VanDerWaalsContact OE1-CZ 3.24Å; E736-R739 IonicContact OE1-NE 3.52Å; E736-R739 PolarHBondContact OE1-NE 3.36Å; E736-R739 IonicContact OE1-NH2 3.28Å; E736-R739 PolarHBondContact OE1-NH2 3.13Å; E736-R739 IonicContact OE2-CZ 3.28Å; E736-R739 IonicContact OE2-NE 3.03Å; E736-R739 PolarHBondContact OE2-NE 2.99Å; E736-R739 IonicContact OE2-NH2 3.65Å; E736-T740 PolarHBondContact O-N 2.89Å; E736-T740 PolarHBondContact O-OG1 3.03Å; E736-Q790 VanDerWaalsContact CD-NE2 3.26Å; E736-Q790 PolarHBondContact OE1-NE2 2.89Å; E736-Q790 VanDerWaalsContact OE1-NE2 3.1Å; E736-Q790 PolarHBondContact OE2-NE2 3Å; E736-W794 HydrophobicContact CB-CZ2 4.46Å; E736-W794 PolarHBondContact OE2-NE1 3.15Å; E736-L932 HydrophobicContact CG-CD1 4.38Å
737S92Very high90Very high7.33333 Ų7.3333341.2 Ų41.25%0.05120%0.204CC..Hα-helixtrans-60.5-38.9174.1-670000112.3P684 H685 Y733 W734 R739 T740 E741P684-S737 WeakPolarHBondContact CB-OG 3.39Å; P684-S737 VanDerWaalsContact CG-OG 3.24Å; P684-S737 WeakPolarHBondContact CG-OG 3.33Å; H685-S737 PolarHBondContact NE2-OG 2.94Å; Y733-S737 WeakPolarHBondContact O-CB 3.33Å; Y733-S737 PolarHBondContact O-N 3.12Å; Y733-S737 PolarHBondContact O-OG 3.23Å; W734-S737 PolarHBondContact O-N 3.17Å; S737-R739 VanDerWaalsContact C-N 3.3Å; S737-R739 PolarHBondContact O-N 3.08Å; S737-T740 PolarHBondContact O-N 3.2Å; S737-E741 WeakPolarHBondContact CA-OE2 3.29Å; S737-E741 VanDerWaalsContact CB-OE2 3.27Å; S737-E741 WeakPolarHBondContact CB-OE2 3.44Å; S737-E741 VanDerWaalsContact O-CB 3.29Å; S737-E741 WeakPolarHBondContact O-CB 3.34Å; S737-E741 PolarHBondContact O-N 3.17Å; S737-E741 PolarHBondContact OG-OE2 3.09Å
738I91.3Very high89.9Confident0.333333 Ų0.33333344.9 Ų44.90%0.00223%0.227CC..Hα-helixtrans-65.2-35.8173.2-65160.8000110.9V706 L710 W734 L735 E736 V742 Y747 L750 I797V706-I738 HydrophobicContact CG1-CD1 4.23Å; V706-I738 HydrophobicContact CG1-CG1 3.81Å; L710-I738 HydrophobicContact CD1-CD1 4.26Å; W734-I738 WeakPolarHBondContact O-CD1 3.39Å; W734-I738 VanDerWaalsContact O-CG1 3.23Å; W734-I738 WeakPolarHBondContact O-CG1 3.29Å; W734-I738 PolarHBondContact O-N 3.28Å; L735-I738 HydrophobicContact CD2-CD1 4.39Å; L735-I738 PolarHBondContact O-N 2.86Å; E736-I738 VanDerWaalsContact C-N 3.31Å; E736-I738 PolarHBondContact O-N 3.09Å; I738-V742 HydrophobicContact CG2-CB 4.46Å; I738-V742 WeakPolarHBondContact O-CB 3.43Å; I738-V742 PolarHBondContact O-N 3.42Å; I738-Y747 HydrophobicContact CG2-CD1 4.32Å; I738-Y747 HydrophobicContact CG2-CE1 3.87Å; I738-Y747 WeakPolarHBondContact O-CE1 3.27Å; I738-Y747 PolarHBondContact O-OH 3.31Å; I738-L750 HydrophobicContact CD1-CD1 4.38Å; I738-L750 HydrophobicContact CG1-CD1 4.31Å; I738-L750 HydrophobicContact CG2-CD1 4.08Å; I738-I797 HydrophobicContact CB-CD1 4.5Å; I738-I797 HydrophobicContact CG2-CD1 4.22Å; I738-I797 HydrophobicContact CG2-CG2 3.79Å
739R90.9Very high89.8Confident97 Ų9748.9 Ų48.937%0.36625%0.245SC..Hα-helixtrans-68.5-37.7178.2-166.6-170.369.974.20.2112.8L735 E736 S737 S793 I797L735-R739 WeakPolarHBondContact O-CB 3.32Å; L735-R739 PolarHBondContact O-N 3.08Å; E736-R739 VanDerWaalsContact CD-NE 3.31Å; E736-R739 CarbonylContact O-C 3.59Å; E736-R739 WeakPolarHBondContact O-CA 3.28Å; E736-R739 VanDerWaalsContact O-CB 3.26Å; E736-R739 WeakPolarHBondContact O-CB 3.26Å; E736-R739 PolarHBondContact O-N 3.22Å; E736-R739 VanDerWaalsContact O-N 3.09Å; E736-R739 IonicContact OE1-CZ 3.32Å; E736-R739 VanDerWaalsContact OE1-CZ 3.24Å; E736-R739 IonicContact OE1-NE 3.52Å; E736-R739 PolarHBondContact OE1-NE 3.36Å; E736-R739 IonicContact OE1-NH2 3.28Å; E736-R739 PolarHBondContact OE1-NH2 3.13Å; E736-R739 IonicContact OE2-CZ 3.28Å; E736-R739 IonicContact OE2-NE 3.03Å; E736-R739 PolarHBondContact OE2-NE 2.99Å; E736-R739 IonicContact OE2-NH2 3.65Å; S737-R739 VanDerWaalsContact C-N 3.3Å; S737-R739 PolarHBondContact O-N 3.08Å; R739-S793 VanDerWaalsContact CD-CB 3.49Å; R739-I797 HydrophobicContact CB-CD1 3.72Å; R739-I797 HydrophobicContact CG-CD1 4.18Å
740T89.5Confident89.7Confident77.6667 Ų77.666745.2 Ų45.248%0.47623%0.229SC..Hα-helixtrans-97.4-30.4-172.350.90000114.3E736 S737 L932E736-T740 PolarHBondContact O-N 2.89Å; E736-T740 PolarHBondContact O-OG1 3.03Å; S737-T740 PolarHBondContact O-N 3.2Å; T740-L932 HydrophobicContact CG2-CD1 4.45Å
741E88.3Confident89.5Confident68.6667 Ų68.666748.2 Ų48.232%0.32124%0.243SC..Hα-helixtrans-117.9-16.7-167-52.6172.3107.600114.5H685 H702 S737H685-E741 VanDerWaalsContact CE1-CD 3.42Å; H685-E741 IonicContact CE1-OE1 3.36Å; H685-E741 PolarHBondContact CE1-OE1 2.98Å; H685-E741 IonicContact CE1-OE2 3.14Å; H685-E741 PolarHBondContact CE1-OE2 3.31Å; H685-E741 IonicContact NE2-OE1 3.04Å; H685-E741 PolarHBondContact NE2-OE1 3.43Å; H685-E741 IonicContact NE2-OE2 3.21Å; H685-E741 PolarHBondContact NE2-OE2 2.98Å; H685-E741 VanDerWaalsContact NE2-OE2 3.13Å; H702-E741 VanDerWaalsContact CD2-CB 3.43Å; H702-E741 WeakPolarHBondContact CD2-CB 3.26Å; H702-E741 IonicContact CD2-OE1 3.26Å; H702-E741 IonicContact CD2-OE2 3.4Å; H702-E741 VanDerWaalsContact CE1-CB 3.45Å; H702-E741 WeakPolarHBondContact CE1-CB 3.39Å; H702-E741 VanDerWaalsContact CE1-CD 3.44Å; H702-E741 IonicContact CE1-OE1 3.53Å; H702-E741 IonicContact CE1-OE2 2.9Å; H702-E741 PolarHBondContact CE1-OE2 3.03Å; H702-E741 VanDerWaalsContact ND1-CB 3.33Å; H702-E741 WeakPolarHBondContact ND1-CB 3.46Å; H702-E741 WeakPolarHBondContact NE2-CB 3.38Å; H702-E741 IonicContact NE2-OE1 3.04Å; H702-E741 PolarHBondContact NE2-OE1 3.2Å; H702-E741 VanDerWaalsContact NE2-OE1 3.1Å; H702-E741 IonicContact NE2-OE2 3.22Å; H702-E741 PolarHBondContact NE2-OE2 3.21Å; S737-E741 WeakPolarHBondContact CA-OE2 3.29Å; S737-E741 VanDerWaalsContact CB-OE2 3.27Å; S737-E741 WeakPolarHBondContact CB-OE2 3.44Å; S737-E741 VanDerWaalsContact O-CB 3.29Å; S737-E741 WeakPolarHBondContact O-CB 3.34Å; S737-E741 PolarHBondContact O-N 3.17Å; S737-E741 PolarHBondContact OG-OE2 3.09Å
742V88.1Confident89.2Confident9 Ų954.4 Ų54.46%0.05528%0.275CS..SBendtrans-103.5131.1176.1-177.50000109.2L703 V706 I738 D746 Y747L703-V742 HydrophobicContact CD1-CG1 3.82Å; V706-V742 HydrophobicContact CB-CG2 4.42Å; V706-V742 HydrophobicContact CG1-CG2 4.46Å; V706-V742 HydrophobicContact CG2-CG2 3.91Å; I738-V742 HydrophobicContact CG2-CB 4.46Å; I738-V742 WeakPolarHBondContact O-CB 3.43Å; I738-V742 PolarHBondContact O-N 3.42Å; V742-D746 HydrophobicContact CG1-CB 4.07Å; V742-Y747 HydrophobicContact CB-CD1 4.48Å; V742-Y747 HydrophobicContact CB-CE1 4.12Å; V742-Y747 HydrophobicContact CG1-CD1 3.93Å; V742-Y747 HydrophobicContact CG1-CE1 4Å; V742-Y747 WeakPolarHBondContact O-CE1 3.49Å
743S87Confident88.9Confident52.6667 Ų52.666755.6 Ų55.637%0.36828%0.28SS..  trans-73.5148.1-179.392.10000111.5S745 D746 Y747S743-S745 PolarHBondContact O-N 3.08Å; S743-S745 VanDerWaalsContact O-N 3.09Å; S743-S745 PolarHBondContact OG-OG 3.05Å; S743-D746 WeakPolarHBondContact CB-OD2 3.41Å; S743-D746 PolarHBondContact O-N 3.02Å; S743-D746 PolarHBondContact OG-OD1 3.1Å; S743-D746 VanDerWaalsContact OG-OD1 3.1Å; S743-D746 PolarHBondContact OG-OD2 2.95Å; S743-Y747 VanDerWaalsContact O-CD1 3.3Å; S743-Y747 WeakPolarHBondContact O-CD1 3.38Å
744R84.5Confident88.6Confident149.333 Ų149.33351.4 Ų51.456%0.56426%0.264SS*.THydrogen-bonded Turntrans-60.8-19.3-178.5-72-174.7173.4-128.1-7.2113.9D746 Y747 E796R744-D746 VanDerWaalsContact C-N 3.3Å; R744-D746 PolarHBondContact O-N 2.63Å; R744-Y747 HydrophobicContact CB-CE2 4.38Å; R744-Y747 HydrophobicContact CG-CE2 3.89Å; R744-E796 IonicContact CZ-OE1 3.28Å; R744-E796 IonicContact CZ-OE2 3.05Å; R744-E796 VanDerWaalsContact NH1-CD 3.35Å; R744-E796 IonicContact NH1-OE1 3.26Å; R744-E796 PolarHBondContact NH1-OE1 2.93Å; R744-E796 IonicContact NH1-OE2 3.04Å; R744-E796 PolarHBondContact NH1-OE2 3.28Å; R744-E796 IonicContact NH2-OE1 3.27Å; R744-E796 PolarHBondContact NH2-OE1 2.66Å; R744-E796 IonicContact NH2-OE2 3.55Å; R744-E796 PolarHBondContact NH2-OE2 3.07Å
745S85.3Confident88.3Confident90.3333 Ų90.333353.7 Ų53.763%0.63227%0.274SS*.THydrogen-bonded Turntrans-73.9-21.6174.146.10000113.5S743 P748S743-S745 PolarHBondContact O-N 3.08Å; S743-S745 VanDerWaalsContact O-N 3.09Å; S743-S745 PolarHBondContact OG-OG 3.05Å; S745-P748 VanDerWaalsContact O-CD 3.28Å; S745-P748 WeakPolarHBondContact O-CD 3.3Å; S745-P748 WeakPolarHBondContact O-CG 3.4Å
746D88Confident87.8Confident47.6667 Ų47.666760.4 Ų60.426%0.25530%0.303SS..THydrogen-bonded Turntrans-100.5-10-168.4-45.2-28.4000112.2L703 V742 S743 R744 P748 E749L703-D746 HydrophobicContact CD1-CB 4.08Å; L703-D746 HydrophobicContact CD2-CB 3.89Å; L703-D746 HydrophobicContact CG-CB 4.49Å; V742-D746 HydrophobicContact CG1-CB 4.07Å; S743-D746 WeakPolarHBondContact CB-OD2 3.41Å; S743-D746 PolarHBondContact O-N 3.02Å; S743-D746 PolarHBondContact OG-OD1 3.1Å; S743-D746 VanDerWaalsContact OG-OD1 3.1Å; S743-D746 PolarHBondContact OG-OD2 2.95Å; R744-D746 VanDerWaalsContact C-N 3.3Å; R744-D746 PolarHBondContact O-N 2.63Å; D746-P748 VanDerWaalsContact C-CD 3.45Å; D746-P748 VanDerWaalsContact C-N 3.32Å; D746-E749 WeakPolarHBondContact O-CB 3.29Å; D746-E749 PolarHBondContact O-N 3.15Å
747Y88.9Confident87.4Confident5 Ų559.3 Ų59.32%0.0230%0.298CS..G310 helixtrans-49.6-40.2174-69.62.2000114.4I738 V742 S743 R744 E749 L750 I797 I800I738-Y747 HydrophobicContact CG2-CD1 4.32Å; I738-Y747 HydrophobicContact CG2-CE1 3.87Å; I738-Y747 WeakPolarHBondContact O-CE1 3.27Å; I738-Y747 PolarHBondContact O-OH 3.31Å; V742-Y747 HydrophobicContact CB-CD1 4.48Å; V742-Y747 HydrophobicContact CB-CE1 4.12Å; V742-Y747 HydrophobicContact CG1-CD1 3.93Å; V742-Y747 HydrophobicContact CG1-CE1 4Å; V742-Y747 WeakPolarHBondContact O-CE1 3.49Å; S743-Y747 VanDerWaalsContact O-CD1 3.3Å; S743-Y747 WeakPolarHBondContact O-CD1 3.38Å; R744-Y747 HydrophobicContact CB-CE2 4.38Å; R744-Y747 HydrophobicContact CG-CE2 3.89Å; Y747-E749 PolarHBondContact O-N 3.05Å; Y747-E749 VanDerWaalsContact O-N 3.14Å; Y747-L750 WeakPolarHBondContact O-CB 3.4Å; Y747-L750 PolarHBondContact O-N 3.15Å; Y747-I797 HydrophobicContact CE2-CG1 3.84Å; Y747-I797 HydrophobicContact CE2-CG2 4.46Å; Y747-I800 HydrophobicContact CD2-CB 4.46Å; Y747-I800 HydrophobicContact CD2-CD1 4.29Å; Y747-I800 HydrophobicContact CD2-CG2 4.07Å; Y747-I800 HydrophobicContact CE2-CD1 4.31Å
748P87.5Confident87.1Confident78.6667 Ų78.666759.2 Ų59.251%0.51130%0.297SS..G310 helixtrans-59.2-24.7175.2-9.613.8000113.9S745 D746 L750 E751S745-P748 VanDerWaalsContact O-CD 3.28Å; S745-P748 WeakPolarHBondContact O-CD 3.3Å; S745-P748 WeakPolarHBondContact O-CG 3.4Å; D746-P748 VanDerWaalsContact C-CD 3.45Å; D746-P748 VanDerWaalsContact C-N 3.32Å; P748-L750 PolarHBondContact O-N 3.12Å; P748-E751 VanDerWaalsContact O-CB 3.22Å; P748-E751 WeakPolarHBondContact O-CB 3.36Å; P748-E751 PolarHBondContact O-N 3.34Å
749E87.1Confident86.3Confident115 Ų11561.9 Ų61.954%0.53731%0.311SS..G310 helixtrans-75.9-10.6176.2-55.8-164.5-166.800113.4L703 K707 D746 Y747L703-E749 HydrophobicContact CD2-CB 4.42Å; L703-E749 WeakPolarHBondContact CD2-OE2 3.24Å; K707-E749 WeakPolarHBondContact CE-O 3.28Å; K707-E749 IonicContact NZ-OE2 3.23Å; K707-E749 PolarHBondContact NZ-OE2 3.24Å; D746-E749 WeakPolarHBondContact O-CB 3.29Å; D746-E749 PolarHBondContact O-N 3.15Å; Y747-E749 PolarHBondContact O-N 3.05Å; Y747-E749 VanDerWaalsContact O-N 3.14Å
750L87.5Confident85Confident0.333333 Ų0.33333358.6 Ų58.60%0.00230%0.304CS..G310 helixtrans-92.4-8172.4-58.3-179.5000112.7L703 V706 K707 L710 I738 Y747 P748 I752 L753 L754L703-L750 HydrophobicContact CD1-CD1 4.33Å; L703-L750 HydrophobicContact CD1-CD2 3.86Å; L703-L750 HydrophobicContact CD1-CG 4.06Å; V706-L750 HydrophobicContact CG1-CD1 4.15Å; V706-L750 HydrophobicContact CG1-CD2 4.09Å; K707-L750 HydrophobicContact CG-CD2 3.57Å; L710-L750 HydrophobicContact CD1-CD2 4.37Å; I738-L750 HydrophobicContact CD1-CD1 4.38Å; I738-L750 HydrophobicContact CG1-CD1 4.31Å; I738-L750 HydrophobicContact CG2-CD1 4.08Å; Y747-L750 WeakPolarHBondContact O-CB 3.4Å; Y747-L750 PolarHBondContact O-N 3.15Å; P748-L750 PolarHBondContact O-N 3.12Å; L750-I752 PolarHBondContact O-N 3.07Å; L750-L753 PolarHBondContact O-N 3.17Å; L750-L753 VanDerWaalsContact O-N 3.16Å; L750-L754 HydrophobicContact CB-CD1 3.89Å; L750-L754 HydrophobicContact CB-CG 4.31Å; L750-L754 HydrophobicContact CD1-CD1 4.36Å; L750-L754 PolarHBondContact O-N 3.14Å
751E87.9Confident83.3Confident66.3333 Ų66.333361 Ų6131%0.3132%0.319SS..Hα-helixtrans-53.3-52.9-172.3-168.6-157.7138.200114.1P748 L753 L754 K755 V801P748-E751 VanDerWaalsContact O-CB 3.22Å; P748-E751 WeakPolarHBondContact O-CB 3.36Å; P748-E751 PolarHBondContact O-N 3.34Å; E751-L753 PolarHBondContact O-N 2.99Å; E751-L754 PolarHBondContact O-N 3.43Å; E751-K755 HydrophobicContact CG-CD 3.85Å; E751-K755 HydrophobicContact CG-CG 4.36Å; E751-K755 VanDerWaalsContact O-CB 3.26Å; E751-K755 WeakPolarHBondContact O-CB 3.26Å; E751-K755 WeakPolarHBondContact O-CG 3.39Å; E751-K755 PolarHBondContact O-N 3.17Å; E751-K755 WeakPolarHBondContact OE1-CE 3.41Å; E751-K755 IonicContact OE1-NZ 3.2Å; E751-K755 PolarHBondContact OE1-NZ 3.38Å; E751-V801 VanDerWaalsContact CA-CG1 3.43Å; E751-V801 HydrophobicContact CB-CG1 3.98Å; E751-V801 HydrophobicContact CG-CG1 4.23Å
752I85Confident81.5Confident132.333 Ų132.33361.6 Ų61.668%0.67934%0.336SS*.Hα-helixtrans-64.6-30.3-177.7-59.7173.7000111.2L750 K756L750-I752 PolarHBondContact O-N 3.07Å; I752-K756 HydrophobicContact CG2-CD 4.48Å; I752-K756 VanDerWaalsContact O-CB 3.26Å; I752-K756 WeakPolarHBondContact O-CB 3.18Å; I752-K756 WeakPolarHBondContact O-CD 3.16Å; I752-K756 WeakPolarHBondContact O-CG 3.39Å; I752-K756 PolarHBondContact O-N 3.29Å; I752-K756 VanDerWaalsContact O-N 3.17Å
753L85.1Confident80.1Confident38 Ų3862.6 Ų62.620%0.19935%0.348CS..Hα-helixtrans-79.5-51.4179.1-65.3177.2000111.2K707 S711 L750 E751 K756 I757K707-L753 HydrophobicContact CB-CD1 3.96Å; K707-L753 HydrophobicContact CG-CD1 4Å; K707-L753 WeakPolarHBondContact O-CD1 3.22Å; S711-L753 WeakPolarHBondContact OG-CD2 3.29Å; L750-L753 PolarHBondContact O-N 3.17Å; L750-L753 VanDerWaalsContact O-N 3.16Å; E751-L753 PolarHBondContact O-N 2.99Å; L753-K756 PolarHBondContact O-N 3.44Å; L753-K756 VanDerWaalsContact O-N 3.17Å; L753-I757 HydrophobicContact CB-CD1 4.39Å; L753-I757 WeakPolarHBondContact O-CB 3.34Å; L753-I757 WeakPolarHBondContact O-CD1 3.38Å; L753-I757 VanDerWaalsContact O-CG1 3.25Å; L753-I757 WeakPolarHBondContact O-CG1 3.24Å; L753-I757 PolarHBondContact O-N 3.05Å
754L88.4Confident78.5Confident1 Ų164 Ų641%0.00536%0.356CS..Hα-helixtrans-66.8-41.3-178.1-72.3173.5000111.7L710 L750 E751 K756 I757 F758 V801 V803L710-L754 HydrophobicContact CD1-CD2 3.91Å; L710-L754 HydrophobicContact CD1-CG 4.2Å; L710-L754 HydrophobicContact CD2-CD2 4.31Å; L750-L754 HydrophobicContact CB-CD1 3.89Å; L750-L754 HydrophobicContact CB-CG 4.31Å; L750-L754 HydrophobicContact CD1-CD1 4.36Å; L750-L754 PolarHBondContact O-N 3.14Å; E751-L754 PolarHBondContact O-N 3.43Å; L754-K756 VanDerWaalsContact C-N 3.29Å; L754-K756 PolarHBondContact O-N 3.07Å; L754-I757 PolarHBondContact O-N 3.21Å; L754-F758 HydrophobicContact CD2-CD2 4.22Å; L754-F758 HydrophobicContact CD2-CE2 3.91Å; L754-F758 WeakPolarHBondContact O-CB 3.38Å; L754-F758 WeakPolarHBondContact O-CD2 3.23Å; L754-F758 PolarHBondContact O-N 3.28Å; L754-V801 HydrophobicContact CB-CG1 4.04Å; L754-V801 HydrophobicContact CD1-CB 4.44Å; L754-V801 HydrophobicContact CD1-CG1 3.99Å; L754-V801 HydrophobicContact CD1-CG2 4.33Å; L754-V803 HydrophobicContact CB-CG2 4.06Å
755K85.6Confident77.4Confident59 Ų5958 Ų5826%0.25733%0.334SS..Hα-helixtrans-58.6-39.8172.3-73-177.6177.4173.60111.8E751 D759 V801 E802 V803E751-K755 HydrophobicContact CG-CD 3.85Å; E751-K755 HydrophobicContact CG-CG 4.36Å; E751-K755 VanDerWaalsContact O-CB 3.26Å; E751-K755 WeakPolarHBondContact O-CB 3.26Å; E751-K755 WeakPolarHBondContact O-CG 3.39Å; E751-K755 PolarHBondContact O-N 3.17Å; E751-K755 WeakPolarHBondContact OE1-CE 3.41Å; E751-K755 IonicContact OE1-NZ 3.2Å; E751-K755 PolarHBondContact OE1-NZ 3.38Å; K755-D759 WeakPolarHBondContact O-CB 3.39Å; K755-D759 PolarHBondContact O-N 3.13Å; K755-D759 VanDerWaalsContact O-N 3.15Å; K755-V801 VanDerWaalsContact CE-O 3.26Å; K755-V801 WeakPolarHBondContact CE-O 3.45Å; K755-E802 VanDerWaalsContact CE-O 3.27Å; K755-E802 WeakPolarHBondContact CE-O 3.46Å; K755-E802 IonicContact NZ-OE2 3.58Å; K755-E802 PolarHBondContact NZ-OE2 2.98Å; K755-V803 HydrophobicContact CG-CG2 4.25Å
756K83.1Confident76.2Confident143 Ų14357.1 Ų57.162%0.62233%0.326SS*.Hα-helixtrans-71.6-34.4177.7-146.5178.7-178.1-178.80113.6I752 L753 L754I752-K756 HydrophobicContact CG2-CD 4.48Å; I752-K756 VanDerWaalsContact O-CB 3.26Å; I752-K756 WeakPolarHBondContact O-CB 3.18Å; I752-K756 WeakPolarHBondContact O-CD 3.16Å; I752-K756 WeakPolarHBondContact O-CG 3.39Å; I752-K756 PolarHBondContact O-N 3.29Å; I752-K756 VanDerWaalsContact O-N 3.17Å; L753-K756 PolarHBondContact O-N 3.44Å; L753-K756 VanDerWaalsContact O-N 3.17Å; L754-K756 VanDerWaalsContact C-N 3.29Å; L754-K756 PolarHBondContact O-N 3.07Å
757I84.7Confident75.3Confident5.66667 Ų5.6666756.6 Ų56.63%0.02932%0.322CS..Hα-helixtrans-79.5-33.1-177.4-71.2164.1000111.5L710 I713 I717 W727 M731 L753 L754 F765L710-I757 HydrophobicContact CB-CD1 3.79Å; L710-I757 HydrophobicContact CD2-CD1 4.33Å; L710-I757 HydrophobicContact CG-CD1 4.44Å; L710-I757 VanDerWaalsContact O-CD1 3.29Å; L710-I757 WeakPolarHBondContact O-CD1 3.46Å; I713-I757 HydrophobicContact CG2-CG2 4.47Å; I717-I757 HydrophobicContact CD1-CG2 4.37Å; W727-I757 HydrophobicContact CH2-CG2 3.71Å; W727-I757 HydrophobicContact CZ3-CG2 3.91Å; M731-I757 HydrophobicContact CE-CG2 4.25Å; L753-I757 HydrophobicContact CB-CD1 4.39Å; L753-I757 WeakPolarHBondContact O-CB 3.34Å; L753-I757 WeakPolarHBondContact O-CD1 3.38Å; L753-I757 VanDerWaalsContact O-CG1 3.25Å; L753-I757 WeakPolarHBondContact O-CG1 3.24Å; L753-I757 PolarHBondContact O-N 3.05Å; L754-I757 PolarHBondContact O-N 3.21Å; I757-F765 WeakPolarHBondContact O-CE2 3.21Å; I757-F765 VanDerWaalsContact O-CZ 3.29Å; I757-F765 WeakPolarHBondContact O-CZ 3.33Å
758F84.3Confident74.4Confident7 Ų762.2 Ų62.23%0.03135%0.351CS..SBendtrans-96.53.5179.3-77.1-93.1000114.4W727 M731 L735 L754 A760 V772 Y773 L798 V803W727-F758 HydrophobicContact CH2-CD1 4.44Å; W727-F758 HydrophobicContact CH2-CE1 4.23Å; W727-F758 HydrophobicContact CH2-CE2 4.38Å; W727-F758 HydrophobicContact CH2-CZ 4.15Å; W727-F758 HydrophobicContact CZ2-CD1 4.16Å; W727-F758 AromaticContact CZ2-CE1 3.71Å; W727-F758 HydrophobicContact CZ2-CE1 3.71Å; W727-F758 AromaticContact CZ2-CZ 3.97Å; W727-F758 HydrophobicContact CZ2-CZ 3.97Å; M731-F758 HydrophobicContact CG-CZ 3.93Å; M731-F758 HydrophobicContact SD-CE2 4.3Å; M731-F758 HydrophobicContact SD-CZ 3.97Å; L735-F758 HydrophobicContact CD1-CZ 4.4Å; L754-F758 HydrophobicContact CD2-CD2 4.22Å; L754-F758 HydrophobicContact CD2-CE2 3.91Å; L754-F758 WeakPolarHBondContact O-CB 3.38Å; L754-F758 WeakPolarHBondContact O-CD2 3.23Å; L754-F758 PolarHBondContact O-N 3.28Å; F758-A760 VanDerWaalsContact C-N 3.31Å; F758-A760 PolarHBondContact O-N 3.25Å; F758-V772 HydrophobicContact CD1-CG1 4.07Å; F758-V772 HydrophobicContact CE1-CG1 4.3Å; F758-Y773 AromaticContact CD1-CE1 3.85Å; F758-Y773 HydrophobicContact CD1-CE1 3.85Å; F758-Y773 HydrophobicContact CE1-CE1 4.14Å; F758-L798 HydrophobicContact CD1-CD1 4.43Å; F758-L798 HydrophobicContact CD1-CD2 4.47Å; F758-L798 HydrophobicContact CD2-CD2 3.94Å; F758-L798 HydrophobicContact CE1-CD1 4.05Å; F758-L798 HydrophobicContact CE1-CD2 4.32Å; F758-L798 HydrophobicContact CE2-CD2 3.73Å; F758-L798 HydrophobicContact CG-CD2 4.34Å; F758-L798 HydrophobicContact CZ-CD1 4.25Å; F758-L798 HydrophobicContact CZ-CD2 3.94Å; F758-V803 HydrophobicContact CB-CG1 3.5Å; F758-V803 VanDerWaalsContact CB-CG1 3.48Å; F758-V803 HydrophobicContact CG-CG1 4.15Å
759D75.9Confident73.6Confident56.3333 Ų56.333360 Ų6030%0.30134%0.337SS..  trans-72.384.7174.2-171.9-10.2000111.5K755 T761 A762 G763K755-D759 WeakPolarHBondContact O-CB 3.39Å; K755-D759 PolarHBondContact O-N 3.13Å; K755-D759 VanDerWaalsContact O-N 3.15Å; D759-T761 VanDerWaalsContact C-N 3.27Å; D759-T761 PolarHBondContact O-N 3.07Å; D759-T761 VanDerWaalsContact O-N 3.13Å; D759-T761 WeakPolarHBondContact OD1-CA 3.41Å; D759-T761 WeakPolarHBondContact OD1-CB 3.36Å; D759-T761 PolarHBondContact OD1-N 3.22Å; D759-T761 VanDerWaalsContact OD1-N 3.17Å; D759-T761 PolarHBondContact OD1-OG1 3.17Å; D759-A762 PolarHBondContact OD1-N 3.32Å; D759-A762 WeakPolarHBondContact OD2-CB 3.3Å; D759-G763 VanDerWaalsContact O-CA 3.27Å; D759-G763 WeakPolarHBondContact O-CA 3.35Å; D759-G763 PolarHBondContact O-N 3.04Å
760A62.4Low73Confident26.6667 Ų26.666759.3 Ų59.322%0.2233%0.333CS..THydrogen-bonded Turntrans-71.11.5175.400000114.1F758 P769 V772F758-A760 VanDerWaalsContact C-N 3.31Å; F758-A760 PolarHBondContact O-N 3.25Å; A760-P769 HydrophobicContact CB-CB 4.36Å; A760-P769 HydrophobicContact CB-CG 4.08Å; A760-V772 HydrophobicContact CB-CG2 3.97Å
761T53.6Low72.7Confident128.667 Ų128.66763.6 Ų63.679%0.78935%0.352SS*.THydrogen-bonded Turntrans-115.9-28.3-175.361.50000114.4D759D759-T761 VanDerWaalsContact C-N 3.27Å; D759-T761 PolarHBondContact O-N 3.07Å; D759-T761 VanDerWaalsContact O-N 3.13Å; D759-T761 WeakPolarHBondContact OD1-CA 3.41Å; D759-T761 WeakPolarHBondContact OD1-CB 3.36Å; D759-T761 PolarHBondContact OD1-N 3.22Å; D759-T761 VanDerWaalsContact OD1-N 3.17Å; D759-T761 PolarHBondContact OD1-OG1 3.17Å
762A52.4Low72.6Confident82.3333 Ų82.333360.5 Ų60.568%0.6834%0.338SS*.THydrogen-bonded Turntrans-115.9-15176.200000114D759D759-A762 PolarHBondContact OD1-N 3.32Å; D759-A762 WeakPolarHBondContact OD2-CB 3.3Å
763G56.9Low72.8Confident28.3333 Ų28.333354.4 Ų54.429%0.29231%0.306SS..SBendtrans-77.6159.6173.700000113.1D759 F765D759-G763 VanDerWaalsContact O-CA 3.27Å; D759-G763 WeakPolarHBondContact O-CA 3.35Å; D759-G763 PolarHBondContact O-N 3.04Å; G763-F765 PolarHBondContact O-N 3.14Å
764P55.2Low73Confident82.3333 Ų82.333355.6 Ų55.654%0.53531%0.311SS..  trans-74.628.1176.233.5-35.9000113I717 P718 P766I717-P764 HydrophobicContact CG2-CG 4.15Å; P718-P764 HydrophobicContact CB-CB 4.5Å; P718-P764 HydrophobicContact CB-CG 4.19Å; P718-P764 HydrophobicContact CG-CG 4.02Å; P764-P766 VanDerWaalsContact O-CD 3.31Å; P764-P766 WeakPolarHBondContact O-CD 3.41Å
765F61.1Low73.1Confident24 Ų2455.7 Ų55.711%0.10531%0.311CS..  trans-66.8124-174.1-121.8-95.4000110.4I717 W727 I757 G763 F767 V772I717-F765 HydrophobicContact CD1-CD2 4.29Å; I717-F765 HydrophobicContact CD1-CE1 4.4Å; I717-F765 HydrophobicContact CD1-CE2 3.87Å; I717-F765 HydrophobicContact CD1-CZ 3.72Å; I717-F765 HydrophobicContact CG1-CE2 4.07Å; I717-F765 HydrophobicContact CG1-CZ 4.31Å; I717-F765 HydrophobicContact CG2-CD1 4.04Å; I717-F765 HydrophobicContact CG2-CD2 3.88Å; I717-F765 HydrophobicContact CG2-CE1 3.96Å; I717-F765 HydrophobicContact CG2-CE2 4.11Å; I717-F765 HydrophobicContact CG2-CG 4.31Å; I717-F765 HydrophobicContact CG2-CZ 4Å; W727-F765 HydrophobicContact CD2-CE1 4.3Å; W727-F765 AromaticContact CD2-CZ 3.9Å; W727-F765 HydrophobicContact CD2-CZ 3.9Å; W727-F765 AromaticContact CE3-CE1 3.86Å; W727-F765 HydrophobicContact CE3-CE1 3.86Å; W727-F765 HydrophobicContact CE3-CE2 4.42Å; W727-F765 AromaticContact CE3-CZ 3.78Å; W727-F765 HydrophobicContact CE3-CZ 3.9Å; W727-F765 HydrophobicContact CH2-CE1 4.22Å; W727-F765 HydrophobicContact CH2-CE2 4.22Å; W727-F765 AromaticContact CH2-CZ 3.84Å; W727-F765 HydrophobicContact CH2-CZ 3.91Å; W727-F765 HydrophobicContact CZ2-CZ 4.21Å; W727-F765 AromaticContact CZ3-CE1 3.81Å; W727-F765 HydrophobicContact CZ3-CE1 3.81Å; W727-F765 HydrophobicContact CZ3-CE2 4.18Å; W727-F765 AromaticContact CZ3-CZ 3.74Å; W727-F765 HydrophobicContact CZ3-CZ 3.74Å; I757-F765 WeakPolarHBondContact O-CE2 3.21Å; I757-F765 VanDerWaalsContact O-CZ 3.29Å; I757-F765 WeakPolarHBondContact O-CZ 3.33Å; G763-F765 PolarHBondContact O-N 3.14Å; F765-F767 HydrophobicContact CD1-CB 4.03Å; F765-F767 AromaticContact CD1-CD2 3.78Å; F765-F767 HydrophobicContact CD1-CD2 4.07Å; F765-F767 HydrophobicContact CD1-CG 4.29Å; F765-F767 HydrophobicContact CE1-CB 4.38Å; F765-F767 AromaticContact CE1-CD2 3.7Å; F765-F767 HydrophobicContact CE1-CD2 3.7Å; F765-F767 HydrophobicContact CE1-CE2 4.23Å; F765-F767 HydrophobicContact CE1-CG 4.4Å; F765-F767 HydrophobicContact CZ-CD2 4.22Å; F765-F767 PolarHBondContact O-N 3.13Å; F765-F767 VanDerWaalsContact O-N 3.14Å; F765-V772 HydrophobicContact CD1-CG2 3.87Å; F765-V772 HydrophobicContact CE1-CB 4.48Å; F765-V772 HydrophobicContact CE1-CG1 4.38Å; F765-V772 HydrophobicContact CE1-CG2 3.72Å; F765-V772 HydrophobicContact CZ-CG1 4.47Å; F765-V772 HydrophobicContact CZ-CG2 4.38Å
766P60.2Low73.4Confident71.6667 Ų71.666753 Ų5347%0.46530%0.299SS..SBendtrans-7711-17624.5-26.6000114D720 P764D720-P766 WeakPolarHBondContact OD1-CB 3.13Å; D720-P766 VanDerWaalsContact OD1-CG 3.29Å; D720-P766 WeakPolarHBondContact OD1-CG 3.36Å; P764-P766 VanDerWaalsContact O-CD 3.31Å; P764-P766 WeakPolarHBondContact O-CD 3.41Å
767F67.6Low73.7Confident37.3333 Ų37.333347.5 Ų47.516%0.16428%0.279CS..SBendtrans-127.1145.2-170-47.3-46.9000112.5I722 T723 F724 F765 K771 V772I722-F767 WeakPolarHBondContact O-CE2 3.47Å; I722-F767 WeakPolarHBondContact O-CZ 3.33Å; T723-F767 VanDerWaalsContact C-CZ 3.41Å; F724-F767 HydrophobicContact CB-CD1 4.28Å; F724-F767 HydrophobicContact CB-CD2 4.38Å; F724-F767 HydrophobicContact CB-CE1 3.87Å; F724-F767 HydrophobicContact CB-CE2 4.07Å; F724-F767 HydrophobicContact CB-CG 4.33Å; F724-F767 HydrophobicContact CB-CZ 3.79Å; F765-F767 HydrophobicContact CD1-CB 4.03Å; F765-F767 AromaticContact CD1-CD2 3.78Å; F765-F767 HydrophobicContact CD1-CD2 4.07Å; F765-F767 HydrophobicContact CD1-CG 4.29Å; F765-F767 HydrophobicContact CE1-CB 4.38Å; F765-F767 AromaticContact CE1-CD2 3.7Å; F765-F767 HydrophobicContact CE1-CD2 3.7Å; F765-F767 HydrophobicContact CE1-CE2 4.23Å; F765-F767 HydrophobicContact CE1-CG 4.4Å; F765-F767 HydrophobicContact CZ-CD2 4.22Å; F765-F767 PolarHBondContact O-N 3.13Å; F765-F767 VanDerWaalsContact O-N 3.14Å; F767-K771 HydrophobicContact CB-CB 3.83Å; F767-K771 HydrophobicContact CB-CD 4.11Å; F767-K771 HydrophobicContact CB-CG 4.44Å; F767-K771 HydrophobicContact CD1-CD 4.24Å; F767-K771 HydrophobicContact CG-CB 4.4Å; F767-K771 HydrophobicContact CG-CD 4.35Å; F767-V772 HydrophobicContact CB-CG2 4.46Å
768L70.4Confident74Confident121.667 Ų121.66751.3 Ų51.364%0.63730%0.297SS*.  trans-66.8154.2171.3-65.3168.8000110.8Q770 K771 V772L768-Q770 VanDerWaalsContact CB-OE1 3.24Å; L768-Q770 PolarHBondContact O-N 3.1Å; L768-K771 WeakPolarHBondContact O-CB 3.44Å; L768-K771 PolarHBondContact O-N 3.08Å; L768-V772 PolarHBondContact O-N 3.18Å
769P70.8Confident74.2Confident33 Ų3354.5 Ų54.521%0.21431%0.309CS..Hα-helixtrans-51.2-33.7179.8-29.435.5000114.9A760 K771 V772 Y773 P806 E809A760-P769 HydrophobicContact CB-CB 4.36Å; A760-P769 HydrophobicContact CB-CG 4.08Å; P769-K771 PolarHBondContact O-N 3.17Å; P769-V772 WeakPolarHBondContact O-CB 3.43Å; P769-V772 PolarHBondContact O-N 3.06Å; P769-V772 VanDerWaalsContact O-N 3.13Å; P769-Y773 WeakPolarHBondContact O-CD2 3.27Å; P769-Y773 PolarHBondContact O-N 2.99Å; P769-P806 HydrophobicContact CB-CG 4.25Å; P769-E809 HydrophobicContact CB-CG 4.49Å
770Q75.1Confident74.9Confident99.6667 Ų99.666751.8 Ų51.847%0.46629%0.294SS..Hα-helixtrans-56.5-32.4174.9-69.2105.815.700113.4L768 E809L768-Q770 VanDerWaalsContact CB-OE1 3.24Å; L768-Q770 PolarHBondContact O-N 3.1Å; Q770-E809 HydrophobicContact CG-CG 4.3Å; Q770-E809 WeakPolarHBondContact CG-OE1 3.16Å; Q770-E809 WeakPolarHBondContact CG-OE2 3.41Å; Q770-E809 PolarHBondContact NE2-OE1 2.9Å
771K82Confident76.2Confident92 Ų9255 Ų5540%0.431%0.307SS..Hα-helixtrans-83-28.9177-78.5-170.7168.7-154.50112.9F724 F767 L768 P769 Y773 H774F724-K771 HydrophobicContact CD2-CB 3.8Å; F724-K771 HydrophobicContact CD2-CD 3.91Å; F724-K771 HydrophobicContact CD2-CG 3.99Å; F724-K771 HydrophobicContact CE2-CB 3.76Å; F724-K771 HydrophobicContact CE2-CD 4.22Å; F724-K771 HydrophobicContact CE2-CG 3.85Å; F724-K771 WeakPolarHBondContact CE2-O 3.35Å; F724-K771 HydrophobicContact CG-CD 4.25Å; F724-K771 HydrophobicContact CZ-CG 4.47Å; F767-K771 HydrophobicContact CB-CB 3.83Å; F767-K771 HydrophobicContact CB-CD 4.11Å; F767-K771 HydrophobicContact CB-CG 4.44Å; F767-K771 HydrophobicContact CD1-CD 4.24Å; F767-K771 HydrophobicContact CG-CB 4.4Å; F767-K771 HydrophobicContact CG-CD 4.35Å; L768-K771 WeakPolarHBondContact O-CB 3.44Å; L768-K771 PolarHBondContact O-N 3.08Å; P769-K771 PolarHBondContact O-N 3.17Å; K771-Y773 VanDerWaalsContact C-N 3.27Å; K771-Y773 PolarHBondContact O-N 3.22Å; K771-H774 WeakPolarHBondContact O-CB 3.39Å; K771-H774 PolarHBondContact O-N 3.23Å
772V85.6Confident77.6Confident1 Ų153.9 Ų53.91%0.00630%0.296CS..Hα-helixtrans-64.7-36.3179.7-176.70000110.9W727 F758 A760 F765 F767 L768 P769 F775W727-V772 HydrophobicContact CZ2-CG1 3.87Å; W727-V772 PolarHBondContact NE1-O 3.13Å; F758-V772 HydrophobicContact CD1-CG1 4.07Å; F758-V772 HydrophobicContact CE1-CG1 4.3Å; A760-V772 HydrophobicContact CB-CG2 3.97Å; F765-V772 HydrophobicContact CD1-CG2 3.87Å; F765-V772 HydrophobicContact CE1-CB 4.48Å; F765-V772 HydrophobicContact CE1-CG1 4.38Å; F765-V772 HydrophobicContact CE1-CG2 3.72Å; F765-V772 HydrophobicContact CZ-CG1 4.47Å; F765-V772 HydrophobicContact CZ-CG2 4.38Å; F767-V772 HydrophobicContact CB-CG2 4.46Å; L768-V772 PolarHBondContact O-N 3.18Å; P769-V772 WeakPolarHBondContact O-CB 3.43Å; P769-V772 PolarHBondContact O-N 3.06Å; P769-V772 VanDerWaalsContact O-N 3.13Å; V772-F775 WeakPolarHBondContact O-CD1 3.26Å; V772-F775 VanDerWaalsContact O-CE1 3.28Å; V772-F775 WeakPolarHBondContact O-CE1 3.24Å
773Y88.8Confident79.2Confident3.33333 Ų3.3333351 Ų511%0.01327%0.27CS..THydrogen-bonded Turntrans-105.217.6179.9-57.2-77.5000113.5F758 P769 K771 F775 A776 S777 L798 I805 M813F758-Y773 AromaticContact CD1-CE1 3.85Å; F758-Y773 HydrophobicContact CD1-CE1 3.85Å; F758-Y773 HydrophobicContact CE1-CE1 4.14Å; P769-Y773 WeakPolarHBondContact O-CD2 3.27Å; P769-Y773 PolarHBondContact O-N 2.99Å; K771-Y773 VanDerWaalsContact C-N 3.27Å; K771-Y773 PolarHBondContact O-N 3.22Å; Y773-F775 VanDerWaalsContact C-N 3.34Å; Y773-F775 PolarHBondContact O-N 2.95Å; Y773-A776 PolarHBondContact O-N 3.24Å; Y773-A776 VanDerWaalsContact O-N 3.11Å; Y773-S777 PolarHBondContact O-N 3.21Å; Y773-L798 HydrophobicContact CE1-CD1 4.18Å; Y773-I805 HydrophobicContact CD2-CG2 4.46Å; Y773-I805 HydrophobicContact CE1-CD1 4.34Å; Y773-I805 HydrophobicContact CE1-CG1 4.06Å; Y773-I805 HydrophobicContact CE1-CG2 4.24Å; Y773-I805 HydrophobicContact CE2-CG2 4.21Å; Y773-M813 VanDerWaalsContact CB-CE 3.47Å; Y773-M813 HydrophobicContact CG-CE 4.37Å
774H89.8Confident80.5Confident63.6667 Ų63.666752.4 Ų52.430%0.29527%0.274SS..Hα-helixtrans-59.3-48.1-176.1176.6-92.2000112F724 D728 K771 A776 S777 E778F724-H774 HydrophobicContact CE2-CB 3.85Å; F724-H774 HydrophobicContact CZ-CB 3.99Å; F724-H774 AromaticContact CZ-CG 3.76Å; F724-H774 AromaticContact CZ-ND1 3.79Å; D728-H774 VanDerWaalsContact CG-ND1 3.29Å; D728-H774 WeakPolarHBondContact OD1-CB 3.45Å; D728-H774 IonicContact OD1-CG 2.92Å; D728-H774 IonicContact OD1-ND1 3.43Å; D728-H774 PolarHBondContact OD1-ND1 3.21Å; D728-H774 VanDerWaalsContact OD1-ND1 3.12Å; D728-H774 IonicContact OD2-CE1 3.33Å; D728-H774 PolarHBondContact OD2-CE1 3.36Å; D728-H774 IonicContact OD2-CG 3.09Å; D728-H774 IonicContact OD2-ND1 2.71Å; D728-H774 PolarHBondContact OD2-ND1 3.08Å; K771-H774 WeakPolarHBondContact O-CB 3.39Å; K771-H774 PolarHBondContact O-N 3.23Å; H774-A776 PolarHBondContact O-N 3.04Å; H774-A776 VanDerWaalsContact O-N 3.11Å; H774-S777 WeakPolarHBondContact CA-OG 3.43Å; H774-S777 WeakPolarHBondContact O-CA 3.27Å; H774-S777 PolarHBondContact O-N 3.15Å; H774-S777 PolarHBondContact O-OG 3.3Å; H774-E778 IonicContact CE1-OE2 2.75Å; H774-E778 PolarHBondContact CE1-OE2 2.68Å; H774-E778 PolarHBondContact O-N 3.23Å
775F90Very high82Confident4 Ų448.9 Ų48.92%0.01825%0.251CS..Hα-helixtrans-50.6-33.2175.373.3-92.4000114.3D728 M731 P732 L735 V772 Y773 R779 W794D728-F775 VanDerWaalsContact OD1-CA 3.26Å; D728-F775 WeakPolarHBondContact OD1-CA 3.24Å; D728-F775 WeakPolarHBondContact OD1-CB 3.37Å; D728-F775 PolarHBondContact OD1-N 3.16Å; M731-F775 HydrophobicContact CB-CD1 4.33Å; M731-F775 HydrophobicContact CB-CE1 4.18Å; M731-F775 HydrophobicContact CB-CZ 4.4Å; M731-F775 HydrophobicContact CG-CE1 3.9Å; M731-F775 HydrophobicContact CG-CZ 4.06Å; P732-F775 HydrophobicContact CG-CB 3.79Å; P732-F775 HydrophobicContact CG-CD2 3.87Å; P732-F775 HydrophobicContact CG-CG 4.03Å; L735-F775 HydrophobicContact CD1-CE2 3.57Å; L735-F775 HydrophobicContact CD1-CZ 3.51Å; V772-F775 WeakPolarHBondContact O-CD1 3.26Å; V772-F775 VanDerWaalsContact O-CE1 3.28Å; V772-F775 WeakPolarHBondContact O-CE1 3.24Å; Y773-F775 VanDerWaalsContact C-N 3.34Å; Y773-F775 PolarHBondContact O-N 2.95Å; F775-R779 VanDerWaalsContact O-CG 3.28Å; F775-R779 WeakPolarHBondContact O-CG 3.3Å; F775-W794 AromaticContact CD2-CE3 3.98Å; F775-W794 HydrophobicContact CD2-CE3 4.03Å; F775-W794 HydrophobicContact CD2-CZ3 4.03Å; F775-W794 AromaticContact CE2-CE3 3.94Å; F775-W794 HydrophobicContact CE2-CE3 3.94Å; F775-W794 HydrophobicContact CE2-CZ3 4.4Å
776A91.1Very high83.2Confident0.666667 Ų0.66666749.6 Ų49.61%0.00626%0.259CS..Hα-helixtrans-81.7-42.5175.300000110.8Y773 H774 E778 R779 F780 L795 M813Y773-A776 PolarHBondContact O-N 3.24Å; Y773-A776 VanDerWaalsContact O-N 3.11Å; H774-A776 PolarHBondContact O-N 3.04Å; H774-A776 VanDerWaalsContact O-N 3.11Å; A776-E778 PolarHBondContact O-N 3.05Å; A776-R779 WeakPolarHBondContact O-CB 3.42Å; A776-R779 PolarHBondContact O-N 2.94Å; A776-R779 VanDerWaalsContact O-N 3.12Å; A776-F780 WeakPolarHBondContact O-CD2 3.34Å; A776-L795 HydrophobicContact CB-CD2 4.43Å; A776-M813 HydrophobicContact CB-SD 4.19Å
777S90.3Very high84.5Confident28.3333 Ų28.333348 Ų4820%0.19825%0.248CC..Hα-helixtrans-62.3-37.8-178.872.80000114Y773 H774 R779 F780Y773-S777 PolarHBondContact O-N 3.21Å; H774-S777 WeakPolarHBondContact CA-OG 3.43Å; H774-S777 WeakPolarHBondContact O-CA 3.27Å; H774-S777 PolarHBondContact O-N 3.15Å; H774-S777 PolarHBondContact O-OG 3.3Å; S777-R779 VanDerWaalsContact C-N 3.26Å; S777-R779 PolarHBondContact O-N 2.95Å; S777-F780 PolarHBondContact O-N 3.09Å; S777-F780 VanDerWaalsContact O-N 3.17Å
778E89.9Confident85.6Confident85.6667 Ų85.666746.3 Ų46.340%0.424%0.24SC..Hα-helixtrans-61.8-35.7176.5-171.1-172.7-17500111.2H774 A776 F780 I781H774-E778 IonicContact CE1-OE2 2.75Å; H774-E778 PolarHBondContact CE1-OE2 2.68Å; H774-E778 PolarHBondContact O-N 3.23Å; A776-E778 PolarHBondContact O-N 3.05Å; E778-F780 PolarHBondContact O-N 3.03Å; E778-F780 VanDerWaalsContact O-N 3.12Å; E778-I781 PolarHBondContact O-N 3.07Å; E778-I781 VanDerWaalsContact O-N 3.09Å
779R89.8Confident86.5Confident73 Ų7342.5 Ų42.528%0.27522%0.221SC..THydrogen-bonded Turntrans-71.7-2-179.4-61.3-76.5175.5-77.5-3114.2F775 A776 S777 T783 V787 A791 W794F775-R779 VanDerWaalsContact O-CG 3.28Å; F775-R779 WeakPolarHBondContact O-CG 3.3Å; A776-R779 WeakPolarHBondContact O-CB 3.42Å; A776-R779 PolarHBondContact O-N 2.94Å; A776-R779 VanDerWaalsContact O-N 3.12Å; S777-R779 VanDerWaalsContact C-N 3.26Å; S777-R779 PolarHBondContact O-N 2.95Å; R779-T783 VanDerWaalsContact O-CB 3.32Å; R779-T783 WeakPolarHBondContact O-CB 3.32Å; R779-T783 WeakPolarHBondContact O-CG2 3.31Å; R779-T783 PolarHBondContact O-OG1 3.16Å; R779-V787 HydrophobicContact CB-CG1 4.07Å; R779-V787 VanDerWaalsContact CD-CG1 3.47Å; R779-V787 HydrophobicContact CG-CG1 4.37Å; R779-A791 HydrophobicContact CB-CB 3.73Å; R779-A791 HydrophobicContact CG-CB 4.39Å; R779-W794 HydrophobicContact CG-CZ3 4.38Å
780F90.6Very high87.5Confident0 Ų043.5 Ų43.50%022%0.222CC..THydrogen-bonded Turntrans-106-4.6172-69.6-76.8000114A776 S777 E778 T783 Q788 A791 L792 L795 M813 F814 A816 G817 S820 M1057A776-F780 WeakPolarHBondContact O-CD2 3.34Å; S777-F780 PolarHBondContact O-N 3.09Å; S777-F780 VanDerWaalsContact O-N 3.17Å; E778-F780 PolarHBondContact O-N 3.03Å; E778-F780 VanDerWaalsContact O-N 3.12Å; F780-T783 WeakPolarHBondContact CA-OG1 3.35Å; F780-Q788 HydrophobicContact CD1-CB 4.18Å; F780-Q788 HydrophobicContact CD1-CG 3.99Å; F780-Q788 HydrophobicContact CE1-CB 4.13Å; F780-Q788 HydrophobicContact CE1-CG 4.45Å; F780-A791 HydrophobicContact CE2-CB 3.89Å; F780-A791 HydrophobicContact CZ-CB 3.94Å; F780-L792 HydrophobicContact CE1-CD1 4.4Å; F780-L792 HydrophobicContact CE1-CD2 4.02Å; F780-L792 HydrophobicContact CE1-CG 3.94Å; F780-L792 HydrophobicContact CZ-CD2 3.82Å; F780-L792 HydrophobicContact CZ-CG 3.89Å; F780-L795 HydrophobicContact CE2-CD1 3.97Å; F780-L795 HydrophobicContact CZ-CD1 4.06Å; F780-M813 WeakPolarHBondContact CB-O 3.38Å; F780-M813 HydrophobicContact CD2-CB 3.78Å; F780-M813 HydrophobicContact CD2-CG 4.36Å; F780-M813 HydrophobicContact CE2-CB 4.11Å; F780-M813 HydrophobicContact CG-CB 4.38Å; F780-M813 WeakPolarHBondContact CG-O 3.39Å; F780-F814 HydrophobicContact CE1-CD1 4.35Å; F780-F814 HydrophobicContact CZ-CD1 4.26Å; F780-F814 HydrophobicContact CZ-CE1 4.15Å; F780-A816 HydrophobicContact CB-CB 4.33Å; F780-A816 CarbonylContact O-C 3.49Å; F780-A816 VanDerWaalsContact O-C 3.27Å; F780-G817 WeakPolarHBondContact O-CA 3.29Å; F780-G817 PolarHBondContact O-N 3Å; F780-S820 PolarHBondContact O-OG 3.1Å; F780-M1057 HydrophobicContact CD1-CE 4.14Å; F780-M1057 HydrophobicContact CE1-CE 3.91Å
781I88.6Confident88.3Confident94.3333 Ų94.333338.7 Ų38.748%0.48420%0.2SC..SBendtrans-101.9110.4-174-59.5169.4000109.9E778 T783 A816E778-I781 PolarHBondContact O-N 3.07Å; E778-I781 VanDerWaalsContact O-N 3.09Å; I781-T783 VanDerWaalsContact C-N 3.33Å; I781-T783 WeakPolarHBondContact O-CG2 3.41Å; I781-T783 PolarHBondContact O-N 3.29Å; I781-A816 HydrophobicContact CG1-CB 4.15Å
782N83.6Confident88.9Confident105.333 Ų105.33334.3 Ų34.356%0.56318%0.181SC*.SBendtrans56.735.9179.6-54-35.6000113.7S820 Q1427N782-S820 VanDerWaalsContact C-OG 3.28Å; N782-S820 VanDerWaalsContact CA-OG 3.25Å; N782-S820 WeakPolarHBondContact CA-OG 3.42Å; N782-S820 PolarHBondContact N-OG 3.07Å; N782-Q1427 PolarHBondContact ND2-NE2 2.76Å; N782-Q1427 PolarHBondContact ND2-OE1 2.98Å; N782-Q1427 PolarHBondContact OD1-NE2 3.09Å; N782-Q1427 PolarHBondContact OD1-OE1 3.43Å
783T84.9Confident89.2Confident22 Ų2235.1 Ų35.114%0.13519%0.186CC..  trans-110.6147.3-178.3480000112R779 F780 I781 V787 Q788 S820R779-T783 VanDerWaalsContact O-CB 3.32Å; R779-T783 WeakPolarHBondContact O-CB 3.32Å; R779-T783 WeakPolarHBondContact O-CG2 3.31Å; R779-T783 PolarHBondContact O-OG1 3.16Å; F780-T783 WeakPolarHBondContact CA-OG1 3.35Å; I781-T783 VanDerWaalsContact C-N 3.33Å; I781-T783 WeakPolarHBondContact O-CG2 3.41Å; I781-T783 PolarHBondContact O-N 3.29Å; T783-V787 HydrophobicContact CG2-CB 4.41Å; T783-V787 HydrophobicContact CG2-CG1 3.91Å; T783-Q788 PolarHBondContact O-NE2 2.94Å; T783-Q788 VanDerWaalsContact O-NE2 3.07Å; T783-Q788 WeakPolarHBondContact OG1-CG 3.35Å; T783-S820 PolarHBondContact N-OG 3.23Å; T783-S820 PolarHBondContact O-OG 3.03Å
784P85.5Confident89.5Confident57 Ų5735.2 Ų35.237%0.3719%0.187SC..  trans-72.4164176.232.3-36.6000111.8S786 V787 Q788P784-S786 PolarHBondContact O-N 3.19Å; P784-S786 VanDerWaalsContact O-N 3.12Å; P784-V787 HydrophobicContact CG-CB 4.4Å; P784-V787 HydrophobicContact CG-CG2 3.96Å; P784-V787 PolarHBondContact O-N 3.05Å; P784-V787 VanDerWaalsContact O-N 3.11Å; P784-Q788 PolarHBondContact O-N 3.14Å
785V85.3Confident89.6Confident9.66667 Ų9.6666732.3 Ų32.36%0.05917%0.173CC..Hα-helixtrans-49-40.1-178.1-161.70000113.6V787 Q788 D789 L821 E824 I1050 C1053V785-V787 VanDerWaalsContact C-N 3.31Å; V785-V787 PolarHBondContact O-N 3.19Å; V785-Q788 PolarHBondContact O-N 2.96Å; V785-D789 WeakPolarHBondContact O-CB 3.24Å; V785-D789 PolarHBondContact O-N 3.33Å; V785-L821 HydrophobicContact CB-CD2 4.38Å; V785-L821 HydrophobicContact CG1-CD2 4.36Å; V785-L821 HydrophobicContact CG2-CD2 3.8Å; V785-E824 VanDerWaalsContact CG2-OE2 3.29Å; V785-E824 WeakPolarHBondContact CG2-OE2 3.35Å; V785-E824 PolarHBondContact N-OE1 2.89Å; V785-E824 PolarHBondContact N-OE2 3.22Å; V785-I1050 HydrophobicContact CG2-CG1 3.76Å; V785-C1053 HydrophobicContact CG1-CB 3.95Å
786S86.3Confident89.8Confident37.6667 Ų37.666733.2 Ų33.226%0.26318%0.178SC..Hα-helixtrans-62.2-39.5-177.354.50000113.7P784 Q790 Y1048P784-S786 PolarHBondContact O-N 3.19Å; P784-S786 VanDerWaalsContact O-N 3.12Å; S786-Q790 PolarHBondContact O-N 3.11Å; S786-Y1048 VanDerWaalsContact CB-CE2 3.43Å
787V88.7Confident89.8Confident39.3333 Ų39.333333.3 Ų33.324%0.23818%0.178CC..Hα-helixtrans-75.3-35.5179.7176.50000110.6R779 T783 P784 V785 Q790 A791R779-V787 HydrophobicContact CB-CG1 4.07Å; R779-V787 VanDerWaalsContact CD-CG1 3.47Å; R779-V787 HydrophobicContact CG-CG1 4.37Å; T783-V787 HydrophobicContact CG2-CB 4.41Å; T783-V787 HydrophobicContact CG2-CG1 3.91Å; P784-V787 HydrophobicContact CG-CB 4.4Å; P784-V787 HydrophobicContact CG-CG2 3.96Å; P784-V787 PolarHBondContact O-N 3.05Å; P784-V787 VanDerWaalsContact O-N 3.11Å; V785-V787 VanDerWaalsContact C-N 3.31Å; V785-V787 PolarHBondContact O-N 3.19Å; V787-Q790 PolarHBondContact O-N 3.34Å; V787-A791 PolarHBondContact O-N 3.31Å
788Q89.9Confident89.9Confident0 Ų032 Ų320%017%0.169CC..Hα-helixtrans-66.9-41.2174.2-63.3-171.744.300111.7F780 T783 P784 V785 Q790 A791 L792 G817F780-Q788 HydrophobicContact CD1-CB 4.18Å; F780-Q788 HydrophobicContact CD1-CG 3.99Å; F780-Q788 HydrophobicContact CE1-CB 4.13Å; F780-Q788 HydrophobicContact CE1-CG 4.45Å; T783-Q788 PolarHBondContact O-NE2 2.94Å; T783-Q788 VanDerWaalsContact O-NE2 3.07Å; T783-Q788 WeakPolarHBondContact OG1-CG 3.35Å; P784-Q788 PolarHBondContact O-N 3.14Å; V785-Q788 PolarHBondContact O-N 2.96Å; Q788-Q790 VanDerWaalsContact C-N 3.35Å; Q788-Q790 PolarHBondContact O-N 3.05Å; Q788-A791 PolarHBondContact O-N 2.93Å; Q788-L792 WeakPolarHBondContact O-CB 3.37Å; Q788-L792 VanDerWaalsContact O-CG 3.26Å; Q788-L792 WeakPolarHBondContact O-CG 3.4Å; Q788-L792 PolarHBondContact O-N 2.99Å; Q788-G817 PolarHBondContact NE2-O 3.09Å; Q788-G817 VanDerWaalsContact OE1-CA 3.23Å; Q788-G817 PolarHBondContact OE1-O 3.42Å
789D89.1Confident90Very high43.6667 Ų43.666728.2 Ų28.223%0.23415%0.151CC..Hα-helixtrans-66.9-34179-169.354.7000113V785 L792 S793 Y1048 H1056V785-D789 WeakPolarHBondContact O-CB 3.24Å; V785-D789 PolarHBondContact O-N 3.33Å; D789-L792 PolarHBondContact O-N 3.18Å; D789-S793 WeakPolarHBondContact O-CB 3.48Å; D789-S793 PolarHBondContact O-N 3.14Å; D789-S793 PolarHBondContact O-OG 3.39Å; D789-Y1048 HydrophobicContact CB-CD1 3.94Å; D789-Y1048 HydrophobicContact CB-CE1 4.16Å; D789-H1056 IonicContact OD1-CE1 3.23Å; D789-H1056 IonicContact OD1-ND1 3.11Å; D789-H1056 PolarHBondContact OD1-ND1 3.11Å
790Q91.7Very high90Very high52.6667 Ų52.666727.4 Ų27.425%0.24615%0.152CC..Hα-helixtrans-62.1-48.4169.5-174.1178.841.900111.3E736 S786 V787 Q788 L792 S793 W794 L932E736-Q790 VanDerWaalsContact CD-NE2 3.26Å; E736-Q790 PolarHBondContact OE1-NE2 2.89Å; E736-Q790 VanDerWaalsContact OE1-NE2 3.1Å; E736-Q790 PolarHBondContact OE2-NE2 3Å; S786-Q790 PolarHBondContact O-N 3.11Å; V787-Q790 PolarHBondContact O-N 3.34Å; Q788-Q790 VanDerWaalsContact C-N 3.35Å; Q788-Q790 PolarHBondContact O-N 3.05Å; Q790-L792 VanDerWaalsContact C-N 3.32Å; Q790-L792 PolarHBondContact O-N 3.17Å; Q790-S793 WeakPolarHBondContact O-CB 3.45Å; Q790-S793 PolarHBondContact O-N 3.05Å; Q790-S793 VanDerWaalsContact O-N 3.15Å; Q790-W794 HydrophobicContact CG-CD2 4.5Å; Q790-W794 HydrophobicContact CG-CH2 4.38Å; Q790-W794 HydrophobicContact CG-CZ2 3.67Å; Q790-W794 PolarHBondContact O-N 3.05Å; Q790-W794 VanDerWaalsContact O-N 3.12Å; Q790-L932 PolarHBondContact NE2-O 3.36Å
791A93.2Very high90Very high0 Ų027.5 Ų27.50%015%0.153CC..Hα-helixtrans-63.9-37177.700000112.5R779 F780 V787 Q788 S793 W794 L795R779-A791 HydrophobicContact CB-CB 3.73Å; R779-A791 HydrophobicContact CG-CB 4.39Å; F780-A791 HydrophobicContact CE2-CB 3.89Å; F780-A791 HydrophobicContact CZ-CB 3.94Å; V787-A791 PolarHBondContact O-N 3.31Å; Q788-A791 PolarHBondContact O-N 2.93Å; A791-S793 VanDerWaalsContact C-N 3.35Å; A791-W794 PolarHBondContact O-N 3.1Å; A791-L795 WeakPolarHBondContact O-CG 3.41Å; A791-L795 PolarHBondContact O-N 3.08Å; A791-L795 VanDerWaalsContact O-N 3.1Å
792L93.8Very high90.1Very high0 Ų027.9 Ų27.90%015%0.153CC..Hα-helixtrans-64.2-40.9172.7-71166.8000111.6F780 Q788 D789 Q790 W794 L795 E796 F814 C1053 H1056 M1057 I1060F780-L792 HydrophobicContact CE1-CD1 4.4Å; F780-L792 HydrophobicContact CE1-CD2 4.02Å; F780-L792 HydrophobicContact CE1-CG 3.94Å; F780-L792 HydrophobicContact CZ-CD2 3.82Å; F780-L792 HydrophobicContact CZ-CG 3.89Å; Q788-L792 WeakPolarHBondContact O-CB 3.37Å; Q788-L792 VanDerWaalsContact O-CG 3.26Å; Q788-L792 WeakPolarHBondContact O-CG 3.4Å; Q788-L792 PolarHBondContact O-N 2.99Å; D789-L792 PolarHBondContact O-N 3.18Å; Q790-L792 VanDerWaalsContact C-N 3.32Å; Q790-L792 PolarHBondContact O-N 3.17Å; L792-W794 VanDerWaalsContact C-N 3.3Å; L792-W794 PolarHBondContact O-N 3.17Å; L792-L795 CarbonylContact O-C 3.54Å; L792-L795 WeakPolarHBondContact O-CA 3.45Å; L792-L795 PolarHBondContact O-N 3.15Å; L792-L795 VanDerWaalsContact O-N 3.12Å; L792-E796 WeakPolarHBondContact O-CB 3.41Å; L792-E796 PolarHBondContact O-N 3.22Å; L792-F814 HydrophobicContact CD2-CD1 4.2Å; L792-F814 HydrophobicContact CD2-CE1 3.45Å; L792-F814 VanDerWaalsContact CD2-CE1 3.41Å; L792-F814 HydrophobicContact CD2-CZ 3.96Å; L792-C1053 HydrophobicContact CD1-CB 4.47Å; L792-C1053 WeakPolarHBondContact CD1-SG 3.31Å; L792-H1056 HydrophobicContact CD1-CB 4.25Å; L792-M1057 HydrophobicContact CD1-CE 4.31Å; L792-M1057 HydrophobicContact CD1-CG 3.96Å; L792-M1057 HydrophobicContact CD2-CB 4.44Å; L792-M1057 HydrophobicContact CD2-CG 3.64Å; L792-M1057 HydrophobicContact CG-CG 4.45Å; L792-I1060 HydrophobicContact CB-CD1 4.25Å; L792-I1060 HydrophobicContact CD2-CD1 3.89Å; L792-I1060 WeakPolarHBondContact O-CD1 3.45Å
793S92.7Very high90.3Very high17 Ų1722.9 Ų22.912%0.11913%0.126CC..Hα-helixtrans-60-39175.1-60.70000112.4R739 D789 Q790 A791 E796 I797R739-S793 VanDerWaalsContact CD-CB 3.49Å; D789-S793 WeakPolarHBondContact O-CB 3.48Å; D789-S793 PolarHBondContact O-N 3.14Å; D789-S793 PolarHBondContact O-OG 3.39Å; Q790-S793 WeakPolarHBondContact O-CB 3.45Å; Q790-S793 PolarHBondContact O-N 3.05Å; Q790-S793 VanDerWaalsContact O-N 3.15Å; A791-S793 VanDerWaalsContact C-N 3.35Å; S793-E796 WeakPolarHBondContact O-CB 3.31Å; S793-E796 PolarHBondContact O-N 3.17Å; S793-I797 WeakPolarHBondContact O-CG1 3.34Å; S793-I797 PolarHBondContact O-N 3.19Å; S793-I797 VanDerWaalsContact O-N 3.11Å
794W94.2Very high90.5Very high5.66667 Ų5.6666725 Ų252%0.02114%0.14CC..Hα-helixtrans-65.3-40.8173.6-59.5-19.8000112.3P732 L735 E736 F775 R779 Q790 A791 L792 E796 I797 L798 L933P732-W794 HydrophobicContact CB-CH2 3.72Å; P732-W794 HydrophobicContact CB-CZ2 4.22Å; P732-W794 HydrophobicContact CB-CZ3 4.12Å; P732-W794 HydrophobicContact CG-CH2 4.48Å; P732-W794 HydrophobicContact CG-CZ3 4.48Å; L735-W794 HydrophobicContact CB-CB 4.01Å; L735-W794 HydrophobicContact CB-CD2 4.27Å; L735-W794 HydrophobicContact CB-CG 3.73Å; L735-W794 HydrophobicContact CD1-CB 4.13Å; L735-W794 HydrophobicContact CD1-CG 4.35Å; E736-W794 HydrophobicContact CB-CZ2 4.46Å; E736-W794 PolarHBondContact OE2-NE1 3.15Å; F775-W794 AromaticContact CD2-CE3 3.98Å; F775-W794 HydrophobicContact CD2-CE3 4.03Å; F775-W794 HydrophobicContact CD2-CZ3 4.03Å; F775-W794 AromaticContact CE2-CE3 3.94Å; F775-W794 HydrophobicContact CE2-CE3 3.94Å; F775-W794 HydrophobicContact CE2-CZ3 4.4Å; R779-W794 HydrophobicContact CG-CZ3 4.38Å; Q790-W794 HydrophobicContact CG-CD2 4.5Å; Q790-W794 HydrophobicContact CG-CH2 4.38Å; Q790-W794 HydrophobicContact CG-CZ2 3.67Å; Q790-W794 PolarHBondContact O-N 3.05Å; Q790-W794 VanDerWaalsContact O-N 3.12Å; A791-W794 PolarHBondContact O-N 3.1Å; L792-W794 VanDerWaalsContact C-N 3.3Å; L792-W794 PolarHBondContact O-N 3.17Å; W794-E796 VanDerWaalsContact C-N 3.32Å; W794-E796 PolarHBondContact O-N 2.7Å; W794-I797 PolarHBondContact O-N 3.1Å; W794-L798 WeakPolarHBondContact O-CG 3.2Å; W794-L798 PolarHBondContact O-N 3.12Å; W794-L933 HydrophobicContact CH2-CD2 4.47Å; W794-L933 HydrophobicContact CZ2-CD2 4.4Å
795L93.3Very high90.7Very high1.33333 Ų1.3333322.3 Ų22.31%0.00712%0.122CC..Hα-helixtrans-69.5-31.1175.1-66.4171.8000112.4A776 F780 A791 L792 L798 T799 I805 L810 M813 F814 I1060A776-L795 HydrophobicContact CB-CD2 4.43Å; F780-L795 HydrophobicContact CE2-CD1 3.97Å; F780-L795 HydrophobicContact CZ-CD1 4.06Å; A791-L795 WeakPolarHBondContact O-CG 3.41Å; A791-L795 PolarHBondContact O-N 3.08Å; A791-L795 VanDerWaalsContact O-N 3.1Å; L792-L795 CarbonylContact O-C 3.54Å; L792-L795 WeakPolarHBondContact O-CA 3.45Å; L792-L795 PolarHBondContact O-N 3.15Å; L792-L795 VanDerWaalsContact O-N 3.12Å; L795-L798 PolarHBondContact O-N 2.88Å; L795-T799 VanDerWaalsContact O-CB 3.25Å; L795-T799 WeakPolarHBondContact O-CB 3.31Å; L795-T799 PolarHBondContact O-N 3.23Å; L795-T799 PolarHBondContact O-OG1 3.1Å; L795-I805 HydrophobicContact CD2-CD1 3.77Å; L795-L810 HydrophobicContact CD1-CD1 4.25Å; L795-M813 HydrophobicContact CD1-CE 4.49Å; L795-M813 HydrophobicContact CD2-CE 4.42Å; L795-F814 HydrophobicContact CD1-CE1 3.92Å; L795-F814 HydrophobicContact CD1-CZ 4.41Å; L795-I1060 HydrophobicContact CB-CD1 4.02Å; L795-I1060 HydrophobicContact CB-CG2 4.38Å
796E93.5Very high90.9Very high24.3333 Ų24.333324.1 Ų24.111%0.11413%0.134CC..Hα-helixtrans-61.9-48.8172.7-162.3-159.2171.500110R744 L792 S793 W794 L798 T799 I800 H1056 I1060R744-E796 IonicContact CZ-OE1 3.28Å; R744-E796 IonicContact CZ-OE2 3.05Å; R744-E796 VanDerWaalsContact NH1-CD 3.35Å; R744-E796 IonicContact NH1-OE1 3.26Å; R744-E796 PolarHBondContact NH1-OE1 2.93Å; R744-E796 IonicContact NH1-OE2 3.04Å; R744-E796 PolarHBondContact NH1-OE2 3.28Å; R744-E796 IonicContact NH2-OE1 3.27Å; R744-E796 PolarHBondContact NH2-OE1 2.66Å; R744-E796 IonicContact NH2-OE2 3.55Å; R744-E796 PolarHBondContact NH2-OE2 3.07Å; L792-E796 WeakPolarHBondContact O-CB 3.41Å; L792-E796 PolarHBondContact O-N 3.22Å; S793-E796 WeakPolarHBondContact O-CB 3.31Å; S793-E796 PolarHBondContact O-N 3.17Å; W794-E796 VanDerWaalsContact C-N 3.32Å; W794-E796 PolarHBondContact O-N 2.7Å; E796-L798 VanDerWaalsContact C-N 3.35Å; E796-L798 PolarHBondContact O-N 3.15Å; E796-T799 CarbonylContact O-C 3.47Å; E796-T799 PolarHBondContact O-N 3.24Å; E796-T799 VanDerWaalsContact O-N 3.09Å; E796-I800 HydrophobicContact CG-CD1 3.87Å; E796-I800 HydrophobicContact CG-CG1 4.39Å; E796-I800 VanDerWaalsContact O-CG1 3.32Å; E796-I800 WeakPolarHBondContact O-CG1 3.36Å; E796-I800 PolarHBondContact O-N 3.16Å; E796-H1056 WeakPolarHBondContact CB-NE2 3.27Å; E796-H1056 IonicContact OE2-CE1 2.88Å; E796-H1056 IonicContact OE2-NE2 3.57Å; E796-I1060 HydrophobicContact CB-CD1 4.38Å
797I91.7Very high91.1Very high2.33333 Ų2.3333322.8 Ų22.81%0.01212%0.124CC..Hα-helixtrans-56.1-52.4177-67.9162.9000110.3I738 R739 Y747 S793 W794 T799 I800 V801I738-I797 HydrophobicContact CB-CD1 4.5Å; I738-I797 HydrophobicContact CG2-CD1 4.22Å; I738-I797 HydrophobicContact CG2-CG2 3.79Å; R739-I797 HydrophobicContact CB-CD1 3.72Å; R739-I797 HydrophobicContact CG-CD1 4.18Å; Y747-I797 HydrophobicContact CE2-CG1 3.84Å; Y747-I797 HydrophobicContact CE2-CG2 4.46Å; S793-I797 WeakPolarHBondContact O-CG1 3.34Å; S793-I797 PolarHBondContact O-N 3.19Å; S793-I797 VanDerWaalsContact O-N 3.11Å; W794-I797 PolarHBondContact O-N 3.1Å; I797-T799 PolarHBondContact O-N 3.13Å; I797-I800 PolarHBondContact O-N 3.15Å; I797-V801 WeakPolarHBondContact O-CB 3.38Å; I797-V801 VanDerWaalsContact O-CG2 3.23Å; I797-V801 WeakPolarHBondContact O-CG2 3.3Å; I797-V801 PolarHBondContact O-N 3.04Å
798L91.6Very high91.1Very high0.333333 Ų0.33333325 Ų250%0.00213%0.13CC..Hα-helixtrans-59.1-34.9178.2-67.7176.3000112.2L735 F758 Y773 W794 L795 E796 V801 E802 V803 I805L735-L798 HydrophobicContact CD1-CD1 4.45Å; L735-L798 HydrophobicContact CD2-CD2 4.09Å; L735-L798 HydrophobicContact CD2-CG 4.26Å; F758-L798 HydrophobicContact CD1-CD1 4.43Å; F758-L798 HydrophobicContact CD1-CD2 4.47Å; F758-L798 HydrophobicContact CD2-CD2 3.94Å; F758-L798 HydrophobicContact CE1-CD1 4.05Å; F758-L798 HydrophobicContact CE1-CD2 4.32Å; F758-L798 HydrophobicContact CE2-CD2 3.73Å; F758-L798 HydrophobicContact CG-CD2 4.34Å; F758-L798 HydrophobicContact CZ-CD1 4.25Å; F758-L798 HydrophobicContact CZ-CD2 3.94Å; Y773-L798 HydrophobicContact CE1-CD1 4.18Å; W794-L798 WeakPolarHBondContact O-CG 3.2Å; W794-L798 PolarHBondContact O-N 3.12Å; L795-L798 PolarHBondContact O-N 2.88Å; E796-L798 VanDerWaalsContact C-N 3.35Å; E796-L798 PolarHBondContact O-N 3.15Å; L798-V801 CarbonylContact O-C 3.51Å; L798-E802 PolarHBondContact O-N 3.25Å; L798-V803 HydrophobicContact CB-CB 4.25Å; L798-V803 HydrophobicContact CD2-CB 4.45Å; L798-V803 HydrophobicContact CD2-CG2 4.12Å; L798-V803 VanDerWaalsContact O-CB 3.31Å; L798-V803 WeakPolarHBondContact O-CB 3.45Å; L798-V803 PolarHBondContact O-N 3.12Å; L798-I805 HydrophobicContact CB-CD1 4.14Å; L798-I805 HydrophobicContact CD1-CD1 4.37Å
799T91.5Very high91Very high6 Ų626.1 Ų26.14%0.03714%0.136CC..Hα-helixtrans-78.4-36.4-179.3-58.20000113.3L795 E796 I797 V801 E802 R1063 Q1064 I1067L795-T799 VanDerWaalsContact O-CB 3.25Å; L795-T799 WeakPolarHBondContact O-CB 3.31Å; L795-T799 PolarHBondContact O-N 3.23Å; L795-T799 PolarHBondContact O-OG1 3.1Å; E796-T799 CarbonylContact O-C 3.47Å; E796-T799 PolarHBondContact O-N 3.24Å; E796-T799 VanDerWaalsContact O-N 3.09Å; I797-T799 PolarHBondContact O-N 3.13Å; T799-V801 VanDerWaalsContact C-N 3.25Å; T799-V801 PolarHBondContact O-N 3.25Å; T799-E802 PolarHBondContact O-N 3.29Å; T799-E802 VanDerWaalsContact O-N 3.11Å; T799-R1063 HydrophobicContact CG2-CB 3.38Å; T799-R1063 HydrophobicContact CG2-CG 4.33Å; T799-Q1064 HydrophobicContact CG2-CG 3.97Å; T799-Q1064 PolarHBondContact OG1-NE2 3.31Å; T799-I1067 HydrophobicContact CG2-CD1 4.4Å
800I91.3Very high91.2Very high56.6667 Ų56.666724 Ų2429%0.29113%0.125SC..Hα-helixtrans-62.7-38171.2-70.3164.1000110Y747 E796 I797 E802Y747-I800 HydrophobicContact CD2-CB 4.46Å; Y747-I800 HydrophobicContact CD2-CD1 4.29Å; Y747-I800 HydrophobicContact CD2-CG2 4.07Å; Y747-I800 HydrophobicContact CE2-CD1 4.31Å; E796-I800 HydrophobicContact CG-CD1 3.87Å; E796-I800 HydrophobicContact CG-CG1 4.39Å; E796-I800 VanDerWaalsContact O-CG1 3.32Å; E796-I800 WeakPolarHBondContact O-CG1 3.36Å; E796-I800 PolarHBondContact O-N 3.16Å; I797-I800 PolarHBondContact O-N 3.15Å; I800-E802 PolarHBondContact O-N 3.05Å
801V89.9Confident91.3Very high2.25 Ų2.2521.7 Ų21.71%0.01411%0.114CC..THydrogen-bonded Turntrans-8413.5177.1-155.40000112.3E751 L754 K755 I797 L798 T799 V803E751-V801 VanDerWaalsContact CA-CG1 3.43Å; E751-V801 HydrophobicContact CB-CG1 3.98Å; E751-V801 HydrophobicContact CG-CG1 4.23Å; L754-V801 HydrophobicContact CB-CG1 4.04Å; L754-V801 HydrophobicContact CD1-CB 4.44Å; L754-V801 HydrophobicContact CD1-CG1 3.99Å; L754-V801 HydrophobicContact CD1-CG2 4.33Å; K755-V801 VanDerWaalsContact CE-O 3.26Å; K755-V801 WeakPolarHBondContact CE-O 3.45Å; I797-V801 WeakPolarHBondContact O-CB 3.38Å; I797-V801 VanDerWaalsContact O-CG2 3.23Å; I797-V801 WeakPolarHBondContact O-CG2 3.3Å; I797-V801 PolarHBondContact O-N 3.04Å; L798-V801 CarbonylContact O-C 3.51Å; T799-V801 VanDerWaalsContact C-N 3.25Å; T799-V801 PolarHBondContact O-N 3.25Å; V801-V803 HydrophobicContact CG1-CG2 4.43Å; V801-V803 HydrophobicContact CG2-CG2 3.88Å; V801-V803 PolarHBondContact O-N 3.06Å; V801-V803 VanDerWaalsContact O-N 3.12Å
802E90.1Very high91.1Very high102.75 Ų102.7524 Ų2448%0.4813%0.128SC..THydrogen-bonded Turntrans53.527.8175.9-63.6-173.5161.600115.3K755 L798 T799 I800 P804 I1067K755-E802 VanDerWaalsContact CE-O 3.27Å; K755-E802 WeakPolarHBondContact CE-O 3.46Å; K755-E802 IonicContact NZ-OE2 3.58Å; K755-E802 PolarHBondContact NZ-OE2 2.98Å; L798-E802 PolarHBondContact O-N 3.25Å; T799-E802 PolarHBondContact O-N 3.29Å; T799-E802 VanDerWaalsContact O-N 3.11Å; I800-E802 PolarHBondContact O-N 3.05Å; E802-P804 WeakPolarHBondContact O-CD 3.37Å; E802-I1067 HydrophobicContact CB-CD1 4.39Å; E802-I1067 HydrophobicContact CG-CD1 4.48Å
803V89.2Confident91.1Very high0.5 Ų0.524.3 Ų24.30%0.00313%0.129CC..  trans-68.3122.4173176.30000108.5L754 K755 F758 L798 V801 I805 Q1064L754-V803 HydrophobicContact CB-CG2 4.06Å; K755-V803 HydrophobicContact CG-CG2 4.25Å; F758-V803 HydrophobicContact CB-CG1 3.5Å; F758-V803 VanDerWaalsContact CB-CG1 3.48Å; F758-V803 HydrophobicContact CG-CG1 4.15Å; L798-V803 HydrophobicContact CB-CB 4.25Å; L798-V803 HydrophobicContact CD2-CB 4.45Å; L798-V803 HydrophobicContact CD2-CG2 4.12Å; L798-V803 VanDerWaalsContact O-CB 3.31Å; L798-V803 WeakPolarHBondContact O-CB 3.45Å; L798-V803 PolarHBondContact O-N 3.12Å; V801-V803 HydrophobicContact CG1-CG2 4.43Å; V801-V803 HydrophobicContact CG2-CG2 3.88Å; V801-V803 PolarHBondContact O-N 3.06Å; V801-V803 VanDerWaalsContact O-N 3.12Å; V803-I805 PolarHBondContact O-N 3.16Å; V803-I805 VanDerWaalsContact O-N 3.15Å; V803-Q1064 PolarHBondContact O-NE2 3.15Å; V803-Q1064 PolarHBondContact O-OE1 3.35Å
804P88Confident91.2Very high65.75 Ų65.7523.5 Ų23.543%0.42712%0.124SC..  trans-76104.2-176.428.8-33.3000111.1E802 P806 I1067 L1068E802-P804 WeakPolarHBondContact O-CD 3.37Å; P804-P806 WeakPolarHBondContact O-CD 3.35Å; P804-I1067 HydrophobicContact CB-CG2 4.29Å; P804-L1068 HydrophobicContact CB-CD2 3.78Å; P804-L1068 HydrophobicContact CB-CG 4.5Å
805I90Very high91Very high0 Ų023.8 Ų23.80%013%0.127CC..  trans-92.1119178.6-54.8177.4000108.7Y773 L795 L798 V803 M807 L810 L1068Y773-I805 HydrophobicContact CD2-CG2 4.46Å; Y773-I805 HydrophobicContact CE1-CD1 4.34Å; Y773-I805 HydrophobicContact CE1-CG1 4.06Å; Y773-I805 HydrophobicContact CE1-CG2 4.24Å; Y773-I805 HydrophobicContact CE2-CG2 4.21Å; L795-I805 HydrophobicContact CD2-CD1 3.77Å; L798-I805 HydrophobicContact CB-CD1 4.14Å; L798-I805 HydrophobicContact CD1-CD1 4.37Å; V803-I805 PolarHBondContact O-N 3.16Å; V803-I805 VanDerWaalsContact O-N 3.15Å; I805-M807 PolarHBondContact O-N 3.06Å; I805-M807 VanDerWaalsContact O-N 3.1Å; I805-L810 HydrophobicContact CG2-CB 4.24Å; I805-L810 HydrophobicContact CG2-CD1 4.32Å; I805-L1068 VanDerWaalsContact O-CD1 3.29Å; I805-L1068 WeakPolarHBondContact O-CD1 3.32Å
806P89.1Confident90.9Very high47 Ų4725.1 Ų25.131%0.30514%0.138SC..  trans-53.3118.2-178.1-2937000112.7P769 P804 K808 E809 L810P769-P806 HydrophobicContact CB-CG 4.25Å; P804-P806 WeakPolarHBondContact O-CD 3.35Å; P806-K808 PolarHBondContact O-N 3.03Å; P806-K808 VanDerWaalsContact O-N 3.16Å; P806-E809 HydrophobicContact CB-CB 4.39Å; P806-E809 HydrophobicContact CB-CG 4.34Å; P806-E809 WeakPolarHBondContact CB-OE2 3.39Å; P806-E809 PolarHBondContact O-N 3.11Å; P806-L810 PolarHBondContact O-N 3.09Å
807M89.8Confident90.7Very high12.25 Ų12.2523.9 Ų23.96%0.0613%0.133CC..Hα-helixtrans-52.7-32.9-172.4-70.1-59-65.300113.9I805 E809 L810 L811 Q1064 L1065 L1068 T1080 L1084I805-M807 PolarHBondContact O-N 3.06Å; I805-M807 VanDerWaalsContact O-N 3.1Å; M807-E809 PolarHBondContact O-N 3.23Å; M807-L810 HydrophobicContact CE-CD2 4.42Å; M807-L810 PolarHBondContact O-N 3.16Å; M807-L810 HydrophobicContact SD-CD2 4.18Å; M807-L811 HydrophobicContact CB-CD1 4.45Å; M807-L811 HydrophobicContact CE-CD1 4.12Å; M807-L811 HydrophobicContact CE-CD2 4.31Å; M807-L811 HydrophobicContact CE-CG 4.26Å; M807-L811 VanDerWaalsContact O-CB 3.29Å; M807-L811 WeakPolarHBondContact O-CB 3.4Å; M807-L811 WeakPolarHBondContact O-CD1 3.44Å; M807-L811 WeakPolarHBondContact O-CG 3.29Å; M807-L811 PolarHBondContact O-N 3.22Å; M807-Q1064 HydrophobicContact SD-CB 3.79Å; M807-L1065 HydrophobicContact CE-CB 4.17Å; M807-L1065 HydrophobicContact CE-CD1 4.47Å; M807-L1065 HydrophobicContact SD-CB 4.46Å; M807-L1068 HydrophobicContact CG-CD1 3.64Å; M807-L1068 HydrophobicContact SD-CD1 4.05Å; M807-T1080 HydrophobicContact CB-CG2 3.78Å; M807-T1080 HydrophobicContact CE-CG2 4.1Å; M807-T1080 HydrophobicContact CG-CG2 3.87Å; M807-L1084 HydrophobicContact CE-CD1 4.38Å; M807-L1084 HydrophobicContact CE-CD2 4.41Å
808K88.6Confident90.6Very high84.25 Ų84.2524.1 Ų24.137%0.36613%0.134SC..Hα-helixtrans-60.6-47.9177.6-175.1175-174.8134.70111.6P806 L811 T812 E1079 L1083P806-K808 PolarHBondContact O-N 3.03Å; P806-K808 VanDerWaalsContact O-N 3.16Å; K808-L811 PolarHBondContact O-N 3.18Å; K808-T812 HydrophobicContact CG-CG2 4.48Å; K808-T812 WeakPolarHBondContact O-CB 3.44Å; K808-T812 VanDerWaalsContact O-CG2 3.27Å; K808-T812 WeakPolarHBondContact O-CG2 3.45Å; K808-T812 PolarHBondContact O-N 3.3Å; K808-T812 PolarHBondContact O-OG1 2.94Å; K808-T812 VanDerWaalsContact O-OG1 3.1Å; K808-E1079 VanDerWaalsContact CE-OE1 3.29Å; K808-E1079 WeakPolarHBondContact CE-OE1 3.38Å; K808-E1079 IonicContact NZ-OE1 3.03Å; K808-E1079 PolarHBondContact NZ-OE1 3.19Å; K808-E1079 IonicContact NZ-OE2 3.43Å; K808-L1083 HydrophobicContact CG-CD1 4.41Å
809E89.1Confident90.4Very high23.75 Ų23.7526.4 Ų26.411%0.11115%0.153CC..Hα-helixtrans-68.7-44.1-179.9-55.9-37.3175.500110.4P769 Q770 P806 M807 L811 T812 M813P769-E809 HydrophobicContact CB-CG 4.49Å; Q770-E809 HydrophobicContact CG-CG 4.3Å; Q770-E809 WeakPolarHBondContact CG-OE1 3.16Å; Q770-E809 WeakPolarHBondContact CG-OE2 3.41Å; Q770-E809 PolarHBondContact NE2-OE1 2.9Å; P806-E809 HydrophobicContact CB-CB 4.39Å; P806-E809 HydrophobicContact CB-CG 4.34Å; P806-E809 WeakPolarHBondContact CB-OE2 3.39Å; P806-E809 PolarHBondContact O-N 3.11Å; M807-E809 PolarHBondContact O-N 3.23Å; E809-L811 VanDerWaalsContact C-N 3.32Å; E809-L811 PolarHBondContact O-N 3.08Å; E809-T812 VanDerWaalsContact CA-OG1 3.32Å; E809-T812 WeakPolarHBondContact CA-OG1 3.36Å; E809-T812 PolarHBondContact O-N 3.03Å; E809-T812 VanDerWaalsContact O-N 3.12Å; E809-T812 PolarHBondContact O-OG1 3.11Å; E809-M813 HydrophobicContact CB-CE 4.13Å; E809-M813 WeakPolarHBondContact O-CE 3.44Å; E809-M813 VanDerWaalsContact O-CG 3.31Å; E809-M813 WeakPolarHBondContact O-CG 3.38Å; E809-M813 PolarHBondContact O-N 3.27Å
810L93Very high90.1Very high0 Ų026.5 Ų26.50%015%0.154CC..Hα-helixtrans-56.9-47.4175.9-172.169.4000112.3L795 I805 P806 M807 T812 M813 F814 I1060 Q1064L795-L810 HydrophobicContact CD1-CD1 4.25Å; I805-L810 HydrophobicContact CG2-CB 4.24Å; I805-L810 HydrophobicContact CG2-CD1 4.32Å; P806-L810 PolarHBondContact O-N 3.09Å; M807-L810 HydrophobicContact CE-CD2 4.42Å; M807-L810 PolarHBondContact O-N 3.16Å; M807-L810 HydrophobicContact SD-CD2 4.18Å; L810-T812 VanDerWaalsContact C-N 3.33Å; L810-T812 PolarHBondContact O-N 2.94Å; L810-M813 HydrophobicContact CD1-CE 4.29Å; L810-M813 WeakPolarHBondContact O-CB 3.14Å; L810-M813 PolarHBondContact O-N 3.24Å; L810-F814 HydrophobicContact CD1-CE1 4.02Å; L810-F814 HydrophobicContact CD1-CE2 3.86Å; L810-F814 HydrophobicContact CD1-CZ 3.48Å; L810-F814 VanDerWaalsContact CD1-CZ 3.46Å; L810-F814 HydrophobicContact CD2-CE2 4.2Å; L810-F814 HydrophobicContact CD2-CZ 4.49Å; L810-F814 HydrophobicContact CG-CD2 4.3Å; L810-F814 HydrophobicContact CG-CE2 3.72Å; L810-F814 HydrophobicContact CG-CZ 3.91Å; L810-F814 WeakPolarHBondContact O-CG 3.34Å; L810-F814 PolarHBondContact O-N 3.01Å; L810-F814 VanDerWaalsContact O-N 3.08Å; L810-I1060 HydrophobicContact CD1-CG2 4.08Å; L810-I1060 HydrophobicContact CD2-CG2 4.35Å; L810-Q1064 HydrophobicContact CD2-CB 3.79Å; L810-Q1064 HydrophobicContact CD2-CG 3.88Å
811L92.9Very high89.8Confident3 Ų323.8 Ų23.82%0.01614%0.14CC..Hα-helixtrans-74.3-27.9-178.7-63.5170.2000112.5M807 K808 E809 F814 A815 A1061 T1080 L1083 L1084 L1087 L1432M807-L811 HydrophobicContact CB-CD1 4.45Å; M807-L811 HydrophobicContact CE-CD1 4.12Å; M807-L811 HydrophobicContact CE-CD2 4.31Å; M807-L811 HydrophobicContact CE-CG 4.26Å; M807-L811 VanDerWaalsContact O-CB 3.29Å; M807-L811 WeakPolarHBondContact O-CB 3.4Å; M807-L811 WeakPolarHBondContact O-CD1 3.44Å; M807-L811 WeakPolarHBondContact O-CG 3.29Å; M807-L811 PolarHBondContact O-N 3.22Å; K808-L811 PolarHBondContact O-N 3.18Å; E809-L811 VanDerWaalsContact C-N 3.32Å; E809-L811 PolarHBondContact O-N 3.08Å; L811-F814 PolarHBondContact O-N 2.94Å; L811-A815 WeakPolarHBondContact O-CB 3.42Å; L811-A815 PolarHBondContact O-N 3.35Å; L811-A815 VanDerWaalsContact O-N 3.1Å; L811-A1061 HydrophobicContact CD2-CB 4.39Å; L811-T1080 HydrophobicContact CD1-CG2 4.36Å; L811-L1083 HydrophobicContact CB-CB 4.3Å; L811-L1083 HydrophobicContact CD1-CB 3.61Å; L811-L1083 HydrophobicContact CD1-CD1 4.42Å; L811-L1084 HydrophobicContact CD1-CD2 4.27Å; L811-L1084 HydrophobicContact CD1-CG 3.89Å; L811-L1084 HydrophobicContact CD2-CD2 3.65Å; L811-L1084 HydrophobicContact CD2-CG 4.16Å; L811-L1087 HydrophobicContact CD2-CD2 3.76Å; L811-L1432 HydrophobicContact CB-CD2 4.01Å
812T90.8Very high89.3Confident49 Ų4926 Ų2630%0.30115%0.149SC..Hα-helixtrans-68.2-38.1170.153.60000112.2K808 E809 L810 A816 L1432K808-T812 HydrophobicContact CG-CG2 4.48Å; K808-T812 WeakPolarHBondContact O-CB 3.44Å; K808-T812 VanDerWaalsContact O-CG2 3.27Å; K808-T812 WeakPolarHBondContact O-CG2 3.45Å; K808-T812 PolarHBondContact O-N 3.3Å; K808-T812 PolarHBondContact O-OG1 2.94Å; K808-T812 VanDerWaalsContact O-OG1 3.1Å; E809-T812 VanDerWaalsContact CA-OG1 3.32Å; E809-T812 WeakPolarHBondContact CA-OG1 3.36Å; E809-T812 PolarHBondContact O-N 3.03Å; E809-T812 VanDerWaalsContact O-N 3.12Å; E809-T812 PolarHBondContact O-OG1 3.11Å; L810-T812 VanDerWaalsContact C-N 3.33Å; L810-T812 PolarHBondContact O-N 2.94Å; T812-A816 PolarHBondContact O-N 3.03Å; T812-A816 VanDerWaalsContact O-N 3.08Å; T812-L1432 HydrophobicContact CG2-CB 3.98Å; T812-L1432 HydrophobicContact CG2-CD2 3.89Å; T812-L1432 HydrophobicContact CG2-CG 4.5Å
813M92Very high88.7Confident6.75 Ų6.7524.5 Ų24.53%0.03315%0.145CC..Hα-helixtrans-63-48.4174.1-67.5179.3-114.400111.1Y773 A776 F780 L795 E809 L810 A815 A816 G817Y773-M813 VanDerWaalsContact CB-CE 3.47Å; Y773-M813 HydrophobicContact CG-CE 4.37Å; A776-M813 HydrophobicContact CB-SD 4.19Å; F780-M813 WeakPolarHBondContact CB-O 3.38Å; F780-M813 HydrophobicContact CD2-CB 3.78Å; F780-M813 HydrophobicContact CD2-CG 4.36Å; F780-M813 HydrophobicContact CE2-CB 4.11Å; F780-M813 HydrophobicContact CG-CB 4.38Å; F780-M813 WeakPolarHBondContact CG-O 3.39Å; L795-M813 HydrophobicContact CD1-CE 4.49Å; L795-M813 HydrophobicContact CD2-CE 4.42Å; E809-M813 HydrophobicContact CB-CE 4.13Å; E809-M813 WeakPolarHBondContact O-CE 3.44Å; E809-M813 VanDerWaalsContact O-CG 3.31Å; E809-M813 WeakPolarHBondContact O-CG 3.38Å; E809-M813 PolarHBondContact O-N 3.27Å; L810-M813 HydrophobicContact CD1-CE 4.29Å; L810-M813 WeakPolarHBondContact O-CB 3.14Å; L810-M813 PolarHBondContact O-N 3.24Å; M813-A815 PolarHBondContact O-N 3.15Å; M813-A816 WeakPolarHBondContact O-CB 3.44Å; M813-A816 PolarHBondContact O-N 3.15Å; M813-A816 VanDerWaalsContact O-N 3.13Å; M813-G817 PolarHBondContact O-N 3.23Å
814F94.9Very high88Confident0 Ų027.9 Ų27.90%016%0.16CC..Hα-helixtrans-66.9-36.2179.8-62.6-13.9000112.8F780 L792 L795 L810 L811 A816 G817 V818 M1057 I1060 A1061 L1087F780-F814 HydrophobicContact CE1-CD1 4.35Å; F780-F814 HydrophobicContact CZ-CD1 4.26Å; F780-F814 HydrophobicContact CZ-CE1 4.15Å; L792-F814 HydrophobicContact CD2-CD1 4.2Å; L792-F814 HydrophobicContact CD2-CE1 3.45Å; L792-F814 VanDerWaalsContact CD2-CE1 3.41Å; L792-F814 HydrophobicContact CD2-CZ 3.96Å; L795-F814 HydrophobicContact CD1-CE1 3.92Å; L795-F814 HydrophobicContact CD1-CZ 4.41Å; L810-F814 HydrophobicContact CD1-CE1 4.02Å; L810-F814 HydrophobicContact CD1-CE2 3.86Å; L810-F814 HydrophobicContact CD1-CZ 3.48Å; L810-F814 VanDerWaalsContact CD1-CZ 3.46Å; L810-F814 HydrophobicContact CD2-CE2 4.2Å; L810-F814 HydrophobicContact CD2-CZ 4.49Å; L810-F814 HydrophobicContact CG-CD2 4.3Å; L810-F814 HydrophobicContact CG-CE2 3.72Å; L810-F814 HydrophobicContact CG-CZ 3.91Å; L810-F814 WeakPolarHBondContact O-CG 3.34Å; L810-F814 PolarHBondContact O-N 3.01Å; L810-F814 VanDerWaalsContact O-N 3.08Å; L811-F814 PolarHBondContact O-N 2.94Å; F814-A816 VanDerWaalsContact C-N 3.31Å; F814-A816 PolarHBondContact O-N 3.3Å; F814-G817 PolarHBondContact O-N 3.03Å; F814-V818 WeakPolarHBondContact O-CB 3.36Å; F814-V818 VanDerWaalsContact O-CG2 3.29Å; F814-V818 WeakPolarHBondContact O-CG2 3.32Å; F814-V818 PolarHBondContact O-N 2.93Å; F814-M1057 HydrophobicContact CB-CG 4.41Å; F814-M1057 HydrophobicContact CB-SD 4.11Å; F814-M1057 HydrophobicContact CD1-CB 4.38Å; F814-M1057 HydrophobicContact CD1-CG 3.86Å; F814-M1057 HydrophobicContact CD1-SD 4.41Å; F814-M1057 HydrophobicContact CD2-CB 3.98Å; F814-M1057 HydrophobicContact CD2-CG 4.34Å; F814-M1057 HydrophobicContact CE1-CB 4.49Å; F814-M1057 HydrophobicContact CE1-CG 4.17Å; F814-M1057 HydrophobicContact CE2-CB 4.16Å; F814-M1057 WeakPolarHBondContact CE2-O 3.44Å; F814-M1057 HydrophobicContact CG-CB 4.1Å; F814-M1057 HydrophobicContact CG-CG 3.96Å; F814-M1057 HydrophobicContact CG-SD 4.3Å; F814-M1057 HydrophobicContact CZ-CB 4.41Å; F814-M1057 HydrophobicContact CZ-CG 4.49Å; F814-I1060 HydrophobicContact CE2-CB 4.41Å; F814-I1060 HydrophobicContact CE2-CG2 4.37Å; F814-I1060 HydrophobicContact CZ-CB 4.07Å; F814-I1060 HydrophobicContact CZ-CG2 3.88Å; F814-A1061 HydrophobicContact CD2-CB 4.43Å; F814-A1061 HydrophobicContact CE2-CB 4.1Å; F814-L1087 HydrophobicContact CB-CD1 4.05Å; F814-L1087 HydrophobicContact CB-CD2 3.85Å; F814-L1087 HydrophobicContact CD2-CD2 4.24Å
815A91.1Very high87.1Confident11.5 Ų11.526.6 Ų26.610%0.09515%0.149CC..Hα-helixtrans-66-34.3173.300000112.9L811 M813 G817 V818 A819 W1086 L1087 L1432L811-A815 WeakPolarHBondContact O-CB 3.42Å; L811-A815 PolarHBondContact O-N 3.35Å; L811-A815 VanDerWaalsContact O-N 3.1Å; M813-A815 PolarHBondContact O-N 3.15Å; A815-G817 VanDerWaalsContact C-N 3.3Å; A815-V818 PolarHBondContact O-N 2.94Å; A815-A819 WeakPolarHBondContact O-CB 3.39Å; A815-A819 PolarHBondContact O-N 3.08Å; A815-W1086 HydrophobicContact CB-CZ3 4.35Å; A815-L1087 HydrophobicContact CB-CD1 4.36Å; A815-L1432 HydrophobicContact CB-CB 3.93Å; A815-L1432 HydrophobicContact CB-CD1 3.21Å; A815-L1432 HydrophobicContact CB-CD2 4.45Å; A815-L1432 HydrophobicContact CB-CG 4.14Å
816A90.2Very high85.7Confident28.5 Ų28.530 Ų3024%0.23617%0.167CC..Hα-helixtrans-66.5-44.3171.200000111.4F780 I781 T812 M813 F814 V818 A819 S820F780-A816 HydrophobicContact CB-CB 4.33Å; F780-A816 CarbonylContact O-C 3.49Å; F780-A816 VanDerWaalsContact O-C 3.27Å; I781-A816 HydrophobicContact CG1-CB 4.15Å; T812-A816 PolarHBondContact O-N 3.03Å; T812-A816 VanDerWaalsContact O-N 3.08Å; M813-A816 WeakPolarHBondContact O-CB 3.44Å; M813-A816 PolarHBondContact O-N 3.15Å; M813-A816 VanDerWaalsContact O-N 3.13Å; F814-A816 VanDerWaalsContact C-N 3.31Å; F814-A816 PolarHBondContact O-N 3.3Å; A816-V818 PolarHBondContact O-N 3.13Å; A816-A819 CarbonylContact O-C 3.57Å; A816-A819 PolarHBondContact O-N 3.17Å; A816-A819 VanDerWaalsContact O-N 3.15Å; A816-S820 PolarHBondContact O-N 3.03Å; A816-S820 PolarHBondContact O-OG 2.97Å
817G90.4Very high84.2Confident0 Ų033.4 Ų33.40%018%0.182CC..Hα-helixtrans-59.6-48.4177.100000112.6F780 Q788 M813 F814 A815 A819 S820 L821F780-G817 WeakPolarHBondContact O-CA 3.29Å; F780-G817 PolarHBondContact O-N 3Å; Q788-G817 PolarHBondContact NE2-O 3.09Å; Q788-G817 VanDerWaalsContact OE1-CA 3.23Å; Q788-G817 PolarHBondContact OE1-O 3.42Å; M813-G817 PolarHBondContact O-N 3.23Å; F814-G817 PolarHBondContact O-N 3.03Å; A815-G817 VanDerWaalsContact C-N 3.3Å; G817-A819 VanDerWaalsContact C-N 3.31Å; G817-A819 PolarHBondContact O-N 3.25Å; G817-S820 WeakPolarHBondContact O-CA 3.27Å; G817-S820 WeakPolarHBondContact O-CB 3.34Å; G817-S820 PolarHBondContact O-N 3.34Å; G817-S820 VanDerWaalsContact O-N 3.08Å; G817-L821 VanDerWaalsContact O-CG 3.29Å; G817-L821 WeakPolarHBondContact O-CG 3.37Å; G817-L821 PolarHBondContact O-N 3.02Å
818V89.2Confident81.8Confident5 Ų537.9 Ų37.93%0.0321%0.212CC..Hα-helixtrans-58.7-39.8174.6168.90000112.1F814 A815 A816 L821 F822 L1054 M1057 L1087 D1090 M1091 L1094F814-V818 WeakPolarHBondContact O-CB 3.36Å; F814-V818 VanDerWaalsContact O-CG2 3.29Å; F814-V818 WeakPolarHBondContact O-CG2 3.32Å; F814-V818 PolarHBondContact O-N 2.93Å; A815-V818 PolarHBondContact O-N 2.94Å; A816-V818 PolarHBondContact O-N 3.13Å; V818-L821 PolarHBondContact O-N 3.22Å; V818-F822 PolarHBondContact O-N 3.14Å; V818-F822 VanDerWaalsContact O-N 3.12Å; V818-L1054 HydrophobicContact CG2-CD2 3.85Å; V818-M1057 HydrophobicContact CG2-SD 4.04Å; V818-L1087 HydrophobicContact CB-CD1 4.48Å; V818-L1087 HydrophobicContact CG2-CD1 3.95Å; V818-D1090 HydrophobicContact CG1-CB 3.63Å; V818-D1090 VanDerWaalsContact CG1-CB 3.46Å; V818-M1091 HydrophobicContact CG1-CG 4.45Å; V818-M1091 HydrophobicContact CG2-CE 3.87Å; V818-M1091 HydrophobicContact CG2-CG 3.8Å; V818-L1094 HydrophobicContact CB-CD1 4.5Å; V818-L1094 HydrophobicContact CG1-CD1 3.86Å; V818-L1094 HydrophobicContact CG1-CD2 4.35Å; V818-L1094 HydrophobicContact CG1-CG 4.22Å
819A87Confident79.6Confident50 Ų5039.3 Ų39.341%0.41323%0.229SC..Hα-helixtrans-68.6-33.9174.400000113A815 A816 G817 F822 L823 K1430A815-A819 WeakPolarHBondContact O-CB 3.39Å; A815-A819 PolarHBondContact O-N 3.08Å; A816-A819 CarbonylContact O-C 3.57Å; A816-A819 PolarHBondContact O-N 3.17Å; A816-A819 VanDerWaalsContact O-N 3.15Å; G817-A819 VanDerWaalsContact C-N 3.31Å; G817-A819 PolarHBondContact O-N 3.25Å; A819-F822 WeakPolarHBondContact O-CB 3.37Å; A819-F822 PolarHBondContact O-N 3.05Å; A819-L823 PolarHBondContact O-N 2.94Å; A819-K1430 HydrophobicContact CB-CB 4.47Å
820S86Confident76.8Confident7 Ų745.5 Ų45.55%0.04926%0.262CS..Hα-helixtrans-67.5-43.5174-112.80000111.7F780 N782 T783 A816 G817 F822 L823 E824F780-S820 PolarHBondContact O-OG 3.1Å; N782-S820 VanDerWaalsContact C-OG 3.28Å; N782-S820 VanDerWaalsContact CA-OG 3.25Å; N782-S820 WeakPolarHBondContact CA-OG 3.42Å; N782-S820 PolarHBondContact N-OG 3.07Å; T783-S820 PolarHBondContact N-OG 3.23Å; T783-S820 PolarHBondContact O-OG 3.03Å; A816-S820 PolarHBondContact O-N 3.03Å; A816-S820 PolarHBondContact O-OG 2.97Å; G817-S820 WeakPolarHBondContact O-CA 3.27Å; G817-S820 WeakPolarHBondContact O-CB 3.34Å; G817-S820 PolarHBondContact O-N 3.34Å; G817-S820 VanDerWaalsContact O-N 3.08Å; S820-F822 VanDerWaalsContact C-N 3.26Å; S820-F822 PolarHBondContact O-N 3.05Å; S820-L823 WeakPolarHBondContact O-CB 3.44Å; S820-L823 PolarHBondContact O-N 3.05Å; S820-L823 VanDerWaalsContact O-N 3.09Å; S820-E824 PolarHBondContact O-N 3.11Å
821L84.7Confident73.8Confident0 Ų051.8 Ų51.80%030%0.296CS..Hα-helixtrans-61.5-33.2174.6-65.6167.4000111.8V785 G817 V818 L823 E824 L825 I1050 L1054 M1057 L1094V785-L821 HydrophobicContact CB-CD2 4.38Å; V785-L821 HydrophobicContact CG1-CD2 4.36Å; V785-L821 HydrophobicContact CG2-CD2 3.8Å; G817-L821 VanDerWaalsContact O-CG 3.29Å; G817-L821 WeakPolarHBondContact O-CG 3.37Å; G817-L821 PolarHBondContact O-N 3.02Å; V818-L821 PolarHBondContact O-N 3.22Å; L821-L823 VanDerWaalsContact C-N 3.33Å; L821-L823 PolarHBondContact O-N 2.9Å; L821-E824 PolarHBondContact O-N 3.36Å; L821-L825 WeakPolarHBondContact O-CB 3.41Å; L821-L825 WeakPolarHBondContact O-CD1 3.34Å; L821-L825 VanDerWaalsContact O-CG 3.26Å; L821-L825 WeakPolarHBondContact O-CG 3.33Å; L821-L825 PolarHBondContact O-N 3.02Å; L821-L825 VanDerWaalsContact O-N 3.12Å; L821-I1050 HydrophobicContact CB-CG2 4.46Å; L821-I1050 HydrophobicContact CD1-CG2 4.18Å; L821-I1050 HydrophobicContact CD2-CG1 4.24Å; L821-I1050 HydrophobicContact CD2-CG2 4.19Å; L821-I1050 HydrophobicContact CG-CG2 4.46Å; L821-L1054 HydrophobicContact CD1-CD2 3.81Å; L821-L1054 HydrophobicContact CD1-CG 4.36Å; L821-M1057 HydrophobicContact CD1-CE 4.39Å; L821-L1094 HydrophobicContact CB-CD1 4.3Å; L821-L1094 HydrophobicContact CB-CD2 4.44Å
822F79Confident71Confident48.25 Ų48.2560.9 Ų60.921%0.21234%0.338CS..Hα-helixtrans-66.1-37.7173.2-168.1-100.4000112.5V818 A819 S820 L825 L826 L1094 N1098V818-F822 PolarHBondContact O-N 3.14Å; V818-F822 VanDerWaalsContact O-N 3.12Å; A819-F822 WeakPolarHBondContact O-CB 3.37Å; A819-F822 PolarHBondContact O-N 3.05Å; S820-F822 VanDerWaalsContact C-N 3.26Å; S820-F822 PolarHBondContact O-N 3.05Å; F822-L825 PolarHBondContact O-N 3.24Å; F822-L826 HydrophobicContact CD1-CD1 3.84Å; F822-L826 HydrophobicContact CD1-CG 4.42Å; F822-L826 HydrophobicContact CE1-CD1 3.68Å; F822-L826 HydrophobicContact CE1-CG 4.39Å; F822-L826 HydrophobicContact CZ-CD1 4.33Å; F822-L826 WeakPolarHBondContact O-CG 3.26Å; F822-L826 PolarHBondContact O-N 3.15Å; F822-L1094 VanDerWaalsContact CA-CD2 3.49Å; F822-L1094 HydrophobicContact CB-CD2 3.67Å; F822-L1094 HydrophobicContact CD2-CD2 3.72Å; F822-L1094 HydrophobicContact CD2-CG 4.16Å; F822-L1094 HydrophobicContact CG-CD2 4.15Å; F822-N1098 HydrophobicContact CZ-CB 3.86Å; F822-N1098 WeakPolarHBondContact CZ-OD1 3.15Å
823L77.4Confident68.1Low73 Ų7363.1 Ų63.138%0.38236%0.356SS..Hα-helixtrans-70.9-38.5176.2-174.264.4000111.7A819 S820 L821 L825 L826 L827A819-L823 PolarHBondContact O-N 2.94Å; S820-L823 WeakPolarHBondContact O-CB 3.44Å; S820-L823 PolarHBondContact O-N 3.05Å; S820-L823 VanDerWaalsContact O-N 3.09Å; L821-L823 VanDerWaalsContact C-N 3.33Å; L821-L823 PolarHBondContact O-N 2.9Å; L823-L825 VanDerWaalsContact C-N 3.31Å; L823-L825 PolarHBondContact O-N 3.21Å; L823-L826 PolarHBondContact O-N 3.16Å; L823-L826 VanDerWaalsContact O-N 3.14Å; L823-L827 PolarHBondContact O-N 3.23Å
824E73.9Confident65.4Low70 Ų7070.5 Ų70.533%0.32740%0.396SS..Hα-helixtrans-60-42.6174.8-167.5169.2-171.400111.3V785 S820 L821 L826 L827V785-E824 VanDerWaalsContact CG2-OE2 3.29Å; V785-E824 WeakPolarHBondContact CG2-OE2 3.35Å; V785-E824 PolarHBondContact N-OE1 2.89Å; V785-E824 PolarHBondContact N-OE2 3.22Å; S820-E824 PolarHBondContact O-N 3.11Å; L821-E824 PolarHBondContact O-N 3.36Å; E824-L826 VanDerWaalsContact C-N 3.26Å; E824-L826 PolarHBondContact O-N 3.2Å; E824-L827 PolarHBondContact O-N 3.28Å
825L69.3Low62.3Low38.75 Ų38.7578.4 Ų78.420%0.20344%0.438CS..THydrogen-bonded Turntrans-69.7-10.6174.9-74.2165.1000115.1L821 F822 L823 I1050 L1094 S1109 L1111L821-L825 WeakPolarHBondContact O-CB 3.41Å; L821-L825 WeakPolarHBondContact O-CD1 3.34Å; L821-L825 VanDerWaalsContact O-CG 3.26Å; L821-L825 WeakPolarHBondContact O-CG 3.33Å; L821-L825 PolarHBondContact O-N 3.02Å; L821-L825 VanDerWaalsContact O-N 3.12Å; F822-L825 PolarHBondContact O-N 3.24Å; L823-L825 VanDerWaalsContact C-N 3.31Å; L823-L825 PolarHBondContact O-N 3.21Å; L825-I1050 HydrophobicContact CD1-CD1 4.26Å; L825-I1050 HydrophobicContact CD2-CD1 3.91Å; L825-I1050 HydrophobicContact CG-CD1 4.01Å; L825-L1094 HydrophobicContact CD1-CD2 3.79Å; L825-S1109 WeakPolarHBondContact CD2-O 3.24Å; L825-S1109 PolarHBondContact O-OG 3.16Å; L825-L1111 HydrophobicContact CD1-CD2 4.11Å; L825-L1111 HydrophobicContact CD1-CG 4.34Å; L825-L1111 HydrophobicContact CD2-CD2 4.35Å
826L62.3Low59.7Low71.5 Ų71.584.9 Ų84.937%0.37447%0.471SS..THydrogen-bonded Turntrans-97.1-10.6177.3-74.9171.5000113.5F822 L823 E824 S1108F822-L826 HydrophobicContact CD1-CD1 3.84Å; F822-L826 HydrophobicContact CD1-CG 4.42Å; F822-L826 HydrophobicContact CE1-CD1 3.68Å; F822-L826 HydrophobicContact CE1-CG 4.39Å; F822-L826 HydrophobicContact CZ-CD1 4.33Å; F822-L826 WeakPolarHBondContact O-CG 3.26Å; F822-L826 PolarHBondContact O-N 3.15Å; L823-L826 PolarHBondContact O-N 3.16Å; L823-L826 VanDerWaalsContact O-N 3.14Å; E824-L826 VanDerWaalsContact C-N 3.26Å; E824-L826 PolarHBondContact O-N 3.2Å; L826-S1108 WeakPolarHBondContact CD2-OG 3.46Å
827L56.4Low57Low119 Ų11993.8 Ų93.862%0.62350%0.5SS*.SBendtrans-80.4130.1176.1-70.4165.8000109.6L823 E824 T829L823-L827 PolarHBondContact O-N 3.23Å; E824-L827 PolarHBondContact O-N 3.28Å; L827-T829 PolarHBondContact O-N 3.04Å
828P40.2Very low54.3Low105.75 Ų105.75101.4 Ų101.469%0.68754%0.54SS*.PPolyproline II helixtrans-65.1133.4174.917.1-19.1000110.2N830P828-N830 PolarHBondContact O-N 3.16Å; P828-N830 VanDerWaalsContact O-N 3.09Å
829T42.6Very low51.6Low115.5 Ų115.5106.6 Ų106.671%0.70957%0.572SS**PPolyproline II helixtrans-66.5116.1167.748.20000108.4L827 D831L827-T829 PolarHBondContact O-N 3.04Å; T829-D831 WeakPolarHBondContact CB-OD2 3.46Å; T829-D831 PolarHBondContact O-N 3.01Å; T829-D831 PolarHBondContact OG1-OD2 2.96Å
830N30.3Very low49Very low152.75 Ų152.75110.6 Ų110.682%0.81759%0.586SS**  trans-73.675.3173.4-75.2-14.8000109.4P828 E832P828-N830 PolarHBondContact O-N 3.16Å; P828-N830 VanDerWaalsContact O-N 3.09Å; N830-E832 VanDerWaalsContact C-N 3.33Å; N830-E832 PolarHBondContact O-N 2.92Å
831D30.2Very low46.6Very low133 Ų133119 Ų11971%0.71163%0.625SS**  trans-97.288.8172.8-77.4-48.7000109.6T829 S833T829-D831 WeakPolarHBondContact CB-OD2 3.46Å; T829-D831 PolarHBondContact O-N 3.01Å; T829-D831 PolarHBondContact OG1-OD2 2.96Å; D831-S833 PolarHBondContact O-N 3.43Å; D831-S833 PolarHBondContact O-OG 3.18Å; D831-S833 VanDerWaalsContact O-OG 3.07Å
832E33.1Very low43.9Very low193.5 Ų193.5126 Ų12690%0.90466%0.662SS**SBendtrans-69.686169.7-69-163.3170.500112.4N830N830-E832 VanDerWaalsContact C-N 3.33Å; N830-E832 PolarHBondContact O-N 2.92Å
833S31Very low41.8Very low95.5 Ų95.5132.4 Ų132.467%0.66869%0.693SS**  trans-146.297.4160.160.40000113D831 N835D831-S833 PolarHBondContact O-N 3.43Å; D831-S833 PolarHBondContact O-OG 3.18Å; D831-S833 VanDerWaalsContact O-OG 3.07Å; S833-N835 PolarHBondContact O-N 3.03Å; S833-N835 PolarHBondContact O-ND2 3.45Å
834D33.4Very low39.7Very low162.75 Ų162.75139.2 Ų139.287%0.8772%0.715SS**  trans-159.595.6154.7-84.2-23000111D836D834-D836 PolarHBondContact O-N 3.32Å
835N31.1Very low37.8Very low166 Ų166142.7 Ų142.789%0.88874%0.736SS**  trans-130.284.7168.4-95.6-67.1000109.1S833 Y837S833-N835 PolarHBondContact O-N 3.03Å; S833-N835 PolarHBondContact O-ND2 3.45Å; N835-Y837 PolarHBondContact O-N 3.14Å
836D35.1Very low36Very low148 Ų148146.7 Ų146.779%0.79176%0.758SS**  trans-114.7136.4158.6-124.3-17.1000111.6D834 L838D834-D836 PolarHBondContact O-N 3.32Å; D836-L838 PolarHBondContact O-N 2.85Å
837Y34.5Very low34.7Very low213.5 Ų213.5147.2 Ų147.284%0.83777%0.767SS**  trans21.8128.1169.2-84.3-83.2000117.9N835N835-Y837 PolarHBondContact O-N 3.14Å
838L33.4Very low33.5Very low160.75 Ų160.75149.6 Ų149.684%0.84278%0.779SS**  trans-75.9130.5163.4-79160.3000113.7D836D836-L838 PolarHBondContact O-N 2.85Å
839T33.3Very low33.1Very low115 Ų115148 Ų14871%0.70678%0.782SS**  trans-153.5135.1138.2-12.30000113.2
840D31.6Very low32.5Very low134 Ų134151.1 Ų151.172%0.71779%0.789SS**  trans0.6128.7157.5-52.2-49.5000117.3
841Q35.4Very low32.4Very low182 Ų182150.6 Ų150.685%0.8579%0.786SS**  172.8124.8128.7-100.4157.247.500115.1
842D29.4Very low32.3Very low148.25 Ų148.25151 Ų15179%0.79379%0.793SS**  trans-62.9151.9165-51.8-72.3000116.5
843E34.8Very low32Very low181.5 Ų181.5146.5 Ų146.585%0.84879%0.789SS**  trans139.9136.6135.7-94.8-175.4161.700117.7
844Y33.3Very low31.9Very low215.5 Ų215.5146.9 Ų146.985%0.84579%0.792SS**  trans-5.4140.2167.2-83.7-100.9000117.4
845D33.2Very low31.6Very low143.75 Ų143.75148.5 Ų148.577%0.76980%0.795SS**  -169.9136105.2-159.613.4000113.4S948D845-S948 PolarHBondContact O-OG 3.45Å
846D31.2Very low31.6Very low123.25 Ų123.25144.5 Ų144.566%0.65978%0.784SS**  trans-127.2136.5160.8-166.219.3000112.6F946 T947 S948D846-F946 HydrophobicContact CB-CD1 3.65Å; D846-F946 HydrophobicContact CB-CE1 4.25Å; D846-F946 WeakPolarHBondContact OD2-CD1 3.16Å; D846-T947 WeakPolarHBondContact OD2-CB 3.35Å; D846-T947 PolarHBondContact OD2-OG1 3.49Å; D846-S948 VanDerWaalsContact OD1-CB 3.26Å; D846-S948 WeakPolarHBondContact OD1-CB 3.41Å
847S34.7Very low31.2Very low82.5 Ų82.5143.8 Ų143.858%0.57778%0.781SS**  trans169.7117.2157.6-150.40000116.6
848L31.4Very low31Very low168.5 Ų168.5144.7 Ų144.788%0.88278%0.783SS**  trans65.4117.2141-65.9161.7000119.8
849G31.4Very low30.8Very low72.5 Ų72.5144.6 Ų144.675%0.74778%0.782SS**  147.877.6117.300000116.8N851G849-N851 PolarHBondContact O-N 3.22Å
850Q30.9Very low30.6Very low180.25 Ų180.25146.1 Ų146.184%0.84279%0.786SS**  trans-5.6132160.1-69.9177.4-15.600117.7
851N27.3Very low30.5Very low143.5 Ų143.5148.1 Ų148.177%0.76779%0.791SS**  trans90.3106.2150.3-64.3-28.7000117.2G849G849-N851 PolarHBondContact O-N 3.22Å
852T28Very low30.2Very low140.25 Ų140.25145.9 Ų145.986%0.8679%0.785SS**  -157.813298.545.50000113
853A27.7Very low30.2Very low98.25 Ų98.25142.2 Ų142.281%0.81278%0.781SS**  trans-120.4126.916500000114.3E855A853-E855 PolarHBondContact O-N 3.18Å
854S28.7Very low29.9Very low104.75 Ų104.75140.6 Ų140.673%0.73378%0.777SS**  trans-85.8134.1152.155.80000113.6A856S854-A856 PolarHBondContact O-N 3.1Å
855E28.2Very low29.6Very low197.25 Ų197.25137.5 Ų137.592%0.92278%0.775SS**  trans-67.679.5173.8-118.6174.2157.800112.9A853A853-E855 PolarHBondContact O-N 3.18Å
856A29.3Very low29.3Very low80.5 Ų80.5135.3 Ų135.367%0.66577%0.77SS**  trans-14376.8161.600000112.1S854 W858S854-A856 PolarHBondContact O-N 3.1Å; A856-W858 VanDerWaalsContact C-N 3.31Å; A856-W858 PolarHBondContact O-N 2.68Å
857D28Very low29Very low134.5 Ų134.5137.8 Ų137.872%0.71978%0.778SS**  trans-128.5107.6177.7-95.5-29.7000112.8L859 N860 E861D857-L859 PolarHBondContact O-N 3.48Å; D857-L859 VanDerWaalsContact O-N 3.14Å; D857-N860 PolarHBondContact O-N 2.95Å; D857-E861 PolarHBondContact O-N 2.9Å
858W29.6Very low28.7Very low232.25 Ų232.25140.3 Ų140.388%0.8879%0.785SS**  trans11.161.7168.3-86.283.5000116.9A856 N862A856-W858 VanDerWaalsContact C-N 3.31Å; A856-W858 PolarHBondContact O-N 2.68Å; W858-N862 PolarHBondContact O-ND2 3.28Å
859L29.4Very low28.6Very low158 Ų158138.7 Ų138.783%0.82778%0.782SS**  trans-11260.6167.7-66.1172.6000113.6D857D857-L859 PolarHBondContact O-N 3.48Å; D857-L859 VanDerWaalsContact O-N 3.14Å
860N30Very low28.4Very low147.25 Ų147.25141.2 Ų141.279%0.78778%0.783SS**  trans-13069.1150.9-134.711.3000114.6D857 N862D857-N860 PolarHBondContact O-N 2.95Å; N860-N862 PolarHBondContact O-N 3.01Å; N860-N862 VanDerWaalsContact O-N 3.16Å
861E29.1Very low28.5Very low175.75 Ų175.75138.1 Ų138.182%0.82178%0.778SS**  trans-115.7114156.7-110.5-166.1157.100110.6D857D857-E861 PolarHBondContact O-N 2.9Å
862N29.6Very low28.5Very low135.75 Ų135.75140 Ų14073%0.72678%0.782SS**  trans-126.598.1-178.4-77.1-55.3000112.2W858 N860 I864W858-N862 PolarHBondContact O-ND2 3.28Å; N860-N862 PolarHBondContact O-N 3.01Å; N860-N862 VanDerWaalsContact O-N 3.16Å; N862-I864 PolarHBondContact O-N 2.77Å
863G27.7Very low28.5Very low69.5 Ų69.5138.9 Ų138.972%0.71677%0.771SS**  trans-102.9127.4157.400000113.2
864I28.6Very low28.7Very low149.5 Ų149.5144.2 Ų144.277%0.76777%0.77SS**  trans-123.5120.3166.5-71.4177000111.2N862N862-I864 PolarHBondContact O-N 2.77Å
865L27Very low28.7Very low150 Ų150146.3 Ų146.379%0.78577%0.772SS**  trans-10.8124.1159.4-60.2171.8000117.6
866S26.8Very low28.7Very low97 Ų97146.5 Ų146.568%0.67877%0.765SS**  145.7118.8104.2132.40000113.9N868S866-N868 PolarHBondContact O-N 3.21Å
867E26.4Very low28.8Very low176.25 Ų176.25148.2 Ų148.282%0.82476%0.762SS**  trans153.6104.1148.9-121.1172.1163.600115.5
868N27.9Very low29Very low134 Ų134150.3 Ų150.372%0.71777%0.768SS**  trans-23.1122.2150.7-69.5-41.3000115.8S866 V870S866-N868 PolarHBondContact O-N 3.21Å; N868-V870 PolarHBondContact O-N 3.09Å
869V29.2Very low29Very low135.25 Ų135.25147.3 Ų147.382%0.8276%0.764SS**  trans-113.1118.1146169.40000111.9P871V869-P871 HydrophobicContact CG1-CG 4.38Å; V869-P871 WeakPolarHBondContact O-CD 3.4Å
870V27.7Very low29Very low126.25 Ų126.25144.4 Ų144.477%0.76576%0.757SS**  trans-83134.2165.7179.80000109.8N868N868-V870 PolarHBondContact O-N 3.09Å
871P33.3Very low29Very low114.25 Ų114.25143.8 Ų143.874%0.74275%0.753SS**  trans-114.1151.4132.715.63.7000113.1V869V869-P871 HydrophobicContact CG1-CG 4.38Å; V869-P871 WeakPolarHBondContact O-CD 3.4Å
872E27.1Very low29Very low183.25 Ų183.25141.9 Ų141.986%0.85675%0.747SS**  trans-60.1151.7168.8-64.8-176.8125.700114.4
873D27.7Very low29Very low117.75 Ų117.75144.5 Ų144.563%0.6375%0.752SS**  171.8142.7129.9-115.6-15.5000113.2
874R30.5Very low29.1Very low209.5 Ų209.5148 Ų14879%0.79175%0.754SS**  trans142.5118.8151.4-76.1178.2-166.7176.515.1114.2
875L28.9Very low29.2Very low148.75 Ų148.75149.1 Ų149.178%0.77976%0.756SS**  48.5129.189-71.8172.7000114.6
876R28Very low29.3Very low202 Ų202147.9 Ų147.976%0.76275%0.751SS**  177.6161.6111.6-97.8177.1166.4-165.8-2.8115
877D31.4Very low29.5Very low115.75 Ų115.75147.4 Ų147.462%0.61975%0.747SS**  118.1130.6116.5-69.1-29000113.5
878E32.3Very low29.7Very low178.5 Ų178.5149.3 Ų149.383%0.83475%0.747SS**  129.314890.7-97.5-171-169.300114.1
879E31.5Very low29.9Very low169.75 Ų169.75148.3 Ų148.379%0.79375%0.745SS**  trans-142.6143.2-145-96.8173.2166.500112.5
880S28Very low30.2Very low97.25 Ų97.25148.4 Ų148.468%0.6874%0.741SS**  121.3152.5124.763.50000117.5
881D30.8Very low30.5Very low133.75 Ų133.75150.4 Ų150.472%0.71574%0.742SS**  -166.4134.3121.8-73.3-44.2000116.1
882I29.7Very low30.7Very low136 Ų136152 Ų15270%0.69774%0.744SS**  117.9130.6105-84165.1000114.9
883F29Very low31Very low189.5 Ų189.5150.1 Ų150.183%0.83174%0.74SS**  trans-148.8142.2139.2-105.4-74.5000114
884L30.6Very low31.4Very low143.75 Ų143.75152.4 Ų152.475%0.75375%0.747SS**  trans-138.1156.9167.7-83.8161.3000111.4
885E29.5Very low31.4Very low172.25 Ų172.25148.6 Ų148.681%0.80574%0.742SS**  169.3157.5121.5-91.3-178.8177.300113.3
886D30.2Very low31.5Very low125.5 Ų125.5147.2 Ų147.267%0.67174%0.74SS**  cis-152.3137.1-9.1-160.65.8000108.1R888D886-R888 IonicContact OD2-CZ 3.69Å; D886-R888 IonicContact OD2-NE 3.01Å; D886-R888 IonicContact OD2-NH2 3.82Å; D886-R888 PolarHBondContact OD2-NH2 3.39Å
887S30.4Very low31.7Very low86.5 Ų86.5143.6 Ų143.661%0.60574%0.736SS**  trans89.5111.6146.32.80000116.2
888R30.8Very low31.6Very low215.75 Ų215.75148.8 Ų148.881%0.81475%0.747SS**  88137.287.2-78.6177.4-162.6-174.12114.9D886D886-R888 IonicContact OD2-CZ 3.69Å; D886-R888 IonicContact OD2-NE 3.01Å; D886-R888 IonicContact OD2-NH2 3.82Å; D886-R888 PolarHBondContact OD2-NH2 3.39Å
889V31.5Very low31.6Very low113 Ų113147.6 Ų147.669%0.68575%0.746SS**  98.7120.7107.51670000113
890D35.1Very low31.9Very low136.5 Ų136.5145.2 Ų145.273%0.7375%0.745SS**  138.5143123.7-72.1-12.3000113.6
891E34.7Very low32Very low168.25 Ų168.25144.9 Ų144.979%0.78675%0.749SS**  -106.6162.271.2-75.5154.5174.100113.6
892D36.5Very low32.5Very low148 Ų148144 Ų14479%0.79175%0.75SS**  146.1125.4115.4-93.5-7000116.8
893D34.6Very low32.6Very low144.25 Ų144.25144.7 Ų144.777%0.77175%0.754SS**  trans13144.7149.1-96.3-20.7000117.5
894E35.5Very low32.5Very low166.5 Ų166.5141.7 Ų141.778%0.77875%0.747SS**  -156.4154.6124.2-88.9-149.5162.900115.4
895N30.6Very low32.5Very low128.75 Ų128.75141.4 Ų141.469%0.68975%0.746SS**  trans-93.2156.6151.7-84.5-55.3000115.6
896V31.4Very low32.4Very low120.25 Ų120.25140.5 Ų140.573%0.72974%0.741SS**  100.1114.4118.7177.50000117.3
897D31.1Very low32.3Very low126.75 Ų126.75142.6 Ų142.668%0.67875%0.745SS**  78.3145.3121.2-122.7-11.9000121.1
898R31.3Very low32.3Very low224 Ų224145.1 Ų145.185%0.84575%0.751SS**  trans154.3116.9158.9-81.7169.2-165.4-165-3119.2
899N30.8Very low32.1Very low154 Ų154139.3 Ų139.382%0.82474%0.743SS**  trans-13154.3136-87.2-16.5000117.2
900P38.7Very low31.9Very low118 Ų118140.3 Ų140.377%0.76675%0.745SS**  trans-129.1178.4151.840.5-24.7000115.4
901A30Very low31.6Very low92.25 Ų92.25142 Ų14276%0.76275%0.748SS**  trans-177.9179.6153.200000112.8
902P40.5Very low31.3Very low114 Ų114141.2 Ų141.274%0.7475%0.749SS**  -128.4-177.5-88.735.8-17.4000113.9
903I31.4Very low30.8Very low150.5 Ų150.5142.3 Ų142.377%0.77275%0.749SS**  trans174.8126.3148.1-79.2163.6000114
904D27.2Very low30.5Very low127.75 Ų127.75145.6 Ų145.668%0.68375%0.753SS**  trans23.6137.7153.8-56.7-33.3000121.8
905N30.1Very low30Very low137 Ų137145.3 Ų145.373%0.73375%0.753SS**  -174.1145.683.2-96.8-55.1000114.9
906Q29.1Very low30Very low153.5 Ų153.5145.6 Ų145.672%0.71776%0.76SS**  trans-129.4154.6140-74.2169.2-5.100114.4
907F27.6Very low29.9Very low169.25 Ų169.25148.7 Ų148.774%0.74277%0.766SS**  167.6121.3114.8-93.5-88.2000111.3
908L29.1Very low29.6Very low138.75 Ų138.75146.3 Ų146.373%0.72677%0.772SS**  66.812696.3-62173000115.2D910L908-D910 WeakPolarHBondContact CD2-OD2 3.49Å
909S26.6Very low29.4Very low94.5 Ų94.5139.2 Ų139.266%0.66177%0.768SS**  cis-151.3162.226.847.30000113.4
910D29Very low29.4Very low133.25 Ų133.25140.9 Ų140.971%0.71377%0.771SS**  164.8130.2115-70.6-19.2000112.5L908L908-D910 WeakPolarHBondContact CD2-OD2 3.49Å
911E28.3Very low29Very low172.5 Ų172.5142.6 Ų142.681%0.80677%0.774SS**  129137.6116.6-83.9-171.9-177.500114.1
912N28.7Very low29Very low150.75 Ų150.75145.8 Ų145.881%0.80678%0.778SS**  trans-169.9124.5140.5-80.9-54.7000112.9
913E25.2Very low28.6Very low170.75 Ų170.75146.5 Ų146.580%0.79878%0.775SS**  trans-106140.2174.1-157.9174.3-170.100109.4
914Y28Very low28.6Very low215.5 Ų215.5145.3 Ų145.385%0.84578%0.775SS**  trans-129127.4161.8-120.3-102.6000114.1V916Y914-V916 PolarHBondContact O-N 3.23Å
915M25.3Very low28.9Very low158.25 Ų158.25144.6 Ų144.678%0.7878%0.775SS**  trans-40.8136.1175-59.3-80.6-167.700113.9
916V30Very low29Very low137 Ų137145.4 Ų145.483%0.8378%0.779SS**  -126.1128129.3175.50000106.4Y914 G918Y914-V916 PolarHBondContact O-N 3.23Å; V916-G918 PolarHBondContact O-N 2.84Å
917E29.1Very low29.2Very low183.5 Ų183.5142.9 Ų142.986%0.85777%0.771SS**  trans-91.4154.2-173-79.8169.5159.400109.7G919E917-G919 PolarHBondContact O-N 3.01Å
918G26Very low29.4Very low77.5 Ų77.5141.9 Ų141.980%0.79977%0.768SS**  trans-110.3117.716100000114.4V916V916-G918 PolarHBondContact O-N 2.84Å
919G27.4Very low29.7Very low73.75 Ų73.75139.1 Ų139.176%0.7676%0.757SS**  trans129.3117157.100000113.1E917 D921E917-G919 PolarHBondContact O-N 3.01Å; G919-D921 PolarHBondContact O-N 2.95Å
920E29.8Very low30.1Very low189.75 Ų189.75142 Ų14289%0.88776%0.758SS**  trans-112.9112.4162.2-75.9175.516400108.3
921D31.3Very low30.4Very low154.75 Ų154.75140.1 Ų140.183%0.82876%0.755SS**  trans-13.2114.2157-68.1-34.2000114.8G919 D923G919-D921 PolarHBondContact O-N 2.95Å; D921-D923 VanDerWaalsContact C-N 3.27Å; D921-D923 PolarHBondContact O-N 3.3Å
922D30.1Very low30.6Very low158.5 Ų158.5137.9 Ų137.985%0.84875%0.748SS**  trans-89.9113.8159.4-110.5-27.1000111.1T924D922-T924 VanDerWaalsContact C-N 3.25Å; D922-T924 PolarHBondContact O-N 2.82Å
923D30.9Very low30.9Very low129.5 Ų129.5136.4 Ų136.469%0.69374%0.74SS**  trans-75.2107.9163.3-16114000113.4D921 T925D921-D923 VanDerWaalsContact C-N 3.27Å; D921-D923 PolarHBondContact O-N 3.3Å; D923-T925 PolarHBondContact O-N 2.93Å; D923-T925 WeakPolarHBondContact OD1-CG2 3.41Å
924T31.6Very low31.1Very low124.25 Ų124.25132.4 Ų132.476%0.76273%0.73SS**  trans-104.389.1163.544.30000112.4D922 L926D922-T924 VanDerWaalsContact C-N 3.25Å; D922-T924 PolarHBondContact O-N 2.82Å; T924-L926 PolarHBondContact O-N 3.11Å
925T33.3Very low31.1Very low113.25 Ų113.25132.7 Ų132.770%0.69573%0.732SS**  trans-63.5107.7165.8520000112.6D923 D927D923-T925 PolarHBondContact O-N 2.93Å; D923-T925 WeakPolarHBondContact OD1-CG2 3.41Å; T925-D927 PolarHBondContact O-N 3.47Å
926L31.9Very low31.2Very low154.75 Ų154.75130.2 Ų130.281%0.8173%0.729SS**  trans-46.9120.4160.3-137.2103.5000111.8T924 E928T924-L926 PolarHBondContact O-N 3.11Å; L926-E928 HydrophobicContact CB-CG 4.31Å; L926-E928 HydrophobicContact CD2-CG 3.87Å; L926-E928 WeakPolarHBondContact CD2-OE1 3.38Å; L926-E928 HydrophobicContact CG-CG 4.01Å; L926-E928 PolarHBondContact O-N 2.98Å
927D34.2Very low31.1Very low100.75 Ų100.75127.8 Ų127.854%0.53972%0.724SS.*  trans-104.398.3168.2-168.25.7000111.4T925 T929 K930T925-D927 PolarHBondContact O-N 3.47Å; D927-T929 VanDerWaalsContact C-N 3.25Å; D927-T929 VanDerWaalsContact CG-OG1 3.26Å; D927-T929 PolarHBondContact O-N 3.15Å; D927-T929 WeakPolarHBondContact OD1-CB 3.28Å; D927-T929 WeakPolarHBondContact OD1-CG2 3.36Å; D927-T929 PolarHBondContact OD1-N 3.38Å; D927-T929 PolarHBondContact OD1-OG1 3.17Å; D927-T929 PolarHBondContact OD2-OG1 3.47Å; D927-K930 PolarHBondContact O-N 3.25Å; D927-K930 WeakPolarHBondContact OD2-CD 3.44Å; D927-K930 WeakPolarHBondContact OD2-CE 3.37Å; D927-K930 IonicContact OD2-NZ 2.7Å; D927-K930 PolarHBondContact OD2-NZ 3.1Å
928E32.1Very low31.1Very low148 Ų148126 Ų12669%0.69272%0.72SS**G310 helixtrans-72.4-20.4-170.8-63-170.4145.600114.6L926 K930 S931L926-E928 HydrophobicContact CB-CG 4.31Å; L926-E928 HydrophobicContact CD2-CG 3.87Å; L926-E928 WeakPolarHBondContact CD2-OE1 3.38Å; L926-E928 HydrophobicContact CG-CG 4.01Å; L926-E928 PolarHBondContact O-N 2.98Å; E928-K930 VanDerWaalsContact C-N 3.26Å; E928-K930 PolarHBondContact O-N 3.15Å; E928-K930 VanDerWaalsContact O-N 3.13Å; E928-S931 WeakPolarHBondContact O-CB 3.32Å; E928-S931 PolarHBondContact O-N 3.27Å; E928-S931 PolarHBondContact O-OG 3.06Å
929T35.3Very low31.4Very low80.5 Ų80.5128.6 Ų128.649%0.49472%0.716SS.*G310 helixtrans-46-2.8178.565.90000115.2D927 S931 L932D927-T929 VanDerWaalsContact C-N 3.25Å; D927-T929 VanDerWaalsContact CG-OG1 3.26Å; D927-T929 PolarHBondContact O-N 3.15Å; D927-T929 WeakPolarHBondContact OD1-CB 3.28Å; D927-T929 WeakPolarHBondContact OD1-CG2 3.36Å; D927-T929 PolarHBondContact OD1-N 3.38Å; D927-T929 PolarHBondContact OD1-OG1 3.17Å; D927-T929 PolarHBondContact OD2-OG1 3.47Å; T929-S931 VanDerWaalsContact C-N 3.31Å; T929-L932 PolarHBondContact O-N 3.15Å
930K34.6Very low31.6Very low155.25 Ų155.25132.9 Ų132.968%0.67571%0.714SS**G310 helixtrans-82.7-26.9168.2-79.6176-177.7156.60112.7L687 D927 E928 L932 L933 S934L687-K930 HydrophobicContact CD2-CG 4.5Å; D927-K930 PolarHBondContact O-N 3.25Å; D927-K930 WeakPolarHBondContact OD2-CD 3.44Å; D927-K930 WeakPolarHBondContact OD2-CE 3.37Å; D927-K930 IonicContact OD2-NZ 2.7Å; D927-K930 PolarHBondContact OD2-NZ 3.1Å; E928-K930 VanDerWaalsContact C-N 3.26Å; E928-K930 PolarHBondContact O-N 3.15Å; E928-K930 VanDerWaalsContact O-N 3.13Å; K930-L932 VanDerWaalsContact C-N 3.33Å; K930-L932 PolarHBondContact O-N 3.31Å; K930-L933 PolarHBondContact O-N 3.44Å; K930-S934 PolarHBondContact O-N 3.06Å; K930-S934 PolarHBondContact O-OG 2.91Å
931S34.3Very low31.5Very low93.25 Ų93.25130.9 Ų130.965%0.65271%0.709SS**Hα-helixtrans-65.2-2.3179.31710000115E928 T929 L933 S934E928-S931 WeakPolarHBondContact O-CB 3.32Å; E928-S931 PolarHBondContact O-N 3.27Å; E928-S931 PolarHBondContact O-OG 3.06Å; T929-S931 VanDerWaalsContact C-N 3.31Å; S931-L933 PolarHBondContact O-N 3.32Å; S931-S934 PolarHBondContact O-N 3.42Å; S931-S934 PolarHBondContact O-OG 2.89Å
932L34.2Very low31.4Very low126.75 Ų126.75129.6 Ų129.666%0.66471%0.706SS**Hα-helixtrans-98.10.4171.7-68.3178.7000113.2E736 T740 Q790 T929 K930E736-L932 HydrophobicContact CG-CD1 4.38Å; T740-L932 HydrophobicContact CG2-CD1 4.45Å; Q790-L932 PolarHBondContact NE2-O 3.36Å; T929-L932 PolarHBondContact O-N 3.15Å; K930-L932 VanDerWaalsContact C-N 3.33Å; K930-L932 PolarHBondContact O-N 3.31Å
933L34.2Very low31.3Very low119.5 Ų119.5127 Ų12763%0.62670%0.701SS**THydrogen-bonded Turntrans-123.525.1179.4-61.5177.8000114.5E676 L687 Y733 W794 K930 S931 Y935E676-L933 HydrophobicContact CB-CD2 4.15Å; L687-L933 HydrophobicContact CD1-CD1 4.32Å; Y733-L933 HydrophobicContact CD1-CD1 4.09Å; Y733-L933 HydrophobicContact CE1-CD1 3.57Å; Y733-L933 HydrophobicContact CE2-CD1 4.4Å; W794-L933 HydrophobicContact CH2-CD2 4.47Å; W794-L933 HydrophobicContact CZ2-CD2 4.4Å; K930-L933 PolarHBondContact O-N 3.44Å; S931-L933 PolarHBondContact O-N 3.32Å; L933-Y935 PolarHBondContact O-N 2.95Å
934S28.4Very low31.1Very low85.5 Ų85.5130.2 Ų130.260%0.59871%0.709SS**  trans-123.5111.1168.363.50000111.8K930 S931 S936K930-S934 PolarHBondContact O-N 3.06Å; K930-S934 PolarHBondContact O-OG 2.91Å; S931-S934 PolarHBondContact O-N 3.42Å; S931-S934 PolarHBondContact O-OG 2.89Å; S934-S936 VanDerWaalsContact C-N 3.34Å; S934-S936 PolarHBondContact O-N 3.26Å
935Y29Very low31.1Very low223.25 Ų223.25129.3 Ų129.388%0.87571%0.705SS**  trans-76.4115.8168.8-116.7-86.6000111.6L933 A937L933-Y935 PolarHBondContact O-N 2.95Å; Y935-A937 PolarHBondContact O-N 3.15Å
936S28.3Very low30.8Very low105 Ų105132.5 Ų132.573%0.73471%0.71SS**  trans-88.3132.7175.9-147.40000111.2S934 D938S934-S936 VanDerWaalsContact C-N 3.34Å; S934-S936 PolarHBondContact O-N 3.26Å; S936-D938 VanDerWaalsContact C-N 3.26Å; S936-D938 PolarHBondContact O-N 3.32Å
937A27.3Very low30.6Very low87 Ų87130.6 Ų130.672%0.71971%0.705SS**  trans-84.4117.8171.700000110.8Y935 D939Y935-A937 PolarHBondContact O-N 3.15Å; A937-D939 PolarHBondContact O-N 2.88Å
938D29.3Very low30.2Very low146 Ų146129.9 Ų129.978%0.78171%0.708SS**  trans-136116.3162.5-106.7-10000108.6S936 K940S936-D938 VanDerWaalsContact C-N 3.26Å; S936-D938 PolarHBondContact O-N 3.32Å; D938-K940 WeakPolarHBondContact OD2-CE 3.34Å; D938-K940 IonicContact OD2-NZ 3.91Å; D938-K940 PolarHBondContact OD2-NZ 3.45Å
939D31.2Very low29.9Very low130.5 Ų130.5129.6 Ų129.670%0.69871%0.711SS**  -127.5145.184.4-143.4-9.7000111.2A937A937-D939 PolarHBondContact O-N 2.88Å
940K31.3Very low29.6Very low165.5 Ų165.5131.9 Ų131.972%0.7273%0.725SS**  trans66.3117.7163.3-79.6163.3-169.4118.70115.9D938D938-K940 WeakPolarHBondContact OD2-CE 3.34Å; D938-K940 IonicContact OD2-NZ 3.91Å; D938-K940 PolarHBondContact OD2-NZ 3.45Å
941N28.2Very low29.2Very low147.5 Ų147.5129.3 Ų129.379%0.78973%0.726SS**  trans142.4137.6137.4-87.6-28.9000116.6
942T28.8Very low28.9Very low126.25 Ų126.25136.1 Ų136.178%0.77574%0.738SS**  -104.5141.6124.45.10000114.3
943S27.6Very low28.5Very low105 Ų105139.7 Ų139.773%0.73475%0.748SS**  trans-113.6151.5143.951.10000114.2
944K28Very low28.1Very low197.25 Ų197.25138.4 Ų138.486%0.85876%0.755SS**  trans-147.7164.1134.5-95.8177.4-179.21800114.3F946K944-F946 PolarHBondContact O-N 3.17Å
945P32.2Very low28Very low105.25 Ų105.25141.5 Ų141.568%0.68376%0.764SS**  trans-114.5-173.2-137.839.9-28.1000114
946F25.6Very low27.9Very low180 Ų180139.3 Ų139.379%0.78976%0.759SS**  trans96.7119.2169.3-78.9-74.6000114.9D846 K944D846-F946 HydrophobicContact CB-CD1 3.65Å; D846-F946 HydrophobicContact CB-CE1 4.25Å; D846-F946 WeakPolarHBondContact OD2-CD1 3.16Å; K944-F946 PolarHBondContact O-N 3.17Å
947T27.3Very low27.8Very low115.25 Ų115.25142.7 Ų142.771%0.70776%0.764SS**  59.714679.8440000112D846 N949D846-T947 WeakPolarHBondContact OD2-CB 3.35Å; D846-T947 PolarHBondContact OD2-OG1 3.49Å; T947-N949 PolarHBondContact O-N 3.21Å
948S27.2Very low27.7Very low86.25 Ų86.25148.4 Ų148.460%0.60377%0.768SS**  cis-142.5165.58.353.40000111.2D845 D846D845-S948 PolarHBondContact O-OG 3.45Å; D846-S948 VanDerWaalsContact OD1-CB 3.26Å; D846-S948 WeakPolarHBondContact OD1-CB 3.41Å
949N26Very low27.6Very low141 Ų141146.8 Ų146.875%0.75477%0.765SS**  trans130.8145.6144.6-86-37.1000113.6T947T947-N949 PolarHBondContact O-N 3.21Å
950T28.4Very low27.3Very low128 Ų128147.1 Ų147.179%0.78577%0.772SS**  -132.414883.5-6.80000115.1R952T950-R952 PolarHBondContact O-N 3.29Å
951S26.3Very low27.1Very low101 Ų101148 Ų14871%0.70678%0.777SS**  trans-69.4122.7151.6-66.80000117.5K953S951-K953 PolarHBondContact O-N 3.39Å
952R28Very low26.9Very low235.75 Ų235.75149.6 Ų149.689%0.8978%0.779SS**  trans103.2123.4137.9-79169.1-174.3-176.61.5116.4T950 A954T950-R952 PolarHBondContact O-N 3.29Å; R952-A954 PolarHBondContact O-N 3.14Å
953K25.1Very low26.8Very low202 Ų202150.2 Ų150.288%0.87878%0.776SS**  trans123.4124.4151.1-70.3176.1175.2-179.50115.9S951 N955S951-K953 PolarHBondContact O-N 3.39Å; K953-N955 PolarHBondContact O-N 3.1Å
954A26.9Very low26.6Very low94 Ų94150.4 Ų150.478%0.77777%0.773SS**  trans122.7123.9144.800000115.9R952R952-A954 PolarHBondContact O-N 3.14Å
955N26.9Very low26.5Very low149 Ų149148.5 Ų148.580%0.79777%0.769SS**  trans-154.3126.9159.2-90.1-24.1000113.6K953K953-N955 PolarHBondContact O-N 3.1Å
956K27Very low26.3Very low176.75 Ų176.75149.1 Ų149.177%0.76877%0.771SS**  trans-99.3114.3155.7-87-179.4173.9-173.60111.2Y958K956-Y958 HydrophobicContact CB-CE2 4.28Å; K956-Y958 HydrophobicContact CD-CD2 4.48Å; K956-Y958 HydrophobicContact CD-CE2 3.71Å; K956-Y958 HydrophobicContact CG-CD2 4.47Å; K956-Y958 HydrophobicContact CG-CE2 3.8Å; K956-Y958 VanDerWaalsContact O-CD2 3.32Å; K956-Y958 WeakPolarHBondContact O-CD2 3.43Å; K956-Y958 PolarHBondContact O-N 3.17Å
957Q25.5Very low26.2Very low178 Ų178148.3 Ų148.383%0.83277%0.77SS**  trans-114116.7148.8-104.5169-42.700109.8P959Q957-P959 WeakPolarHBondContact O-CD 3.45Å
958Y25.3Very low26.2Very low206 Ų206147.4 Ų147.481%0.80877%0.768SS**  trans-69.9125.4154.3-76-80.1000110.3K956 T960K956-Y958 HydrophobicContact CB-CE2 4.28Å; K956-Y958 HydrophobicContact CD-CD2 4.48Å; K956-Y958 HydrophobicContact CD-CE2 3.71Å; K956-Y958 HydrophobicContact CG-CD2 4.47Å; K956-Y958 HydrophobicContact CG-CE2 3.8Å; K956-Y958 VanDerWaalsContact O-CD2 3.32Å; K956-Y958 WeakPolarHBondContact O-CD2 3.43Å; K956-Y958 PolarHBondContact O-N 3.17Å; Y958-T960 PolarHBondContact O-N 3.3Å
959P26.9Very low26.2Very low111.5 Ų111.5153 Ų15372%0.72478%0.778SS**  trans-91.4136.7153.833.3-28.3000111.3Q957 K961Q957-P959 WeakPolarHBondContact O-CD 3.45Å; P959-K961 PolarHBondContact O-N 3.07Å; P959-K961 VanDerWaalsContact O-N 3.13Å
960T24.3Very low26.2Very low137 Ų137153.6 Ų153.684%0.8478%0.779SS**  trans-61.1115.8168-44.90000109.9Y958 Q962Y958-T960 PolarHBondContact O-N 3.3Å; T960-Q962 PolarHBondContact O-N 3.06Å
961K27.4Very low26.2Very low186.25 Ų186.25155.2 Ų155.281%0.8178%0.778SS**  trans-88.4120.8167.1-85.6-171.8173.9-177.90109.5P959 I963P959-K961 PolarHBondContact O-N 3.07Å; P959-K961 VanDerWaalsContact O-N 3.13Å; K961-I963 PolarHBondContact O-N 3.03Å
962Q24.2Very low26.2Very low180 Ų180155.5 Ų155.584%0.84178%0.777SS**  trans-60.8130165.4-75.5171.1-51.200109.6T960T960-Q962 PolarHBondContact O-N 3.06Å
963I27.2Very low26.2Very low138 Ų138151.6 Ų151.671%0.70877%0.774SS**  trans-95.7112.8164-66.8-178.9000106.5K961 M965K961-I963 PolarHBondContact O-N 3.03Å; I963-M965 HydrophobicContact CG2-CE 4.1Å; I963-M965 PolarHBondContact O-N 2.92Å; I963-M965 VanDerWaalsContact O-N 3.14Å
964T23.9Very low26.2Very low110 Ų110149.3 Ų149.368%0.67577%0.771SS**  trans-65.6127.7169.111.50000109.2T966T964-T966 PolarHBondContact O-N 3.11Å; T964-T966 PolarHBondContact O-OG1 3.03Å
965M25.5Very low26.2Very low156.5 Ų156.5149.6 Ų149.677%0.77177%0.768SS**  trans-80.5136.4166.6-84.4-86165.400109.2I963 E967I963-M965 HydrophobicContact CG2-CE 4.1Å; I963-M965 PolarHBondContact O-N 2.92Å; I963-M965 VanDerWaalsContact O-N 3.14Å; M965-E967 PolarHBondContact O-N 2.91Å
966T26.6Very low26.1Very low119.75 Ų119.75151.6 Ų151.674%0.73577%0.77SS**  trans-97.6123.6161-40.60000109.5T964 S968T964-T966 PolarHBondContact O-N 3.11Å; T964-T966 PolarHBondContact O-OG1 3.03Å; T966-S968 PolarHBondContact O-N 3.09Å; T966-S968 VanDerWaalsContact O-N 3.14Å
967E24.5Very low26Very low162.75 Ų162.75148.1 Ų148.176%0.76177%0.767SS**  trans-51.7118.6173-65.5-177.4149.100112.2M965 Y969M965-E967 PolarHBondContact O-N 2.91Å; E967-Y969 HydrophobicContact CB-CD2 3.92Å; E967-Y969 HydrophobicContact CB-CE2 3.55Å; E967-Y969 HydrophobicContact CG-CE2 4.33Å; E967-Y969 PolarHBondContact O-N 3.24Å; E967-Y969 WeakPolarHBondContact OE2-CE2 3.17Å; E967-Y969 PolarHBondContact OE2-OH 2.86Å
968S27.9Very low26.1Very low96.5 Ų96.5145.7 Ų145.768%0.67577%0.765SS**  trans-127.4109.8156.138.30000111.3T966 I970T966-S968 PolarHBondContact O-N 3.09Å; T966-S968 VanDerWaalsContact O-N 3.14Å; S968-I970 PolarHBondContact O-N 3.22Å
969Y25.7Very low26.2Very low202.75 Ų202.75141.8 Ų141.880%0.79576%0.762SS**  trans-12.1109.5158-67.1-79.9000115.1E967E967-Y969 HydrophobicContact CB-CD2 3.92Å; E967-Y969 HydrophobicContact CB-CE2 3.55Å; E967-Y969 HydrophobicContact CG-CE2 4.33Å; E967-Y969 PolarHBondContact O-N 3.24Å; E967-Y969 WeakPolarHBondContact OE2-CE2 3.17Å; E967-Y969 PolarHBondContact OE2-OH 2.86Å
970I27.3Very low26.3Very low153.5 Ų153.5144.1 Ų144.179%0.78776%0.763SS**  trans-112.3116.9140.3-73.6172.6000108.5S968 P972S968-I970 PolarHBondContact O-N 3.22Å; I970-P972 WeakPolarHBondContact O-CD 3.34Å
971H27.5Very low26.4Very low162.25 Ų162.25144 Ų14475%0.75176%0.757SS**  trans-60.6134.8168.7-98.7-93.3000113.6N973H971-N973 PolarHBondContact O-N 3.09Å; H971-N973 VanDerWaalsContact O-N 3.16Å
972P27Very low26.5Very low107.75 Ų107.75138.9 Ų138.970%0.775%0.745SS**  trans-84.2137.1173.733.8-32.5000111.2I970 D974I970-P972 WeakPolarHBondContact O-CD 3.34Å; P972-D974 VanDerWaalsContact C-N 3.33Å; P972-D974 PolarHBondContact O-N 3.09Å
973N26.9Very low26.7Very low153.5 Ų153.5137.2 Ų137.282%0.82174%0.742SS**  trans-116.6111160.3-87.4-10.3000110.4H971 S975H971-N973 PolarHBondContact O-N 3.09Å; H971-N973 VanDerWaalsContact O-N 3.16Å; N973-S975 PolarHBondContact O-N 3.26Å; N973-S975 VanDerWaalsContact O-N 3.12Å
974D26.2Very low26.9Very low153.25 Ų153.25136.9 Ų136.982%0.8274%0.741SS**  trans-101.4126.5150-113-21.1000109.7P972 F976P972-D974 VanDerWaalsContact C-N 3.33Å; P972-D974 PolarHBondContact O-N 3.09Å; D974-F976 PolarHBondContact O-N 2.73Å
975S26.5Very low27.3Very low101 Ų101140.5 Ų140.571%0.70675%0.747SS**  trans-134.1125.6167.453.90000112.5N973 S977N973-S975 PolarHBondContact O-N 3.26Å; N973-S975 VanDerWaalsContact O-N 3.12Å; S975-S977 PolarHBondContact O-N 2.75Å
976F24.8Very low27.4Very low191 Ų191139.5 Ų139.584%0.83875%0.745SS**  trans-6.5107.4162.9-95.5-89.8000114.4D974 V978D974-F976 PolarHBondContact O-N 2.73Å; F976-V978 HydrophobicContact CD1-CG2 4.47Å; F976-V978 PolarHBondContact O-N 3.37Å
977S25.2Very low27.6Very low102.75 Ų102.75142.2 Ų142.272%0.71975%0.75SS**  trans-130.7133.313265.90000110.3S975 T979S975-S977 PolarHBondContact O-N 2.75Å; S977-T979 VanDerWaalsContact C-N 3.31Å; S977-T979 PolarHBondContact O-N 3.4Å
978V27.4Very low27.8Very low127.5 Ų127.5140.9 Ų140.977%0.77375%0.748SS**  trans39.1107.9156.7-1780000110.9F976 H980F976-V978 HydrophobicContact CD1-CG2 4.47Å; F976-V978 PolarHBondContact O-N 3.37Å; V978-H980 VanDerWaalsContact C-N 3.32Å; V978-H980 PolarHBondContact O-N 3.17Å
979T27.5Very low27.8Very low123.25 Ų123.25143.2 Ų143.276%0.75675%0.752SS**  trans-132139.7148.931.80000109.6S977 D981S977-T979 VanDerWaalsContact C-N 3.31Å; S977-T979 PolarHBondContact O-N 3.4Å; T979-D981 VanDerWaalsContact C-N 3.25Å; T979-D981 PolarHBondContact O-N 2.85Å
980H27.9Very low27.9Very low160.5 Ų160.5140.1 Ų140.174%0.74375%0.748SS**  trans-121135.3171.4-125.8-84.5000110.5V978 S982V978-H980 VanDerWaalsContact C-N 3.32Å; V978-H980 PolarHBondContact O-N 3.17Å; H980-S982 PolarHBondContact ND1-OG 3.43Å; H980-S982 VanDerWaalsContact ND1-OG 3.16Å; H980-S982 PolarHBondContact O-N 3.27Å
981D27Very low27.8Very low134.5 Ų134.5140 Ų14072%0.71975%0.749SS**  trans-148.8134.1137.3-123.3-28.9000113.7T979 N983T979-D981 VanDerWaalsContact C-N 3.25Å; T979-D981 PolarHBondContact O-N 2.85Å; D981-N983 PolarHBondContact O-N 2.7Å
982S30.3Very low27.7Very low80 Ų80136.8 Ų136.856%0.55974%0.744SS**  trans23.4131.6141.568.50000115.9H980 L984H980-S982 PolarHBondContact ND1-OG 3.43Å; H980-S982 VanDerWaalsContact ND1-OG 3.16Å; H980-S982 PolarHBondContact O-N 3.27Å; S982-L984 PolarHBondContact O-N 2.89Å
983N28.8Very low27.6Very low143.5 Ų143.5139.2 Ų139.277%0.76775%0.751SS**  52.3129.2126.5-89.7-44.4000114.5D981 K985D981-N983 PolarHBondContact O-N 2.7Å; N983-K985 PolarHBondContact O-N 2.82Å
984L30.3Very low27.7Very low133.25 Ų133.25138.3 Ų138.370%0.69875%0.751SS**  cis-151.1123.945.6-154.572.8000110.1S982 N986S982-L984 PolarHBondContact O-N 2.89Å; L984-N986 PolarHBondContact O-N 3.2Å
985K31.8Very low27.7Very low184 Ų184140.1 Ų140.180%0.875%0.751SS**  trans53.4129.2152.7-81.9164.8-177172.30115.2N983 Q987N983-K985 PolarHBondContact O-N 2.82Å; K985-Q987 PolarHBondContact O-N 2.88Å
986N29Very low27.8Very low135.25 Ų135.25141.3 Ų141.372%0.72376%0.755SS**  trans-78.7124148.4-74.7-18.9000114.4L984 N988L984-N986 PolarHBondContact O-N 3.2Å; N986-N988 VanDerWaalsContact C-N 3.27Å; N986-N988 PolarHBondContact O-N 2.82Å
987Q30.7Very low27.8Very low178.25 Ų178.25139.4 Ų139.483%0.83375%0.754SS**  trans-144.6107.6131.4-92.6178.91400113.4K985 L989K985-Q987 PolarHBondContact O-N 2.88Å; Q987-L989 PolarHBondContact O-N 3.21Å
988N28.1Very low28Very low134.25 Ų134.25143.5 Ų143.572%0.71876%0.761SS**  trans-95.9151.8147.9-88.7-32.4000109.8N986N986-N988 VanDerWaalsContact C-N 3.27Å; N986-N988 PolarHBondContact O-N 2.82Å
989L28.2Very low27.8Very low144.5 Ų144.5141.9 Ų141.976%0.75776%0.756SS**  trans140.4135.8147.3-74.5122.9000113.2Q987Q987-L989 PolarHBondContact O-N 3.21Å
990L27Very low27.8Very low139 Ų139144.7 Ų144.773%0.72876%0.758SS**  127.6137.265.3-81174.4000114.2
991L25.6Very low27.9Very low151.5 Ų151.5144.7 Ų144.779%0.79376%0.758SS**  121.1132.4101.9-100.3149.7000113.3
992S25.3Very low27.8Very low94.75 Ų94.75144.6 Ų144.666%0.66376%0.757SS**  trans121.2131.7146.454.30000116.7V994S992-V994 PolarHBondContact O-N 3.26Å; S992-V994 VanDerWaalsContact O-N 3.08Å
993N24.6Very low27.7Very low157 Ų157149.6 Ų149.684%0.8477%0.769SS**  trans-13.3127153.2-64-21.6000114.1
994V30.2Very low27.5Very low135.5 Ų135.5147.6 Ų147.682%0.82177%0.767SS**  -128.1137.2126.2177.90000109.1S992 T996S992-V994 PolarHBondContact O-N 3.26Å; S992-V994 VanDerWaalsContact O-N 3.08Å; V994-T996 PolarHBondContact O-N 3.4Å
995K25.8Very low27.4Very low190 Ų190148.4 Ų148.483%0.82677%0.77SS**  trans-79.9139.7172.5-72.8-179172-172.90111
996T27.7Very low27.2Very low127.75 Ų127.75145.9 Ų145.978%0.78477%0.765SS**  trans-132.3116.8154360000107.8V994V994-T996 PolarHBondContact O-N 3.4Å
997D24.8Very low27.1Very low150.75 Ų150.75147 Ų14781%0.80677%0.766SS**  24.5110105.7-76.9-34000111.2
998E29.2Very low27Very low187.5 Ų187.5146.5 Ų146.588%0.87676%0.764SS**  trans-132.9135.1146.7-76.9-155.614500110.3
999S24.1Very low26.9Very low94.25 Ų94.25147 Ų14766%0.65977%0.767SS**  trans-115.4139.817160.30000111.5
1000F28.1Very low26.9Very low182.5 Ų182.5144.7 Ų144.780%0.876%0.763SS**  trans-153.1106.4154.6-77.5-72.3000111.9
1001Q28.2Very low26.9Very low161.2 Ų161.2143.7 Ų143.775%0.75376%0.762SS**  87136111.3-79-174.622.200115.2
1002N24.7Very low27.1Very low131 Ų131143.3 Ų143.370%0.70176%0.761SS**  70.5119.7125.8-82.5-34.3000115.7
1003K28.7Very low27.4Very low185.2 Ų185.2147.1 Ų147.181%0.80577%0.769SS**  116.6125124.9-84.6168.4-175.8172.90113.8
1004S24.7Very low27.5Very low103.2 Ų103.2145.8 Ų145.872%0.72276%0.761SS**  86.4132.9108.3-58.30000114.6
1005I28.4Very low27.6Very low150 Ų150146.8 Ų146.877%0.76976%0.762SS**  trans151.9120.8136.8-77.9162.7000112.5
1006N26.7Very low27.8Very low129.6 Ų129.6141.5 Ų141.569%0.69375%0.754SS**  trans54.3135141.6-78.2-3.9000117
1007Q27.8Very low27.9Very low159 Ų159143.4 Ų143.474%0.74375%0.754SS**  105.1133.2105.1-79.6170.325.800113.1
1008Q28.7Very low28.1Very low168 Ų168144 Ų14479%0.78575%0.752SS**  -174.5137.559.8-109.3177.80.900111.2
1009N26.9Very low28Very low145.6 Ų145.6142 Ų14278%0.77975%0.746SS**  trans130146.1157.2-67.6-22.5000112.7
1010S26.8Very low28.2Very low96.2 Ų96.2143 Ų14367%0.67375%0.749SS**  165.314254.262.70000113.2
1011T28.6Very low28.1Very low117 Ų117142.7 Ų142.772%0.71875%0.75SS**  trans57.3137.4157.1580000116
1012D28Very low28Very low144.2 Ų144.2143.5 Ų143.577%0.77175%0.753SS**  cis174.1149.97.1-94.9-32.5000108.8
1013E31.8Very low28.4Very low174.6 Ų174.6142.3 Ų142.382%0.81675%0.753SS**  trans87.4131.2138.2-73.3-163.6154.300116.5
1014N27.8Very low28.3Very low129 Ų129141.5 Ų141.569%0.6975%0.752SS**  96.6136.6112-67.1-41.4000115.2
1015D31.2Very low28.4Very low155.6 Ų155.6142.4 Ų142.483%0.83275%0.749SS**  158.6149.3114.3-103.2-27000116.2
1016A30.4Very low28.4Very low78.6 Ų78.6143.4 Ų143.465%0.6575%0.747SS**  trans68.1126.4150.500000119.1
1017Q29.3Very low28.5Very low169.2 Ų169.2143.8 Ų143.879%0.79175%0.75SS**  trans40.8144.2144-68.11681600114.9
1018Q30.6Very low28.6Very low162.8 Ų162.8142.2 Ų142.276%0.76175%0.751SS**  -168.7141.188.8-98.4179.427.100113.4
1019L26.7Very low28.5Very low145.8 Ų145.8144.6 Ų144.676%0.76375%0.753SS**  trans-11.4141.6155.3-95.379000115.1
1020T27.1Very low28.6Very low115.4 Ų115.4145.1 Ų145.171%0.70875%0.75SS**  -170.5138.159.9-3.40000113.9
1021Q28Very low28.7Very low176.4 Ų176.4147.5 Ų147.582%0.82476%0.755SS**  trans19.6134.8155.7-76.3162-12.300117.4
1022E25.6Very low28.6Very low176.4 Ų176.4147.6 Ų147.682%0.82476%0.755SS**  24.8163.4123.9-64.7-170.9145.800114.2
1023P33.5Very low28.6Very low107.4 Ų107.4146.2 Ų146.270%0.69775%0.752SS**  cis-127165.6-1.427.9-6.7000114
1024E24.9Very low28.5Very low167.2 Ų167.2145 Ų14578%0.78175%0.751SS**  trans38.6136.1134.5-74.9-163.6156.100116.8
1025N28.4Very low28.5Very low122.8 Ų122.8147.8 Ų147.866%0.65776%0.76SS**  trans162.4128.9136.6-101.8-46.1000115.7
1026K28.4Very low28.3Very low170 Ų170148.5 Ų148.574%0.73976%0.759SS**  trans49.4134.6139.3-73.3169.7-179153.90117.2
1027D27.9Very low28.3Very low138.2 Ų138.2152 Ų15274%0.73977%0.765SS**  -176.8142.890-99.8-31.9000115.7
1028T29.8Very low28.2Very low125.8 Ų125.8153.5 Ų153.577%0.77277%0.769SS**  trans-166.6120.3147.825.40000117.5
1029R27.7Very low28.1Very low218.4 Ų218.4155.1 Ų155.182%0.82477%0.773SS**  trans102.8136.3140.1-83.3178.4146.5141.94.4116
1030E27.7Very low28.1Very low156 Ų156156.9 Ų156.973%0.72978%0.775SS**  115.1138.1109.2-90.5173169.500116
1031L28.4Very low28Very low147 Ų147158.6 Ų158.677%0.7778%0.78SS**  trans59133.1172.7-89.479.6000117.1
1032T26.9Very low27.9Very low118.2 Ų118.2155.5 Ų155.573%0.72578%0.777SS**  97.8123.369.838.60000114.4
1033T27.5Very low28Very low115.2 Ų115.2151.5 Ų151.571%0.70777%0.769SS**  trans165.1122.2143.69.40000113.5Q1035T1033-Q1035 PolarHBondContact O-N 3.01Å
1034D29.6Very low27.9Very low149.2 Ų149.2154.7 Ų154.780%0.79878%0.775SS**  trans173.685.6140.8-71.4-34.3000114.5E1036 I1037D1034-E1036 VanDerWaalsContact C-N 3.34Å; D1034-E1036 PolarHBondContact O-N 3.13Å; D1034-I1037 WeakPolarHBondContact O-CB 3.39Å; D1034-I1037 PolarHBondContact O-N 3.27Å; D1034-I1037 VanDerWaalsContact O-N 3.15Å
1035Q27.9Very low28.2Very low188.2 Ų188.2153.5 Ų153.588%0.87977%0.772SS**  trans-103.559.9170.9-84.7-177.3-6.600112.5T1033 I1037T1033-Q1035 PolarHBondContact O-N 3.01Å; Q1035-I1037 VanDerWaalsContact C-N 3.28Å
1036E28.2Very low28.8Very low169.4 Ų169.4153.5 Ų153.579%0.79277%0.772SS**SBendtrans-115.368.8163.9-83.5-173161.600113D1034 K1038 K1039 K1040D1034-E1036 VanDerWaalsContact C-N 3.34Å; D1034-E1036 PolarHBondContact O-N 3.13Å; E1036-K1038 VanDerWaalsContact C-N 3.35Å; E1036-K1038 PolarHBondContact O-N 3.11Å; E1036-K1039 PolarHBondContact O-N 3.4Å; E1036-K1040 HydrophobicContact CB-CD 4.12Å; E1036-K1040 VanDerWaalsContact O-CB 3.31Å; E1036-K1040 WeakPolarHBondContact O-CB 3.38Å; E1036-K1040 WeakPolarHBondContact O-CG 3.41Å; E1036-K1040 PolarHBondContact O-N 3.25Å; E1036-K1040 IonicContact OE1-NZ 3.25Å; E1036-K1040 PolarHBondContact OE1-NZ 3.49Å; E1036-K1040 VanDerWaalsContact OE1-NZ 3.13Å; E1036-K1040 IonicContact OE2-NZ 2.62Å; E1036-K1040 PolarHBondContact OE2-NZ 3.48Å
1037I30.5Very low30.2Very low152.2 Ų152.2153.4 Ų153.478%0.78177%0.774SS**SBendtrans-142.526.1179.2-55169.6000113.8D1034 Q1035 N1041D1034-I1037 WeakPolarHBondContact O-CB 3.39Å; D1034-I1037 PolarHBondContact O-N 3.27Å; D1034-I1037 VanDerWaalsContact O-N 3.15Å; Q1035-I1037 VanDerWaalsContact C-N 3.28Å; I1037-N1041 VanDerWaalsContact O-CG 3.24Å; I1037-N1041 PolarHBondContact O-OD1 2.86Å
1038K27.5Very low32Very low201.8 Ų201.8152.6 Ų152.688%0.87776%0.762SS**  trans-129.841.7166.9-90.7-174.6179.1-179.60114.3E1036E1036-K1038 VanDerWaalsContact C-N 3.35Å; E1036-K1038 PolarHBondContact O-N 3.11Å
1039K27.7Very low34.2Very low196.4 Ų196.4150.4 Ų150.485%0.85474%0.739SS**SBendtrans-137.342.8166.1-96.4-174.9178.7-177.90112.8E1036 N1041 S1043E1036-K1039 PolarHBondContact O-N 3.4Å; K1039-N1041 VanDerWaalsContact C-N 3.26Å; K1039-N1041 PolarHBondContact O-N 3.3Å; K1039-S1043 PolarHBondContact O-N 3.48Å; K1039-S1043 PolarHBondContact O-OG 2.65Å
1040K26.7Very low36.8Very low183.4 Ų183.4141.3 Ų141.380%0.79771%0.706SS**SBendtrans-120.924.8167.3-101.8-178.7-179.9179.50112.9E1036 S1042 S1043 Q1044E1036-K1040 HydrophobicContact CB-CD 4.12Å; E1036-K1040 VanDerWaalsContact O-CB 3.31Å; E1036-K1040 WeakPolarHBondContact O-CB 3.38Å; E1036-K1040 WeakPolarHBondContact O-CG 3.41Å; E1036-K1040 PolarHBondContact O-N 3.25Å; E1036-K1040 IonicContact OE1-NZ 3.25Å; E1036-K1040 PolarHBondContact OE1-NZ 3.49Å; E1036-K1040 VanDerWaalsContact OE1-NZ 3.13Å; E1036-K1040 IonicContact OE2-NZ 2.62Å; E1036-K1040 PolarHBondContact OE2-NZ 3.48Å; K1040-S1042 PolarHBondContact O-N 3.48Å; K1040-S1043 WeakPolarHBondContact CA-OG 3.48Å; K1040-S1043 CarbonylContact O-C 3.6Å; K1040-Q1044 PolarHBondContact O-N 3.25Å
1041N25.1Very low39.3Very low151.6 Ų151.6134 Ų13481%0.81167%0.672SS**  trans-113.547.9171-80.14.7000110I1037 K1039 S1043I1037-N1041 VanDerWaalsContact O-CG 3.24Å; I1037-N1041 PolarHBondContact O-OD1 2.86Å; K1039-N1041 VanDerWaalsContact C-N 3.26Å; K1039-N1041 PolarHBondContact O-N 3.3Å; N1041-S1043 PolarHBondContact O-N 3.12Å; N1041-S1043 VanDerWaalsContact O-N 3.16Å
1042S25.6Very low42Very low110.2 Ų110.2128.1 Ų128.177%0.77165%0.646SS**  trans-79.992.416556.50000108.9K1040 Q1044K1040-S1042 PolarHBondContact O-N 3.48Å; S1042-Q1044 PolarHBondContact O-N 3.17Å; S1042-Q1044 VanDerWaalsContact O-N 3.15Å
1043S28.7Very low44.9Very low92 Ų92122.9 Ų122.964%0.64361%0.614SS**  trans-44.9104.6166.745.30000111.6K1039 K1040 N1041 I1045K1039-S1043 PolarHBondContact O-N 3.48Å; K1039-S1043 PolarHBondContact O-OG 2.65Å; K1040-S1043 WeakPolarHBondContact CA-OG 3.48Å; K1040-S1043 CarbonylContact O-C 3.6Å; N1041-S1043 PolarHBondContact O-N 3.12Å; N1041-S1043 VanDerWaalsContact O-N 3.16Å; S1043-I1045 VanDerWaalsContact C-N 3.33Å; S1043-I1045 PolarHBondContact O-N 3.1Å
1044Q30.4Very low47.8Very low175.8 Ų175.8117.5 Ų117.582%0.82158%0.581SS**  trans-6786.5170.8-137.2174.7-6.800108.8K1040 S1042 N1046K1040-Q1044 PolarHBondContact O-N 3.25Å; S1042-Q1044 PolarHBondContact O-N 3.17Å; S1042-Q1044 VanDerWaalsContact O-N 3.15Å; Q1044-N1046 VanDerWaalsContact C-N 3.29Å; Q1044-N1046 PolarHBondContact O-N 3.12Å; Q1044-N1046 VanDerWaalsContact O-N 3.13Å
1045I32.1Very low50.7Low141.2 Ų141.2111.1 Ų111.172%0.72455%0.547SS*.  trans-60.7110.6169.7-62.6171.1000106.2S1043 Q1047S1043-I1045 VanDerWaalsContact C-N 3.33Å; S1043-I1045 PolarHBondContact O-N 3.1Å; I1045-Q1047 VanDerWaalsContact C-N 3.29Å; I1045-Q1047 PolarHBondContact O-N 2.95Å
1046N40.8Very low53.7Low123.4 Ų123.4104.4 Ų104.466%0.6652%0.516SS*.  trans-64.291.1173.3-82-23.1000108.3Q1044 Y1048Q1044-N1046 VanDerWaalsContact C-N 3.29Å; Q1044-N1046 PolarHBondContact O-N 3.12Å; Q1044-N1046 VanDerWaalsContact O-N 3.13Å; N1046-Y1048 HydrophobicContact CB-CE1 4.48Å; N1046-Y1048 HydrophobicContact CB-CE2 4.27Å; N1046-Y1048 VanDerWaalsContact O-CD2 3.26Å; N1046-Y1048 WeakPolarHBondContact O-CD2 3.42Å; N1046-Y1048 WeakPolarHBondContact O-CE2 3.46Å; N1046-Y1048 PolarHBondContact O-N 3.12Å
1047Q56.3Low56.8Low166.8 Ų166.896.7 Ų96.778%0.77948%0.479SS*.  trans-69.3100.2179.5-165.9171.713.800108I1045 R1049I1045-Q1047 VanDerWaalsContact C-N 3.29Å; I1045-Q1047 PolarHBondContact O-N 2.95Å; Q1047-R1049 VanDerWaalsContact O-CG 3.28Å; Q1047-R1049 WeakPolarHBondContact O-CG 3.4Å; Q1047-R1049 PolarHBondContact O-N 3.24Å; Q1047-R1049 VanDerWaalsContact O-N 3.09Å
1048Y65.9Low59.7Low122.4 Ų122.489.4 Ų89.448%0.4844%0.442SS..  trans-59.8114.5-175.7-80.9-86.8000110.3S786 D789 N1046 I1050S786-Y1048 VanDerWaalsContact CB-CE2 3.43Å; D789-Y1048 HydrophobicContact CB-CD1 3.94Å; D789-Y1048 HydrophobicContact CB-CE1 4.16Å; N1046-Y1048 HydrophobicContact CB-CE1 4.48Å; N1046-Y1048 HydrophobicContact CB-CE2 4.27Å; N1046-Y1048 VanDerWaalsContact O-CD2 3.26Å; N1046-Y1048 WeakPolarHBondContact O-CD2 3.42Å; N1046-Y1048 WeakPolarHBondContact O-CE2 3.46Å; N1046-Y1048 PolarHBondContact O-N 3.12Å; Y1048-I1050 HydrophobicContact CD1-CG1 4.09Å; Y1048-I1050 PolarHBondContact O-N 2.84Å
1049R77.1Confident62.9Low80 Ų8080.7 Ų80.730%0.30241%0.405SS..  trans-95.4125.1-177.6-61-170.1-71.6-771110.8Q1047 T1051 A1052 C1053 I1170 D1171 D1174Q1047-R1049 VanDerWaalsContact O-CG 3.28Å; Q1047-R1049 WeakPolarHBondContact O-CG 3.4Å; Q1047-R1049 PolarHBondContact O-N 3.24Å; Q1047-R1049 VanDerWaalsContact O-N 3.09Å; R1049-T1051 VanDerWaalsContact C-N 3.27Å; R1049-T1051 VanDerWaalsContact CB-OG1 3.3Å; R1049-T1051 WeakPolarHBondContact CB-OG1 3.38Å; R1049-T1051 PolarHBondContact O-N 3.25Å; R1049-A1052 HydrophobicContact CB-CB 4.07Å; R1049-A1052 PolarHBondContact O-N 3.12Å; R1049-A1052 VanDerWaalsContact O-N 3.15Å; R1049-C1053 PolarHBondContact O-N 3.27Å; R1049-C1053 PolarHBondContact O-SG 3.12Å; R1049-I1170 VanDerWaalsContact NH2-CG1 3.31Å; R1049-I1170 VanDerWaalsContact NH2-CG2 3.25Å; R1049-D1171 WeakPolarHBondContact CD-OD1 3.47Å; R1049-D1171 IonicContact CZ-OD1 3.17Å; R1049-D1171 IonicContact NE-OD1 3.23Å; R1049-D1171 PolarHBondContact NE-OD1 3.21Å; R1049-D1171 IonicContact NH2-OD1 2.71Å; R1049-D1171 PolarHBondContact NH2-OD1 3.19Å; R1049-D1171 IonicContact NH2-OD2 2.7Å; R1049-D1174 IonicContact CZ-OD2 3.18Å; R1049-D1174 IonicContact NE-OD2 3.14Å; R1049-D1174 PolarHBondContact NE-OD2 3.29Å; R1049-D1174 VanDerWaalsContact NH2-CG 3.29Å; R1049-D1174 IonicContact NH2-OD1 3.39Å; R1049-D1174 PolarHBondContact NH2-OD1 3.16Å; R1049-D1174 IonicContact NH2-OD2 3.06Å; R1049-D1174 PolarHBondContact NH2-OD2 3.33Å
1050I81.1Confident66Low26.4 Ų26.472 Ų7214%0.13537%0.368CS..Hα-helixtrans-57.1-42.5174.1-58.8175.6000110.1V785 L821 L825 Y1048 A1052 C1053 L1054 L1111V785-I1050 HydrophobicContact CG2-CG1 3.76Å; L821-I1050 HydrophobicContact CB-CG2 4.46Å; L821-I1050 HydrophobicContact CD1-CG2 4.18Å; L821-I1050 HydrophobicContact CD2-CG1 4.24Å; L821-I1050 HydrophobicContact CD2-CG2 4.19Å; L821-I1050 HydrophobicContact CG-CG2 4.46Å; L825-I1050 HydrophobicContact CD1-CD1 4.26Å; L825-I1050 HydrophobicContact CD2-CD1 3.91Å; L825-I1050 HydrophobicContact CG-CD1 4.01Å; Y1048-I1050 HydrophobicContact CD1-CG1 4.09Å; Y1048-I1050 PolarHBondContact O-N 2.84Å; I1050-A1052 PolarHBondContact O-N 3.04Å; I1050-C1053 WeakPolarHBondContact O-CB 3.31Å; I1050-C1053 PolarHBondContact O-N 3.28Å; I1050-L1054 HydrophobicContact CG2-CD1 4.26Å; I1050-L1054 HydrophobicContact CG2-CG 4.36Å; I1050-L1054 VanDerWaalsContact O-CG 3.28Å; I1050-L1054 WeakPolarHBondContact O-CG 3.27Å; I1050-L1054 PolarHBondContact O-N 3.17Å; I1050-L1111 HydrophobicContact CB-CD2 4.15Å; I1050-L1111 HydrophobicContact CD1-CD2 4.19Å; I1050-L1111 HydrophobicContact CG2-CD1 4.39Å; I1050-L1111 HydrophobicContact CG2-CD2 3.91Å
1051T81.3Confident69.1Low2.2 Ų2.263.3 Ų63.31%0.01333%0.33CS..Hα-helixtrans-55.6-50.3176.747.40000112.6R1049 C1053 L1054 T1055 L1114 D1171 D1174 M1175R1049-T1051 VanDerWaalsContact C-N 3.27Å; R1049-T1051 VanDerWaalsContact CB-OG1 3.3Å; R1049-T1051 WeakPolarHBondContact CB-OG1 3.38Å; R1049-T1051 PolarHBondContact O-N 3.25Å; T1051-C1053 VanDerWaalsContact C-N 3.27Å; T1051-C1053 PolarHBondContact O-N 3.12Å; T1051-L1054 PolarHBondContact O-N 3.11Å; T1051-T1055 WeakPolarHBondContact O-CB 3.34Å; T1051-T1055 PolarHBondContact O-N 2.88Å; T1051-T1055 VanDerWaalsContact O-N 3.13Å; T1051-T1055 PolarHBondContact O-OG1 3.11Å; T1051-L1114 HydrophobicContact CG2-CD1 3.93Å; T1051-D1171 WeakPolarHBondContact CB-OD1 3.36Å; T1051-D1171 HydrophobicContact CG2-CB 4.29Å; T1051-D1171 WeakPolarHBondContact CG2-OD1 3.32Å; T1051-D1171 PolarHBondContact OG1-OD1 3Å; T1051-D1174 WeakPolarHBondContact CB-OD2 3.4Å; T1051-D1174 PolarHBondContact OG1-OD2 3.11Å; T1051-M1175 HydrophobicContact CG2-CG 4.15Å; T1051-M1175 HydrophobicContact CG2-SD 4.26Å
1052A85.6Confident72.4Confident25 Ų2557.8 Ų57.821%0.20730%0.298CS..Hα-helixtrans-61.6-43.2175.600000112.3R1049 I1050 L1054 T1055 H1056 D1174R1049-A1052 HydrophobicContact CB-CB 4.07Å; R1049-A1052 PolarHBondContact O-N 3.12Å; R1049-A1052 VanDerWaalsContact O-N 3.15Å; I1050-A1052 PolarHBondContact O-N 3.04Å; A1052-L1054 PolarHBondContact O-N 3.06Å; A1052-T1055 WeakPolarHBondContact O-CB 3.44Å; A1052-T1055 PolarHBondContact O-N 3.1Å; A1052-T1055 VanDerWaalsContact O-N 3.11Å; A1052-H1056 WeakPolarHBondContact O-CB 3.4Å; A1052-H1056 PolarHBondContact O-CD2 3.47Å; A1052-H1056 PolarHBondContact O-N 3.12Å; A1052-D1174 WeakPolarHBondContact CB-OD2 3.31Å; A1052-D1174 PolarHBondContact N-OD2 3.34Å
1053C87.8Confident75.5Confident7.8 Ų7.857.6 Ų57.65%0.05328%0.28CS..Hα-helixtrans-59.5-45.6178-161.70000112V785 L792 R1049 I1050 T1051 T1055 H1056 M1057V785-C1053 HydrophobicContact CG1-CB 3.95Å; L792-C1053 HydrophobicContact CD1-CB 4.47Å; L792-C1053 WeakPolarHBondContact CD1-SG 3.31Å; R1049-C1053 PolarHBondContact O-N 3.27Å; R1049-C1053 PolarHBondContact O-SG 3.12Å; I1050-C1053 WeakPolarHBondContact O-CB 3.31Å; I1050-C1053 PolarHBondContact O-N 3.28Å; T1051-C1053 VanDerWaalsContact C-N 3.27Å; T1051-C1053 PolarHBondContact O-N 3.12Å; C1053-T1055 VanDerWaalsContact C-N 3.32Å; C1053-T1055 PolarHBondContact O-N 3.17Å; C1053-H1056 PolarHBondContact O-N 3.16Å; C1053-M1057 WeakPolarHBondContact O-CG 3.31Å; C1053-M1057 PolarHBondContact O-N 3.18Å
1054L88.7Confident78.5Confident2.8 Ų2.853.2 Ų53.22%0.01525%0.25CC..Hα-helixtrans-63.5-38.4176.2-63.9179.5000112.5V818 L821 I1050 T1051 A1052 M1057 L1058 M1091 L1094 Y1095 L1111V818-L1054 HydrophobicContact CG2-CD2 3.85Å; L821-L1054 HydrophobicContact CD1-CD2 3.81Å; L821-L1054 HydrophobicContact CD1-CG 4.36Å; I1050-L1054 HydrophobicContact CG2-CD1 4.26Å; I1050-L1054 HydrophobicContact CG2-CG 4.36Å; I1050-L1054 VanDerWaalsContact O-CG 3.28Å; I1050-L1054 WeakPolarHBondContact O-CG 3.27Å; I1050-L1054 PolarHBondContact O-N 3.17Å; T1051-L1054 PolarHBondContact O-N 3.11Å; A1052-L1054 PolarHBondContact O-N 3.06Å; L1054-M1057 HydrophobicContact CD2-SD 4.3Å; L1054-M1057 PolarHBondContact O-N 3.24Å; L1054-L1058 PolarHBondContact O-N 3.22Å; L1054-L1058 VanDerWaalsContact O-N 3.12Å; L1054-M1091 HydrophobicContact CB-SD 4.41Å; L1054-M1091 HydrophobicContact CD1-CB 4.45Å; L1054-M1091 HydrophobicContact CD1-CG 4.46Å; L1054-M1091 HydrophobicContact CD2-CE 4.08Å; L1054-M1091 HydrophobicContact CD2-CG 4.04Å; L1054-M1091 HydrophobicContact CD2-SD 4.34Å; L1054-L1094 HydrophobicContact CD1-CD1 3.99Å; L1054-L1094 HydrophobicContact CD2-CD1 4.05Å; L1054-L1094 HydrophobicContact CG-CD1 4.49Å; L1054-Y1095 HydrophobicContact CD1-CE2 4.45Å; L1054-L1111 HydrophobicContact CD1-CD1 4.02Å
1055T89.5Confident81.3Confident14.4 Ų14.445.1 Ų45.19%0.08821%0.212CC..Hα-helixtrans-66.1-42.1175.1-66.40000111.6T1051 A1052 C1053 M1057 L1058 D1059 D1174 T1177 W1178 Y1181T1051-T1055 WeakPolarHBondContact O-CB 3.34Å; T1051-T1055 PolarHBondContact O-N 2.88Å; T1051-T1055 VanDerWaalsContact O-N 3.13Å; T1051-T1055 PolarHBondContact O-OG1 3.11Å; A1052-T1055 WeakPolarHBondContact O-CB 3.44Å; A1052-T1055 PolarHBondContact O-N 3.1Å; A1052-T1055 VanDerWaalsContact O-N 3.11Å; C1053-T1055 VanDerWaalsContact C-N 3.32Å; C1053-T1055 PolarHBondContact O-N 3.17Å; T1055-M1057 PolarHBondContact O-N 3.13Å; T1055-L1058 PolarHBondContact O-N 3.28Å; T1055-L1058 VanDerWaalsContact O-N 3.1Å; T1055-D1059 PolarHBondContact O-N 3.04Å; T1055-D1059 VanDerWaalsContact O-N 3.1Å; T1055-D1174 PolarHBondContact OG1-O 3.16Å; T1055-T1177 VanDerWaalsContact CG2-OG1 3.29Å; T1055-T1177 WeakPolarHBondContact CG2-OG1 3.36Å; T1055-W1178 WeakPolarHBondContact OG1-CB 3.42Å; T1055-W1178 PolarHBondContact OG1-N 3.1Å; T1055-Y1181 HydrophobicContact CG2-CD2 4.05Å; T1055-Y1181 HydrophobicContact CG2-CE2 3.95Å
1056H91.1Very high84Confident48 Ų4843.5 Ų43.522%0.22220%0.2CC..Hα-helixtrans-64.4-40.4178.4-151.4-167.7000111.8D789 L792 E796 A1052 C1053 L1058 D1059 I1060D789-H1056 IonicContact OD1-CE1 3.23Å; D789-H1056 IonicContact OD1-ND1 3.11Å; D789-H1056 PolarHBondContact OD1-ND1 3.11Å; L792-H1056 HydrophobicContact CD1-CB 4.25Å; E796-H1056 WeakPolarHBondContact CB-NE2 3.27Å; E796-H1056 IonicContact OE2-CE1 2.88Å; E796-H1056 IonicContact OE2-NE2 3.57Å; A1052-H1056 WeakPolarHBondContact O-CB 3.4Å; A1052-H1056 PolarHBondContact O-CD2 3.47Å; A1052-H1056 PolarHBondContact O-N 3.12Å; C1053-H1056 PolarHBondContact O-N 3.16Å; H1056-L1058 VanDerWaalsContact C-N 3.32Å; H1056-L1058 PolarHBondContact O-N 3.16Å; H1056-D1059 PolarHBondContact O-N 3.09Å; H1056-I1060 WeakPolarHBondContact O-CD1 3.41Å; H1056-I1060 VanDerWaalsContact O-CG1 3.27Å; H1056-I1060 WeakPolarHBondContact O-CG1 3.28Å; H1056-I1060 PolarHBondContact O-N 3.07Å; H1056-I1060 VanDerWaalsContact O-N 3.13Å
1057M93.1Very high86.2Confident6.2 Ų6.240.4 Ų40.43%0.03118%0.183CC..Hα-helixtrans-55.8-44.2170.3-71.4177.3-173.100112.2F780 L792 F814 V818 L821 C1053 L1054 T1055 I1060 A1061 M1091F780-M1057 HydrophobicContact CD1-CE 4.14Å; F780-M1057 HydrophobicContact CE1-CE 3.91Å; L792-M1057 HydrophobicContact CD1-CE 4.31Å; L792-M1057 HydrophobicContact CD1-CG 3.96Å; L792-M1057 HydrophobicContact CD2-CB 4.44Å; L792-M1057 HydrophobicContact CD2-CG 3.64Å; L792-M1057 HydrophobicContact CG-CG 4.45Å; F814-M1057 HydrophobicContact CB-CG 4.41Å; F814-M1057 HydrophobicContact CB-SD 4.11Å; F814-M1057 HydrophobicContact CD1-CB 4.38Å; F814-M1057 HydrophobicContact CD1-CG 3.86Å; F814-M1057 HydrophobicContact CD1-SD 4.41Å; F814-M1057 HydrophobicContact CD2-CB 3.98Å; F814-M1057 HydrophobicContact CD2-CG 4.34Å; F814-M1057 HydrophobicContact CE1-CB 4.49Å; F814-M1057 HydrophobicContact CE1-CG 4.17Å; F814-M1057 HydrophobicContact CE2-CB 4.16Å; F814-M1057 WeakPolarHBondContact CE2-O 3.44Å; F814-M1057 HydrophobicContact CG-CB 4.1Å; F814-M1057 HydrophobicContact CG-CG 3.96Å; F814-M1057 HydrophobicContact CG-SD 4.3Å; F814-M1057 HydrophobicContact CZ-CB 4.41Å; F814-M1057 HydrophobicContact CZ-CG 4.49Å; V818-M1057 HydrophobicContact CG2-SD 4.04Å; L821-M1057 HydrophobicContact CD1-CE 4.39Å; C1053-M1057 WeakPolarHBondContact O-CG 3.31Å; C1053-M1057 PolarHBondContact O-N 3.18Å; L1054-M1057 HydrophobicContact CD2-SD 4.3Å; L1054-M1057 PolarHBondContact O-N 3.24Å; T1055-M1057 PolarHBondContact O-N 3.13Å; M1057-I1060 PolarHBondContact O-N 3.01Å; M1057-A1061 VanDerWaalsContact O-CB 3.29Å; M1057-A1061 WeakPolarHBondContact O-CB 3.37Å; M1057-A1061 PolarHBondContact O-N 3.12Å; M1057-M1091 HydrophobicContact CB-CE 3.74Å; M1057-M1091 HydrophobicContact CG-CE 4.37Å; M1057-M1091 HydrophobicContact SD-CE 3.72Å
1058L92.6Very high87.6Confident0.4 Ų0.436.2 Ų36.20%0.00217%0.165CC..Hα-helixtrans-71.6-35.5-179.4-70.6-165.4000113.9L1054 T1055 H1056 A1061 Y1062 L1088 M1091 W1178 Y1181 A1182 I1185L1054-L1058 PolarHBondContact O-N 3.22Å; L1054-L1058 VanDerWaalsContact O-N 3.12Å; T1055-L1058 PolarHBondContact O-N 3.28Å; T1055-L1058 VanDerWaalsContact O-N 3.1Å; H1056-L1058 VanDerWaalsContact C-N 3.32Å; H1056-L1058 PolarHBondContact O-N 3.16Å; L1058-A1061 PolarHBondContact O-N 3.34Å; L1058-Y1062 VanDerWaalsContact O-CB 3.28Å; L1058-Y1062 WeakPolarHBondContact O-CB 3.31Å; L1058-Y1062 PolarHBondContact O-N 3.08Å; L1058-L1088 HydrophobicContact CD1-CD2 3.7Å; L1058-L1088 HydrophobicContact CD2-CD2 3.79Å; L1058-L1088 HydrophobicContact CG-CD2 4.42Å; L1058-M1091 HydrophobicContact CD1-SD 4.42Å; L1058-M1091 HydrophobicContact CD2-CE 4.13Å; L1058-M1091 HydrophobicContact CD2-SD 3.78Å; L1058-M1091 HydrophobicContact CG-CE 4.41Å; L1058-M1091 HydrophobicContact CG-SD 3.97Å; L1058-W1178 VanDerWaalsContact CD1-CD1 3.45Å; L1058-W1178 HydrophobicContact CD1-CD2 3.98Å; L1058-W1178 VanDerWaalsContact CD1-CE2 3.5Å; L1058-W1178 HydrophobicContact CD1-CG 3.96Å; L1058-W1178 HydrophobicContact CD1-CZ2 4.07Å; L1058-W1178 VanDerWaalsContact CD1-NE1 3.31Å; L1058-Y1181 HydrophobicContact CB-CD2 4.47Å; L1058-Y1181 HydrophobicContact CB-CG 4.33Å; L1058-A1182 HydrophobicContact CD1-CB 4.43Å; L1058-I1185 HydrophobicContact CB-CD1 4.43Å; L1058-I1185 HydrophobicContact CD2-CD1 4.05Å
1059D93Very high88.5Confident18.8 Ų18.832.4 Ų32.410%0.10115%0.153CC..Hα-helixtrans-63.7-47.4174.9-17425.9000110.9T1055 H1056 A1061 Y1062 R1063 Y1181T1055-D1059 PolarHBondContact O-N 3.04Å; T1055-D1059 VanDerWaalsContact O-N 3.1Å; H1056-D1059 PolarHBondContact O-N 3.09Å; D1059-A1061 VanDerWaalsContact C-N 3.35Å; D1059-A1061 PolarHBondContact O-N 3Å; D1059-Y1062 PolarHBondContact O-N 3.23Å; D1059-R1063 VanDerWaalsContact CG-NE 3.28Å; D1059-R1063 WeakPolarHBondContact O-CB 3.29Å; D1059-R1063 VanDerWaalsContact O-CG 3.31Å; D1059-R1063 WeakPolarHBondContact O-CG 3.35Å; D1059-R1063 PolarHBondContact O-N 3.29Å; D1059-R1063 IonicContact OD1-CZ 3.02Å; D1059-R1063 IonicContact OD1-NE 2.83Å; D1059-R1063 PolarHBondContact OD1-NE 3.02Å; D1059-R1063 IonicContact OD1-NH2 3.16Å; D1059-R1063 PolarHBondContact OD1-NH2 3.3Å; D1059-R1063 IonicContact OD2-CZ 3.2Å; D1059-R1063 VanDerWaalsContact OD2-CZ 3.29Å; D1059-R1063 IonicContact OD2-NE 3.35Å; D1059-R1063 PolarHBondContact OD2-NE 3.08Å; D1059-R1063 VanDerWaalsContact OD2-NE 3.12Å; D1059-R1063 IonicContact OD2-NH2 2.98Å; D1059-R1063 PolarHBondContact OD2-NH2 2.97Å; D1059-R1063 VanDerWaalsContact OD2-NH2 3.11Å; D1059-Y1181 HydrophobicContact CB-CD1 4.38Å; D1059-Y1181 HydrophobicContact CB-CD2 4.46Å; D1059-Y1181 HydrophobicContact CB-CE1 3.82Å; D1059-Y1181 HydrophobicContact CB-CE2 4Å; D1059-Y1181 VanDerWaalsContact CG-CZ 3.48Å; D1059-Y1181 VanDerWaalsContact CG-OH 3.25Å; D1059-Y1181 WeakPolarHBondContact OD1-CE1 3.42Å; D1059-Y1181 PolarHBondContact OD1-OH 3.07Å; D1059-Y1181 PolarHBondContact OD2-OH 3Å
1060I93.3Very high88.6Confident13 Ų1333.5 Ų33.57%0.06717%0.17CC..Hα-helixtrans-59.9-46.8175.9-64.7167.3000110.5L792 L795 E796 L810 F814 H1056 M1057 Y1062 R1063 Q1064L792-I1060 HydrophobicContact CB-CD1 4.25Å; L792-I1060 HydrophobicContact CD2-CD1 3.89Å; L792-I1060 WeakPolarHBondContact O-CD1 3.45Å; L795-I1060 HydrophobicContact CB-CD1 4.02Å; L795-I1060 HydrophobicContact CB-CG2 4.38Å; E796-I1060 HydrophobicContact CB-CD1 4.38Å; L810-I1060 HydrophobicContact CD1-CG2 4.08Å; L810-I1060 HydrophobicContact CD2-CG2 4.35Å; F814-I1060 HydrophobicContact CE2-CB 4.41Å; F814-I1060 HydrophobicContact CE2-CG2 4.37Å; F814-I1060 HydrophobicContact CZ-CB 4.07Å; F814-I1060 HydrophobicContact CZ-CG2 3.88Å; H1056-I1060 WeakPolarHBondContact O-CD1 3.41Å; H1056-I1060 VanDerWaalsContact O-CG1 3.27Å; H1056-I1060 WeakPolarHBondContact O-CG1 3.28Å; H1056-I1060 PolarHBondContact O-N 3.07Å; H1056-I1060 VanDerWaalsContact O-N 3.13Å; M1057-I1060 PolarHBondContact O-N 3.01Å; I1060-Y1062 VanDerWaalsContact C-N 3.31Å; I1060-Y1062 PolarHBondContact O-N 3.03Å; I1060-R1063 PolarHBondContact O-N 3.11Å; I1060-Q1064 HydrophobicContact CG2-CG 4.39Å; I1060-Q1064 WeakPolarHBondContact O-CB 3.42Å; I1060-Q1064 VanDerWaalsContact O-CG 3.27Å; I1060-Q1064 WeakPolarHBondContact O-CG 3.27Å; I1060-Q1064 PolarHBondContact O-N 3.11Å
1061A93Very high88.3Confident0 Ų038.4 Ų38.40%020%0.195CC..Hα-helixtrans-60.7-41.7177.900000112.6L811 F814 M1057 L1058 D1059 Q1064 L1065 L1084L811-A1061 HydrophobicContact CD2-CB 4.39Å; F814-A1061 HydrophobicContact CD2-CB 4.43Å; F814-A1061 HydrophobicContact CE2-CB 4.1Å; M1057-A1061 VanDerWaalsContact O-CB 3.29Å; M1057-A1061 WeakPolarHBondContact O-CB 3.37Å; M1057-A1061 PolarHBondContact O-N 3.12Å; L1058-A1061 PolarHBondContact O-N 3.34Å; D1059-A1061 VanDerWaalsContact C-N 3.35Å; D1059-A1061 PolarHBondContact O-N 3Å; A1061-Q1064 PolarHBondContact O-N 2.88Å; A1061-L1065 VanDerWaalsContact O-CB 3.29Å; A1061-L1065 WeakPolarHBondContact O-CB 3.31Å; A1061-L1065 PolarHBondContact O-N 3.17Å; A1061-L1084 HydrophobicContact CB-CD1 4.2Å; A1061-L1084 HydrophobicContact CB-CD2 4.25Å
1062Y92.4Very high88.1Confident36.6 Ų36.638.6 Ų38.614%0.14420%0.198CC..Hα-helixtrans-69.7-39.7179.1176.1-116.4000112.5L1058 D1059 I1060 Q1064 L1065 K1066 Y1181 L1184 I1185 H1188L1058-Y1062 VanDerWaalsContact O-CB 3.28Å; L1058-Y1062 WeakPolarHBondContact O-CB 3.31Å; L1058-Y1062 PolarHBondContact O-N 3.08Å; D1059-Y1062 PolarHBondContact O-N 3.23Å; I1060-Y1062 VanDerWaalsContact C-N 3.31Å; I1060-Y1062 PolarHBondContact O-N 3.03Å; Y1062-Q1064 PolarHBondContact O-N 3.37Å; Y1062-L1065 PolarHBondContact O-N 3.26Å; Y1062-K1066 HydrophobicContact CD2-CD 4.5Å; Y1062-K1066 HydrophobicContact CE1-CD 4.09Å; Y1062-K1066 HydrophobicContact CE2-CD 4.07Å; Y1062-K1066 HydrophobicContact CE2-CG 4.32Å; Y1062-K1066 WeakPolarHBondContact O-CB 3.37Å; Y1062-K1066 WeakPolarHBondContact O-CG 3.47Å; Y1062-K1066 PolarHBondContact O-N 3.19Å; Y1062-K1066 VanDerWaalsContact O-N 3.08Å; Y1062-K1066 WeakPolarHBondContact OH-CE 3.36Å; Y1062-K1066 PolarHBondContact OH-NZ 2.82Å; Y1062-Y1181 HydrophobicContact CD1-CD1 4.19Å; Y1062-Y1181 HydrophobicContact CD1-CE1 4.25Å; Y1062-Y1181 HydrophobicContact CG-CD1 4.38Å; Y1062-L1184 HydrophobicContact CD1-CD1 4.44Å; Y1062-L1184 HydrophobicContact CD2-CB 4.24Å; Y1062-L1184 HydrophobicContact CE1-CB 4.23Å; Y1062-L1184 HydrophobicContact CE1-CD1 3.98Å; Y1062-L1184 HydrophobicContact CE1-CG 4.47Å; Y1062-L1184 HydrophobicContact CE2-CB 3.8Å; Y1062-I1185 HydrophobicContact CD2-CG1 4Å; Y1062-I1185 HydrophobicContact CG-CG1 4.42Å; Y1062-H1188 HydrophobicContact CE2-CB 4.37Å; Y1062-H1188 AromaticContact CE2-CD2 3.96Å
1063R91.7Very high87.8Confident106.2 Ų106.239.8 Ų39.840%0.40120%0.199SC..Hα-helixtrans-66.3-46.2175.3-69.8178-165.9-139.714.8111.8T799 D1059 I1060 L1065 K1066 I1067T799-R1063 HydrophobicContact CG2-CB 3.38Å; T799-R1063 HydrophobicContact CG2-CG 4.33Å; D1059-R1063 VanDerWaalsContact CG-NE 3.28Å; D1059-R1063 WeakPolarHBondContact O-CB 3.29Å; D1059-R1063 VanDerWaalsContact O-CG 3.31Å; D1059-R1063 WeakPolarHBondContact O-CG 3.35Å; D1059-R1063 PolarHBondContact O-N 3.29Å; D1059-R1063 IonicContact OD1-CZ 3.02Å; D1059-R1063 IonicContact OD1-NE 2.83Å; D1059-R1063 PolarHBondContact OD1-NE 3.02Å; D1059-R1063 IonicContact OD1-NH2 3.16Å; D1059-R1063 PolarHBondContact OD1-NH2 3.3Å; D1059-R1063 IonicContact OD2-CZ 3.2Å; D1059-R1063 VanDerWaalsContact OD2-CZ 3.29Å; D1059-R1063 IonicContact OD2-NE 3.35Å; D1059-R1063 PolarHBondContact OD2-NE 3.08Å; D1059-R1063 VanDerWaalsContact OD2-NE 3.12Å; D1059-R1063 IonicContact OD2-NH2 2.98Å; D1059-R1063 PolarHBondContact OD2-NH2 2.97Å; D1059-R1063 VanDerWaalsContact OD2-NH2 3.11Å; I1060-R1063 PolarHBondContact O-N 3.11Å; R1063-L1065 VanDerWaalsContact C-N 3.33Å; R1063-L1065 PolarHBondContact O-N 3.32Å; R1063-K1066 WeakPolarHBondContact O-CB 3.39Å; R1063-K1066 PolarHBondContact O-N 3.09Å; R1063-K1066 VanDerWaalsContact O-N 3.11Å; R1063-I1067 WeakPolarHBondContact O-CD1 3.46Å; R1063-I1067 VanDerWaalsContact O-CG1 3.29Å; R1063-I1067 WeakPolarHBondContact O-CG1 3.31Å; R1063-I1067 PolarHBondContact O-N 3.01Å; R1063-I1067 VanDerWaalsContact O-N 3.15Å
1064Q91.9Very high87.2Confident0.2 Ų0.240.9 Ų40.90%0.00121%0.207CC..Hα-helixtrans-63.8-38.8176.3-72.8-69.1-22.900112.1T799 V803 M807 L810 I1060 A1061 Y1062 K1066 I1067 L1068T799-Q1064 HydrophobicContact CG2-CG 3.97Å; T799-Q1064 PolarHBondContact OG1-NE2 3.31Å; V803-Q1064 PolarHBondContact O-NE2 3.15Å; V803-Q1064 PolarHBondContact O-OE1 3.35Å; M807-Q1064 HydrophobicContact SD-CB 3.79Å; L810-Q1064 HydrophobicContact CD2-CB 3.79Å; L810-Q1064 HydrophobicContact CD2-CG 3.88Å; I1060-Q1064 HydrophobicContact CG2-CG 4.39Å; I1060-Q1064 WeakPolarHBondContact O-CB 3.42Å; I1060-Q1064 VanDerWaalsContact O-CG 3.27Å; I1060-Q1064 WeakPolarHBondContact O-CG 3.27Å; I1060-Q1064 PolarHBondContact O-N 3.11Å; A1061-Q1064 PolarHBondContact O-N 2.88Å; Y1062-Q1064 PolarHBondContact O-N 3.37Å; Q1064-K1066 VanDerWaalsContact C-N 3.29Å; Q1064-K1066 PolarHBondContact O-N 3.14Å; Q1064-I1067 PolarHBondContact O-N 3.12Å; Q1064-L1068 WeakPolarHBondContact O-CB 3.39Å; Q1064-L1068 WeakPolarHBondContact O-CG 3.34Å; Q1064-L1068 PolarHBondContact O-N 2.97Å; Q1064-L1068 VanDerWaalsContact O-N 3.09Å
1065L89.7Confident86.7Confident5.8 Ų5.841.3 Ų41.33%0.0321%0.212CC..Hα-helixtrans-57.7-41.3172.6-17964.6000111.9M807 A1061 Y1062 R1063 I1067 L1068 D1069 T1080 L1084 H1188 L1189M807-L1065 HydrophobicContact CE-CB 4.17Å; M807-L1065 HydrophobicContact CE-CD1 4.47Å; M807-L1065 HydrophobicContact SD-CB 4.46Å; A1061-L1065 VanDerWaalsContact O-CB 3.29Å; A1061-L1065 WeakPolarHBondContact O-CB 3.31Å; A1061-L1065 PolarHBondContact O-N 3.17Å; Y1062-L1065 PolarHBondContact O-N 3.26Å; R1063-L1065 VanDerWaalsContact C-N 3.33Å; R1063-L1065 PolarHBondContact O-N 3.32Å; L1065-I1067 VanDerWaalsContact C-N 3.3Å; L1065-I1067 PolarHBondContact O-N 3.24Å; L1065-L1068 PolarHBondContact O-N 2.78Å; L1065-D1069 CarbonylContact O-C 3.52Å; L1065-D1069 WeakPolarHBondContact O-CA 3.36Å; L1065-D1069 PolarHBondContact O-N 2.86Å; L1065-T1080 HydrophobicContact CD1-CG2 4.25Å; L1065-L1084 HydrophobicContact CD1-CD1 4.17Å; L1065-L1084 HydrophobicContact CD2-CD1 3.94Å; L1065-L1084 HydrophobicContact CD2-CD2 4.02Å; L1065-H1188 HydrophobicContact CD2-CB 4.34Å; L1065-L1189 HydrophobicContact CD1-CD2 4.45Å; L1065-L1189 HydrophobicContact CD2-CD2 4.3Å; L1065-L1189 HydrophobicContact CD2-CG 4.45Å
1066K88.7Confident86.3Confident106.4 Ų106.441.2 Ų41.246%0.46321%0.21SC..Hα-helixtrans-71.7-30.3177.2-111179.6158.9-179.90114Y1062 R1063 Q1064 L1068 P1070 H1188Y1062-K1066 HydrophobicContact CD2-CD 4.5Å; Y1062-K1066 HydrophobicContact CE1-CD 4.09Å; Y1062-K1066 HydrophobicContact CE2-CD 4.07Å; Y1062-K1066 HydrophobicContact CE2-CG 4.32Å; Y1062-K1066 WeakPolarHBondContact O-CB 3.37Å; Y1062-K1066 WeakPolarHBondContact O-CG 3.47Å; Y1062-K1066 PolarHBondContact O-N 3.19Å; Y1062-K1066 VanDerWaalsContact O-N 3.08Å; Y1062-K1066 WeakPolarHBondContact OH-CE 3.36Å; Y1062-K1066 PolarHBondContact OH-NZ 2.82Å; R1063-K1066 WeakPolarHBondContact O-CB 3.39Å; R1063-K1066 PolarHBondContact O-N 3.09Å; R1063-K1066 VanDerWaalsContact O-N 3.11Å; Q1064-K1066 VanDerWaalsContact C-N 3.29Å; Q1064-K1066 PolarHBondContact O-N 3.14Å; K1066-L1068 VanDerWaalsContact C-N 3.3Å; K1066-P1070 VanDerWaalsContact O-CA 3.27Å; K1066-P1070 WeakPolarHBondContact O-CA 3.23Å; K1066-P1070 WeakPolarHBondContact O-CB 3.4Å; K1066-H1188 WeakPolarHBondContact CG-NE2 3.49Å
1067I86.8Confident85.6Confident58.6 Ų58.644.1 Ų44.130%0.30123%0.232SC..Hα-helixtrans-70-40.9175.1-68.7162.3000110.2T799 E802 P804 R1063 Q1064 L1065T799-I1067 HydrophobicContact CG2-CD1 4.4Å; E802-I1067 HydrophobicContact CB-CD1 4.39Å; E802-I1067 HydrophobicContact CG-CD1 4.48Å; P804-I1067 HydrophobicContact CB-CG2 4.29Å; R1063-I1067 WeakPolarHBondContact O-CD1 3.46Å; R1063-I1067 VanDerWaalsContact O-CG1 3.29Å; R1063-I1067 WeakPolarHBondContact O-CG1 3.31Å; R1063-I1067 PolarHBondContact O-N 3.01Å; R1063-I1067 VanDerWaalsContact O-N 3.15Å; Q1064-I1067 PolarHBondContact O-N 3.12Å; L1065-I1067 VanDerWaalsContact C-N 3.3Å; L1065-I1067 PolarHBondContact O-N 3.24Å
1068L85.6Confident85Confident80 Ų8048.8 Ų48.842%0.41925%0.253SS..Hα-helixtrans-90.8-32.5-172.9-69.4168.5000114.3P804 I805 M807 Q1064 L1065 K1066P804-L1068 HydrophobicContact CB-CD2 3.78Å; P804-L1068 HydrophobicContact CB-CG 4.5Å; I805-L1068 VanDerWaalsContact O-CD1 3.29Å; I805-L1068 WeakPolarHBondContact O-CD1 3.32Å; M807-L1068 HydrophobicContact CG-CD1 3.64Å; M807-L1068 HydrophobicContact SD-CD1 4.05Å; Q1064-L1068 WeakPolarHBondContact O-CB 3.39Å; Q1064-L1068 WeakPolarHBondContact O-CG 3.34Å; Q1064-L1068 PolarHBondContact O-N 2.97Å; Q1064-L1068 VanDerWaalsContact O-N 3.09Å; L1065-L1068 PolarHBondContact O-N 2.78Å; K1066-L1068 VanDerWaalsContact C-N 3.3Å
1069D83.8Confident84.5Confident42.4 Ų42.453.8 Ų53.823%0.22728%0.277CS..  trans-127.277.8172.1-173.94.8000110L1065 I1071 G1072 S1074 H1188L1065-D1069 CarbonylContact O-C 3.52Å; L1065-D1069 WeakPolarHBondContact O-CA 3.36Å; L1065-D1069 PolarHBondContact O-N 2.86Å; D1069-I1071 VanDerWaalsContact C-N 3.26Å; D1069-I1071 PolarHBondContact O-N 3.12Å; D1069-I1071 VanDerWaalsContact O-N 3.13Å; D1069-I1071 PolarHBondContact OD1-N 3.26Å; D1069-G1072 VanDerWaalsContact CG-N 3.32Å; D1069-G1072 PolarHBondContact O-N 3.26Å; D1069-G1072 VanDerWaalsContact O-N 3.13Å; D1069-G1072 WeakPolarHBondContact OD1-CA 3.34Å; D1069-G1072 PolarHBondContact OD1-N 3.07Å; D1069-G1072 VanDerWaalsContact OD2-CA 3.31Å; D1069-G1072 WeakPolarHBondContact OD2-CA 3.37Å; D1069-S1074 WeakPolarHBondContact OD2-CB 3.49Å; D1069-S1074 PolarHBondContact OD2-OG 3.17Å; D1069-S1074 VanDerWaalsContact OD2-OG 3.04Å; D1069-H1188 PolarHBondContact O-CE1 3.12Å; D1069-H1188 VanDerWaalsContact O-CE1 3.22Å; D1069-H1188 PolarHBondContact O-NE2 3.06Å
1070P79.4Confident84.2Confident101.4 Ų101.454.9 Ų54.966%0.65828%0.284SS*.SBendtrans-71-11.8-177.528.7-36.1000113.7K1066K1066-P1070 VanDerWaalsContact O-CA 3.27Å; K1066-P1070 WeakPolarHBondContact O-CA 3.23Å; K1066-P1070 WeakPolarHBondContact O-CB 3.4Å
1071I75.7Confident83.9Confident129.4 Ų129.454.4 Ų54.466%0.66428%0.282SS*.SBendtrans-89.7-39174-59.8176.3000109.6D1069 H1073 I1192D1069-I1071 VanDerWaalsContact C-N 3.26Å; D1069-I1071 PolarHBondContact O-N 3.12Å; D1069-I1071 VanDerWaalsContact O-N 3.13Å; D1069-I1071 PolarHBondContact OD1-N 3.26Å; I1071-H1073 PolarHBondContact O-CD2 3.06Å; I1071-H1073 VanDerWaalsContact O-CD2 3.27Å; I1071-I1192 HydrophobicContact CG2-CD1 4.28Å
1072G77Confident83.6Confident7.2 Ų7.257.8 Ų57.87%0.07430%0.298CS..  trans68.1-158.8-177.200000112.7D1069 S1074 H1188D1069-G1072 VanDerWaalsContact CG-N 3.32Å; D1069-G1072 PolarHBondContact O-N 3.26Å; D1069-G1072 VanDerWaalsContact O-N 3.13Å; D1069-G1072 WeakPolarHBondContact OD1-CA 3.34Å; D1069-G1072 PolarHBondContact OD1-N 3.07Å; D1069-G1072 VanDerWaalsContact OD2-CA 3.31Å; D1069-G1072 WeakPolarHBondContact OD2-CA 3.37Å; G1072-S1074 PolarHBondContact O-N 3Å; G1072-S1074 VanDerWaalsContact O-N 3.1Å; G1072-H1188 VanDerWaalsContact CA-CE1 3.4Å; G1072-H1188 WeakPolarHBondContact CA-CE1 3.38Å; G1072-H1188 VanDerWaalsContact CA-NE2 3.29Å; G1072-H1188 WeakPolarHBondContact CA-NE2 3.38Å
1073H78.8Confident83.4Confident49.8 Ų49.857.8 Ų57.823%0.23130%0.3CS..  trans59.825.9170.5-52.3-64000114.6I1071 G1075 Q1187 H1188 A1190 I1192I1071-H1073 PolarHBondContact O-CD2 3.06Å; I1071-H1073 VanDerWaalsContact O-CD2 3.27Å; H1073-G1075 VanDerWaalsContact C-N 3.27Å; H1073-G1075 PolarHBondContact O-N 3.13Å; H1073-Q1187 PolarHBondContact CE1-O 3.27Å; H1073-Q1187 VanDerWaalsContact CE1-O 3.24Å; H1073-Q1187 PolarHBondContact ND1-O 3.35Å; H1073-H1188 WeakPolarHBondContact CA-O 3.39Å; H1073-H1188 PolarHBondContact N-O 3.15Å; H1073-H1188 PolarHBondContact ND1-O 3.06Å; H1073-A1190 VanDerWaalsContact CA-O 3.26Å; H1073-A1190 WeakPolarHBondContact CA-O 3.33Å; H1073-A1190 VanDerWaalsContact CB-O 3.28Å; H1073-A1190 WeakPolarHBondContact CB-O 3.26Å; H1073-A1190 VanDerWaalsContact CG-O 3.3Å; H1073-A1190 PolarHBondContact ND1-O 3.02Å; H1073-I1192 HydrophobicContact CB-CB 4.4Å; H1073-I1192 HydrophobicContact CB-CD1 3.87Å; H1073-I1192 HydrophobicContact CB-CG1 3.34Å; H1073-I1192 VanDerWaalsContact CD2-CG1 3.49Å; H1073-I1192 WeakPolarHBondContact CD2-CG1 3.35Å; H1073-I1192 VanDerWaalsContact CG-CG1 3.43Å
1074S74.6Confident83.4Confident31.6 Ų31.652.8 Ų52.822%0.22128%0.281CS..  trans-68.1-11.2-18034.80000114.2D1069 G1072 Q1078D1069-S1074 WeakPolarHBondContact OD2-CB 3.49Å; D1069-S1074 PolarHBondContact OD2-OG 3.17Å; D1069-S1074 VanDerWaalsContact OD2-OG 3.04Å; G1072-S1074 PolarHBondContact O-N 3Å; G1072-S1074 VanDerWaalsContact O-N 3.1Å; S1074-Q1078 VanDerWaalsContact CB-CD 3.43Å; S1074-Q1078 VanDerWaalsContact CB-NE2 3.28Å; S1074-Q1078 PolarHBondContact O-NE2 2.94Å; S1074-Q1078 VanDerWaalsContact O-NE2 3.08Å
1075G79.1Confident83.3Confident10.8 Ų10.852.8 Ų52.811%0.11128%0.281CS..  trans80.4166.3178.200000113.5H1073 T1077 Q1078 P1081 L1189H1073-G1075 VanDerWaalsContact C-N 3.27Å; H1073-G1075 PolarHBondContact O-N 3.13Å; G1075-T1077 PolarHBondContact O-N 3.26Å; G1075-T1077 VanDerWaalsContact O-N 3.17Å; G1075-Q1078 PolarHBondContact O-N 2.95Å; G1075-P1081 WeakPolarHBondContact O-CB 3.36Å; G1075-P1081 WeakPolarHBondContact O-CG 3.24Å; G1075-L1189 VanDerWaalsContact CA-O 3.32Å; G1075-L1189 WeakPolarHBondContact CA-O 3.36Å; G1075-L1189 PolarHBondContact N-O 3.05Å
1076Y81.1Confident83.2Confident12.2 Ų12.254.7 Ų54.75%0.04829%0.288CS..THydrogen-bonded Turntrans-78.80.9-170.8-47.4-51000115.2Q1082 L1085 C1186 L1189 V1258 Y1337 L1338 A1344Y1076-Q1082 VanDerWaalsContact O-CG 3.31Å; Y1076-Q1082 WeakPolarHBondContact O-CG 3.38Å; Y1076-Q1082 PolarHBondContact O-NE2 3.11Å; Y1076-L1085 HydrophobicContact CD1-CD1 4.1Å; Y1076-L1085 HydrophobicContact CD1-CG 4.41Å; Y1076-L1085 HydrophobicContact CG-CD1 4.35Å; Y1076-C1186 PolarHBondContact OH-O 2.77Å; Y1076-L1189 HydrophobicContact CD1-CB 4.04Å; Y1076-L1189 HydrophobicContact CD1-CD1 4.29Å; Y1076-L1189 HydrophobicContact CE1-CB 3.75Å; Y1076-L1189 HydrophobicContact CE1-CD1 4.16Å; Y1076-L1189 HydrophobicContact CE1-CG 4.44Å; Y1076-V1258 HydrophobicContact CD2-CG2 4.4Å; Y1076-V1258 HydrophobicContact CG-CG2 4.4Å; Y1076-Y1337 VanDerWaalsContact OH-C 3.24Å; Y1076-Y1337 PolarHBondContact OH-O 3.27Å; Y1076-L1338 HydrophobicContact CD1-CD2 4.45Å; Y1076-L1338 HydrophobicContact CE1-CD2 4.02Å; Y1076-L1338 HydrophobicContact CE2-CD2 4.33Å; Y1076-A1344 HydrophobicContact CD2-CB 4.04Å; Y1076-A1344 HydrophobicContact CE2-CB 4.19Å
1077T75.5Confident83.3Confident109.4 Ų109.449.7 Ų49.767%0.67127%0.266SS*.THydrogen-bonded Turntrans-92.3-9.5-173.253.10000114.7G1075 Q1082G1075-T1077 PolarHBondContact O-N 3.26Å; G1075-T1077 VanDerWaalsContact O-N 3.17Å; T1077-Q1082 VanDerWaalsContact C-NE2 3.33Å; T1077-Q1082 PolarHBondContact O-NE2 3.38Å; T1077-Q1082 VanDerWaalsContact O-NE2 3.11Å
1078Q80.7Confident83.5Confident104.6 Ų104.647 Ų4749%0.48925%0.252SS..SBendtrans-85.9161.1178-50.4-169.71800111.8S1074 G1075 T1080 P1081 Q1082S1074-Q1078 VanDerWaalsContact CB-CD 3.43Å; S1074-Q1078 VanDerWaalsContact CB-NE2 3.28Å; S1074-Q1078 PolarHBondContact O-NE2 2.94Å; S1074-Q1078 VanDerWaalsContact O-NE2 3.08Å; G1075-Q1078 PolarHBondContact O-N 2.95Å; Q1078-T1080 PolarHBondContact O-N 3.28Å; Q1078-P1081 HydrophobicContact CB-CG 3.95Å; Q1078-P1081 VanDerWaalsContact O-CD 3.29Å; Q1078-P1081 WeakPolarHBondContact O-CD 3.35Å; Q1078-P1081 WeakPolarHBondContact O-CG 3.28Å; Q1078-Q1082 VanDerWaalsContact O-CG 3.25Å; Q1078-Q1082 WeakPolarHBondContact O-CG 3.4Å; Q1078-Q1082 PolarHBondContact O-N 3.15Å; Q1078-Q1082 VanDerWaalsContact O-N 3.12Å
1079E82.8Confident83.6Confident106 Ų10643.2 Ų43.250%0.49523%0.232SC..Hα-helixtrans-59-50.3-175.5-158.8177.5-172.900112.7K808 Q1082 L1083K808-E1079 VanDerWaalsContact CE-OE1 3.29Å; K808-E1079 WeakPolarHBondContact CE-OE1 3.38Å; K808-E1079 IonicContact NZ-OE1 3.03Å; K808-E1079 PolarHBondContact NZ-OE1 3.19Å; K808-E1079 IonicContact NZ-OE2 3.43Å; E1079-Q1082 WeakPolarHBondContact O-CB 3.48Å; E1079-Q1082 PolarHBondContact O-N 3.36Å; E1079-Q1082 VanDerWaalsContact O-N 3.11Å; E1079-L1083 HydrophobicContact CG-CD1 4.05Å; E1079-L1083 HydrophobicContact CG-CG 4.4Å; E1079-L1083 WeakPolarHBondContact O-CG 3.33Å; E1079-L1083 PolarHBondContact O-N 2.89Å
1080T86.3Confident83.7Confident41.2 Ų41.242.1 Ų42.125%0.25323%0.227SC..Hα-helixtrans-59.6-49.5-179.6-59.80000113.4M807 L811 L1065 Q1078 Q1082 L1083 L1084M807-T1080 HydrophobicContact CB-CG2 3.78Å; M807-T1080 HydrophobicContact CE-CG2 4.1Å; M807-T1080 HydrophobicContact CG-CG2 3.87Å; L811-T1080 HydrophobicContact CD1-CG2 4.36Å; L1065-T1080 HydrophobicContact CD1-CG2 4.25Å; Q1078-T1080 PolarHBondContact O-N 3.28Å; T1080-Q1082 VanDerWaalsContact C-N 3.3Å; T1080-Q1082 PolarHBondContact O-N 2.89Å; T1080-L1083 PolarHBondContact O-N 3.18Å; T1080-L1084 HydrophobicContact CG2-CD1 4.02Å; T1080-L1084 WeakPolarHBondContact O-CB 3.35Å; T1080-L1084 WeakPolarHBondContact O-CG 3.41Å; T1080-L1084 PolarHBondContact O-N 3.13Å
1081P86.7Confident84.1Confident2.2 Ų2.237.5 Ų37.51%0.01420%0.196CC..Hα-helixtrans-52.9-43.7169.8-23.725.7000113.9G1075 Q1078 L1084 L1085 L1189G1075-P1081 WeakPolarHBondContact O-CB 3.36Å; G1075-P1081 WeakPolarHBondContact O-CG 3.24Å; Q1078-P1081 HydrophobicContact CB-CG 3.95Å; Q1078-P1081 VanDerWaalsContact O-CD 3.29Å; Q1078-P1081 WeakPolarHBondContact O-CD 3.35Å; Q1078-P1081 WeakPolarHBondContact O-CG 3.28Å; P1081-L1084 PolarHBondContact O-N 3.08Å; P1081-L1085 WeakPolarHBondContact O-CB 3.34Å; P1081-L1085 VanDerWaalsContact O-CD1 3.32Å; P1081-L1085 WeakPolarHBondContact O-CD1 3.36Å; P1081-L1085 VanDerWaalsContact O-CG 3.22Å; P1081-L1085 WeakPolarHBondContact O-CG 3.35Å; P1081-L1085 PolarHBondContact O-N 3.19Å; P1081-L1189 HydrophobicContact CB-CD1 4.29Å; P1081-L1189 HydrophobicContact CB-CD2 3.94Å; P1081-L1189 HydrophobicContact CG-CD2 3.93Å
1082Q87.3Confident84.4Confident72 Ų7231.4 Ų31.434%0.33617%0.165SC..Hα-helixtrans-66.4-42.4-179.1-71.9-147.8-6.700112Y1076 T1077 Q1078 E1079 T1080 L1084 L1085 W1086 P1257Y1076-Q1082 VanDerWaalsContact O-CG 3.31Å; Y1076-Q1082 WeakPolarHBondContact O-CG 3.38Å; Y1076-Q1082 PolarHBondContact O-NE2 3.11Å; T1077-Q1082 VanDerWaalsContact C-NE2 3.33Å; T1077-Q1082 PolarHBondContact O-NE2 3.38Å; T1077-Q1082 VanDerWaalsContact O-NE2 3.11Å; Q1078-Q1082 VanDerWaalsContact O-CG 3.25Å; Q1078-Q1082 WeakPolarHBondContact O-CG 3.4Å; Q1078-Q1082 PolarHBondContact O-N 3.15Å; Q1078-Q1082 VanDerWaalsContact O-N 3.12Å; E1079-Q1082 WeakPolarHBondContact O-CB 3.48Å; E1079-Q1082 PolarHBondContact O-N 3.36Å; E1079-Q1082 VanDerWaalsContact O-N 3.11Å; T1080-Q1082 VanDerWaalsContact C-N 3.3Å; T1080-Q1082 PolarHBondContact O-N 2.89Å; Q1082-L1084 VanDerWaalsContact C-N 3.31Å; Q1082-L1084 PolarHBondContact O-N 3.23Å; Q1082-L1085 PolarHBondContact O-N 3.05Å; Q1082-W1086 WeakPolarHBondContact O-CB 3.43Å; Q1082-W1086 PolarHBondContact O-N 3.22Å; Q1082-P1257 VanDerWaalsContact OE1-CD 3.23Å; Q1082-P1257 VanDerWaalsContact OE1-CG 3.24Å
1083L88.4Confident84.6Confident36 Ų3632.1 Ų32.119%0.18817%0.167CC..Hα-helixtrans-63.7-42.1175.2-68.1175.7000111.9K808 L811 E1079 T1080 W1086 L1087 L1432K808-L1083 HydrophobicContact CG-CD1 4.41Å; L811-L1083 HydrophobicContact CB-CB 4.3Å; L811-L1083 HydrophobicContact CD1-CB 3.61Å; L811-L1083 HydrophobicContact CD1-CD1 4.42Å; E1079-L1083 HydrophobicContact CG-CD1 4.05Å; E1079-L1083 HydrophobicContact CG-CG 4.4Å; E1079-L1083 WeakPolarHBondContact O-CG 3.33Å; E1079-L1083 PolarHBondContact O-N 2.89Å; T1080-L1083 PolarHBondContact O-N 3.18Å; L1083-W1086 PolarHBondContact O-N 3.12Å; L1083-L1087 WeakPolarHBondContact O-CB 3.36Å; L1083-L1087 PolarHBondContact O-N 3.3Å; L1083-L1432 HydrophobicContact CB-CD2 3.97Å; L1083-L1432 HydrophobicContact CD1-CD2 3.7Å; L1083-L1432 HydrophobicContact CD2-CD2 3.35Å; L1083-L1432 HydrophobicContact CD2-CG 3.75Å; L1083-L1432 HydrophobicContact CG-CD2 3.82Å
1084L90.7Very high84.4Confident0.8 Ų0.829.9 Ų29.90%0.00416%0.157CC..Hα-helixtrans-63.9-44.6176.2-94.6150.1000112.3M807 L811 A1061 L1065 T1080 P1081 Q1082 W1086 L1087 L1088 I1185 L1189M807-L1084 HydrophobicContact CE-CD1 4.38Å; M807-L1084 HydrophobicContact CE-CD2 4.41Å; L811-L1084 HydrophobicContact CD1-CD2 4.27Å; L811-L1084 HydrophobicContact CD1-CG 3.89Å; L811-L1084 HydrophobicContact CD2-CD2 3.65Å; L811-L1084 HydrophobicContact CD2-CG 4.16Å; A1061-L1084 HydrophobicContact CB-CD1 4.2Å; A1061-L1084 HydrophobicContact CB-CD2 4.25Å; L1065-L1084 HydrophobicContact CD1-CD1 4.17Å; L1065-L1084 HydrophobicContact CD2-CD1 3.94Å; L1065-L1084 HydrophobicContact CD2-CD2 4.02Å; T1080-L1084 HydrophobicContact CG2-CD1 4.02Å; T1080-L1084 WeakPolarHBondContact O-CB 3.35Å; T1080-L1084 WeakPolarHBondContact O-CG 3.41Å; T1080-L1084 PolarHBondContact O-N 3.13Å; P1081-L1084 PolarHBondContact O-N 3.08Å; Q1082-L1084 VanDerWaalsContact C-N 3.31Å; Q1082-L1084 PolarHBondContact O-N 3.23Å; L1084-W1086 VanDerWaalsContact C-N 3.29Å; L1084-W1086 PolarHBondContact O-N 3.15Å; L1084-L1087 PolarHBondContact O-N 2.92Å; L1084-L1088 WeakPolarHBondContact O-CB 3.39Å; L1084-L1088 VanDerWaalsContact O-CG 3.31Å; L1084-L1088 WeakPolarHBondContact O-CG 3.34Å; L1084-L1088 PolarHBondContact O-N 3.2Å; L1084-I1185 HydrophobicContact CB-CG2 4.35Å; L1084-I1185 HydrophobicContact CD1-CD1 4.32Å; L1084-I1185 HydrophobicContact CD1-CG2 4.3Å; L1084-I1185 HydrophobicContact CD2-CD1 4.48Å; L1084-I1185 HydrophobicContact CD2-CG1 4.44Å; L1084-I1185 HydrophobicContact CD2-CG2 4.16Å; L1084-I1185 VanDerWaalsContact CD2-CG2 3.5Å; L1084-I1185 HydrophobicContact CG-CG2 3.8Å; L1084-L1189 HydrophobicContact CB-CD1 4.36Å; L1084-L1189 HydrophobicContact CD1-CD1 4.27Å; L1084-L1189 HydrophobicContact CD1-CD2 4.26Å; L1084-L1189 HydrophobicContact CD2-CD1 4.49Å
1085L89.8Confident84.1Confident0.6 Ų0.629.2 Ų29.20%0.00315%0.149CC..Hα-helixtrans-66.2-32.8177-69.1167000112.1Y1076 P1081 Q1082 G1089 L1189 P1257 V1258 L1261 L1338Y1076-L1085 HydrophobicContact CD1-CD1 4.1Å; Y1076-L1085 HydrophobicContact CD1-CG 4.41Å; Y1076-L1085 HydrophobicContact CG-CD1 4.35Å; P1081-L1085 WeakPolarHBondContact O-CB 3.34Å; P1081-L1085 VanDerWaalsContact O-CD1 3.32Å; P1081-L1085 WeakPolarHBondContact O-CD1 3.36Å; P1081-L1085 VanDerWaalsContact O-CG 3.22Å; P1081-L1085 WeakPolarHBondContact O-CG 3.35Å; P1081-L1085 PolarHBondContact O-N 3.19Å; Q1082-L1085 PolarHBondContact O-N 3.05Å; L1085-G1089 PolarHBondContact O-N 3.21Å; L1085-L1189 HydrophobicContact CD2-CD1 4.35Å; L1085-L1189 HydrophobicContact CG-CD1 4.3Å; L1085-P1257 HydrophobicContact CB-CB 4.07Å; L1085-V1258 HydrophobicContact CD1-CB 4.09Å; L1085-V1258 HydrophobicContact CD1-CG2 4.08Å; L1085-L1261 HydrophobicContact CD2-CD2 3.48Å; L1085-L1261 VanDerWaalsContact CD2-CD2 3.48Å; L1085-L1338 HydrophobicContact CD2-CD2 3.89Å
1086W88.4Confident83.3Confident46 Ų4629.6 Ų29.617%0.17415%0.147CC..Hα-helixtrans-70.6-45.9175.8-16173.9000111.3A815 Q1082 L1083 L1084 L1088 G1089 D1090 P1257 R1260 L1432 R1435A815-W1086 HydrophobicContact CB-CZ3 4.35Å; Q1082-W1086 WeakPolarHBondContact O-CB 3.43Å; Q1082-W1086 PolarHBondContact O-N 3.22Å; L1083-W1086 PolarHBondContact O-N 3.12Å; L1084-W1086 VanDerWaalsContact C-N 3.29Å; L1084-W1086 PolarHBondContact O-N 3.15Å; W1086-L1088 PolarHBondContact O-N 3.2Å; W1086-G1089 CarbonylContact O-C 3.5Å; W1086-G1089 VanDerWaalsContact O-CA 3.29Å; W1086-G1089 WeakPolarHBondContact O-CA 3.36Å; W1086-G1089 PolarHBondContact O-N 3.03Å; W1086-D1090 VanDerWaalsContact CE3-OD2 3.23Å; W1086-D1090 WeakPolarHBondContact CH2-OD1 3.32Å; W1086-D1090 VanDerWaalsContact CH2-OD2 3.26Å; W1086-D1090 WeakPolarHBondContact CH2-OD2 3.28Å; W1086-D1090 WeakPolarHBondContact CZ3-OD2 3.3Å; W1086-D1090 PolarHBondContact O-N 3.14Å; W1086-D1090 VanDerWaalsContact O-OD2 3.09Å; W1086-P1257 HydrophobicContact CB-CB 4.14Å; W1086-P1257 HydrophobicContact CB-CG 4.27Å; W1086-P1257 HydrophobicContact CG-CB 4.48Å; W1086-P1257 HydrophobicContact CG-CG 4.44Å; W1086-R1260 PolarHBondContact O-NH1 3.25Å; W1086-L1432 HydrophobicContact CE3-CD1 3.4Å; W1086-L1432 VanDerWaalsContact CE3-CD1 3.4Å; W1086-L1432 HydrophobicContact CE3-CG 4.14Å; W1086-L1432 HydrophobicContact CZ3-CB 4.42Å; W1086-L1432 HydrophobicContact CZ3-CD1 3.76Å; W1086-L1432 HydrophobicContact CZ3-CG 4.31Å; W1086-R1435 VanDerWaalsContact CH2-CZ 3.46Å; W1086-R1435 VanDerWaalsContact CZ3-NH1 3.28Å
1087L90.6Very high81.9Confident1.6 Ų1.629.6 Ų29.61%0.00815%0.151CC..Hα-helixtrans-58.3-45174.3-176.967.2000112.1L811 F814 A815 V818 L1083 L1084 G1089 D1090 M1091L811-L1087 HydrophobicContact CD2-CD2 3.76Å; F814-L1087 HydrophobicContact CB-CD1 4.05Å; F814-L1087 HydrophobicContact CB-CD2 3.85Å; F814-L1087 HydrophobicContact CD2-CD2 4.24Å; A815-L1087 HydrophobicContact CB-CD1 4.36Å; V818-L1087 HydrophobicContact CB-CD1 4.48Å; V818-L1087 HydrophobicContact CG2-CD1 3.95Å; L1083-L1087 WeakPolarHBondContact O-CB 3.36Å; L1083-L1087 PolarHBondContact O-N 3.3Å; L1084-L1087 PolarHBondContact O-N 2.92Å; L1087-G1089 VanDerWaalsContact C-N 3.26Å; L1087-G1089 PolarHBondContact O-N 3.16Å; L1087-D1090 WeakPolarHBondContact CA-OD2 3.06Å; L1087-D1090 PolarHBondContact O-N 3.29Å; L1087-D1090 VanDerWaalsContact O-N 3.16Å; L1087-M1091 HydrophobicContact CD1-CE 4.09Å; L1087-M1091 HydrophobicContact CD2-CE 4.11Å; L1087-M1091 HydrophobicContact CG-CE 3.95Å; L1087-M1091 HydrophobicContact CG-SD 4.37Å; L1087-M1091 WeakPolarHBondContact O-CB 3.32Å; L1087-M1091 VanDerWaalsContact O-CG 3.28Å; L1087-M1091 WeakPolarHBondContact O-CG 3.35Å; L1087-M1091 PolarHBondContact O-N 3.22Å
1088L90.7Very high80.6Confident1.2 Ų1.227.4 Ų27.41%0.00614%0.135CC..Hα-helixtrans-60.6-33.3173.8-73171.8000112.2L1058 L1084 W1086 L1092 W1178 A1182 I1185 L1261L1058-L1088 HydrophobicContact CD1-CD2 3.7Å; L1058-L1088 HydrophobicContact CD2-CD2 3.79Å; L1058-L1088 HydrophobicContact CG-CD2 4.42Å; L1084-L1088 WeakPolarHBondContact O-CB 3.39Å; L1084-L1088 VanDerWaalsContact O-CG 3.31Å; L1084-L1088 WeakPolarHBondContact O-CG 3.34Å; L1084-L1088 PolarHBondContact O-N 3.2Å; W1086-L1088 PolarHBondContact O-N 3.2Å; L1088-L1092 WeakPolarHBondContact O-CD1 3.28Å; L1088-L1092 VanDerWaalsContact O-CG 3.31Å; L1088-L1092 WeakPolarHBondContact O-CG 3.29Å; L1088-L1092 PolarHBondContact O-N 3.05Å; L1088-L1092 VanDerWaalsContact O-N 3.1Å; L1088-W1178 HydrophobicContact CD2-CH2 3.88Å; L1088-W1178 HydrophobicContact CD2-CZ2 3.6Å; L1088-A1182 HydrophobicContact CD2-CB 3.83Å; L1088-I1185 HydrophobicContact CD1-CG2 4.24Å; L1088-L1261 HydrophobicContact CB-CD1 3.96Å; L1088-L1261 HydrophobicContact CB-CD2 4.19Å; L1088-L1261 HydrophobicContact CD1-CD2 4.16Å
1089G87.3Confident78.6Confident0.2 Ų0.225.5 Ų25.50%0.00213%0.13CC..Hα-helixtrans-66-49.5172.400000112.5L1085 W1086 L1087 M1091 L1092 E1093 L1264L1085-G1089 PolarHBondContact O-N 3.21Å; W1086-G1089 CarbonylContact O-C 3.5Å; W1086-G1089 VanDerWaalsContact O-CA 3.29Å; W1086-G1089 WeakPolarHBondContact O-CA 3.36Å; W1086-G1089 PolarHBondContact O-N 3.03Å; L1087-G1089 VanDerWaalsContact C-N 3.26Å; L1087-G1089 PolarHBondContact O-N 3.16Å; G1089-M1091 VanDerWaalsContact C-N 3.35Å; G1089-M1091 PolarHBondContact O-N 3.33Å; G1089-L1092 PolarHBondContact O-N 3.06Å; G1089-L1092 VanDerWaalsContact O-N 3.15Å; G1089-E1093 WeakPolarHBondContact O-CB 3.44Å; G1089-E1093 PolarHBondContact O-N 3.06Å; G1089-L1264 VanDerWaalsContact O-CD1 3.31Å; G1089-L1264 WeakPolarHBondContact O-CD1 3.33Å
1090D86.1Confident76.4Confident20.8 Ų20.825.1 Ų25.111%0.11114%0.136CC..Hα-helixtrans-60.3-44.7178.6-61.2-26.7000111.8V818 W1086 L1087 L1092 E1093 L1094 R1260V818-D1090 HydrophobicContact CG1-CB 3.63Å; V818-D1090 VanDerWaalsContact CG1-CB 3.46Å; W1086-D1090 VanDerWaalsContact CE3-OD2 3.23Å; W1086-D1090 WeakPolarHBondContact CH2-OD1 3.32Å; W1086-D1090 VanDerWaalsContact CH2-OD2 3.26Å; W1086-D1090 WeakPolarHBondContact CH2-OD2 3.28Å; W1086-D1090 WeakPolarHBondContact CZ3-OD2 3.3Å; W1086-D1090 PolarHBondContact O-N 3.14Å; W1086-D1090 VanDerWaalsContact O-OD2 3.09Å; L1087-D1090 WeakPolarHBondContact CA-OD2 3.06Å; L1087-D1090 PolarHBondContact O-N 3.29Å; L1087-D1090 VanDerWaalsContact O-N 3.16Å; D1090-L1092 VanDerWaalsContact C-N 3.31Å; D1090-L1092 PolarHBondContact O-N 3.22Å; D1090-E1093 WeakPolarHBondContact O-CA 3.27Å; D1090-E1093 WeakPolarHBondContact O-CB 3.43Å; D1090-E1093 PolarHBondContact O-N 3.12Å; D1090-E1093 VanDerWaalsContact O-N 3.12Å; D1090-L1094 PolarHBondContact O-N 3.4Å; D1090-L1094 VanDerWaalsContact O-N 3.11Å; D1090-R1260 IonicContact OD1-CZ 3.16Å; D1090-R1260 IonicContact OD1-NH1 3.1Å; D1090-R1260 PolarHBondContact OD1-NH1 3.08Å; D1090-R1260 IonicContact OD1-NH2 3.23Å; D1090-R1260 PolarHBondContact OD1-NH2 3.08Å
1091M87.7Confident74Confident4 Ų430.9 Ų30.92%0.0216%0.16CC..Hα-helixtrans-61.1-38.1177.1-70.6-176.6168.200112.6V818 L1054 M1057 L1058 L1087 G1089 E1093 L1094 Y1095 W1178V818-M1091 HydrophobicContact CG1-CG 4.45Å; V818-M1091 HydrophobicContact CG2-CE 3.87Å; V818-M1091 HydrophobicContact CG2-CG 3.8Å; L1054-M1091 HydrophobicContact CB-SD 4.41Å; L1054-M1091 HydrophobicContact CD1-CB 4.45Å; L1054-M1091 HydrophobicContact CD1-CG 4.46Å; L1054-M1091 HydrophobicContact CD2-CE 4.08Å; L1054-M1091 HydrophobicContact CD2-CG 4.04Å; L1054-M1091 HydrophobicContact CD2-SD 4.34Å; M1057-M1091 HydrophobicContact CB-CE 3.74Å; M1057-M1091 HydrophobicContact CG-CE 4.37Å; M1057-M1091 HydrophobicContact SD-CE 3.72Å; L1058-M1091 HydrophobicContact CD1-SD 4.42Å; L1058-M1091 HydrophobicContact CD2-CE 4.13Å; L1058-M1091 HydrophobicContact CD2-SD 3.78Å; L1058-M1091 HydrophobicContact CG-CE 4.41Å; L1058-M1091 HydrophobicContact CG-SD 3.97Å; L1087-M1091 HydrophobicContact CD1-CE 4.09Å; L1087-M1091 HydrophobicContact CD2-CE 4.11Å; L1087-M1091 HydrophobicContact CG-CE 3.95Å; L1087-M1091 HydrophobicContact CG-SD 4.37Å; L1087-M1091 WeakPolarHBondContact O-CB 3.32Å; L1087-M1091 VanDerWaalsContact O-CG 3.28Å; L1087-M1091 WeakPolarHBondContact O-CG 3.35Å; L1087-M1091 PolarHBondContact O-N 3.22Å; G1089-M1091 VanDerWaalsContact C-N 3.35Å; G1089-M1091 PolarHBondContact O-N 3.33Å; M1091-E1093 VanDerWaalsContact C-N 3.31Å; M1091-E1093 PolarHBondContact O-N 2.85Å; M1091-L1094 WeakPolarHBondContact O-CB 3.15Å; M1091-L1094 PolarHBondContact O-N 3.2Å; M1091-Y1095 VanDerWaalsContact O-CD2 3.26Å; M1091-Y1095 WeakPolarHBondContact O-CD2 3.22Å; M1091-Y1095 WeakPolarHBondContact O-CE2 3.33Å; M1091-W1178 HydrophobicContact CB-CZ2 3.78Å; M1091-W1178 HydrophobicContact CG-CZ2 4.5Å; M1091-W1178 HydrophobicContact SD-CZ2 4.23Å; M1091-W1178 PolarHBondContact SD-NE1 3.15Å; M1091-W1178 VanDerWaalsContact SD-NE1 3.38Å
1092L83.4Confident71.4Confident1.2 Ų1.235.8 Ų35.81%0.00619%0.19CC..Hα-helixtrans-71.2-32.8173.3-73.8176.3000112L1088 G1089 D1090 L1094 Y1095 W1096 W1178 F1179 L1261 L1264 L1265 F1268L1088-L1092 WeakPolarHBondContact O-CD1 3.28Å; L1088-L1092 VanDerWaalsContact O-CG 3.31Å; L1088-L1092 WeakPolarHBondContact O-CG 3.29Å; L1088-L1092 PolarHBondContact O-N 3.05Å; L1088-L1092 VanDerWaalsContact O-N 3.1Å; G1089-L1092 PolarHBondContact O-N 3.06Å; G1089-L1092 VanDerWaalsContact O-N 3.15Å; D1090-L1092 VanDerWaalsContact C-N 3.31Å; D1090-L1092 PolarHBondContact O-N 3.22Å; L1092-L1094 VanDerWaalsContact C-N 3.33Å; L1092-L1094 PolarHBondContact O-N 3.29Å; L1092-Y1095 WeakPolarHBondContact O-CA 3.33Å; L1092-Y1095 VanDerWaalsContact O-CB 3.27Å; L1092-Y1095 WeakPolarHBondContact O-CB 3.32Å; L1092-Y1095 WeakPolarHBondContact O-CD2 3.4Å; L1092-Y1095 PolarHBondContact O-N 3.12Å; L1092-Y1095 VanDerWaalsContact O-N 3.1Å; L1092-W1096 HydrophobicContact CB-CH2 4.33Å; L1092-W1096 HydrophobicContact CB-CZ3 3.87Å; L1092-W1096 WeakPolarHBondContact O-CZ3 3.31Å; L1092-W1096 PolarHBondContact O-N 3.08Å; L1092-W1096 VanDerWaalsContact O-N 3.13Å; L1092-W1178 HydrophobicContact CD1-CH2 4.11Å; L1092-W1178 HydrophobicContact CD2-CE3 4.32Å; L1092-W1178 HydrophobicContact CD2-CH2 3.56Å; L1092-W1178 HydrophobicContact CD2-CZ2 4.21Å; L1092-W1178 HydrophobicContact CD2-CZ3 3.63Å; L1092-W1178 VanDerWaalsContact CD2-CZ3 3.45Å; L1092-W1178 HydrophobicContact CG-CH2 3.58Å; L1092-W1178 HydrophobicContact CG-CZ2 4.27Å; L1092-W1178 HydrophobicContact CG-CZ3 4.16Å; L1092-F1179 HydrophobicContact CD2-CE1 4.25Å; L1092-F1179 HydrophobicContact CD2-CZ 4.24Å; L1092-L1261 HydrophobicContact CD1-CD1 3.6Å; L1092-L1261 VanDerWaalsContact CD1-CD1 3.47Å; L1092-L1264 HydrophobicContact CB-CB 4.23Å; L1092-L1264 HydrophobicContact CB-CD1 4.17Å; L1092-L1264 HydrophobicContact CD1-CB 4Å; L1092-L1265 HydrophobicContact CD1-CD2 3.92Å; L1092-L1265 HydrophobicContact CD1-CG 4.13Å; L1092-F1268 HydrophobicContact CB-CE2 4.29Å; L1092-F1268 HydrophobicContact CD1-CE2 4.26Å; L1092-F1268 HydrophobicContact CD2-CD2 4.18Å; L1092-F1268 HydrophobicContact CD2-CE2 3.57Å; L1092-F1268 HydrophobicContact CD2-CZ 4.13Å; L1092-F1268 HydrophobicContact CG-CE2 4.26Å
1093E80Confident68.8Low22.4 Ų22.437.4 Ų37.411%0.10522%0.215CC..Hα-helixtrans-69.6-33.4179.6-144.5164.6168.300112.5G1089 D1090 M1091 Y1095 W1096 G1097 S1249 R1260 L1264G1089-E1093 WeakPolarHBondContact O-CB 3.44Å; G1089-E1093 PolarHBondContact O-N 3.06Å; D1090-E1093 WeakPolarHBondContact O-CA 3.27Å; D1090-E1093 WeakPolarHBondContact O-CB 3.43Å; D1090-E1093 PolarHBondContact O-N 3.12Å; D1090-E1093 VanDerWaalsContact O-N 3.12Å; M1091-E1093 VanDerWaalsContact C-N 3.31Å; M1091-E1093 PolarHBondContact O-N 2.85Å; E1093-Y1095 PolarHBondContact O-N 3.2Å; E1093-Y1095 VanDerWaalsContact O-N 3.15Å; E1093-W1096 PolarHBondContact O-N 3.23Å; E1093-W1096 VanDerWaalsContact O-N 3.09Å; E1093-G1097 PolarHBondContact O-N 3.01Å; E1093-S1249 WeakPolarHBondContact OE1-CA 3.19Å; E1093-S1249 WeakPolarHBondContact OE1-CB 3.23Å; E1093-S1249 PolarHBondContact OE1-OG 3.07Å; E1093-R1260 IonicContact OE2-CZ 3.2Å; E1093-R1260 VanDerWaalsContact OE2-CZ 3.3Å; E1093-R1260 IonicContact OE2-NE 3.15Å; E1093-R1260 PolarHBondContact OE2-NE 3Å; E1093-R1260 VanDerWaalsContact OE2-NE 3.13Å; E1093-R1260 IonicContact OE2-NH2 3.09Å; E1093-R1260 PolarHBondContact OE2-NH2 3.04Å; E1093-L1264 HydrophobicContact CB-CD1 4.48Å
1094L75.7Confident66Low3.8 Ų3.842.2 Ų42.22%0.0224%0.241CC..Hα-helixtrans-51.9-36.7167.2-71.1-178.2000112.7V818 L821 F822 L825 L1054 D1090 M1091 L1092 W1096 G1110 L1111V818-L1094 HydrophobicContact CB-CD1 4.5Å; V818-L1094 HydrophobicContact CG1-CD1 3.86Å; V818-L1094 HydrophobicContact CG1-CD2 4.35Å; V818-L1094 HydrophobicContact CG1-CG 4.22Å; L821-L1094 HydrophobicContact CB-CD1 4.3Å; L821-L1094 HydrophobicContact CB-CD2 4.44Å; F822-L1094 VanDerWaalsContact CA-CD2 3.49Å; F822-L1094 HydrophobicContact CB-CD2 3.67Å; F822-L1094 HydrophobicContact CD2-CD2 3.72Å; F822-L1094 HydrophobicContact CD2-CG 4.16Å; F822-L1094 HydrophobicContact CG-CD2 4.15Å; L825-L1094 HydrophobicContact CD1-CD2 3.79Å; L1054-L1094 HydrophobicContact CD1-CD1 3.99Å; L1054-L1094 HydrophobicContact CD2-CD1 4.05Å; L1054-L1094 HydrophobicContact CG-CD1 4.49Å; D1090-L1094 PolarHBondContact O-N 3.4Å; D1090-L1094 VanDerWaalsContact O-N 3.11Å; M1091-L1094 WeakPolarHBondContact O-CB 3.15Å; M1091-L1094 PolarHBondContact O-N 3.2Å; L1092-L1094 VanDerWaalsContact C-N 3.33Å; L1092-L1094 PolarHBondContact O-N 3.29Å; L1094-W1096 VanDerWaalsContact C-N 3.34Å; L1094-W1096 PolarHBondContact O-N 3.38Å; L1094-G1110 WeakPolarHBondContact O-CA 3.32Å; L1094-L1111 HydrophobicContact CB-CD1 4.15Å; L1094-L1111 HydrophobicContact CB-CG 4.41Å; L1094-L1111 PolarHBondContact O-N 3.12Å
1095Y68.4Low63.3Low16.8 Ų16.850.9 Ų50.97%0.06628%0.282CS..Hα-helixtrans-69.5-32.9179.3-162.5-87000112.8L1054 M1091 L1092 E1093 G1097 L1111 R1112 L1117 I1123 L1124 M1175 F1268L1054-Y1095 HydrophobicContact CD1-CE2 4.45Å; M1091-Y1095 VanDerWaalsContact O-CD2 3.26Å; M1091-Y1095 WeakPolarHBondContact O-CD2 3.22Å; M1091-Y1095 WeakPolarHBondContact O-CE2 3.33Å; L1092-Y1095 WeakPolarHBondContact O-CA 3.33Å; L1092-Y1095 VanDerWaalsContact O-CB 3.27Å; L1092-Y1095 WeakPolarHBondContact O-CB 3.32Å; L1092-Y1095 WeakPolarHBondContact O-CD2 3.4Å; L1092-Y1095 PolarHBondContact O-N 3.12Å; L1092-Y1095 VanDerWaalsContact O-N 3.1Å; E1093-Y1095 PolarHBondContact O-N 3.2Å; E1093-Y1095 VanDerWaalsContact O-N 3.15Å; Y1095-G1097 VanDerWaalsContact C-N 3.35Å; Y1095-L1111 HydrophobicContact CD1-CB 4.13Å; Y1095-L1111 HydrophobicContact CD1-CD1 3.96Å; Y1095-L1111 HydrophobicContact CD2-CB 4.09Å; Y1095-L1111 HydrophobicContact CD2-CD1 4.37Å; Y1095-L1111 HydrophobicContact CE1-CD1 3.9Å; Y1095-L1111 HydrophobicContact CG-CB 4.41Å; Y1095-L1111 PolarHBondContact O-N 3.28Å; Y1095-R1112 HydrophobicContact CD1-CG 4.03Å; Y1095-R1112 HydrophobicContact CE1-CG 3.7Å; Y1095-R1112 HydrophobicContact CE2-CG 4.14Å; Y1095-R1112 HydrophobicContact CG-CG 4.47Å; Y1095-R1112 VanDerWaalsContact O-CD 3.23Å; Y1095-R1112 WeakPolarHBondContact O-CD 3.24Å; Y1095-R1112 VanDerWaalsContact O-CG 3.23Å; Y1095-R1112 WeakPolarHBondContact O-CG 3.37Å; Y1095-R1112 PolarHBondContact O-N 3.2Å; Y1095-R1112 PolarHBondContact O-NE 3.13Å; Y1095-L1117 HydrophobicContact CE2-CD1 3.85Å; Y1095-L1117 HydrophobicContact CE2-CD2 4.13Å; Y1095-L1117 WeakPolarHBondContact OH-CD1 3.32Å; Y1095-L1117 WeakPolarHBondContact OH-CD2 3.43Å; Y1095-I1123 PolarHBondContact OH-O 3.4Å; Y1095-L1124 HydrophobicContact CE2-CD2 3.95Å; Y1095-L1124 HydrophobicContact CE2-CG 4.2Å; Y1095-M1175 HydrophobicContact CD1-CE 4.16Å; Y1095-M1175 HydrophobicContact CD1-SD 4.33Å; Y1095-M1175 HydrophobicContact CD2-CE 3.94Å; Y1095-M1175 HydrophobicContact CD2-SD 4.38Å; Y1095-M1175 HydrophobicContact CE1-CE 3.57Å; Y1095-M1175 HydrophobicContact CE1-SD 3.3Å; Y1095-M1175 WeakPolarHBondContact CE1-SD 3.41Å; Y1095-M1175 HydrophobicContact CE2-CE 4.16Å; Y1095-M1175 HydrophobicContact CE2-SD 4.47Å; Y1095-M1175 PolarHBondContact OH-SD 3.26Å; Y1095-F1268 AromaticContact CD1-CE1 3.67Å; Y1095-F1268 HydrophobicContact CD1-CE1 3.85Å; Y1095-F1268 VanDerWaalsContact CD1-CE1 3.43Å; Y1095-F1268 AromaticContact CD1-CE2 3.52Å; Y1095-F1268 HydrophobicContact CD1-CE2 3.69Å; Y1095-F1268 AromaticContact CD1-CZ 3.13Å; Y1095-F1268 HydrophobicContact CD1-CZ 3.13Å; Y1095-F1268 HydrophobicContact CD2-CE1 4.38Å; Y1095-F1268 HydrophobicContact CD2-CZ 4.17Å; Y1095-F1268 HydrophobicContact CE1-CD1 4.16Å; Y1095-F1268 AromaticContact CE1-CE1 3.52Å; Y1095-F1268 HydrophobicContact CE1-CE1 3.52Å; Y1095-F1268 AromaticContact CE1-CE2 3.65Å; Y1095-F1268 HydrophobicContact CE1-CE2 3.95Å; Y1095-F1268 AromaticContact CE1-CZ 3.31Å; Y1095-F1268 HydrophobicContact CE1-CZ 3.31Å; Y1095-F1268 VanDerWaalsContact CE1-CZ 3.43Å; Y1095-F1268 HydrophobicContact CE2-CE1 4.19Å; Y1095-F1268 HydrophobicContact CE2-CZ 4.31Å; Y1095-F1268 HydrophobicContact CG-CE1 4.03Å; Y1095-F1268 HydrophobicContact CG-CE2 4.13Å; Y1095-F1268 AromaticContact CG-CZ 3.6Å; Y1095-F1268 HydrophobicContact CG-CZ 3.6Å; Y1095-F1268 VanDerWaalsContact CG-CZ 3.49Å; Y1095-F1268 AromaticContact CZ-CE1 3.79Å; Y1095-F1268 AromaticContact CZ-CZ 3.64Å
1096W60.9Low60.7Low18.4 Ų18.457.3 Ų57.37%0.0732%0.321CS..Hα-helixtrans-83.5-23.9179.7-65.791.9000113.4L1092 E1093 L1094 N1098 V1099 R1112 R1267 F1268 L1319L1092-W1096 HydrophobicContact CB-CH2 4.33Å; L1092-W1096 HydrophobicContact CB-CZ3 3.87Å; L1092-W1096 WeakPolarHBondContact O-CZ3 3.31Å; L1092-W1096 PolarHBondContact O-N 3.08Å; L1092-W1096 VanDerWaalsContact O-N 3.13Å; E1093-W1096 PolarHBondContact O-N 3.23Å; E1093-W1096 VanDerWaalsContact O-N 3.09Å; L1094-W1096 VanDerWaalsContact C-N 3.34Å; L1094-W1096 PolarHBondContact O-N 3.38Å; W1096-N1098 PolarHBondContact O-N 3.18Å; W1096-V1099 HydrophobicContact CB-CG2 4.2Å; W1096-V1099 VanDerWaalsContact O-CG2 3.3Å; W1096-V1099 WeakPolarHBondContact O-CG2 3.26Å; W1096-R1112 VanDerWaalsContact CD1-NH2 3.26Å; W1096-R1112 VanDerWaalsContact CD2-NH2 3.27Å; W1096-R1112 VanDerWaalsContact CE3-NE 3.33Å; W1096-R1112 VanDerWaalsContact CH2-NH2 3.34Å; W1096-R1112 PolarHBondContact O-NE 3.04Å; W1096-R1112 PolarHBondContact O-NH2 2.99Å; W1096-R1267 HydrophobicContact CD2-CG 4.44Å; W1096-R1267 VanDerWaalsContact CE3-CD 3.47Å; W1096-R1267 HydrophobicContact CE3-CG 4.22Å; W1096-R1267 VanDerWaalsContact CE3-NE 3.26Å; W1096-R1267 HydrophobicContact CH2-CB 3.94Å; W1096-R1267 HydrophobicContact CH2-CG 3.47Å; W1096-R1267 VanDerWaalsContact CH2-CG 3.46Å; W1096-R1267 VanDerWaalsContact CH2-O 3.24Å; W1096-R1267 WeakPolarHBondContact CH2-O 3.28Å; W1096-R1267 VanDerWaalsContact CZ2-C 3.47Å; W1096-R1267 HydrophobicContact CZ2-CB 3.74Å; W1096-R1267 HydrophobicContact CZ2-CG 3.74Å; W1096-R1267 HydrophobicContact CZ3-CB 4.25Å; W1096-R1267 VanDerWaalsContact CZ3-CD 3.4Å; W1096-R1267 HydrophobicContact CZ3-CG 3.76Å; W1096-R1267 VanDerWaalsContact CZ3-CG 3.47Å; W1096-R1267 VanDerWaalsContact CZ3-NE 3.26Å; W1096-F1268 AromaticContact CE2-CD2 3.85Å; W1096-F1268 AromaticContact CE2-CE2 3.6Å; W1096-F1268 AromaticContact CE2-CZ 3.8Å; W1096-F1268 HydrophobicContact CZ2-CB 4.33Å; W1096-F1268 HydrophobicContact CZ2-CD1 4.09Å; W1096-F1268 AromaticContact CZ2-CD2 3.55Å; W1096-F1268 HydrophobicContact CZ2-CD2 3.73Å; W1096-F1268 VanDerWaalsContact CZ2-CD2 3.4Å; W1096-F1268 AromaticContact CZ2-CE1 3.89Å; W1096-F1268 HydrophobicContact CZ2-CE1 4.16Å; W1096-F1268 AromaticContact CZ2-CE2 3.68Å; W1096-F1268 HydrophobicContact CZ2-CE2 4.02Å; W1096-F1268 AromaticContact CZ2-CG 3.81Å; W1096-F1268 HydrophobicContact CZ2-CG 4Å; W1096-F1268 AromaticContact CZ2-CZ 3.93Å; W1096-F1268 HydrophobicContact CZ2-CZ 4.08Å; W1096-F1268 AromaticContact NE1-CD2 3.64Å; W1096-F1268 AromaticContact NE1-CE1 3.96Å; W1096-F1268 AromaticContact NE1-CE2 3.52Å; W1096-F1268 AromaticContact NE1-CZ 3.2Å; W1096-L1319 HydrophobicContact CE3-CD2 4.24Å; W1096-L1319 HydrophobicContact CH2-CD1 4.01Å; W1096-L1319 HydrophobicContact CH2-CD2 3.68Å; W1096-L1319 HydrophobicContact CH2-CG 4.46Å; W1096-L1319 HydrophobicContact CZ3-CD1 3.62Å; W1096-L1319 HydrophobicContact CZ3-CD2 3.31Å; W1096-L1319 HydrophobicContact CZ3-CG 4.08Å
1097G52.8Low58.3Low11.8 Ų11.859.6 Ų59.612%0.12234%0.344CS..  trans57165.9-170.500000112.9E1093 Y1095 V1099 R1112E1093-G1097 PolarHBondContact O-N 3.01Å; Y1095-G1097 VanDerWaalsContact C-N 3.35Å; G1097-V1099 VanDerWaalsContact C-N 3.3Å; G1097-V1099 PolarHBondContact O-N 3.13Å; G1097-R1112 PolarHBondContact O-NH2 3.35Å
1098N47.1Very low56Low63.4 Ų63.461.9 Ų61.934%0.33936%0.36SS..  trans-60.192.3177.2-91.2-11.1000111.6F822 W1096 T1100 S1108 R1112F822-N1098 HydrophobicContact CZ-CB 3.86Å; F822-N1098 WeakPolarHBondContact CZ-OD1 3.15Å; W1096-N1098 PolarHBondContact O-N 3.18Å; N1098-T1100 HydrophobicContact CB-CG2 4.38Å; N1098-T1100 PolarHBondContact O-N 3.17Å; N1098-S1108 PolarHBondContact N-OG 3.08Å; N1098-R1112 PolarHBondContact O-NH2 3.44Å
1099V40.3Very low53.9Low64.6 Ų64.664.7 Ų64.739%0.39238%0.38SS..  trans-86.973.3169.7-173.60000109.1W1096 G1097 E1101 R1112 I1317W1096-V1099 HydrophobicContact CB-CG2 4.2Å; W1096-V1099 VanDerWaalsContact O-CG2 3.3Å; W1096-V1099 WeakPolarHBondContact O-CG2 3.26Å; G1097-V1099 VanDerWaalsContact C-N 3.3Å; G1097-V1099 PolarHBondContact O-N 3.13Å; V1099-E1101 HydrophobicContact CG1-CB 4.46Å; V1099-E1101 HydrophobicContact CG1-CG 3.77Å; V1099-E1101 WeakPolarHBondContact CG1-OE1 3.34Å; V1099-E1101 PolarHBondContact O-N 2.86Å; V1099-R1112 VanDerWaalsContact CG2-NH2 3.28Å; V1099-I1317 HydrophobicContact CG1-CD1 3.65Å
1100T36.8Very low52.4Low99 Ų9965.1 Ų65.161%0.60738%0.384SS*.  trans-90.3102.516247.70000108.2N1098 T1102N1098-T1100 HydrophobicContact CB-CG2 4.38Å; N1098-T1100 PolarHBondContact O-N 3.17Å; T1100-T1102 VanDerWaalsContact C-N 3.34Å; T1100-T1102 PolarHBondContact O-N 3.11Å
1101E34Very low51Low161.6 Ų161.664.5 Ų64.576%0.75538%0.381SS*.  trans-72.566.4176.9-72.1175.7175.800111.4V1099 R1267V1099-E1101 HydrophobicContact CG1-CB 4.46Å; V1099-E1101 HydrophobicContact CG1-CG 3.77Å; V1099-E1101 WeakPolarHBondContact CG1-OE1 3.34Å; V1099-E1101 PolarHBondContact O-N 2.86Å; E1101-R1267 IonicContact OE1-NH2 3.79Å; E1101-R1267 PolarHBondContact OE1-NH2 2.86Å
1102T33Very low49.4Very low106.6 Ų106.668.3 Ų68.365%0.65440%0.395SS*.  trans-105.2134.8163.549.50000108.9T1100 D1104T1100-T1102 VanDerWaalsContact C-N 3.34Å; T1100-T1102 PolarHBondContact O-N 3.11Å; T1102-D1104 PolarHBondContact O-N 3.17Å; T1102-D1104 VanDerWaalsContact O-N 3.08Å
1103A31.9Very low47.7Very low105.4 Ų105.472.8 Ų72.887%0.87142%0.419SS*.SBendtrans-72.721.2-165.300000115.7
1104D31.1Very low46.4Very low136.2 Ų136.274.3 Ų74.373%0.72843%0.427SS*.SBendtrans-110.9132.6175.4-79-44.2000111.3T1102 T1106T1102-D1104 PolarHBondContact O-N 3.17Å; T1102-D1104 VanDerWaalsContact O-N 3.08Å; D1104-T1106 VanDerWaalsContact C-N 3.3Å; D1104-T1106 PolarHBondContact O-N 3.11Å
1105Q33.7Very low45.1Very low183.4 Ų183.481.4 Ų81.486%0.85746%0.46SS*.SBendtrans-71.294.4-174.5-59.9179.917.400115.3
1106T34.7Very low44.2Very low134.8 Ų134.881 Ų8183%0.82746%0.46SS*.  trans-158.382.9171.359.30000114.2D1104 S1108D1104-T1106 VanDerWaalsContact C-N 3.3Å; D1104-T1106 PolarHBondContact O-N 3.11Å; T1106-S1108 PolarHBondContact O-N 3.12Å; T1106-S1108 VanDerWaalsContact O-N 3.16Å
1107S38.1Very low43.4Very low95 Ų9585.2 Ų85.266%0.66448%0.483SS*.  trans-65.9119.7172.560.50000113.1S1109S1107-S1109 PolarHBondContact O-N 3.05Å
1108S41.5Very low42.8Very low49.4 Ų49.486.8 Ų86.835%0.34550%0.5SS..  trans-42.4122.6177.264.50000112.4L826 N1098 T1106 G1110L826-S1108 WeakPolarHBondContact CD2-OG 3.46Å; N1098-S1108 PolarHBondContact N-OG 3.08Å; T1106-S1108 PolarHBondContact O-N 3.12Å; T1106-S1108 VanDerWaalsContact O-N 3.16Å; S1108-G1110 PolarHBondContact O-N 3.16Å; S1108-G1110 VanDerWaalsContact O-N 3.12Å
1109S48.3Very low42.6Very low59.8 Ų59.885.6 Ų85.642%0.41849%0.493SS..  trans-85.194.217849.20000110.9L825 S1107 N1113L825-S1109 WeakPolarHBondContact CD2-O 3.24Å; L825-S1109 PolarHBondContact O-OG 3.16Å; S1107-S1109 PolarHBondContact O-N 3.05Å; S1109-N1113 VanDerWaalsContact CB-CG 3.4Å; S1109-N1113 VanDerWaalsContact CB-ND2 3.34Å; S1109-N1113 WeakPolarHBondContact CB-ND2 3.4Å; S1109-N1113 WeakPolarHBondContact OG-CB 3.49Å; S1109-N1113 PolarHBondContact OG-ND2 2.93Å
1110G54.7Low42.8Very low8 Ų889.5 Ų89.58%0.08251%0.507CS..  trans-62.6179.2165.300000111.8L1094 S1108 R1112 N1113L1094-G1110 WeakPolarHBondContact O-CA 3.32Å; S1108-G1110 PolarHBondContact O-N 3.16Å; S1108-G1110 VanDerWaalsContact O-N 3.12Å; G1110-R1112 PolarHBondContact O-N 3.08Å; G1110-N1113 PolarHBondContact O-N 2.98Å
1111L56.4Low43.2Very low8.4 Ų8.489.2 Ų89.24%0.04451%0.505CS..G310 helixtrans-56.9-12.9-175.4-59.5168.3000114.4L825 I1050 L1054 L1094 Y1095 N1113 L1114 L1124L825-L1111 HydrophobicContact CD1-CD2 4.11Å; L825-L1111 HydrophobicContact CD1-CG 4.34Å; L825-L1111 HydrophobicContact CD2-CD2 4.35Å; I1050-L1111 HydrophobicContact CB-CD2 4.15Å; I1050-L1111 HydrophobicContact CD1-CD2 4.19Å; I1050-L1111 HydrophobicContact CG2-CD1 4.39Å; I1050-L1111 HydrophobicContact CG2-CD2 3.91Å; L1054-L1111 HydrophobicContact CD1-CD1 4.02Å; L1094-L1111 HydrophobicContact CB-CD1 4.15Å; L1094-L1111 HydrophobicContact CB-CG 4.41Å; L1094-L1111 PolarHBondContact O-N 3.12Å; Y1095-L1111 HydrophobicContact CD1-CB 4.13Å; Y1095-L1111 HydrophobicContact CD1-CD1 3.96Å; Y1095-L1111 HydrophobicContact CD2-CB 4.09Å; Y1095-L1111 HydrophobicContact CD2-CD1 4.37Å; Y1095-L1111 HydrophobicContact CE1-CD1 3.9Å; Y1095-L1111 HydrophobicContact CG-CB 4.41Å; Y1095-L1111 PolarHBondContact O-N 3.28Å; L1111-N1113 PolarHBondContact O-N 3.09Å; L1111-N1113 VanDerWaalsContact O-N 3.09Å; L1111-L1114 HydrophobicContact CB-CD1 4.18Å; L1111-L1114 HydrophobicContact CD2-CD1 3.83Å; L1111-L1114 HydrophobicContact CD2-CG 4.43Å; L1111-L1114 HydrophobicContact CG-CD1 4.31Å; L1111-L1114 VanDerWaalsContact O-CB 3.31Å; L1111-L1114 WeakPolarHBondContact O-CB 3.27Å; L1111-L1114 WeakPolarHBondContact O-CD1 3.35Å; L1111-L1114 WeakPolarHBondContact O-CG 3.39Å; L1111-L1114 PolarHBondContact O-N 3.28Å; L1111-L1114 VanDerWaalsContact O-N 3.12Å; L1111-L1124 VanDerWaalsContact O-CD2 3.27Å; L1111-L1124 WeakPolarHBondContact O-CD2 3.41Å
1112R53.9Low44Very low83.6 Ų83.682.3 Ų82.332%0.31548%0.475SS..G310 helixtrans-48.5-28.3167.6-73.4171.4-176.6-113.7-17.4115.6Y1095 W1096 G1097 N1098 V1099 G1110 L1114 L1117 P1125Y1095-R1112 HydrophobicContact CD1-CG 4.03Å; Y1095-R1112 HydrophobicContact CE1-CG 3.7Å; Y1095-R1112 HydrophobicContact CE2-CG 4.14Å; Y1095-R1112 HydrophobicContact CG-CG 4.47Å; Y1095-R1112 VanDerWaalsContact O-CD 3.23Å; Y1095-R1112 WeakPolarHBondContact O-CD 3.24Å; Y1095-R1112 VanDerWaalsContact O-CG 3.23Å; Y1095-R1112 WeakPolarHBondContact O-CG 3.37Å; Y1095-R1112 PolarHBondContact O-N 3.2Å; Y1095-R1112 PolarHBondContact O-NE 3.13Å; W1096-R1112 VanDerWaalsContact CD1-NH2 3.26Å; W1096-R1112 VanDerWaalsContact CD2-NH2 3.27Å; W1096-R1112 VanDerWaalsContact CE3-NE 3.33Å; W1096-R1112 VanDerWaalsContact CH2-NH2 3.34Å; W1096-R1112 PolarHBondContact O-NE 3.04Å; W1096-R1112 PolarHBondContact O-NH2 2.99Å; G1097-R1112 PolarHBondContact O-NH2 3.35Å; N1098-R1112 PolarHBondContact O-NH2 3.44Å; V1099-R1112 VanDerWaalsContact CG2-NH2 3.28Å; G1110-R1112 PolarHBondContact O-N 3.08Å; R1112-L1114 VanDerWaalsContact C-N 3.32Å; R1112-L1114 PolarHBondContact O-N 2.98Å; R1112-L1117 WeakPolarHBondContact O-CD1 3.49Å; R1112-P1125 VanDerWaalsContact O-CD 3.23Å; R1112-P1125 WeakPolarHBondContact O-CD 3.09Å; R1112-P1125 WeakPolarHBondContact O-CG 3.35Å
1113N49.4Very low44.7Very low95.6 Ų95.680.3 Ų80.351%0.51146%0.459SS..G310 helixtrans-89.50.2-179-78.84.1000113.8S1109 G1110 L1111 H1115S1109-N1113 VanDerWaalsContact CB-CG 3.4Å; S1109-N1113 VanDerWaalsContact CB-ND2 3.34Å; S1109-N1113 WeakPolarHBondContact CB-ND2 3.4Å; S1109-N1113 WeakPolarHBondContact OG-CB 3.49Å; S1109-N1113 PolarHBondContact OG-ND2 2.93Å; G1110-N1113 PolarHBondContact O-N 2.98Å; L1111-N1113 PolarHBondContact O-N 3.09Å; L1111-N1113 VanDerWaalsContact O-N 3.09Å; N1113-H1115 PolarHBondContact O-CE1 3.14Å; N1113-H1115 PolarHBondContact O-N 3.1Å; N1113-H1115 VanDerWaalsContact O-N 3.12Å; N1113-H1115 PolarHBondContact O-ND1 2.95Å
1114L52Low45.4Very low55 Ų5577.9 Ų77.929%0.28843%0.431SS..SBendtrans-58.9125.1169-74.3168.3000109.6T1051 L1111 R1112 C1116 L1124 D1171T1051-L1114 HydrophobicContact CG2-CD1 3.93Å; L1111-L1114 HydrophobicContact CB-CD1 4.18Å; L1111-L1114 HydrophobicContact CD2-CD1 3.83Å; L1111-L1114 HydrophobicContact CD2-CG 4.43Å; L1111-L1114 HydrophobicContact CG-CD1 4.31Å; L1111-L1114 VanDerWaalsContact O-CB 3.31Å; L1111-L1114 WeakPolarHBondContact O-CB 3.27Å; L1111-L1114 WeakPolarHBondContact O-CD1 3.35Å; L1111-L1114 WeakPolarHBondContact O-CG 3.39Å; L1111-L1114 PolarHBondContact O-N 3.28Å; L1111-L1114 VanDerWaalsContact O-N 3.12Å; R1112-L1114 VanDerWaalsContact C-N 3.32Å; R1112-L1114 PolarHBondContact O-N 2.98Å; L1114-C1116 VanDerWaalsContact C-N 3.29Å; L1114-C1116 CarbonylContact O-C 3.39Å; L1114-C1116 PolarHBondContact O-N 3.2Å; L1114-C1116 VanDerWaalsContact O-N 3.1Å; L1114-L1124 HydrophobicContact CB-CD1 3.77Å; L1114-L1124 HydrophobicContact CB-CD2 4.23Å; L1114-L1124 WeakPolarHBondContact O-CB 3.08Å; L1114-D1171 HydrophobicContact CD2-CB 4.08Å
1115H48.3Very low46Very low152.4 Ų152.474.5 Ų74.571%0.70642%0.417SS*.  trans-83.668.7-167.8-95.2-53000113.4N1113 K1126 P1127N1113-H1115 PolarHBondContact O-CE1 3.14Å; N1113-H1115 PolarHBondContact O-N 3.1Å; N1113-H1115 VanDerWaalsContact O-N 3.12Å; N1113-H1115 PolarHBondContact O-ND1 2.95Å; H1115-K1126 VanDerWaalsContact CB-CE 3.42Å; H1115-P1127 HydrophobicContact CB-CB 4.47Å
1116C49.8Very low46.2Very low9.4 Ų9.472.4 Ų72.46%0.06441%0.405CS..  trans-99.2123.7169.1169.60000110.9L1114 G1118 C1122 L1124 P1125 K1126 P1127 C1169 C1172L1114-C1116 VanDerWaalsContact C-N 3.29Å; L1114-C1116 CarbonylContact O-C 3.39Å; L1114-C1116 PolarHBondContact O-N 3.2Å; L1114-C1116 VanDerWaalsContact O-N 3.1Å; C1116-G1118 PolarHBondContact O-N 3.1Å; C1116-G1118 VanDerWaalsContact O-N 3.08Å; C1116-G1118 WeakPolarHBondContact SG-CA 3.28Å; C1116-G1118 PolarHBondContact SG-N 3.48Å; C1116-C1122 HydrophobicContact CB-CB 3.97Å; C1116-C1122 WeakPolarHBondContact CB-SG 3.41Å; C1116-C1122 WeakPolarHBondContact SG-CB 3.4Å; C1116-C1122 CovalentContact SG-SG 2.03Å; C1116-C1122 PolarHBondContact SG-SG 3.27Å; C1116-L1124 HydrophobicContact CB-CB 4.06Å; C1116-L1124 HydrophobicContact CB-CD1 4.2Å; C1116-L1124 HydrophobicContact CB-CD2 4.08Å; C1116-L1124 HydrophobicContact CB-CG 4.32Å; C1116-L1124 WeakPolarHBondContact CB-O 3.5Å; C1116-P1125 PolarHBondContact N-O 3.49Å; C1116-K1126 WeakPolarHBondContact O-CD 3.25Å; C1116-K1126 WeakPolarHBondContact O-CE 3.26Å; C1116-K1126 WeakPolarHBondContact O-CG 3.42Å; C1116-P1127 WeakPolarHBondContact O-CD 3.27Å; C1116-C1169 HydrophobicContact CB-CB 4.27Å; C1116-C1169 VanDerWaalsContact CB-SG 3.55Å; C1116-C1169 WeakPolarHBondContact CB-SG 3.15Å; C1116-C1169 WeakPolarHBondContact SG-CB 3.18Å; C1116-C1169 CovalentContact SG-SG 2.02Å; C1116-C1169 PolarHBondContact SG-SG 3.13Å; C1116-C1172 PolarHBondContact O-SG 3.1Å; C1116-C1172 PolarHBondContact SG-SG 3.25Å
1117L43.3Very low46.2Very low105.4 Ų105.470 Ų7055%0.55239%0.392SS*.  trans-91.662.8172-85.4136.5000111.2Y1095 R1112 L1119 S1167 K1320 F1322Y1095-L1117 HydrophobicContact CE2-CD1 3.85Å; Y1095-L1117 HydrophobicContact CE2-CD2 4.13Å; Y1095-L1117 WeakPolarHBondContact OH-CD1 3.32Å; Y1095-L1117 WeakPolarHBondContact OH-CD2 3.43Å; R1112-L1117 WeakPolarHBondContact O-CD1 3.49Å; L1117-L1119 VanDerWaalsContact C-N 3.3Å; L1117-L1119 PolarHBondContact O-N 3.07Å; L1117-L1119 VanDerWaalsContact O-N 3.11Å; L1117-S1167 WeakPolarHBondContact CD2-OG 3.44Å; L1117-K1320 HydrophobicContact CB-CD 4.04Å; L1117-K1320 WeakPolarHBondContact O-CE 2.93Å; L1117-K1320 PolarHBondContact O-NZ 3.05Å; L1117-F1322 HydrophobicContact CD2-CZ 4.4Å
1118G39.8Very low46Very low46.2 Ų46.274.1 Ų74.148%0.47640%0.398SS..  trans120.110.4174.600000116C1116 E1120 C1122 K1126C1116-G1118 PolarHBondContact O-N 3.1Å; C1116-G1118 VanDerWaalsContact O-N 3.08Å; C1116-G1118 WeakPolarHBondContact SG-CA 3.28Å; C1116-G1118 PolarHBondContact SG-N 3.48Å; G1118-E1120 VanDerWaalsContact C-N 3.32Å; G1118-E1120 PolarHBondContact O-N 3.03Å; G1118-C1122 VanDerWaalsContact O-CB 3.31Å; G1118-C1122 WeakPolarHBondContact O-CB 3.42Å; G1118-K1126 WeakPolarHBondContact O-CE 3.26Å; G1118-K1126 PolarHBondContact O-NZ 3.5Å
1119L44.7Very low45.5Very low38.6 Ų38.678.7 Ų78.720%0.20242%0.418CS..  trans-60132.7175-69.9156.5000111.6L1117 T1121 C1122 K1126 V1166 S1167 C1169 C1172 D1324 V1327L1117-L1119 VanDerWaalsContact C-N 3.3Å; L1117-L1119 PolarHBondContact O-N 3.07Å; L1117-L1119 VanDerWaalsContact O-N 3.11Å; L1119-T1121 VanDerWaalsContact C-N 3.3Å; L1119-T1121 PolarHBondContact O-N 3.26Å; L1119-C1122 HydrophobicContact CB-CB 4.28Å; L1119-C1122 WeakPolarHBondContact O-CB 3.42Å; L1119-C1122 PolarHBondContact O-N 3.48Å; L1119-K1126 WeakPolarHBondContact O-CE 3.24Å; L1119-K1126 PolarHBondContact O-NZ 3.29Å; L1119-V1166 HydrophobicContact CD1-CG1 4.47Å; L1119-V1166 HydrophobicContact CD2-CG1 3.87Å; L1119-V1166 HydrophobicContact CG-CG1 4.13Å; L1119-S1167 WeakPolarHBondContact CD1-O 3.36Å; L1119-C1169 HydrophobicContact CD1-CB 3.82Å; L1119-C1172 HydrophobicContact CD1-CB 4.08Å; L1119-C1172 HydrophobicContact CD2-CB 3.89Å; L1119-C1172 HydrophobicContact CG-CB 3.78Å; L1119-D1324 HydrophobicContact CB-CB 3.68Å; L1119-D1324 WeakPolarHBondContact CB-OD2 3.49Å; L1119-D1324 WeakPolarHBondContact CD1-OD2 3.37Å; L1119-D1324 WeakPolarHBondContact O-CA 3.49Å; L1119-D1324 WeakPolarHBondContact O-CB 3.25Å; L1119-D1324 PolarHBondContact O-N 2.87Å; L1119-V1327 HydrophobicContact CD1-CG2 4.34Å
1120E43.2Very low44.6Very low146.6 Ų146.685.6 Ų85.669%0.68544%0.441SS*.THydrogen-bonded Turntrans-79.513.1158.3-64.2-177.9154.500112.2G1118 C1122 K1128G1118-E1120 VanDerWaalsContact C-N 3.32Å; G1118-E1120 PolarHBondContact O-N 3.03Å; E1120-C1122 VanDerWaalsContact C-N 3.3Å; E1120-K1128 IonicContact OE1-NZ 3.74Å
1121T45Very low43.4Very low91.8 Ų91.893 Ų9356%0.56348%0.477SS*.THydrogen-bonded Turntrans-49.632.6178.151.50000114.9L1119 I1123 F1322L1119-T1121 VanDerWaalsContact C-N 3.3Å; L1119-T1121 PolarHBondContact O-N 3.26Å; T1121-I1123 PolarHBondContact O-N 3.17Å; T1121-F1322 CarbonylContact C-O 3.12Å; T1121-F1322 WeakPolarHBondContact CA-O 3.47Å
1122C50.2Low42.1Very low16.8 Ų16.897.1 Ų97.111%0.11451%0.507CS..  trans-65.3130.6-171.2-135.30000113.7C1116 G1118 L1119 E1120 L1124 P1125 C1169 C1172C1116-C1122 HydrophobicContact CB-CB 3.97Å; C1116-C1122 WeakPolarHBondContact CB-SG 3.41Å; C1116-C1122 WeakPolarHBondContact SG-CB 3.4Å; C1116-C1122 CovalentContact SG-SG 2.03Å; C1116-C1122 PolarHBondContact SG-SG 3.27Å; G1118-C1122 VanDerWaalsContact O-CB 3.31Å; G1118-C1122 WeakPolarHBondContact O-CB 3.42Å; L1119-C1122 HydrophobicContact CB-CB 4.28Å; L1119-C1122 WeakPolarHBondContact O-CB 3.42Å; L1119-C1122 PolarHBondContact O-N 3.48Å; E1120-C1122 VanDerWaalsContact C-N 3.3Å; C1122-L1124 VanDerWaalsContact C-N 3.34Å; C1122-L1124 PolarHBondContact O-N 3Å; C1122-P1125 WeakPolarHBondContact O-CD 3.22Å; C1122-C1169 HydrophobicContact CB-CB 3.51Å; C1122-C1169 PolarHBondContact O-N 2.96Å; C1122-C1169 VanDerWaalsContact SG-CB 3.53Å; C1122-C1169 WeakPolarHBondContact SG-CB 3.19Å; C1122-C1172 PolarHBondContact SG-SG 3.36Å; C1122-C1172 VanDerWaalsContact SG-SG 3.67Å
1123I48.5Very low40.9Very low63.8 Ų63.8100.4 Ų100.433%0.32753%0.531SS..SBendtrans-9218.4171.9-54.1166000109.4Y1095 T1121 P1125 V1166 C1172 M1175 L1176 F1268 D1324 V1327Y1095-I1123 PolarHBondContact OH-O 3.4Å; T1121-I1123 PolarHBondContact O-N 3.17Å; I1123-P1125 WeakPolarHBondContact O-CD 3.24Å; I1123-V1166 HydrophobicContact CD1-CG1 3.48Å; I1123-V1166 VanDerWaalsContact CD1-CG1 3.48Å; I1123-V1166 HydrophobicContact CG1-CG1 3.88Å; I1123-C1172 HydrophobicContact CB-CB 4.41Å; I1123-C1172 HydrophobicContact CD1-CB 4.09Å; I1123-C1172 VanDerWaalsContact CD1-O 3.28Å; I1123-C1172 WeakPolarHBondContact CD1-O 3.3Å; I1123-C1172 HydrophobicContact CG1-CB 4.19Å; I1123-C1172 PolarHBondContact N-SG 3.16Å; I1123-C1172 VanDerWaalsContact N-SG 3.36Å; I1123-M1175 HydrophobicContact CD1-CB 4.08Å; I1123-L1176 HydrophobicContact CD1-CB 4.42Å; I1123-F1268 HydrophobicContact CG2-CE1 4.48Å; I1123-D1324 HydrophobicContact CD1-CB 4.3Å; I1123-D1324 HydrophobicContact CG1-CB 4.27Å; I1123-V1327 HydrophobicContact CD1-CG2 3.64Å; I1123-V1327 HydrophobicContact CG1-CG2 4.07Å
1124L45.8Very low40Very low55 Ų55104.8 Ų104.829%0.28855%0.551SS.*SBendtrans-95.3130.2-174.9-76.7165.5000112.5Y1095 L1111 L1114 C1116 C1122 K1126 D1171 M1175Y1095-L1124 HydrophobicContact CE2-CD2 3.95Å; Y1095-L1124 HydrophobicContact CE2-CG 4.2Å; L1111-L1124 VanDerWaalsContact O-CD2 3.27Å; L1111-L1124 WeakPolarHBondContact O-CD2 3.41Å; L1114-L1124 HydrophobicContact CB-CD1 3.77Å; L1114-L1124 HydrophobicContact CB-CD2 4.23Å; L1114-L1124 WeakPolarHBondContact O-CB 3.08Å; C1116-L1124 HydrophobicContact CB-CB 4.06Å; C1116-L1124 HydrophobicContact CB-CD1 4.2Å; C1116-L1124 HydrophobicContact CB-CD2 4.08Å; C1116-L1124 HydrophobicContact CB-CG 4.32Å; C1116-L1124 WeakPolarHBondContact CB-O 3.5Å; C1122-L1124 VanDerWaalsContact C-N 3.34Å; C1122-L1124 PolarHBondContact O-N 3Å; L1124-K1126 PolarHBondContact O-N 3Å; L1124-D1171 HydrophobicContact CD1-CB 3.91Å; L1124-M1175 HydrophobicContact CD1-CG 4.39Å
1125P43.7Very low38.9Very low65.8 Ų65.8110.6 Ų110.643%0.42758%0.576SS.*PPolyproline II helixtrans-81.4142-173.614.7-7.6000112.4R1112 C1116 C1122 I1123 R1274 T1321R1112-P1125 VanDerWaalsContact O-CD 3.23Å; R1112-P1125 WeakPolarHBondContact O-CD 3.09Å; R1112-P1125 WeakPolarHBondContact O-CG 3.35Å; C1116-P1125 PolarHBondContact N-O 3.49Å; C1122-P1125 WeakPolarHBondContact O-CD 3.22Å; I1123-P1125 WeakPolarHBondContact O-CD 3.24Å; P1125-R1274 PolarHBondContact O-NH2 2.96Å; P1125-T1321 HydrophobicContact CG-CG2 3.91Å
1126K37.9Very low38.1Very low139.2 Ų139.2108.9 Ų108.961%0.60558%0.578SS**PPolyproline II helixtrans-77.9138.2165.5-73.5-179.5-176.5-176.70111.9H1115 C1116 G1118 L1119 L1124 K1128H1115-K1126 VanDerWaalsContact CB-CE 3.42Å; C1116-K1126 WeakPolarHBondContact O-CD 3.25Å; C1116-K1126 WeakPolarHBondContact O-CE 3.26Å; C1116-K1126 WeakPolarHBondContact O-CG 3.42Å; G1118-K1126 WeakPolarHBondContact O-CE 3.26Å; G1118-K1126 PolarHBondContact O-NZ 3.5Å; L1119-K1126 WeakPolarHBondContact O-CE 3.24Å; L1119-K1126 PolarHBondContact O-NZ 3.29Å; L1124-K1126 PolarHBondContact O-N 3Å; K1126-K1128 PolarHBondContact O-N 3.19Å
1127P36Very low37.2Very low83.8 Ų83.8112.5 Ų112.554%0.54461%0.609SS.*PPolyproline II helixtrans-67.6139.7166.428.7-32.6000110.6H1115 C1116 N1129H1115-P1127 HydrophobicContact CB-CB 4.47Å; C1116-P1127 WeakPolarHBondContact O-CD 3.27Å; P1127-N1129 VanDerWaalsContact C-N 3.31Å; P1127-N1129 PolarHBondContact O-N 2.97Å
1128K32.8Very low36.6Very low181.8 Ų181.8114.9 Ų114.979%0.7962%0.621SS**  trans-83.395.9169.8-75.9-174.1177.5-178.80109E1120 K1126 K1130 Y1276E1120-K1128 IonicContact OE1-NZ 3.74Å; K1126-K1128 PolarHBondContact O-N 3.19Å; K1128-K1130 PolarHBondContact O-N 3.02Å; K1128-Y1276 PolarHBondContact NZ-OH 3.38Å
1129N32Very low36.1Very low146.6 Ų146.6117.5 Ų117.578%0.78463%0.632SS**  trans-64.5122.5163.9-84.22.5000109.1P1127 L1131P1127-N1129 VanDerWaalsContact C-N 3.31Å; P1127-N1129 PolarHBondContact O-N 2.97Å; N1129-L1131 PolarHBondContact O-N 3.14Å; N1129-L1131 VanDerWaalsContact O-N 3.13Å
1130K28.8Very low35.2Very low203 Ų203121.4 Ų121.488%0.88366%0.658SS**  trans-65.498.5165.2-73.8178.6176.5174.90108.7K1128 S1132 E1278K1128-K1130 PolarHBondContact O-N 3.02Å; K1130-S1132 VanDerWaalsContact C-N 3.25Å; K1130-S1132 PolarHBondContact O-N 3.39Å; K1130-E1278 IonicContact NZ-OE1 3Å
1131L29Very low34.6Very low163.8 Ų163.8120.5 Ų120.586%0.85866%0.662SS**  trans-100.1118.4161.3-153.975.7000108.1N1129N1129-L1131 PolarHBondContact O-N 3.14Å; N1129-L1131 VanDerWaalsContact O-N 3.13Å
1132S29.7Very low33.8Very low94 Ų94121.5 Ų121.566%0.65767%0.673SS**  trans-51.2127.8176.651.10000113.7K1130 M1134K1130-S1132 VanDerWaalsContact C-N 3.25Å; K1130-S1132 PolarHBondContact O-N 3.39Å; S1132-M1134 PolarHBondContact O-N 3.22Å; S1132-M1134 VanDerWaalsContact O-N 3.16Å
1133D28.9Very low32.7Very low153.8 Ų153.8125.1 Ų125.182%0.82270%0.704SS**  trans27.7112.9144.6-49.9-44000118.1
1134M30.4Very low32.1Very low188 Ų188127.4 Ų127.493%0.92672%0.723SS**  trans-160.2116142.4-87.4-81.4162.200111.9S1132S1132-M1134 PolarHBondContact O-N 3.22Å; S1132-M1134 VanDerWaalsContact O-N 3.16Å
1135E28.3Very low31.2Very low177.2 Ų177.2132.4 Ų132.483%0.82875%0.747SS**  trans-79.5150.2177.4-157.1-175162.900111.3A1137E1135-A1137 PolarHBondContact O-N 3.1Å; E1135-A1137 VanDerWaalsContact O-N 3.1Å; E1135-A1137 WeakPolarHBondContact OE1-CB 3.46Å
1136P32.7Very low30.5Very low115.6 Ų115.6134.8 Ų134.875%0.75176%0.76SS**  trans-107.6145.4159.630.2-21.6000114.2I1138P1136-I1138 PolarHBondContact O-N 3.15Å
1137A30Very low30Very low85 Ų85135.9 Ų135.970%0.70277%0.768SS**  trans-85.1142174.100000113.8E1135 S1139E1135-A1137 PolarHBondContact O-N 3.1Å; E1135-A1137 VanDerWaalsContact O-N 3.1Å; E1135-A1137 WeakPolarHBondContact OE1-CB 3.46Å; A1137-S1139 PolarHBondContact O-N 3.45Å
1138I30.7Very low29.7Very low155.8 Ų155.8138.2 Ų138.280%0.79978%0.775SS**  trans96.2124.1139.1-68.4163000113.3P1136 T1140P1136-I1138 PolarHBondContact O-N 3.15Å; I1138-T1140 HydrophobicContact CG2-CG2 4.29Å
1139S29.4Very low29.7Very low101.6 Ų101.6136.7 Ų136.771%0.7177%0.771SS**  trans-159.7120.7156.430.40000114.2A1137 T1141A1137-S1139 PolarHBondContact O-N 3.45Å; S1139-T1141 PolarHBondContact O-N 3.16Å
1140T26.8Very low29.7Very low121.4 Ų121.4136.3 Ų136.375%0.74577%0.769SS**  trans21.9123.2131.750.20000115.5I1138I1138-T1140 HydrophobicContact CG2-CG2 4.29Å
1141T29.1Very low29.7Very low126.2 Ų126.2134.5 Ų134.577%0.77476%0.763SS**  155.3143.9100-20.70000115.4S1139S1139-T1141 PolarHBondContact O-N 3.16Å
1142S28.9Very low29.8Very low113.2 Ų113.2132.9 Ų132.979%0.79276%0.755SS**  trans58.4145152.254.80000118.2
1143A28.1Very low29.9Very low92 Ų92134.8 Ų134.876%0.7676%0.759SS**  trans-90.6179154.300000111.7
1144P34.2Very low30.1Very low112 Ų112134.6 Ų134.673%0.72776%0.756SS**  cis-136.9-178.940.439.5-21.1000116.6
1145M27.4Very low30Very low161.4 Ų161.4132 Ų13280%0.79575%0.746SS**  trans55.9134.2162.5-56.8-81.2120.300117.1
1146T29.6Very low30.1Very low115.2 Ų115.2132 Ų13271%0.70775%0.745SS**  142.9132.6115.335.90000112.4
1147E27.7Very low30Very low163.2 Ų163.2133.8 Ų133.876%0.76375%0.747SS**  54.8140.1114.2-74.7158.1-177.200114.7
1148D28.5Very low30Very low131.8 Ų131.8136.7 Ų136.771%0.70575%0.751SS**  147.7154.690.9-96.6-15000118.1
1149H32.9Very low30.1Very low150.2 Ų150.2136.5 Ų136.570%0.69575%0.75SS**  trans71.8108.4155.7-68.9-64.1000121.6
1150D32.6Very low30.1Very low138.6 Ų138.6139.2 Ų139.274%0.74176%0.756SS**  84.7125.7106.7-65.5-13.4000119
1151E29.5Very low30.4Very low165.4 Ų165.4142.4 Ų142.477%0.77376%0.76SS**  trans178.9141.3138.6-95.8-169.2173.600113.5
1152N31.5Very low30.5Very low128.8 Ų128.8144.7 Ų144.769%0.68976%0.762SS**  trans89.2115.6150.7-69.6-51.7000117.9
1153N30.5Very low30.5Very low135.4 Ų135.4144.5 Ų144.572%0.72476%0.756SS**  118.8125.5114.1-112.3-29.2000116.8N1155N1153-N1155 PolarHBondContact O-N 3.29Å
1154I32.6Very low30.9Very low149.2 Ų149.2147.4 Ų147.477%0.76576%0.759SS**  trans165.8110.6136.1-79.3160.2000112
1155N29.9Very low31.1Very low132.8 Ų132.8148.6 Ų148.671%0.7176%0.759SS**  trans56136.4148.8-67.6-22.8000117.1N1153N1153-N1155 PolarHBondContact O-N 3.29Å
1156Q28.8Very low31.9Very low176.2 Ų176.2146.3 Ų146.382%0.82375%0.754SS**  trans80.5103.6137.2-115.2177.8-3.400115.8
1157I31.9Very low33Very low153.8 Ų153.8145 Ų14579%0.78975%0.75SS**  trans-144.3124.2146.9-69.2170.6000109.8I1159I1157-I1159 HydrophobicContact CG2-CD1 4.2Å; I1157-I1159 HydrophobicContact CG2-CG1 3.85Å; I1157-I1159 PolarHBondContact O-N 2.91Å
1158D30.5Very low34.6Very low147 Ų147143.7 Ų143.779%0.78674%0.743SS**  trans-52.3133.7173.2-66.4-61.8000115.4N1160D1158-N1160 PolarHBondContact O-N 2.8Å; D1158-N1160 VanDerWaalsContact O-N 3.13Å
1159I32Very low36.7Very low151.2 Ų151.2138.2 Ų138.278%0.77572%0.716SS**  trans-115.499.9162.4-55.5175.6000109.6I1157 K1161I1157-I1159 HydrophobicContact CG2-CD1 4.2Å; I1157-I1159 HydrophobicContact CG2-CG1 3.85Å; I1157-I1159 PolarHBondContact O-N 2.91Å; I1159-K1161 VanDerWaalsContact C-N 3.27Å; I1159-K1161 HydrophobicContact CG2-CB 4.13Å; I1159-K1161 PolarHBondContact O-N 3.22Å
1160N29.6Very low38.8Very low158 Ų158135.1 Ų135.185%0.84570%0.703SS**  trans-65.198.2158-77.5-35.4000111.2D1158 Q1162D1158-N1160 PolarHBondContact O-N 2.8Å; D1158-N1160 VanDerWaalsContact O-N 3.13Å; N1160-Q1162 PolarHBondContact O-N 3.43Å; N1160-Q1162 VanDerWaalsContact O-N 3.07Å
1161K32.1Very low40.7Very low188.2 Ų188.2129.9 Ų129.982%0.81868%0.675SS**  trans-102.3109.2173.2-154176.5-175.2-177.70109.2I1159 T1163I1159-K1161 VanDerWaalsContact C-N 3.27Å; I1159-K1161 HydrophobicContact CG2-CB 4.13Å; I1159-K1161 PolarHBondContact O-N 3.22Å; K1161-T1163 HydrophobicContact CD-CG2 4.2Å; K1161-T1163 HydrophobicContact CG-CG2 4.19Å; K1161-T1163 PolarHBondContact O-N 3.23Å
1162Q31.5Very low42.8Very low174.6 Ų174.6122.6 Ų122.682%0.81664%0.643SS**  trans-56.1132174.4-88159.5-48.600110.6N1160 D1164N1160-Q1162 PolarHBondContact O-N 3.43Å; N1160-Q1162 VanDerWaalsContact O-N 3.07Å; Q1162-D1164 PolarHBondContact O-N 3.1Å
1163T30.3Very low45.2Very low109.8 Ų109.8119.8 Ų119.867%0.67463%0.627SS**  trans-95.7113.6164.745.60000107.3K1161 D1165K1161-T1163 HydrophobicContact CD-CG2 4.2Å; K1161-T1163 HydrophobicContact CG-CG2 4.19Å; K1161-T1163 PolarHBondContact O-N 3.23Å; T1163-D1165 PolarHBondContact O-N 3.08Å; T1163-D1165 VanDerWaalsContact O-N 3.13Å
1164D34.7Very low47.7Very low152.4 Ų152.4114.3 Ų114.382%0.81560%0.597SS**  trans-69111.3171.8-64.9-51.5000108.8Q1162 V1166Q1162-D1164 PolarHBondContact O-N 3.1Å; D1164-V1166 PolarHBondContact O-N 3.07Å; D1164-V1166 VanDerWaalsContact O-N 3.07Å
1165D39Very low50Low136.8 Ų136.8107.8 Ų107.873%0.73256%0.564SS**  trans-68.5126.9-179.8-76.5-42.9000110.7T1163 S1167T1163-D1165 PolarHBondContact O-N 3.08Å; T1163-D1165 VanDerWaalsContact O-N 3.13Å; D1165-S1167 PolarHBondContact O-N 3.16Å; D1165-S1167 VanDerWaalsContact O-N 3.13Å
1166V43.8Very low52.6Low114.2 Ų114.2103.2 Ų103.269%0.69254%0.539SS*.  trans-75.197.4179.6-177.80000109.1L1119 I1123 D1164 E1168L1119-V1166 HydrophobicContact CD1-CG1 4.47Å; L1119-V1166 HydrophobicContact CD2-CG1 3.87Å; L1119-V1166 HydrophobicContact CG-CG1 4.13Å; I1123-V1166 HydrophobicContact CD1-CG1 3.48Å; I1123-V1166 VanDerWaalsContact CD1-CG1 3.48Å; I1123-V1166 HydrophobicContact CG1-CG1 3.88Å; D1164-V1166 PolarHBondContact O-N 3.07Å; D1164-V1166 VanDerWaalsContact O-N 3.07Å; V1166-E1168 PolarHBondContact O-N 3.11Å
1167S52.8Low55.3Low88.2 Ų88.296.9 Ų96.962%0.61751%0.513SS*.  trans-78.9118.7-179.449.90000111.5L1117 L1119 D1165L1117-S1167 WeakPolarHBondContact CD2-OG 3.44Å; L1119-S1167 WeakPolarHBondContact CD1-O 3.36Å; D1165-S1167 PolarHBondContact O-N 3.16Å; D1165-S1167 VanDerWaalsContact O-N 3.13Å
1168E61.4Low58.1Low134.4 Ų134.489.8 Ų89.863%0.62848%0.476SS*.  trans-67.1145.9177.5-61.9-177.5168.200111.9V1166 I1170V1166-E1168 PolarHBondContact O-N 3.11Å; E1168-I1170 PolarHBondContact O-N 3.14Å; E1168-I1170 VanDerWaalsContact O-N 3.07Å
1169C72.6Confident60.9Low18 Ų1882.8 Ų82.812%0.12244%0.439CS..  trans-76.3111.9176.51750000110.6C1116 L1119 C1122 D1171 C1172 L1173C1116-C1169 HydrophobicContact CB-CB 4.27Å; C1116-C1169 VanDerWaalsContact CB-SG 3.55Å; C1116-C1169 WeakPolarHBondContact CB-SG 3.15Å; C1116-C1169 WeakPolarHBondContact SG-CB 3.18Å; C1116-C1169 CovalentContact SG-SG 2.02Å; C1116-C1169 PolarHBondContact SG-SG 3.13Å; L1119-C1169 HydrophobicContact CD1-CB 3.82Å; C1122-C1169 HydrophobicContact CB-CB 3.51Å; C1122-C1169 PolarHBondContact O-N 2.96Å; C1122-C1169 VanDerWaalsContact SG-CB 3.53Å; C1122-C1169 WeakPolarHBondContact SG-CB 3.19Å; C1169-D1171 VanDerWaalsContact C-N 3.3Å; C1169-D1171 PolarHBondContact O-N 3.35Å; C1169-C1172 HydrophobicContact CB-CB 4.2Å; C1169-C1172 WeakPolarHBondContact O-CA 3.37Å; C1169-C1172 VanDerWaalsContact O-CB 3.27Å; C1169-C1172 WeakPolarHBondContact O-CB 3.3Å; C1169-C1172 PolarHBondContact O-N 3.27Å; C1169-C1172 VanDerWaalsContact O-N 3.09Å; C1169-C1172 VanDerWaalsContact SG-SG 3.64Å; C1169-L1173 PolarHBondContact O-N 3.06Å; C1169-L1173 VanDerWaalsContact O-N 3.09Å
1170I76.7Confident63.7Low83.4 Ų83.478.2 Ų78.243%0.42842%0.416SS..Hα-helixtrans-64.2-34.6-173.7-150.5153.8000113.2R1049 E1168 C1172 L1173 D1174R1049-I1170 VanDerWaalsContact NH2-CG1 3.31Å; R1049-I1170 VanDerWaalsContact NH2-CG2 3.25Å; E1168-I1170 PolarHBondContact O-N 3.14Å; E1168-I1170 VanDerWaalsContact O-N 3.07Å; I1170-C1172 VanDerWaalsContact C-N 3.29Å; I1170-C1172 PolarHBondContact O-N 3.29Å; I1170-L1173 HydrophobicContact CD1-CD2 4.2Å; I1170-L1173 CarbonylContact O-C 3.56Å; I1170-L1173 WeakPolarHBondContact O-CA 3.36Å; I1170-L1173 WeakPolarHBondContact O-CB 3.35Å; I1170-L1173 PolarHBondContact O-N 2.94Å; I1170-L1173 VanDerWaalsContact O-N 3.12Å; I1170-D1174 WeakPolarHBondContact O-CB 3.17Å; I1170-D1174 VanDerWaalsContact O-CG 3.27Å; I1170-D1174 PolarHBondContact O-N 3.23Å
1171D73.2Confident66.7Low30.6 Ų30.673.2 Ų73.216%0.16439%0.386CS..Hα-helixtrans-63.8-33.6173.3-68.3-67.5000112.9R1049 T1051 L1114 L1124 C1169 D1174 M1175R1049-D1171 WeakPolarHBondContact CD-OD1 3.47Å; R1049-D1171 IonicContact CZ-OD1 3.17Å; R1049-D1171 IonicContact NE-OD1 3.23Å; R1049-D1171 PolarHBondContact NE-OD1 3.21Å; R1049-D1171 IonicContact NH2-OD1 2.71Å; R1049-D1171 PolarHBondContact NH2-OD1 3.19Å; R1049-D1171 IonicContact NH2-OD2 2.7Å; T1051-D1171 WeakPolarHBondContact CB-OD1 3.36Å; T1051-D1171 HydrophobicContact CG2-CB 4.29Å; T1051-D1171 WeakPolarHBondContact CG2-OD1 3.32Å; T1051-D1171 PolarHBondContact OG1-OD1 3Å; L1114-D1171 HydrophobicContact CD2-CB 4.08Å; L1124-D1171 HydrophobicContact CD1-CB 3.91Å; C1169-D1171 VanDerWaalsContact C-N 3.3Å; C1169-D1171 PolarHBondContact O-N 3.35Å; D1171-D1174 PolarHBondContact O-N 3.38Å; D1171-M1175 WeakPolarHBondContact O-CB 3.29Å; D1171-M1175 VanDerWaalsContact O-CG 3.29Å; D1171-M1175 WeakPolarHBondContact O-CG 3.33Å; D1171-M1175 PolarHBondContact O-N 3.09Å
1172C74.2Confident69.5Low12.2 Ų12.264.4 Ų64.48%0.08235%0.348CS..Hα-helixtrans-72.7-34.2173.6-75.90000111.6C1116 L1119 C1122 I1123 C1169 I1170 M1175 L1176C1116-C1172 PolarHBondContact O-SG 3.1Å; C1116-C1172 PolarHBondContact SG-SG 3.25Å; L1119-C1172 HydrophobicContact CD1-CB 4.08Å; L1119-C1172 HydrophobicContact CD2-CB 3.89Å; L1119-C1172 HydrophobicContact CG-CB 3.78Å; C1122-C1172 PolarHBondContact SG-SG 3.36Å; C1122-C1172 VanDerWaalsContact SG-SG 3.67Å; I1123-C1172 HydrophobicContact CB-CB 4.41Å; I1123-C1172 HydrophobicContact CD1-CB 4.09Å; I1123-C1172 VanDerWaalsContact CD1-O 3.28Å; I1123-C1172 WeakPolarHBondContact CD1-O 3.3Å; I1123-C1172 HydrophobicContact CG1-CB 4.19Å; I1123-C1172 PolarHBondContact N-SG 3.16Å; I1123-C1172 VanDerWaalsContact N-SG 3.36Å; C1169-C1172 HydrophobicContact CB-CB 4.2Å; C1169-C1172 WeakPolarHBondContact O-CA 3.37Å; C1169-C1172 VanDerWaalsContact O-CB 3.27Å; C1169-C1172 WeakPolarHBondContact O-CB 3.3Å; C1169-C1172 PolarHBondContact O-N 3.27Å; C1169-C1172 VanDerWaalsContact O-N 3.09Å; C1169-C1172 VanDerWaalsContact SG-SG 3.64Å; I1170-C1172 VanDerWaalsContact C-N 3.29Å; I1170-C1172 PolarHBondContact O-N 3.29Å; C1172-M1175 WeakPolarHBondContact O-CB 3.4Å; C1172-M1175 PolarHBondContact O-N 2.96Å; C1172-L1176 VanDerWaalsContact O-CB 3.26Å; C1172-L1176 WeakPolarHBondContact O-CB 3.41Å; C1172-L1176 PolarHBondContact O-N 3.09Å
1173L81.3Confident72.3Confident69.6 Ų69.657.6 Ų57.636%0.36432%0.315SS..Hα-helixtrans-67.1-41.8172.8-176.462.1000111.6C1169 I1170 M1175 L1176 T1177C1169-L1173 PolarHBondContact O-N 3.06Å; C1169-L1173 VanDerWaalsContact O-N 3.09Å; I1170-L1173 HydrophobicContact CD1-CD2 4.2Å; I1170-L1173 CarbonylContact O-C 3.56Å; I1170-L1173 WeakPolarHBondContact O-CA 3.36Å; I1170-L1173 WeakPolarHBondContact O-CB 3.35Å; I1170-L1173 PolarHBondContact O-N 2.94Å; I1170-L1173 VanDerWaalsContact O-N 3.12Å; L1173-M1175 VanDerWaalsContact C-N 3.34Å; L1173-M1175 PolarHBondContact O-N 3.3Å; L1173-L1176 HydrophobicContact CD1-CD2 4.4Å; L1173-L1176 PolarHBondContact O-N 2.93Å; L1173-T1177 HydrophobicContact CD1-CG2 4.44Å; L1173-T1177 WeakPolarHBondContact O-CB 3.31Å; L1173-T1177 WeakPolarHBondContact O-CG2 3.36Å; L1173-T1177 PolarHBondContact O-N 3.32Å; L1173-T1177 PolarHBondContact O-OG1 3.04Å
1174D83Confident75.2Confident19 Ų1954.2 Ų54.210%0.10229%0.292CS..Hα-helixtrans-60.1-46173.5-68.4-25.5000110.6R1049 T1051 A1052 T1055 I1170 D1171 L1176 T1177 W1178R1049-D1174 IonicContact CZ-OD2 3.18Å; R1049-D1174 IonicContact NE-OD2 3.14Å; R1049-D1174 PolarHBondContact NE-OD2 3.29Å; R1049-D1174 VanDerWaalsContact NH2-CG 3.29Å; R1049-D1174 IonicContact NH2-OD1 3.39Å; R1049-D1174 PolarHBondContact NH2-OD1 3.16Å; R1049-D1174 IonicContact NH2-OD2 3.06Å; R1049-D1174 PolarHBondContact NH2-OD2 3.33Å; T1051-D1174 WeakPolarHBondContact CB-OD2 3.4Å; T1051-D1174 PolarHBondContact OG1-OD2 3.11Å; A1052-D1174 WeakPolarHBondContact CB-OD2 3.31Å; A1052-D1174 PolarHBondContact N-OD2 3.34Å; T1055-D1174 PolarHBondContact OG1-O 3.16Å; I1170-D1174 WeakPolarHBondContact O-CB 3.17Å; I1170-D1174 VanDerWaalsContact O-CG 3.27Å; I1170-D1174 PolarHBondContact O-N 3.23Å; D1171-D1174 PolarHBondContact O-N 3.38Å; D1174-L1176 VanDerWaalsContact C-N 3.31Å; D1174-L1176 PolarHBondContact O-N 3.19Å; D1174-T1177 VanDerWaalsContact CA-OG1 3.32Å; D1174-T1177 WeakPolarHBondContact CA-OG1 3.34Å; D1174-T1177 CarbonylContact O-C 3.48Å; D1174-T1177 WeakPolarHBondContact O-CA 3.47Å; D1174-T1177 PolarHBondContact O-N 3.01Å; D1174-T1177 PolarHBondContact O-OG1 3.15Å; D1174-W1178 WeakPolarHBondContact O-CB 3.4Å; D1174-W1178 PolarHBondContact O-N 3.06Å
1175M80.8Confident77.9Confident13.2 Ų13.246.9 Ų46.97%0.06525%0.253CS..Hα-helixtrans-64.9-39.7175.5-73.2-62.5-58.600113T1051 Y1095 I1123 L1124 D1171 C1172 L1173 T1177 W1178 F1179 F1268 F1322T1051-M1175 HydrophobicContact CG2-CG 4.15Å; T1051-M1175 HydrophobicContact CG2-SD 4.26Å; Y1095-M1175 HydrophobicContact CD1-CE 4.16Å; Y1095-M1175 HydrophobicContact CD1-SD 4.33Å; Y1095-M1175 HydrophobicContact CD2-CE 3.94Å; Y1095-M1175 HydrophobicContact CD2-SD 4.38Å; Y1095-M1175 HydrophobicContact CE1-CE 3.57Å; Y1095-M1175 HydrophobicContact CE1-SD 3.3Å; Y1095-M1175 WeakPolarHBondContact CE1-SD 3.41Å; Y1095-M1175 HydrophobicContact CE2-CE 4.16Å; Y1095-M1175 HydrophobicContact CE2-SD 4.47Å; Y1095-M1175 PolarHBondContact OH-SD 3.26Å; I1123-M1175 HydrophobicContact CD1-CB 4.08Å; L1124-M1175 HydrophobicContact CD1-CG 4.39Å; D1171-M1175 WeakPolarHBondContact O-CB 3.29Å; D1171-M1175 VanDerWaalsContact O-CG 3.29Å; D1171-M1175 WeakPolarHBondContact O-CG 3.33Å; D1171-M1175 PolarHBondContact O-N 3.09Å; C1172-M1175 WeakPolarHBondContact O-CB 3.4Å; C1172-M1175 PolarHBondContact O-N 2.96Å; L1173-M1175 VanDerWaalsContact C-N 3.34Å; L1173-M1175 PolarHBondContact O-N 3.3Å; M1175-T1177 VanDerWaalsContact C-N 3.32Å; M1175-T1177 PolarHBondContact O-N 3.39Å; M1175-W1178 WeakPolarHBondContact O-CB 3.36Å; M1175-W1178 PolarHBondContact O-N 3.18Å; M1175-F1179 HydrophobicContact CE-CD2 4.36Å; M1175-F1179 HydrophobicContact CE-CE2 3.98Å; M1175-F1179 HydrophobicContact CE-CZ 4.49Å; M1175-F1179 VanDerWaalsContact O-CD2 3.28Å; M1175-F1179 WeakPolarHBondContact O-CD2 3.37Å; M1175-F1179 PolarHBondContact O-N 3.09Å; M1175-F1179 VanDerWaalsContact O-N 3.09Å; M1175-F1268 HydrophobicContact CE-CZ 4.48Å; M1175-F1322 HydrophobicContact CE-CZ 4.27Å
1176L84Confident80.2Confident36.4 Ų36.440.5 Ų40.519%0.19122%0.219CC..Hα-helixtrans-64.2-40.5175.9173.361.4000111.5I1123 C1172 L1173 D1174 F1179 N1180 V1326 V1327I1123-L1176 HydrophobicContact CD1-CB 4.42Å; C1172-L1176 VanDerWaalsContact O-CB 3.26Å; C1172-L1176 WeakPolarHBondContact O-CB 3.41Å; C1172-L1176 PolarHBondContact O-N 3.09Å; L1173-L1176 HydrophobicContact CD1-CD2 4.4Å; L1173-L1176 PolarHBondContact O-N 2.93Å; D1174-L1176 VanDerWaalsContact C-N 3.31Å; D1174-L1176 PolarHBondContact O-N 3.19Å; L1176-F1179 PolarHBondContact O-N 3Å; L1176-N1180 PolarHBondContact O-N 3.2Å; L1176-N1180 VanDerWaalsContact O-N 3.08Å; L1176-N1180 PolarHBondContact O-ND2 3.03Å; L1176-V1326 HydrophobicContact CD1-CB 4Å; L1176-V1326 HydrophobicContact CD1-CG1 3.78Å; L1176-V1327 HydrophobicContact CB-CG2 4.25Å; L1176-V1327 HydrophobicContact CD1-CG2 3.76Å; L1176-V1327 HydrophobicContact CG-CG2 4.48Å
1177T86.7Confident82.3Confident43.6 Ų43.637.3 Ų37.327%0.26720%0.196SC..Hα-helixtrans-68.9-39.5175510000111.7T1055 L1173 D1174 M1175 F1179 N1180 Y1181T1055-T1177 VanDerWaalsContact CG2-OG1 3.29Å; T1055-T1177 WeakPolarHBondContact CG2-OG1 3.36Å; L1173-T1177 HydrophobicContact CD1-CG2 4.44Å; L1173-T1177 WeakPolarHBondContact O-CB 3.31Å; L1173-T1177 WeakPolarHBondContact O-CG2 3.36Å; L1173-T1177 PolarHBondContact O-N 3.32Å; L1173-T1177 PolarHBondContact O-OG1 3.04Å; D1174-T1177 VanDerWaalsContact CA-OG1 3.32Å; D1174-T1177 WeakPolarHBondContact CA-OG1 3.34Å; D1174-T1177 CarbonylContact O-C 3.48Å; D1174-T1177 WeakPolarHBondContact O-CA 3.47Å; D1174-T1177 PolarHBondContact O-N 3.01Å; D1174-T1177 PolarHBondContact O-OG1 3.15Å; M1175-T1177 VanDerWaalsContact C-N 3.32Å; M1175-T1177 PolarHBondContact O-N 3.39Å; T1177-F1179 VanDerWaalsContact C-N 3.35Å; T1177-F1179 PolarHBondContact O-N 3.27Å; T1177-N1180 WeakPolarHBondContact O-CA 3.29Å; T1177-N1180 WeakPolarHBondContact O-CB 3.46Å; T1177-N1180 PolarHBondContact O-N 3.31Å; T1177-N1180 VanDerWaalsContact O-N 3.14Å; T1177-Y1181 VanDerWaalsContact O-CD2 3.22Å; T1177-Y1181 WeakPolarHBondContact O-CD2 3.27Å; T1177-Y1181 PolarHBondContact O-N 3.17Å
1178W90.9Very high84Confident4.6 Ų4.634.2 Ų34.22%0.01717%0.172CC..Hα-helixtrans-53.5-50.7170.2-173.396.8000111.6T1055 L1058 L1088 M1091 L1092 D1174 M1175 N1180 Y1181 A1182T1055-W1178 WeakPolarHBondContact OG1-CB 3.42Å; T1055-W1178 PolarHBondContact OG1-N 3.1Å; L1058-W1178 VanDerWaalsContact CD1-CD1 3.45Å; L1058-W1178 HydrophobicContact CD1-CD2 3.98Å; L1058-W1178 VanDerWaalsContact CD1-CE2 3.5Å; L1058-W1178 HydrophobicContact CD1-CG 3.96Å; L1058-W1178 HydrophobicContact CD1-CZ2 4.07Å; L1058-W1178 VanDerWaalsContact CD1-NE1 3.31Å; L1088-W1178 HydrophobicContact CD2-CH2 3.88Å; L1088-W1178 HydrophobicContact CD2-CZ2 3.6Å; M1091-W1178 HydrophobicContact CB-CZ2 3.78Å; M1091-W1178 HydrophobicContact CG-CZ2 4.5Å; M1091-W1178 HydrophobicContact SD-CZ2 4.23Å; M1091-W1178 PolarHBondContact SD-NE1 3.15Å; M1091-W1178 VanDerWaalsContact SD-NE1 3.38Å; L1092-W1178 HydrophobicContact CD1-CH2 4.11Å; L1092-W1178 HydrophobicContact CD2-CE3 4.32Å; L1092-W1178 HydrophobicContact CD2-CH2 3.56Å; L1092-W1178 HydrophobicContact CD2-CZ2 4.21Å; L1092-W1178 HydrophobicContact CD2-CZ3 3.63Å; L1092-W1178 VanDerWaalsContact CD2-CZ3 3.45Å; L1092-W1178 HydrophobicContact CG-CH2 3.58Å; L1092-W1178 HydrophobicContact CG-CZ2 4.27Å; L1092-W1178 HydrophobicContact CG-CZ3 4.16Å; D1174-W1178 WeakPolarHBondContact O-CB 3.4Å; D1174-W1178 PolarHBondContact O-N 3.06Å; M1175-W1178 WeakPolarHBondContact O-CB 3.36Å; M1175-W1178 PolarHBondContact O-N 3.18Å; W1178-N1180 VanDerWaalsContact C-N 3.28Å; W1178-N1180 PolarHBondContact O-N 3.04Å; W1178-Y1181 PolarHBondContact O-N 3.4Å; W1178-Y1181 VanDerWaalsContact O-N 3.16Å; W1178-A1182 HydrophobicContact CE3-CB 4.22Å; W1178-A1182 HydrophobicContact CH2-CB 3.99Å; W1178-A1182 HydrophobicContact CZ3-CB 3.8Å; W1178-A1182 WeakPolarHBondContact O-CB 3.21Å; W1178-A1182 PolarHBondContact O-N 3.16Å
1179F89.3Confident85.2Confident0.6 Ų0.627.8 Ų27.80%0.00314%0.142CC..Hα-helixtrans-62.7-33.8178.3-84-66.4000112.6L1092 M1175 L1176 T1177 A1182 R1183 L1265 F1268 V1327 C1330 I1331L1092-F1179 HydrophobicContact CD2-CE1 4.25Å; L1092-F1179 HydrophobicContact CD2-CZ 4.24Å; M1175-F1179 HydrophobicContact CE-CD2 4.36Å; M1175-F1179 HydrophobicContact CE-CE2 3.98Å; M1175-F1179 HydrophobicContact CE-CZ 4.49Å; M1175-F1179 VanDerWaalsContact O-CD2 3.28Å; M1175-F1179 WeakPolarHBondContact O-CD2 3.37Å; M1175-F1179 PolarHBondContact O-N 3.09Å; M1175-F1179 VanDerWaalsContact O-N 3.09Å; L1176-F1179 PolarHBondContact O-N 3Å; T1177-F1179 VanDerWaalsContact C-N 3.35Å; T1177-F1179 PolarHBondContact O-N 3.27Å; F1179-A1182 PolarHBondContact O-N 3.3Å; F1179-R1183 VanDerWaalsContact O-CB 3.26Å; F1179-R1183 WeakPolarHBondContact O-CB 3.35Å; F1179-R1183 PolarHBondContact O-N 3.07Å; F1179-L1265 HydrophobicContact CE1-CD2 4.23Å; F1179-F1268 HydrophobicContact CE2-CD1 4.38Å; F1179-F1268 AromaticContact CE2-CE1 3.86Å; F1179-F1268 HydrophobicContact CE2-CE1 4.11Å; F1179-F1268 HydrophobicContact CE2-CZ 4.26Å; F1179-F1268 AromaticContact CZ-CD1 3.86Å; F1179-F1268 HydrophobicContact CZ-CD1 3.93Å; F1179-F1268 HydrophobicContact CZ-CD2 4.27Å; F1179-F1268 AromaticContact CZ-CE1 3.71Å; F1179-F1268 HydrophobicContact CZ-CE1 3.71Å; F1179-F1268 HydrophobicContact CZ-CE2 4.31Å; F1179-F1268 HydrophobicContact CZ-CG 4.29Å; F1179-F1268 AromaticContact CZ-CZ 3.8Å; F1179-F1268 HydrophobicContact CZ-CZ 3.89Å; F1179-V1327 HydrophobicContact CD2-CG1 3.62Å; F1179-V1327 HydrophobicContact CD2-CG2 4.37Å; F1179-V1327 HydrophobicContact CE2-CG1 3.72Å; F1179-V1327 HydrophobicContact CG-CG1 4.15Å; F1179-V1327 HydrophobicContact CZ-CG1 4.3Å; F1179-C1330 HydrophobicContact CB-CB 3.98Å; F1179-I1331 HydrophobicContact CD1-CD1 4.45Å; F1179-I1331 HydrophobicContact CD1-CG1 3.89Å; F1179-I1331 HydrophobicContact CE1-CD1 4Å; F1179-I1331 HydrophobicContact CE1-CG1 3.65Å; F1179-I1331 HydrophobicContact CZ-CD1 4.19Å; F1179-I1331 HydrophobicContact CZ-CG1 4.34Å
1180N90.8Very high85.6Confident54.8 Ų54.827.2 Ų27.229%0.29314%0.138SC..Hα-helixtrans-69.1-38.7174.4-120-28.2000112.8L1176 T1177 W1178 R1183 L1184 C1330L1176-N1180 PolarHBondContact O-N 3.2Å; L1176-N1180 VanDerWaalsContact O-N 3.08Å; L1176-N1180 PolarHBondContact O-ND2 3.03Å; T1177-N1180 WeakPolarHBondContact O-CA 3.29Å; T1177-N1180 WeakPolarHBondContact O-CB 3.46Å; T1177-N1180 PolarHBondContact O-N 3.31Å; T1177-N1180 VanDerWaalsContact O-N 3.14Å; W1178-N1180 VanDerWaalsContact C-N 3.28Å; W1178-N1180 PolarHBondContact O-N 3.04Å; N1180-R1183 WeakPolarHBondContact O-CB 3.28Å; N1180-R1183 PolarHBondContact O-N 3.2Å; N1180-R1183 PolarHBondContact OD1-NE 2.97Å; N1180-R1183 VanDerWaalsContact OD1-NE 3.11Å; N1180-R1183 PolarHBondContact OD1-NH2 3.11Å; N1180-L1184 WeakPolarHBondContact O-CB 3.48Å; N1180-L1184 VanDerWaalsContact O-CG 3.3Å; N1180-L1184 WeakPolarHBondContact O-CG 3.41Å; N1180-L1184 PolarHBondContact O-N 2.97Å; N1180-C1330 PolarHBondContact OD1-SG 2.95Å
1181Y91.6Very high85.7Confident52.8 Ų52.824.9 Ų24.921%0.20713%0.129CC..Hα-helixtrans-68.1-43.2173-73.9-66.7000112T1055 L1058 D1059 Y1062 T1177 W1178 R1183 L1184 I1185T1055-Y1181 HydrophobicContact CG2-CD2 4.05Å; T1055-Y1181 HydrophobicContact CG2-CE2 3.95Å; L1058-Y1181 HydrophobicContact CB-CD2 4.47Å; L1058-Y1181 HydrophobicContact CB-CG 4.33Å; D1059-Y1181 HydrophobicContact CB-CD1 4.38Å; D1059-Y1181 HydrophobicContact CB-CD2 4.46Å; D1059-Y1181 HydrophobicContact CB-CE1 3.82Å; D1059-Y1181 HydrophobicContact CB-CE2 4Å; D1059-Y1181 VanDerWaalsContact CG-CZ 3.48Å; D1059-Y1181 VanDerWaalsContact CG-OH 3.25Å; D1059-Y1181 WeakPolarHBondContact OD1-CE1 3.42Å; D1059-Y1181 PolarHBondContact OD1-OH 3.07Å; D1059-Y1181 PolarHBondContact OD2-OH 3Å; Y1062-Y1181 HydrophobicContact CD1-CD1 4.19Å; Y1062-Y1181 HydrophobicContact CD1-CE1 4.25Å; Y1062-Y1181 HydrophobicContact CG-CD1 4.38Å; T1177-Y1181 VanDerWaalsContact O-CD2 3.22Å; T1177-Y1181 WeakPolarHBondContact O-CD2 3.27Å; T1177-Y1181 PolarHBondContact O-N 3.17Å; W1178-Y1181 PolarHBondContact O-N 3.4Å; W1178-Y1181 VanDerWaalsContact O-N 3.16Å; Y1181-R1183 VanDerWaalsContact C-N 3.27Å; Y1181-R1183 PolarHBondContact O-N 2.96Å; Y1181-L1184 HydrophobicContact CD1-CD1 4.4Å; Y1181-L1184 PolarHBondContact O-N 3.04Å; Y1181-L1184 VanDerWaalsContact O-N 3.11Å; Y1181-I1185 WeakPolarHBondContact O-CB 3.42Å; Y1181-I1185 WeakPolarHBondContact O-CD1 3.27Å; Y1181-I1185 VanDerWaalsContact O-CG1 3.3Å; Y1181-I1185 WeakPolarHBondContact O-CG1 3.25Å; Y1181-I1185 PolarHBondContact O-N 3.11Å
1182A91.1Very high85.4Confident3.6 Ų3.627.7 Ų27.73%0.0314%0.143CC..Hα-helixtrans-56.6-41173.900000111.8L1058 L1088 W1178 F1179 I1185 C1186L1058-A1182 HydrophobicContact CD1-CB 4.43Å; L1088-A1182 HydrophobicContact CD2-CB 3.83Å; W1178-A1182 HydrophobicContact CE3-CB 4.22Å; W1178-A1182 HydrophobicContact CH2-CB 3.99Å; W1178-A1182 HydrophobicContact CZ3-CB 3.8Å; W1178-A1182 WeakPolarHBondContact O-CB 3.21Å; W1178-A1182 PolarHBondContact O-N 3.16Å; F1179-A1182 PolarHBondContact O-N 3.3Å; A1182-I1185 PolarHBondContact O-N 3.29Å; A1182-C1186 WeakPolarHBondContact O-CB 3.39Å; A1182-C1186 PolarHBondContact O-N 3.07Å; A1182-C1186 PolarHBondContact O-SG 2.97Å
1183R90.8Very high84.8Confident31.2 Ų31.237.5 Ų37.512%0.11818%0.178CC..Hα-helixtrans-63.3-45.7174.3-171.5-165.972.160.515112.5F1179 N1180 Y1181 I1185 C1186 Q1187 C1330 E1333 C1334F1179-R1183 VanDerWaalsContact O-CB 3.26Å; F1179-R1183 WeakPolarHBondContact O-CB 3.35Å; F1179-R1183 PolarHBondContact O-N 3.07Å; N1180-R1183 WeakPolarHBondContact O-CB 3.28Å; N1180-R1183 PolarHBondContact O-N 3.2Å; N1180-R1183 PolarHBondContact OD1-NE 2.97Å; N1180-R1183 VanDerWaalsContact OD1-NE 3.11Å; N1180-R1183 PolarHBondContact OD1-NH2 3.11Å; Y1181-R1183 VanDerWaalsContact C-N 3.27Å; Y1181-R1183 PolarHBondContact O-N 2.96Å; R1183-I1185 VanDerWaalsContact C-N 3.31Å; R1183-I1185 PolarHBondContact O-N 3.26Å; R1183-C1186 PolarHBondContact O-N 3.19Å; R1183-Q1187 VanDerWaalsContact O-CB 3.29Å; R1183-Q1187 WeakPolarHBondContact O-CB 3.36Å; R1183-Q1187 PolarHBondContact O-N 3Å; R1183-C1330 HydrophobicContact CB-CB 4.42Å; R1183-E1333 VanDerWaalsContact CD-OE2 3.28Å; R1183-E1333 WeakPolarHBondContact CD-OE2 3.39Å; R1183-E1333 HydrophobicContact CG-CB 3.75Å; R1183-E1333 IonicContact CZ-OE2 3.08Å; R1183-E1333 IonicContact NE-OE2 3.33Å; R1183-E1333 IonicContact NH1-OE2 3.32Å; R1183-E1333 PolarHBondContact NH1-OE2 3.12Å; R1183-E1333 VanDerWaalsContact NH1-OE2 3.16Å; R1183-C1334 WeakPolarHBondContact CA-SG 3.28Å
1184L90.7Very high83.7Confident38.2 Ų38.236.9 Ų36.920%0.218%0.179CC..Hα-helixtrans-64.8-38.4176.1-73.9170.4000112.6Y1062 N1180 Y1181 Q1187 H1188Y1062-L1184 HydrophobicContact CD1-CD1 4.44Å; Y1062-L1184 HydrophobicContact CD2-CB 4.24Å; Y1062-L1184 HydrophobicContact CE1-CB 4.23Å; Y1062-L1184 HydrophobicContact CE1-CD1 3.98Å; Y1062-L1184 HydrophobicContact CE1-CG 4.47Å; Y1062-L1184 HydrophobicContact CE2-CB 3.8Å; N1180-L1184 WeakPolarHBondContact O-CB 3.48Å; N1180-L1184 VanDerWaalsContact O-CG 3.3Å; N1180-L1184 WeakPolarHBondContact O-CG 3.41Å; N1180-L1184 PolarHBondContact O-N 2.97Å; Y1181-L1184 HydrophobicContact CD1-CD1 4.4Å; Y1181-L1184 PolarHBondContact O-N 3.04Å; Y1181-L1184 VanDerWaalsContact O-N 3.11Å; L1184-Q1187 WeakPolarHBondContact O-CB 3.36Å; L1184-Q1187 PolarHBondContact O-N 3.22Å; L1184-H1188 WeakPolarHBondContact O-CB 3.39Å; L1184-H1188 PolarHBondContact O-N 2.99Å; L1184-H1188 VanDerWaalsContact O-N 3.08Å
1185I90.4Very high82.4Confident0.2 Ų0.238.9 Ų38.90%0.00119%0.192CC..Hα-helixtrans-65.4-50.3174.6-69.1163.9000110L1058 Y1062 L1084 L1088 Y1181 A1182 R1183 Q1187 H1188 L1189L1058-I1185 HydrophobicContact CB-CD1 4.43Å; L1058-I1185 HydrophobicContact CD2-CD1 4.05Å; Y1062-I1185 HydrophobicContact CD2-CG1 4Å; Y1062-I1185 HydrophobicContact CG-CG1 4.42Å; L1084-I1185 HydrophobicContact CB-CG2 4.35Å; L1084-I1185 HydrophobicContact CD1-CD1 4.32Å; L1084-I1185 HydrophobicContact CD1-CG2 4.3Å; L1084-I1185 HydrophobicContact CD2-CD1 4.48Å; L1084-I1185 HydrophobicContact CD2-CG1 4.44Å; L1084-I1185 HydrophobicContact CD2-CG2 4.16Å; L1084-I1185 VanDerWaalsContact CD2-CG2 3.5Å; L1084-I1185 HydrophobicContact CG-CG2 3.8Å; L1088-I1185 HydrophobicContact CD1-CG2 4.24Å; Y1181-I1185 WeakPolarHBondContact O-CB 3.42Å; Y1181-I1185 WeakPolarHBondContact O-CD1 3.27Å; Y1181-I1185 VanDerWaalsContact O-CG1 3.3Å; Y1181-I1185 WeakPolarHBondContact O-CG1 3.25Å; Y1181-I1185 PolarHBondContact O-N 3.11Å; A1182-I1185 PolarHBondContact O-N 3.29Å; R1183-I1185 VanDerWaalsContact C-N 3.31Å; R1183-I1185 PolarHBondContact O-N 3.26Å; I1185-Q1187 VanDerWaalsContact C-N 3.27Å; I1185-Q1187 PolarHBondContact O-N 3.22Å; I1185-H1188 WeakPolarHBondContact O-CB 3.37Å; I1185-H1188 PolarHBondContact O-N 3.06Å; I1185-H1188 VanDerWaalsContact O-N 3.12Å; I1185-L1189 HydrophobicContact CG2-CD1 3.85Å; I1185-L1189 HydrophobicContact CG2-CG 4.31Å; I1185-L1189 WeakPolarHBondContact O-CB 3.44Å; I1185-L1189 VanDerWaalsContact O-CG 3.28Å; I1185-L1189 WeakPolarHBondContact O-CG 3.4Å; I1185-L1189 PolarHBondContact O-N 3.01Å; I1185-L1189 VanDerWaalsContact O-N 3.1Å
1186C88.5Confident81.1Confident1 Ų144.1 Ų44.11%0.00723%0.227CC..Hα-helixtrans-58.2-39.3176.9-68.10000112.1Y1076 A1182 R1183 H1188 L1189 A1190 Y1337Y1076-C1186 PolarHBondContact OH-O 2.77Å; A1182-C1186 WeakPolarHBondContact O-CB 3.39Å; A1182-C1186 PolarHBondContact O-N 3.07Å; A1182-C1186 PolarHBondContact O-SG 2.97Å; R1183-C1186 PolarHBondContact O-N 3.19Å; C1186-H1188 VanDerWaalsContact C-N 3.33Å; C1186-H1188 PolarHBondContact O-N 2.88Å; C1186-L1189 PolarHBondContact O-N 2.92Å; C1186-A1190 WeakPolarHBondContact O-CB 3.38Å; C1186-A1190 PolarHBondContact O-N 3.14Å; C1186-A1190 VanDerWaalsContact O-N 3.12Å; C1186-Y1337 HydrophobicContact CB-CD2 4.2Å
1187Q88.2Confident79.8Confident47 Ų4747.5 Ų47.522%0.2224%0.24CC..Hα-helixtrans-62.8-41.7174.7-178.1178.6-17.100112.5H1073 R1183 L1184 I1185 L1189 Y1337 L1542H1073-Q1187 PolarHBondContact CE1-O 3.27Å; H1073-Q1187 VanDerWaalsContact CE1-O 3.24Å; H1073-Q1187 PolarHBondContact ND1-O 3.35Å; R1183-Q1187 VanDerWaalsContact O-CB 3.29Å; R1183-Q1187 WeakPolarHBondContact O-CB 3.36Å; R1183-Q1187 PolarHBondContact O-N 3Å; L1184-Q1187 WeakPolarHBondContact O-CB 3.36Å; L1184-Q1187 PolarHBondContact O-N 3.22Å; I1185-Q1187 VanDerWaalsContact C-N 3.27Å; I1185-Q1187 PolarHBondContact O-N 3.22Å; Q1187-L1189 VanDerWaalsContact C-N 3.34Å; Q1187-Y1337 HydrophobicContact CB-CD1 4.46Å; Q1187-Y1337 HydrophobicContact CB-CD2 4.09Å; Q1187-Y1337 HydrophobicContact CB-CE1 4.17Å; Q1187-Y1337 HydrophobicContact CB-CE2 3.65Å; Q1187-Y1337 HydrophobicContact CB-CG 4.45Å; Q1187-Y1337 HydrophobicContact CG-CE1 4.04Å; Q1187-Y1337 HydrophobicContact CG-CE2 4.15Å; Q1187-Y1337 PolarHBondContact OE1-OH 2.88Å; Q1187-L1542 HydrophobicContact CG-CD1 4Å; Q1187-L1542 HydrophobicContact CG-CD2 3.74Å; Q1187-L1542 HydrophobicContact CG-CG 4.26Å; Q1187-L1542 VanDerWaalsContact NE2-CD2 3.32Å
1188H86.8Confident78.2Confident22.8 Ų22.849.5 Ų49.511%0.10625%0.252CS..Hα-helixtrans-72.6-28.5178.8-161.443.2000112.8Y1062 L1065 K1066 D1069 G1072 H1073 L1184 I1185 C1186Y1062-H1188 HydrophobicContact CE2-CB 4.37Å; Y1062-H1188 AromaticContact CE2-CD2 3.96Å; L1065-H1188 HydrophobicContact CD2-CB 4.34Å; K1066-H1188 WeakPolarHBondContact CG-NE2 3.49Å; D1069-H1188 PolarHBondContact O-CE1 3.12Å; D1069-H1188 VanDerWaalsContact O-CE1 3.22Å; D1069-H1188 PolarHBondContact O-NE2 3.06Å; G1072-H1188 VanDerWaalsContact CA-CE1 3.4Å; G1072-H1188 WeakPolarHBondContact CA-CE1 3.38Å; G1072-H1188 VanDerWaalsContact CA-NE2 3.29Å; G1072-H1188 WeakPolarHBondContact CA-NE2 3.38Å; H1073-H1188 WeakPolarHBondContact CA-O 3.39Å; H1073-H1188 PolarHBondContact N-O 3.15Å; H1073-H1188 PolarHBondContact ND1-O 3.06Å; L1184-H1188 WeakPolarHBondContact O-CB 3.39Å; L1184-H1188 PolarHBondContact O-N 2.99Å; L1184-H1188 VanDerWaalsContact O-N 3.08Å; I1185-H1188 WeakPolarHBondContact O-CB 3.37Å; I1185-H1188 PolarHBondContact O-N 3.06Å; I1185-H1188 VanDerWaalsContact O-N 3.12Å; C1186-H1188 VanDerWaalsContact C-N 3.33Å; C1186-H1188 PolarHBondContact O-N 2.88Å
1189L86.7Confident76.4Confident0.4 Ų0.453.5 Ų53.50%0.00228%0.277CS..Hα-helixtrans-84.7-24.7179.3-65179000113.7L1065 G1075 Y1076 P1081 L1084 L1085 I1185 C1186 Q1187L1065-L1189 HydrophobicContact CD1-CD2 4.45Å; L1065-L1189 HydrophobicContact CD2-CD2 4.3Å; L1065-L1189 HydrophobicContact CD2-CG 4.45Å; G1075-L1189 VanDerWaalsContact CA-O 3.32Å; G1075-L1189 WeakPolarHBondContact CA-O 3.36Å; G1075-L1189 PolarHBondContact N-O 3.05Å; Y1076-L1189 HydrophobicContact CD1-CB 4.04Å; Y1076-L1189 HydrophobicContact CD1-CD1 4.29Å; Y1076-L1189 HydrophobicContact CE1-CB 3.75Å; Y1076-L1189 HydrophobicContact CE1-CD1 4.16Å; Y1076-L1189 HydrophobicContact CE1-CG 4.44Å; P1081-L1189 HydrophobicContact CB-CD1 4.29Å; P1081-L1189 HydrophobicContact CB-CD2 3.94Å; P1081-L1189 HydrophobicContact CG-CD2 3.93Å; L1084-L1189 HydrophobicContact CB-CD1 4.36Å; L1084-L1189 HydrophobicContact CD1-CD1 4.27Å; L1084-L1189 HydrophobicContact CD1-CD2 4.26Å; L1084-L1189 HydrophobicContact CD2-CD1 4.49Å; L1085-L1189 HydrophobicContact CD2-CD1 4.35Å; L1085-L1189 HydrophobicContact CG-CD1 4.3Å; I1185-L1189 HydrophobicContact CG2-CD1 3.85Å; I1185-L1189 HydrophobicContact CG2-CG 4.31Å; I1185-L1189 WeakPolarHBondContact O-CB 3.44Å; I1185-L1189 VanDerWaalsContact O-CG 3.28Å; I1185-L1189 WeakPolarHBondContact O-CG 3.4Å; I1185-L1189 PolarHBondContact O-N 3.01Å; I1185-L1189 VanDerWaalsContact O-N 3.1Å; C1186-L1189 PolarHBondContact O-N 2.92Å; Q1187-L1189 VanDerWaalsContact C-N 3.34Å
1190A82.8Confident74.8Confident5 Ų555.8 Ų55.84%0.04129%0.291CS..SBendtrans-64138.4-178.100000112.3H1073 C1186 Y1337 T1341H1073-A1190 VanDerWaalsContact CA-O 3.26Å; H1073-A1190 WeakPolarHBondContact CA-O 3.33Å; H1073-A1190 VanDerWaalsContact CB-O 3.28Å; H1073-A1190 WeakPolarHBondContact CB-O 3.26Å; H1073-A1190 VanDerWaalsContact CG-O 3.3Å; H1073-A1190 PolarHBondContact ND1-O 3.02Å; C1186-A1190 WeakPolarHBondContact O-CB 3.38Å; C1186-A1190 PolarHBondContact O-N 3.14Å; C1186-A1190 VanDerWaalsContact O-N 3.12Å; A1190-Y1337 HydrophobicContact CB-CD1 3.99Å; A1190-Y1337 HydrophobicContact CB-CG 4.4Å; A1190-T1341 HydrophobicContact CB-CG2 4.03Å
1191P77.1Confident73.2Confident35.4 Ų35.458.5 Ų58.523%0.2331%0.305CS..  trans-72.6142.5-173.328.7-35.2000114.1R1193 G1342P1191-R1193 VanDerWaalsContact C-N 3.27Å; P1191-R1193 PolarHBondContact O-N 3.12Å; P1191-R1193 VanDerWaalsContact O-N 3.14Å; P1191-G1342 VanDerWaalsContact CD-CA 3.48Å
1192I68.1Low72Confident90.2 Ų90.259.6 Ų59.646%0.46331%0.312SS..SBendtrans-58.3-29.2-179.4-59.1170.3000112.8I1071 H1073 P1194 L1543I1071-I1192 HydrophobicContact CG2-CD1 4.28Å; H1073-I1192 HydrophobicContact CB-CB 4.4Å; H1073-I1192 HydrophobicContact CB-CD1 3.87Å; H1073-I1192 HydrophobicContact CB-CG1 3.34Å; H1073-I1192 VanDerWaalsContact CD2-CG1 3.49Å; H1073-I1192 WeakPolarHBondContact CD2-CG1 3.35Å; H1073-I1192 VanDerWaalsContact CG-CG1 3.43Å; I1192-P1194 WeakPolarHBondContact O-CD 3.39Å; I1192-L1543 WeakPolarHBondContact O-CD2 3.36Å
1193R60.9Low70.8Confident217.6 Ų217.662.7 Ų62.782%0.82133%0.33SS*.SBendtrans-108.7103.8177.5-68-175.6-176.6159.63.2108.9P1191 T1195P1191-R1193 VanDerWaalsContact C-N 3.27Å; P1191-R1193 PolarHBondContact O-N 3.12Å; P1191-R1193 VanDerWaalsContact O-N 3.14Å; R1193-T1195 PolarHBondContact O-N 3.32Å
1194P59.2Low69.6Low58 Ų5863.4 Ų63.438%0.37734%0.338SS..  trans-58.1137.4166.616.4-21.4000109.1I1192 T1341 F1557I1192-P1194 WeakPolarHBondContact O-CD 3.39Å; P1194-T1341 WeakPolarHBondContact CA-O 3.45Å; P1194-T1341 WeakPolarHBondContact CB-O 3.2Å; P1194-T1341 HydrophobicContact CG-CG2 4.11Å; P1194-F1557 HydrophobicContact CB-CZ 4.35Å; P1194-F1557 HydrophobicContact CG-CE1 3.98Å; P1194-F1557 HydrophobicContact CG-CE2 3.84Å; P1194-F1557 HydrophobicContact CG-CZ 4.09Å
1195T55.5Low68.3Low61.2 Ų61.267.5 Ų67.538%0.37536%0.36SS..  trans-57142.8172.8390000109.7R1193 K1197 D1343R1193-T1195 PolarHBondContact O-N 3.32Å; T1195-K1197 PolarHBondContact O-N 3.15Å; T1195-K1197 VanDerWaalsContact O-N 3.1Å; T1195-D1343 WeakPolarHBondContact CB-OD2 3.1Å; T1195-D1343 HydrophobicContact CG2-CB 4.15Å; T1195-D1343 WeakPolarHBondContact OG1-CB 3.35Å; T1195-D1343 VanDerWaalsContact OG1-CG 3.25Å; T1195-D1343 PolarHBondContact OG1-OD2 3.1Å
1196P52.6Low67.2Low122 Ų12269.1 Ų69.179%0.79237%0.373SS*.  trans-59.3117.3177.115.5-20.6000109V1198P1196-V1198 PolarHBondContact O-N 3.22Å
1197K57Low66.3Low106.4 Ų106.469.9 Ų69.946%0.46338%0.377SS..  trans-54.4126.1-175.5-70175.4178.6169.90110.3T1195 T1199 H1340 A1528 S1529T1195-K1197 PolarHBondContact O-N 3.15Å; T1195-K1197 VanDerWaalsContact O-N 3.1Å; K1197-T1199 PolarHBondContact O-N 3.14Å; K1197-T1199 VanDerWaalsContact O-N 3.09Å; K1197-H1340 WeakPolarHBondContact CE-CE1 3.46Å; K1197-H1340 VanDerWaalsContact CE-NE2 3.29Å; K1197-H1340 WeakPolarHBondContact CE-NE2 3.44Å; K1197-H1340 PolarHBondContact NZ-CE1 3.17Å; K1197-H1340 PolarHBondContact NZ-NE2 3.27Å; K1197-A1528 WeakPolarHBondContact CD-O 3.21Å; K1197-A1528 PolarHBondContact NZ-O 2.95Å; K1197-S1529 WeakPolarHBondContact CE-O 3.33Å; K1197-S1529 PolarHBondContact NZ-O 3.18Å
1198V53.1Low65.3Low86.4 Ų86.472.1 Ų72.152%0.52439%0.386SS..  trans-64.2110.2174.5-179.10000108.1P1196 V1200 R1346P1196-V1198 PolarHBondContact O-N 3.22Å; V1198-V1200 HydrophobicContact CB-CG2 4.49Å; V1198-V1200 HydrophobicContact CG1-CG2 4.1Å; V1198-V1200 PolarHBondContact O-N 3.2Å; V1198-V1200 VanDerWaalsContact O-N 3.12Å; V1198-R1346 HydrophobicContact CG2-CG 4.41Å
1199T53Low64.3Low89.4 Ų89.473.4 Ų73.455%0.54841%0.405SS..  trans-69108.7166.446.90000107.7K1197 D1201 N1605K1197-T1199 PolarHBondContact O-N 3.14Å; K1197-T1199 VanDerWaalsContact O-N 3.09Å; T1199-D1201 PolarHBondContact O-N 3.17Å; T1199-N1605 HydrophobicContact CG2-CB 4.09Å; T1199-N1605 WeakPolarHBondContact CG2-ND2 3.3Å
1200V55.6Low63.3Low48.4 Ų48.474.3 Ų74.329%0.29341%0.411SS..  trans-71.7110.5169.5176.90000107.2V1198 F1202 A1206 L1207 V1210 H1607V1198-V1200 HydrophobicContact CB-CG2 4.49Å; V1198-V1200 HydrophobicContact CG1-CG2 4.1Å; V1198-V1200 PolarHBondContact O-N 3.2Å; V1198-V1200 VanDerWaalsContact O-N 3.12Å; V1200-F1202 HydrophobicContact CB-CE2 4.43Å; V1200-F1202 HydrophobicContact CB-CZ 4.41Å; V1200-F1202 HydrophobicContact CG1-CE1 4.35Å; V1200-F1202 HydrophobicContact CG1-CZ 4.34Å; V1200-F1202 WeakPolarHBondContact O-CD2 3.23Å; V1200-F1202 WeakPolarHBondContact O-CE2 3.43Å; V1200-F1202 PolarHBondContact O-N 3.16Å; V1200-F1202 VanDerWaalsContact O-N 3.1Å; V1200-A1206 HydrophobicContact CG1-CB 4.1Å; V1200-L1207 HydrophobicContact CG1-CD2 4.14Å; V1200-V1210 HydrophobicContact CG1-CG2 4.5Å; V1200-V1210 HydrophobicContact CG2-CG2 4.23Å; V1200-H1607 VanDerWaalsContact CG2-NE2 3.29Å; V1200-H1607 WeakPolarHBondContact CG2-NE2 3.32Å
1201D56.9Low62.6Low111.4 Ų111.475.5 Ų75.560%0.59642%0.417SS*.  trans-58.2132.5175.8-71.1-37.7000109.7T1199 T1203 A1206T1199-D1201 PolarHBondContact O-N 3.17Å; D1201-T1203 HydrophobicContact CB-CG2 4.27Å; D1201-T1203 PolarHBondContact O-N 3.06Å; D1201-A1206 HydrophobicContact CB-CB 4.4Å; D1201-A1206 WeakPolarHBondContact O-CB 3.42Å
1202F67.5Low62.1Low76.8 Ų76.878.3 Ų78.334%0.33743%0.431SS..SBendtrans-76.554.2-178.8-152.7-103000112V1200 L1207 P1608 F1657 T1661 E1734 R1735 F1738 I1746V1200-F1202 HydrophobicContact CB-CE2 4.43Å; V1200-F1202 HydrophobicContact CB-CZ 4.41Å; V1200-F1202 HydrophobicContact CG1-CE1 4.35Å; V1200-F1202 HydrophobicContact CG1-CZ 4.34Å; V1200-F1202 WeakPolarHBondContact O-CD2 3.23Å; V1200-F1202 WeakPolarHBondContact O-CE2 3.43Å; V1200-F1202 PolarHBondContact O-N 3.16Å; V1200-F1202 VanDerWaalsContact O-N 3.1Å; F1202-L1207 HydrophobicContact CD2-CD1 4.19Å; F1202-L1207 HydrophobicContact CE2-CD1 4.17Å; F1202-P1608 HydrophobicContact CD2-CB 4.1Å; F1202-P1608 HydrophobicContact CD2-CG 4.25Å; F1202-P1608 HydrophobicContact CE2-CB 4.11Å; F1202-F1657 AromaticContact CE2-CE2 3.98Å; F1202-F1657 HydrophobicContact CE2-CE2 4.05Å; F1202-F1657 AromaticContact CE2-CZ 3.96Å; F1202-F1657 HydrophobicContact CE2-CZ 3.96Å; F1202-F1657 HydrophobicContact CZ-CE2 4.41Å; F1202-T1661 HydrophobicContact CE2-CG2 4.33Å; F1202-T1661 HydrophobicContact CZ-CG2 3.66Å; F1202-E1734 HydrophobicContact CD1-CB 4.47Å; F1202-R1735 HydrophobicContact CE1-CG 4.22Å; F1202-R1735 HydrophobicContact CZ-CG 4.45Å; F1202-F1738 HydrophobicContact CD1-CB 4.46Å; F1202-F1738 HydrophobicContact CD1-CD2 4.11Å; F1202-F1738 HydrophobicContact CD1-CG 4.44Å; F1202-F1738 HydrophobicContact CE1-CB 3.6Å; F1202-F1738 HydrophobicContact CE1-CD1 4.22Å; F1202-F1738 AromaticContact CE1-CD2 3.59Å; F1202-F1738 HydrophobicContact CE1-CD2 3.93Å; F1202-F1738 HydrophobicContact CE1-CE2 4.31Å; F1202-F1738 AromaticContact CE1-CG 3.65Å; F1202-F1738 HydrophobicContact CE1-CG 3.65Å; F1202-F1738 HydrophobicContact CE2-CD2 4.24Å; F1202-F1738 HydrophobicContact CE2-CE2 4.14Å; F1202-F1738 HydrophobicContact CE2-CG 4.47Å; F1202-F1738 HydrophobicContact CE2-CZ 4.3Å; F1202-F1738 HydrophobicContact CZ-CB 4.05Å; F1202-F1738 AromaticContact CZ-CD1 3.76Å; F1202-F1738 HydrophobicContact CZ-CD1 3.76Å; F1202-F1738 AromaticContact CZ-CD2 3.64Å; F1202-F1738 HydrophobicContact CZ-CD2 3.95Å; F1202-F1738 HydrophobicContact CZ-CE1 4.19Å; F1202-F1738 AromaticContact CZ-CE2 3.97Å; F1202-F1738 HydrophobicContact CZ-CE2 3.97Å; F1202-F1738 AromaticContact CZ-CG 3.64Å; F1202-F1738 HydrophobicContact CZ-CG 3.64Å; F1202-F1738 HydrophobicContact CZ-CZ 4.17Å; F1202-I1746 HydrophobicContact CE2-CD1 4.37Å
1203T65.1Low62.2Low68.6 Ų68.678 Ų7842%0.42143%0.426SS..SBendtrans-113.7149.9178.763.30000110D1201 D1205 A1206 L1207D1201-T1203 HydrophobicContact CB-CG2 4.27Å; D1201-T1203 PolarHBondContact O-N 3.06Å; T1203-D1205 VanDerWaalsContact C-N 3.31Å; T1203-D1205 PolarHBondContact O-N 3.12Å; T1203-A1206 PolarHBondContact O-N 3.16Å; T1203-A1206 VanDerWaalsContact O-N 3.17Å; T1203-A1206 VanDerWaalsContact OG1-CB 3.24Å; T1203-A1206 WeakPolarHBondContact OG1-CB 3.36Å; T1203-A1206 PolarHBondContact OG1-N 2.99Å; T1203-L1207 WeakPolarHBondContact O-CB 3.38Å; T1203-L1207 VanDerWaalsContact O-CG 3.27Å; T1203-L1207 WeakPolarHBondContact O-CG 3.23Å; T1203-L1207 PolarHBondContact O-N 3.09Å; T1203-L1207 VanDerWaalsContact O-N 3.14Å
1204V66.3Low62.5Low45.6 Ų45.669.6 Ų69.628%0.27640%0.4SS..Hα-helixtrans-60.7-39.8-177.5177.30000111.7L1207 K1208 F1738 K1742 S1743V1204-L1207 PolarHBondContact O-N 3.4Å; V1204-K1208 HydrophobicContact CG1-CD 3.92Å; V1204-K1208 HydrophobicContact CG1-CG 4.3Å; V1204-K1208 WeakPolarHBondContact O-CA 3.4Å; V1204-K1208 VanDerWaalsContact O-CB 3.25Å; V1204-K1208 WeakPolarHBondContact O-CB 3.44Å; V1204-K1208 VanDerWaalsContact O-CG 3.27Å; V1204-K1208 WeakPolarHBondContact O-CG 3.32Å; V1204-K1208 PolarHBondContact O-N 3.04Å; V1204-F1738 HydrophobicContact CB-CE2 4.41Å; V1204-F1738 HydrophobicContact CG2-CD2 4.14Å; V1204-F1738 HydrophobicContact CG2-CE1 4.42Å; V1204-F1738 HydrophobicContact CG2-CE2 3.86Å; V1204-F1738 HydrophobicContact CG2-CZ 3.56Å; V1204-K1742 HydrophobicContact CB-CB 3.89Å; V1204-K1742 HydrophobicContact CB-CD 3.6Å; V1204-K1742 HydrophobicContact CB-CG 4.4Å; V1204-K1742 HydrophobicContact CG1-CB 4.05Å; V1204-K1742 HydrophobicContact CG1-CD 4.01Å; V1204-K1742 HydrophobicContact CG2-CB 3.46Å; V1204-K1742 VanDerWaalsContact CG2-CB 3.46Å; V1204-K1742 HydrophobicContact CG2-CD 4.03Å; V1204-K1742 HydrophobicContact CG2-CG 4.38Å; V1204-S1743 VanDerWaalsContact CG1-CB 3.44Å; V1204-S1743 WeakPolarHBondContact CG2-OG 3.37Å
1205D63.8Low62.5Low123.6 Ų123.674.7 Ų74.766%0.66142%0.419SS*.Hα-helixtrans-74.3-37.6-175.6-52.5-58.1000111.7T1203 K1208 G1209 K1742T1203-D1205 VanDerWaalsContact C-N 3.31Å; T1203-D1205 PolarHBondContact O-N 3.12Å; D1205-K1208 PolarHBondContact O-N 3.03Å; D1205-G1209 PolarHBondContact O-N 3.31Å; D1205-G1209 VanDerWaalsContact O-N 3.12Å; D1205-K1742 IonicContact OD1-NZ 2.66Å; D1205-K1742 PolarHBondContact OD1-NZ 3.25Å; D1205-K1742 IonicContact OD2-NZ 3.2Å; D1205-K1742 PolarHBondContact OD2-NZ 2.87Å
1206A66.2Low63Low34.4 Ų34.474 Ų7428%0.28441%0.409SS..Hα-helixtrans-66.7-42.3172.700000111.9V1200 D1201 T1203 K1208 G1209 V1210V1200-A1206 HydrophobicContact CG1-CB 4.1Å; D1201-A1206 HydrophobicContact CB-CB 4.4Å; D1201-A1206 WeakPolarHBondContact O-CB 3.42Å; T1203-A1206 PolarHBondContact O-N 3.16Å; T1203-A1206 VanDerWaalsContact O-N 3.17Å; T1203-A1206 VanDerWaalsContact OG1-CB 3.24Å; T1203-A1206 WeakPolarHBondContact OG1-CB 3.36Å; T1203-A1206 PolarHBondContact OG1-N 2.99Å; A1206-K1208 PolarHBondContact O-N 3.46Å; A1206-G1209 PolarHBondContact O-N 2.9Å; A1206-V1210 WeakPolarHBondContact O-CG2 3.34Å; A1206-V1210 PolarHBondContact O-N 3.25Å; A1206-V1210 VanDerWaalsContact O-N 3.15Å
1207L68.9Low63.1Low16.8 Ų16.873.6 Ų73.69%0.08841%0.405CS..Hα-helixtrans-65.8-44.3176.4-73.7168.7000111.9V1200 F1202 T1203 V1204 G1209 V1210 V1211 P1608 L1609 F1738 I1746V1200-L1207 HydrophobicContact CG1-CD2 4.14Å; F1202-L1207 HydrophobicContact CD2-CD1 4.19Å; F1202-L1207 HydrophobicContact CE2-CD1 4.17Å; T1203-L1207 WeakPolarHBondContact O-CB 3.38Å; T1203-L1207 VanDerWaalsContact O-CG 3.27Å; T1203-L1207 WeakPolarHBondContact O-CG 3.23Å; T1203-L1207 PolarHBondContact O-N 3.09Å; T1203-L1207 VanDerWaalsContact O-N 3.14Å; V1204-L1207 PolarHBondContact O-N 3.4Å; L1207-G1209 VanDerWaalsContact C-N 3.33Å; L1207-G1209 PolarHBondContact O-N 3.05Å; L1207-V1210 CarbonylContact O-C 3.34Å; L1207-V1210 PolarHBondContact O-N 3.16Å; L1207-V1210 VanDerWaalsContact O-N 3.13Å; L1207-V1211 WeakPolarHBondContact O-CB 3.39Å; L1207-V1211 WeakPolarHBondContact O-CG2 3.3Å; L1207-V1211 PolarHBondContact O-N 3.21Å; L1207-V1211 VanDerWaalsContact O-N 3.09Å; L1207-P1608 HydrophobicContact CD1-CG 4.39Å; L1207-P1608 HydrophobicContact CD2-CB 4.21Å; L1207-P1608 HydrophobicContact CD2-CG 3.44Å; L1207-P1608 HydrophobicContact CG-CG 4.47Å; L1207-L1609 HydrophobicContact CD2-CD2 3.98Å; L1207-L1609 HydrophobicContact CD2-CG 4.13Å; L1207-F1738 HydrophobicContact CD1-CD2 4.29Å; L1207-F1738 HydrophobicContact CD1-CE2 3.57Å; L1207-F1738 HydrophobicContact CD1-CZ 3.66Å; L1207-I1746 HydrophobicContact CD1-CD1 4.39Å; L1207-I1746 HydrophobicContact CD1-CG1 4.32Å
1208K68.3Low63.2Low93.6 Ų93.671.6 Ų71.641%0.40740%0.399SS..Hα-helixtrans-60.3-43.3175.2-138.8178.7174.6-173.80111.6V1204 D1205 A1206 V1210 V1211 D1212V1204-K1208 HydrophobicContact CG1-CD 3.92Å; V1204-K1208 HydrophobicContact CG1-CG 4.3Å; V1204-K1208 WeakPolarHBondContact O-CA 3.4Å; V1204-K1208 VanDerWaalsContact O-CB 3.25Å; V1204-K1208 WeakPolarHBondContact O-CB 3.44Å; V1204-K1208 VanDerWaalsContact O-CG 3.27Å; V1204-K1208 WeakPolarHBondContact O-CG 3.32Å; V1204-K1208 PolarHBondContact O-N 3.04Å; D1205-K1208 PolarHBondContact O-N 3.03Å; A1206-K1208 PolarHBondContact O-N 3.46Å; K1208-V1210 PolarHBondContact O-N 3.13Å; K1208-V1210 VanDerWaalsContact O-N 3.13Å; K1208-V1211 PolarHBondContact O-N 3.31Å; K1208-V1211 VanDerWaalsContact O-N 3.14Å; K1208-D1212 WeakPolarHBondContact CE-OD2 3.2Å; K1208-D1212 VanDerWaalsContact CG-OD2 3.31Å; K1208-D1212 WeakPolarHBondContact CG-OD2 3.38Å; K1208-D1212 IonicContact NZ-OD2 3.78Å; K1208-D1212 VanDerWaalsContact O-CB 3.29Å; K1208-D1212 WeakPolarHBondContact O-CB 3.4Å; K1208-D1212 VanDerWaalsContact O-CG 3.26Å; K1208-D1212 PolarHBondContact O-N 3.14Å; K1208-D1212 VanDerWaalsContact O-N 3.07Å
1209G64.9Low63.6Low49.2 Ų49.268.5 Ų68.551%0.50738%0.378SS..Hα-helixtrans-62.7-17.1176.100000115.2D1205 A1206 L1207D1205-G1209 PolarHBondContact O-N 3.31Å; D1205-G1209 VanDerWaalsContact O-N 3.12Å; A1206-G1209 PolarHBondContact O-N 2.9Å; L1207-G1209 VanDerWaalsContact C-N 3.33Å; L1207-G1209 PolarHBondContact O-N 3.05Å
1210V66.4Low63.8Low21.2 Ų21.265.6 Ų65.613%0.12836%0.361CS..Hα-helixtrans-99.9-27.3173.8-178.80000112.1V1200 A1206 L1207 K1208 P1486 G1487 L1609V1200-V1210 HydrophobicContact CG1-CG2 4.5Å; V1200-V1210 HydrophobicContact CG2-CG2 4.23Å; A1206-V1210 WeakPolarHBondContact O-CG2 3.34Å; A1206-V1210 PolarHBondContact O-N 3.25Å; A1206-V1210 VanDerWaalsContact O-N 3.15Å; L1207-V1210 CarbonylContact O-C 3.34Å; L1207-V1210 PolarHBondContact O-N 3.16Å; L1207-V1210 VanDerWaalsContact O-N 3.13Å; K1208-V1210 PolarHBondContact O-N 3.13Å; K1208-V1210 VanDerWaalsContact O-N 3.13Å; V1210-P1486 CarbonylContact O-C 3.57Å; V1210-P1486 VanDerWaalsContact O-CA 3.26Å; V1210-P1486 WeakPolarHBondContact O-CA 3.39Å; V1210-G1487 PolarHBondContact O-N 3.2Å; V1210-L1609 HydrophobicContact CB-CD1 4.04Å; V1210-L1609 HydrophobicContact CG1-CD1 3.63Å
1211V67.4Low63.4Low28.8 Ų28.867.1 Ų67.118%0.17537%0.368CS..Hα-helixtrans-78.4-40175.4172.10000111.8L1207 K1208 F1213 F1489 N1490 L1609 G1745L1207-V1211 WeakPolarHBondContact O-CB 3.39Å; L1207-V1211 WeakPolarHBondContact O-CG2 3.3Å; L1207-V1211 PolarHBondContact O-N 3.21Å; L1207-V1211 VanDerWaalsContact O-N 3.09Å; K1208-V1211 PolarHBondContact O-N 3.31Å; K1208-V1211 VanDerWaalsContact O-N 3.14Å; V1211-F1213 PolarHBondContact O-N 3.25Å; V1211-F1489 HydrophobicContact CG1-CD1 4.38Å; V1211-F1489 HydrophobicContact CG2-CD1 4.04Å; V1211-F1489 HydrophobicContact CG2-CE1 4.38Å; V1211-N1490 PolarHBondContact O-ND2 3.2Å; V1211-L1609 HydrophobicContact CG2-CD1 3.67Å; V1211-L1609 HydrophobicContact CG2-CD2 3.5Å; V1211-L1609 VanDerWaalsContact CG2-CD2 3.5Å; V1211-L1609 HydrophobicContact CG2-CG 4.25Å; V1211-G1745 WeakPolarHBondContact CG2-O 3.45Å
1212D67.2Low62.5Low95.6 Ų95.666.1 Ų66.151%0.51137%0.37SS..SBendtrans-66.5120.7179.3-72.7-16.7000110.4K1208 P1214 G1487K1208-D1212 WeakPolarHBondContact CE-OD2 3.2Å; K1208-D1212 VanDerWaalsContact CG-OD2 3.31Å; K1208-D1212 WeakPolarHBondContact CG-OD2 3.38Å; K1208-D1212 IonicContact NZ-OD2 3.78Å; K1208-D1212 VanDerWaalsContact O-CB 3.29Å; K1208-D1212 WeakPolarHBondContact O-CB 3.4Å; K1208-D1212 VanDerWaalsContact O-CG 3.26Å; K1208-D1212 PolarHBondContact O-N 3.14Å; K1208-D1212 VanDerWaalsContact O-N 3.07Å; D1212-P1214 WeakPolarHBondContact O-CD 3.31Å; D1212-G1487 PolarHBondContact O-N 2.88Å
1213F69.3Low60.8Low83.6 Ų83.665.4 Ų65.437%0.36738%0.384SS..PPolyproline II helixtrans-83.2122.4177.7-153.2-90.4000108.9V1211 E1215 Y1216 H1453 N1490 V1491V1211-F1213 PolarHBondContact O-N 3.25Å; F1213-E1215 PolarHBondContact O-N 3.03Å; F1213-Y1216 HydrophobicContact CD1-CE1 4.4Å; F1213-Y1216 AromaticContact CE1-CD1 3.84Å; F1213-Y1216 HydrophobicContact CE1-CD1 4.08Å; F1213-Y1216 HydrophobicContact CE1-CD2 4.22Å; F1213-Y1216 AromaticContact CE1-CE1 3.63Å; F1213-Y1216 HydrophobicContact CE1-CE1 3.63Å; F1213-Y1216 VanDerWaalsContact CE1-CE1 3.5Å; F1213-Y1216 HydrophobicContact CE1-CE2 4.16Å; F1213-Y1216 AromaticContact CE1-CZ 3.95Å; F1213-Y1216 HydrophobicContact CE2-CE1 4.25Å; F1213-Y1216 AromaticContact CZ-CD1 3.89Å; F1213-Y1216 HydrophobicContact CZ-CD1 3.89Å; F1213-Y1216 AromaticContact CZ-CE1 3.62Å; F1213-Y1216 HydrophobicContact CZ-CE1 3.62Å; F1213-Y1216 HydrophobicContact CZ-CE2 4.37Å; F1213-Y1216 AromaticContact CZ-CZ 3.88Å; F1213-Y1216 WeakPolarHBondContact CZ-OH 3.41Å; F1213-H1453 AromaticContact CD1-CE1 3.91Å; F1213-H1453 AromaticContact CD2-CE1 3.93Å; F1213-H1453 AromaticContact CE1-CE1 3.97Å; F1213-H1453 AromaticContact CE1-ND1 3.85Å; F1213-H1453 AromaticContact CE2-CD2 3.95Å; F1213-H1453 AromaticContact CE2-CE1 3.72Å; F1213-H1453 VanDerWaalsContact CE2-CE1 3.47Å; F1213-H1453 WeakPolarHBondContact CE2-CE1 3.31Å; F1213-H1453 AromaticContact CE2-CG 3.81Å; F1213-H1453 AromaticContact CE2-ND1 3.47Å; F1213-H1453 VanDerWaalsContact CE2-ND1 3.33Å; F1213-H1453 WeakPolarHBondContact CE2-ND1 3.24Å; F1213-H1453 AromaticContact CZ-CE1 3.84Å; F1213-H1453 AromaticContact CZ-ND1 3.54Å; F1213-H1453 WeakPolarHBondContact CZ-ND1 3.4Å; F1213-N1490 HydrophobicContact CD2-CB 4.13Å; F1213-N1490 HydrophobicContact CE2-CB 3.31Å; F1213-N1490 HydrophobicContact CZ-CB 3.65Å; F1213-V1491 HydrophobicContact CE1-CG2 3.75Å; F1213-V1491 HydrophobicContact CE2-CG2 4.09Å; F1213-V1491 HydrophobicContact CZ-CG2 3.73Å
1214P67.7Low59.1Low41 Ų4169.1 Ų69.127%0.26640%0.402SS..PPolyproline II helixtrans-63.5137.5177.517.2-20.8000110.2D1212 Y1216 Y1449 P1486D1212-P1214 WeakPolarHBondContact O-CD 3.31Å; P1214-Y1216 HydrophobicContact CB-CD1 4.24Å; P1214-Y1216 HydrophobicContact CG-CD1 4.2Å; P1214-Y1216 HydrophobicContact CG-CE1 4.28Å; P1214-Y1216 HydrophobicContact CG-CE2 4.24Å; P1214-Y1216 VanDerWaalsContact O-CD1 3.22Å; P1214-Y1216 WeakPolarHBondContact O-CD1 3.3Å; P1214-Y1216 PolarHBondContact O-N 3.12Å; P1214-Y1449 HydrophobicContact CB-CD2 3.79Å; P1214-Y1449 HydrophobicContact CB-CE1 4.42Å; P1214-Y1449 HydrophobicContact CB-CE2 3.79Å; P1214-Y1449 HydrophobicContact CB-CG 4.32Å; P1214-Y1449 HydrophobicContact CG-CD1 3.78Å; P1214-Y1449 HydrophobicContact CG-CD2 3.72Å; P1214-Y1449 HydrophobicContact CG-CE1 3.94Å; P1214-Y1449 HydrophobicContact CG-CE2 3.62Å; P1214-Y1449 HydrophobicContact CG-CG 3.9Å; P1214-P1486 HydrophobicContact CG-CB 4.11Å
1215E60.3Low57.3Low164.6 Ų164.674.2 Ų74.277%0.76943%0.427SS*.  trans-76.1101.2178.1-170.4168.7-142.200109.9F1213 T1217F1213-E1215 PolarHBondContact O-N 3.03Å; E1215-T1217 PolarHBondContact O-N 3.19Å; E1215-T1217 VanDerWaalsContact O-N 3.14Å
1216Y65.9Low55.7Low45.8 Ų45.877.5 Ų77.518%0.1844%0.438CS..  trans-110.4112.9170.959.1-89.6000109.8F1213 P1214 W1219 N1446 Y1449 H1453F1213-Y1216 HydrophobicContact CD1-CE1 4.4Å; F1213-Y1216 AromaticContact CE1-CD1 3.84Å; F1213-Y1216 HydrophobicContact CE1-CD1 4.08Å; F1213-Y1216 HydrophobicContact CE1-CD2 4.22Å; F1213-Y1216 AromaticContact CE1-CE1 3.63Å; F1213-Y1216 HydrophobicContact CE1-CE1 3.63Å; F1213-Y1216 VanDerWaalsContact CE1-CE1 3.5Å; F1213-Y1216 HydrophobicContact CE1-CE2 4.16Å; F1213-Y1216 AromaticContact CE1-CZ 3.95Å; F1213-Y1216 HydrophobicContact CE2-CE1 4.25Å; F1213-Y1216 AromaticContact CZ-CD1 3.89Å; F1213-Y1216 HydrophobicContact CZ-CD1 3.89Å; F1213-Y1216 AromaticContact CZ-CE1 3.62Å; F1213-Y1216 HydrophobicContact CZ-CE1 3.62Å; F1213-Y1216 HydrophobicContact CZ-CE2 4.37Å; F1213-Y1216 AromaticContact CZ-CZ 3.88Å; F1213-Y1216 WeakPolarHBondContact CZ-OH 3.41Å; P1214-Y1216 HydrophobicContact CB-CD1 4.24Å; P1214-Y1216 HydrophobicContact CG-CD1 4.2Å; P1214-Y1216 HydrophobicContact CG-CE1 4.28Å; P1214-Y1216 HydrophobicContact CG-CE2 4.24Å; P1214-Y1216 VanDerWaalsContact O-CD1 3.22Å; P1214-Y1216 WeakPolarHBondContact O-CD1 3.3Å; P1214-Y1216 PolarHBondContact O-N 3.12Å; Y1216-W1219 HydrophobicContact CD2-CE3 4.18Å; Y1216-W1219 AromaticContact CD2-CZ3 3.9Å; Y1216-W1219 HydrophobicContact CD2-CZ3 3.9Å; Y1216-W1219 HydrophobicContact CE2-CZ3 4.12Å; Y1216-N1446 VanDerWaalsContact CB-CG 3.45Å; Y1216-Y1449 HydrophobicContact CD1-CD2 4.12Å; Y1216-Y1449 HydrophobicContact CD1-CG 4.34Å; Y1216-H1453 AromaticContact CE1-CE1 3.88Å; Y1216-H1453 AromaticContact CE1-ND1 3.39Å; Y1216-H1453 VanDerWaalsContact CE1-ND1 3.31Å; Y1216-H1453 WeakPolarHBondContact CE1-ND1 3.25Å; Y1216-H1453 AromaticContact CZ-ND1 3.49Å; Y1216-H1453 VanDerWaalsContact OH-CB 3.29Å; Y1216-H1453 WeakPolarHBondContact OH-CB 3.46Å; Y1216-H1453 PolarHBondContact OH-ND1 2.99Å
1217T55.1Low53.9Low114.8 Ų114.881.9 Ų81.970%0.70446%0.462SS*.SBendtrans-87.3-39.2172.246.70000111.7E1215 W1219 N1446E1215-T1217 PolarHBondContact O-N 3.19Å; E1215-T1217 VanDerWaalsContact O-N 3.14Å; T1217-W1219 PolarHBondContact O-N 2.95Å; T1217-N1446 PolarHBondContact O-ND2 2.87Å
1218D58Low51.8Low63.6 Ų63.686.8 Ų86.834%0.3450%0.498SS..  trans-122.6148179-135.8-18.9000110.5S1220 K1245 N1446D1218-S1220 PolarHBondContact O-N 3.38Å; D1218-S1220 WeakPolarHBondContact OD1-CB 3.43Å; D1218-S1220 PolarHBondContact OD1-N 2.99Å; D1218-S1220 PolarHBondContact OD1-OG 2.95Å; D1218-S1220 VanDerWaalsContact OD2-CB 3.3Å; D1218-S1220 WeakPolarHBondContact OD2-CB 3.44Å; D1218-S1220 PolarHBondContact OD2-N 3.18Å; D1218-S1220 PolarHBondContact OD2-OG 3.3Å; D1218-K1245 IonicContact OD2-NZ 3.91Å; D1218-K1245 PolarHBondContact OD2-NZ 3.49Å; D1218-N1446 PolarHBondContact O-ND2 3.04Å
1219W62.4Low50Low21.8 Ų21.891.1 Ų91.18%0.08352%0.519CS..SBendtrans-95-11.817952.8-87.3000112.6Y1216 T1217 K1245 P1247 D1251 I1255 N1446 F1447 Y1450Y1216-W1219 HydrophobicContact CD2-CE3 4.18Å; Y1216-W1219 AromaticContact CD2-CZ3 3.9Å; Y1216-W1219 HydrophobicContact CD2-CZ3 3.9Å; Y1216-W1219 HydrophobicContact CE2-CZ3 4.12Å; T1217-W1219 PolarHBondContact O-N 2.95Å; W1219-K1245 PolarHBondContact NE1-O 3.37Å; W1219-P1247 HydrophobicContact CD2-CG 4.28Å; W1219-P1247 HydrophobicContact CH2-CB 3.67Å; W1219-P1247 HydrophobicContact CH2-CG 3.67Å; W1219-P1247 HydrophobicContact CZ2-CB 4.21Å; W1219-P1247 HydrophobicContact CZ3-CB 4.1Å; W1219-P1247 HydrophobicContact CZ3-CG 4.42Å; W1219-D1251 HydrophobicContact CH2-CB 3.73Å; W1219-D1251 VanDerWaalsContact CH2-CG 3.43Å; W1219-D1251 VanDerWaalsContact CH2-OD1 3.24Å; W1219-D1251 WeakPolarHBondContact CH2-OD1 3.47Å; W1219-D1251 WeakPolarHBondContact CH2-OD2 3.26Å; W1219-D1251 HydrophobicContact CZ2-CB 3.98Å; W1219-D1251 WeakPolarHBondContact CZ2-OD2 3.49Å; W1219-D1251 HydrophobicContact CZ3-CB 3.86Å; W1219-D1251 VanDerWaalsContact CZ3-CG 3.49Å; W1219-D1251 WeakPolarHBondContact CZ3-OD1 3.1Å; W1219-I1255 HydrophobicContact CE3-CD1 4.42Å; W1219-I1255 HydrophobicContact CZ3-CD1 4.22Å; W1219-N1446 HydrophobicContact CB-CB 4.36Å; W1219-F1447 HydrophobicContact CB-CB 4.29Å; W1219-F1447 HydrophobicContact CB-CD2 4.24Å; W1219-F1447 HydrophobicContact CD2-CD2 4.06Å; W1219-F1447 AromaticContact CE3-CD2 3.33Å; W1219-F1447 HydrophobicContact CE3-CD2 3.33Å; W1219-F1447 AromaticContact CE3-CE2 3.79Å; W1219-F1447 HydrophobicContact CE3-CE2 3.79Å; W1219-F1447 HydrophobicContact CE3-CG 4.34Å; W1219-F1447 HydrophobicContact CG-CD2 4.25Å; W1219-F1447 HydrophobicContact CH2-CD2 4.12Å; W1219-F1447 AromaticContact CH2-CE2 3.72Å; W1219-F1447 HydrophobicContact CH2-CE2 3.72Å; W1219-F1447 AromaticContact CZ3-CD2 3.35Å; W1219-F1447 HydrophobicContact CZ3-CD2 3.35Å; W1219-F1447 AromaticContact CZ3-CE2 3.26Å; W1219-F1447 HydrophobicContact CZ3-CE2 3.26Å; W1219-F1447 HydrophobicContact CZ3-CZ 4.38Å; W1219-Y1450 HydrophobicContact CB-CD1 4.18Å; W1219-Y1450 HydrophobicContact CB-CD2 4.5Å; W1219-Y1450 HydrophobicContact CB-CG 3.99Å; W1219-Y1450 HydrophobicContact CD2-CD1 4.22Å; W1219-Y1450 HydrophobicContact CD2-CE1 4.34Å; W1219-Y1450 HydrophobicContact CD2-CG 4.35Å; W1219-Y1450 AromaticContact CE2-CD1 3.71Å; W1219-Y1450 AromaticContact CE2-CE1 3.57Å; W1219-Y1450 AromaticContact CE2-CZ 3.86Å; W1219-Y1450 HydrophobicContact CE3-CD1 4.4Å; W1219-Y1450 HydrophobicContact CE3-CD2 4.21Å; W1219-Y1450 AromaticContact CE3-CG 3.86Å; W1219-Y1450 HydrophobicContact CE3-CG 3.86Å; W1219-Y1450 HydrophobicContact CG-CD1 4.44Å; W1219-Y1450 HydrophobicContact CG-CG 4.47Å; W1219-Y1450 HydrophobicContact CH2-CD1 4.21Å; W1219-Y1450 AromaticContact CH2-CD2 3.3Å; W1219-Y1450 HydrophobicContact CH2-CD2 3.3Å; W1219-Y1450 AromaticContact CH2-CE1 3.52Å; W1219-Y1450 HydrophobicContact CH2-CE1 3.52Å; W1219-Y1450 AromaticContact CH2-CE2 3.53Å; W1219-Y1450 HydrophobicContact CH2-CE2 3.53Å; W1219-Y1450 AromaticContact CH2-CG 3.77Å; W1219-Y1450 HydrophobicContact CH2-CG 3.77Å; W1219-Y1450 AromaticContact CZ2-CD1 3.73Å; W1219-Y1450 HydrophobicContact CZ2-CD1 4.03Å; W1219-Y1450 AromaticContact CZ2-CD2 3.93Å; W1219-Y1450 HydrophobicContact CZ2-CD2 3.93Å; W1219-Y1450 AromaticContact CZ2-CE1 3.13Å; W1219-Y1450 HydrophobicContact CZ2-CE1 3.68Å; W1219-Y1450 AromaticContact CZ2-CE2 3.84Å; W1219-Y1450 HydrophobicContact CZ2-CE2 4.07Å; W1219-Y1450 HydrophobicContact CZ2-CG 4.32Å; W1219-Y1450 AromaticContact CZ2-CZ 3.71Å; W1219-Y1450 VanDerWaalsContact CZ2-CZ 3.46Å; W1219-Y1450 HydrophobicContact CZ3-CD1 4.44Å; W1219-Y1450 AromaticContact CZ3-CD2 3.47Å; W1219-Y1450 HydrophobicContact CZ3-CD2 3.47Å; W1219-Y1450 VanDerWaalsContact CZ3-CD2 3.47Å; W1219-Y1450 HydrophobicContact CZ3-CE1 4.36Å; W1219-Y1450 HydrophobicContact CZ3-CE2 4.19Å; W1219-Y1450 AromaticContact CZ3-CG 3.6Å; W1219-Y1450 HydrophobicContact CZ3-CG 3.6Å; W1219-Y1450 AromaticContact NE1-CD2 3.93Å; W1219-Y1450 AromaticContact NE1-CE2 3.94Å; W1219-Y1450 AromaticContact NE1-CZ 3.99Å
1220S55.8Low48.1Very low27.8 Ų27.895.7 Ų95.719%0.19453%0.532CS..SBendtrans-86137.717564.30000111.3D1218 S1222 D1251D1218-S1220 PolarHBondContact O-N 3.38Å; D1218-S1220 WeakPolarHBondContact OD1-CB 3.43Å; D1218-S1220 PolarHBondContact OD1-N 2.99Å; D1218-S1220 PolarHBondContact OD1-OG 2.95Å; D1218-S1220 VanDerWaalsContact OD2-CB 3.3Å; D1218-S1220 WeakPolarHBondContact OD2-CB 3.44Å; D1218-S1220 PolarHBondContact OD2-N 3.18Å; D1218-S1220 PolarHBondContact OD2-OG 3.3Å; S1220-S1222 VanDerWaalsContact C-N 3.28Å; S1220-S1222 PolarHBondContact O-N 3.01Å; S1220-S1222 PolarHBondContact O-OG 3.49Å; S1220-S1222 PolarHBondContact OG-OG 3Å; S1220-D1251 WeakPolarHBondContact CB-OD1 3.42Å
1221D47.2Very low46.4Very low81.4 Ų81.4104.4 Ų104.444%0.43557%0.568SS.*  trans-81.864.3177.1-116.6-15.5000110G1223 A1439 T1440 A1443D1221-G1223 PolarHBondContact O-N 2.96Å; D1221-G1223 VanDerWaalsContact O-N 3.16Å; D1221-A1439 WeakPolarHBondContact OD2-CA 3.47Å; D1221-T1440 WeakPolarHBondContact OD1-CB 3.3Å; D1221-T1440 WeakPolarHBondContact OD1-CG2 3.15Å; D1221-T1440 PolarHBondContact OD1-OG1 3.06Å; D1221-T1440 VanDerWaalsContact OD2-CB 3.27Å; D1221-T1440 WeakPolarHBondContact OD2-CB 3.43Å; D1221-T1440 WeakPolarHBondContact OD2-CG2 3.34Å; D1221-T1440 PolarHBondContact OD2-N 3.07Å; D1221-T1440 VanDerWaalsContact OD2-N 3.09Å; D1221-T1440 PolarHBondContact OD2-OG1 3.13Å; D1221-A1443 HydrophobicContact CB-CB 4.38Å; D1221-A1443 WeakPolarHBondContact OD2-CB 3.19Å
1222S38.8Very low44.4Very low90.4 Ų90.4108.2 Ų108.263%0.63260%0.596SS**  trans-68.889176.5-290000110.1S1220 D1224S1220-S1222 VanDerWaalsContact C-N 3.28Å; S1220-S1222 PolarHBondContact O-N 3.01Å; S1220-S1222 PolarHBondContact O-OG 3.49Å; S1220-S1222 PolarHBondContact OG-OG 3Å; S1222-D1224 VanDerWaalsContact C-N 3.28Å; S1222-D1224 PolarHBondContact O-N 3.04Å; S1222-D1224 VanDerWaalsContact O-N 3.12Å
1223G32.4Very low42.6Very low62.2 Ų62.2111.9 Ų111.964%0.64162%0.615SS**  trans-67.4116.9-17700000113.3D1221 N1225D1221-G1223 PolarHBondContact O-N 2.96Å; D1221-G1223 VanDerWaalsContact O-N 3.16Å; G1223-N1225 PolarHBondContact O-N 3.32Å; G1223-N1225 VanDerWaalsContact O-N 3.09Å
1224D29.1Very low40.6Very low146.2 Ų146.2112.3 Ų112.378%0.78263%0.633SS**SBendtrans-73.196.7179.9-69.4-59.6000113.1S1222 E1226S1222-D1224 VanDerWaalsContact C-N 3.28Å; S1222-D1224 PolarHBondContact O-N 3.04Å; S1222-D1224 VanDerWaalsContact O-N 3.12Å; D1224-E1226 HydrophobicContact CB-CG 4.36Å; D1224-E1226 PolarHBondContact O-N 3.21Å
1225N27.5Very low38.9Very low150.8 Ų150.8116.5 Ų116.581%0.80666%0.661SS**  trans-120.852.1169.8-85.2-43.8000114.5G1223 T1227G1223-N1225 PolarHBondContact O-N 3.32Å; G1223-N1225 VanDerWaalsContact O-N 3.09Å; N1225-T1227 PolarHBondContact O-N 3.19Å; N1225-T1227 VanDerWaalsContact O-N 3.11Å
1226E30.1Very low37.2Very low193.8 Ų193.8111.5 Ų111.591%0.90665%0.654SS**  trans-85.4103.1160-71.4-159.1148.600110.4D1224D1224-E1226 HydrophobicContact CB-CG 4.36Å; D1224-E1226 PolarHBondContact O-N 3.21Å
1227T28.3Very low35.5Very low127 Ų127115.2 Ų115.278%0.77968%0.683SS**  trans-94.1123.2170.348.50000111.1N1225 E1229N1225-T1227 PolarHBondContact O-N 3.19Å; N1225-T1227 VanDerWaalsContact O-N 3.11Å; T1227-E1229 PolarHBondContact O-N 3.02Å; T1227-E1229 VanDerWaalsContact O-N 3.17Å
1228S26.5Very low34Very low119.4 Ų119.4116.5 Ų116.584%0.83569%0.686SS**  trans-41.9118164.5-56.60000115.1
1229E29.1Very low32.5Very low183.4 Ų183.4119.9 Ų119.986%0.85771%0.709SS**  trans-121.1149.1140.4-84.9-154.2136.300112.7T1227T1227-E1229 PolarHBondContact O-N 3.02Å; T1227-E1229 VanDerWaalsContact O-N 3.17Å
1230N26.4Very low30.9Very low145.6 Ų145.6124.8 Ų124.878%0.77974%0.742SS**  trans-65.9125.2173-61.2-74.5000114.5
1231K30.9Very low29.5Very low205 Ų205131.4 Ų131.489%0.89177%0.769SS**  -157.7127126.8-102.6156.9-172.2167.90113L1233K1231-L1233 PolarHBondContact O-N 3.47Å
1232S24.8Very low28.9Very low109 Ų109134.6 Ų134.676%0.76279%0.785SS**  trans-79.6130.1168.254.70000111.5
1233L29.9Very low28.6Very low173 Ų173135.5 Ų135.591%0.90679%0.791SS**  trans-150.3157.2141.5-125.476.3000109.5K1231K1231-L1233 PolarHBondContact O-N 3.47Å
1234A27.1Very low29.4Very low91.2 Ų91.2136.7 Ų136.775%0.75478%0.78SS**PPolyproline II helixtrans-73.2149.2-165.900000114.1G1236A1234-G1236 PolarHBondContact O-N 2.94Å
1235P30.9Very low30.6Very low129.2 Ų129.2136.1 Ų136.184%0.83977%0.77SS**PPolyproline II helixtrans-76.4123.6175.430.9-32.6000111.3
1236G24.7Very low32.6Very low60 Ų60132 Ų13262%0.61975%0.748SS**PPolyproline II helixtrans-84.6151161.100000110.6A1234 D1238A1234-G1236 PolarHBondContact O-N 2.94Å; G1236-D1238 PolarHBondContact O-N 3.15Å; G1236-D1238 VanDerWaalsContact O-N 3.16Å
1237P30.2Very low34.5Very low122.8 Ų122.8123.3 Ų123.380%0.79771%0.709SS**  trans-85.691.5-17735.2-34.2000111.5
1238D24.9Very low36.4Very low143.4 Ų143.4119.7 Ų119.777%0.76769%0.688SS**  trans-112.7112170.3-78.2-43.9000113.5G1236 T1240G1236-D1238 PolarHBondContact O-N 3.15Å; G1236-D1238 VanDerWaalsContact O-N 3.16Å; D1238-T1240 VanDerWaalsContact C-N 3.34Å; D1238-T1240 PolarHBondContact O-N 3.08Å; D1238-T1240 VanDerWaalsContact O-N 3.14Å; D1238-T1240 PolarHBondContact O-OG1 3.34Å
1239T26.1Very low38.4Very low135.2 Ų135.2116.2 Ų116.283%0.82966%0.664SS**  trans-41.990.7158.4-33.50000112.8E1241T1239-E1241 HydrophobicContact CG2-CG 4.23Å; T1239-E1241 PolarHBondContact O-N 2.98Å
1240T27.7Very low40.2Very low124.2 Ų124.2115.3 Ų115.376%0.76266%0.659SS**  trans-97.6102.4166.4360000109.1D1238 I1242D1238-T1240 VanDerWaalsContact C-N 3.34Å; D1238-T1240 PolarHBondContact O-N 3.08Å; D1238-T1240 VanDerWaalsContact O-N 3.14Å; D1238-T1240 PolarHBondContact O-OG1 3.34Å; T1240-I1242 VanDerWaalsContact C-N 3.29Å; T1240-I1242 PolarHBondContact O-N 3.23Å; T1240-I1242 VanDerWaalsContact O-N 3.16Å
1241E28Very low42.5Very low166.2 Ų166.2110.5 Ų110.578%0.77763%0.634SS**  trans-62.9105.6163.7-70.4-166.314100108.4T1239 S1243 R1275T1239-E1241 HydrophobicContact CG2-CG 4.23Å; T1239-E1241 PolarHBondContact O-N 2.98Å; E1241-S1243 VanDerWaalsContact C-N 3.28Å; E1241-S1243 PolarHBondContact O-N 3.08Å; E1241-S1243 VanDerWaalsContact O-N 3.09Å; E1241-R1275 IonicContact OE1-CZ 2.74Å; E1241-R1275 VanDerWaalsContact OE1-CZ 3.3Å; E1241-R1275 IonicContact OE1-NH1 2.71Å; E1241-R1275 PolarHBondContact OE1-NH1 3.48Å; E1241-R1275 IonicContact OE1-NH2 3.3Å; E1241-R1275 PolarHBondContact OE1-NH2 2.96Å; E1241-R1275 IonicContact OE2-CZ 2.7Å; E1241-R1275 IonicContact OE2-NH1 3.94Å; E1241-R1275 PolarHBondContact OE2-NH1 2.83Å; E1241-R1275 IonicContact OE2-NH2 3.77Å
1242I32.6Very low44.6Very low149.6 Ų149.6101 Ų10177%0.76759%0.593SS**  trans-70.7101.9173.2-59.1174.7000106.8T1240 E1244T1240-I1242 VanDerWaalsContact C-N 3.29Å; T1240-I1242 PolarHBondContact O-N 3.23Å; T1240-I1242 VanDerWaalsContact O-N 3.16Å; I1242-E1244 PolarHBondContact O-N 3.33Å; I1242-E1244 VanDerWaalsContact O-N 3.08Å
1243S32.5Very low47.1Very low107.4 Ų107.498.3 Ų98.375%0.75157%0.573SS**  trans-59.1110.2169.2-176.40000108.5E1241 K1245E1241-S1243 VanDerWaalsContact C-N 3.28Å; E1241-S1243 PolarHBondContact O-N 3.08Å; E1241-S1243 VanDerWaalsContact O-N 3.09Å; S1243-K1245 VanDerWaalsContact C-N 3.33Å; S1243-K1245 PolarHBondContact O-N 3.04Å
1244E50Low49.3Very low87.4 Ų87.491.3 Ų91.341%0.40854%0.539SS..  trans-60.198.5-178-70.9-169.2158.600110I1242 L1246 K1270 S1454 H1455I1242-E1244 PolarHBondContact O-N 3.33Å; I1242-E1244 VanDerWaalsContact O-N 3.08Å; E1244-L1246 VanDerWaalsContact C-N 3.28Å; E1244-L1246 HydrophobicContact CB-CD1 4.09Å; E1244-L1246 VanDerWaalsContact O-CD1 3.28Å; E1244-L1246 WeakPolarHBondContact O-CD1 3.37Å; E1244-L1246 PolarHBondContact O-N 3.17Å; E1244-L1246 VanDerWaalsContact O-N 3.12Å; E1244-K1270 IonicContact OE1-NZ 3.74Å; E1244-K1270 PolarHBondContact OE1-NZ 3.1Å; E1244-K1270 IonicContact OE2-NZ 3.55Å; E1244-K1270 PolarHBondContact OE2-NZ 3.1Å; E1244-S1454 WeakPolarHBondContact OE1-CB 3.45Å; E1244-S1454 PolarHBondContact OE1-OG 3.2Å; E1244-H1455 IonicContact OE2-CE1 3.61Å
1245K54.6Low52.1Low134.4 Ų134.487.3 Ų87.358%0.58451%0.505SS*.  trans-65.499.2174-171.4-178.2177.5-170.30108.7D1218 W1219 S1243 Y1450D1218-K1245 IonicContact OD2-NZ 3.91Å; D1218-K1245 PolarHBondContact OD2-NZ 3.49Å; W1219-K1245 PolarHBondContact NE1-O 3.37Å; S1243-K1245 VanDerWaalsContact C-N 3.33Å; S1243-K1245 PolarHBondContact O-N 3.04Å; K1245-Y1450 PolarHBondContact O-OH 3.31Å
1246L68.6Low54.7Low65.8 Ų65.881.8 Ų81.835%0.34547%0.469SS..PPolyproline II helixtrans-63.7142175.9-105.468.3000110.1E1244 S1248 R1267E1244-L1246 VanDerWaalsContact C-N 3.28Å; E1244-L1246 HydrophobicContact CB-CD1 4.09Å; E1244-L1246 VanDerWaalsContact O-CD1 3.28Å; E1244-L1246 WeakPolarHBondContact O-CD1 3.37Å; E1244-L1246 PolarHBondContact O-N 3.17Å; E1244-L1246 VanDerWaalsContact O-N 3.12Å; L1246-S1248 PolarHBondContact O-N 3.42Å; L1246-R1267 VanDerWaalsContact CD2-NH2 3.28Å
1247P71.1Confident57.6Low11 Ų1179.6 Ų79.67%0.07144%0.444CS..PPolyproline II helixtrans-61.6138.9170.817.4-21.3000110.5W1219 D1251 L1252 Y1263 F1447 Y1450W1219-P1247 HydrophobicContact CD2-CG 4.28Å; W1219-P1247 HydrophobicContact CH2-CB 3.67Å; W1219-P1247 HydrophobicContact CH2-CG 3.67Å; W1219-P1247 HydrophobicContact CZ2-CB 4.21Å; W1219-P1247 HydrophobicContact CZ3-CB 4.1Å; W1219-P1247 HydrophobicContact CZ3-CG 4.42Å; P1247-D1251 HydrophobicContact CB-CB 4.23Å; P1247-L1252 HydrophobicContact CB-CD1 4.35Å; P1247-L1252 HydrophobicContact CB-CD2 4.09Å; P1247-L1252 HydrophobicContact CB-CG 4.12Å; P1247-L1252 HydrophobicContact CG-CD1 4.15Å; P1247-L1252 HydrophobicContact CG-CD2 3.95Å; P1247-L1252 HydrophobicContact CG-CG 4.25Å; P1247-Y1263 VanDerWaalsContact CD-OH 3.26Å; P1247-Y1263 WeakPolarHBondContact CD-OH 3.36Å; P1247-Y1263 HydrophobicContact CG-CD1 4.36Å; P1247-Y1263 HydrophobicContact CG-CE1 3.89Å; P1247-Y1263 HydrophobicContact CG-CE2 4.25Å; P1247-Y1263 WeakPolarHBondContact CG-OH 3.24Å; P1247-F1447 HydrophobicContact CB-CE2 4.32Å; P1247-F1447 HydrophobicContact CG-CE2 4.11Å; P1247-Y1450 HydrophobicContact CG-CE1 4.12Å
1248S67.9Low60.4Low50 Ų5074.1 Ų74.135%0.3541%0.408SS..PPolyproline II helixtrans-74.2166.8171.574.30000111.5L1246 E1250 D1251 L1252L1246-S1248 PolarHBondContact O-N 3.42Å; S1248-E1250 PolarHBondContact O-N 3.15Å; S1248-E1250 PolarHBondContact OG-N 3.18Å; S1248-D1251 VanDerWaalsContact CB-OD2 3.27Å; S1248-D1251 WeakPolarHBondContact CB-OD2 3.33Å; S1248-D1251 PolarHBondContact N-OD2 3.02Å; S1248-D1251 WeakPolarHBondContact O-CB 3.38Å; S1248-D1251 PolarHBondContact O-N 3.24Å; S1248-D1251 VanDerWaalsContact OG-CG 3.31Å; S1248-D1251 PolarHBondContact OG-N 3.05Å; S1248-D1251 VanDerWaalsContact OG-N 3.11Å; S1248-D1251 PolarHBondContact OG-OD2 3.17Å; S1248-L1252 VanDerWaalsContact O-CG 3.29Å; S1248-L1252 WeakPolarHBondContact O-CG 3.32Å; S1248-L1252 PolarHBondContact O-N 3.01Å
1249S67.9Low63.5Low45.8 Ų45.867.3 Ų67.332%0.3237%0.372SS..Hα-helixtrans-56.7-38172.9-177.10000112E1093 D1251 L1252 C1253E1093-S1249 WeakPolarHBondContact OE1-CA 3.19Å; E1093-S1249 WeakPolarHBondContact OE1-CB 3.23Å; E1093-S1249 PolarHBondContact OE1-OG 3.07Å; S1249-D1251 VanDerWaalsContact C-N 3.34Å; S1249-D1251 PolarHBondContact O-N 3.13Å; S1249-L1252 PolarHBondContact O-N 3.1Å; S1249-C1253 WeakPolarHBondContact O-CB 3.33Å; S1249-C1253 PolarHBondContact O-N 3.04Å; S1249-C1253 VanDerWaalsContact O-N 3.11Å; S1249-C1253 PolarHBondContact O-SG 3.19Å
1250E68Low66.5Low165 Ų16561.1 Ų61.177%0.77133%0.333SS*.Hα-helixtrans-68-40.9179.7-60.5-177.4169.600111.5S1248 L1252 C1253 S1254S1248-E1250 PolarHBondContact O-N 3.15Å; S1248-E1250 PolarHBondContact OG-N 3.18Å; E1250-L1252 VanDerWaalsContact C-N 3.35Å; E1250-L1252 PolarHBondContact O-N 2.94Å; E1250-C1253 WeakPolarHBondContact O-CB 3.32Å; E1250-C1253 PolarHBondContact O-N 3.14Å; E1250-S1254 PolarHBondContact O-N 3.26Å; E1250-S1254 VanDerWaalsContact O-N 3.15Å
1251D74.6Confident69.5Low44 Ų4455.4 Ų55.424%0.23530%0.298CS..Hα-helixtrans-61.6-46173.6-60.6-57.7000111W1219 S1220 P1247 S1248 S1249 C1253 S1254 I1255W1219-D1251 HydrophobicContact CH2-CB 3.73Å; W1219-D1251 VanDerWaalsContact CH2-CG 3.43Å; W1219-D1251 VanDerWaalsContact CH2-OD1 3.24Å; W1219-D1251 WeakPolarHBondContact CH2-OD1 3.47Å; W1219-D1251 WeakPolarHBondContact CH2-OD2 3.26Å; W1219-D1251 HydrophobicContact CZ2-CB 3.98Å; W1219-D1251 WeakPolarHBondContact CZ2-OD2 3.49Å; W1219-D1251 HydrophobicContact CZ3-CB 3.86Å; W1219-D1251 VanDerWaalsContact CZ3-CG 3.49Å; W1219-D1251 WeakPolarHBondContact CZ3-OD1 3.1Å; S1220-D1251 WeakPolarHBondContact CB-OD1 3.42Å; P1247-D1251 HydrophobicContact CB-CB 4.23Å; S1248-D1251 VanDerWaalsContact CB-OD2 3.27Å; S1248-D1251 WeakPolarHBondContact CB-OD2 3.33Å; S1248-D1251 PolarHBondContact N-OD2 3.02Å; S1248-D1251 WeakPolarHBondContact O-CB 3.38Å; S1248-D1251 PolarHBondContact O-N 3.24Å; S1248-D1251 VanDerWaalsContact OG-CG 3.31Å; S1248-D1251 PolarHBondContact OG-N 3.05Å; S1248-D1251 VanDerWaalsContact OG-N 3.11Å; S1248-D1251 PolarHBondContact OG-OD2 3.17Å; S1249-D1251 VanDerWaalsContact C-N 3.34Å; S1249-D1251 PolarHBondContact O-N 3.13Å; D1251-C1253 VanDerWaalsContact C-N 3.3Å; D1251-C1253 PolarHBondContact O-N 3.25Å; D1251-S1254 WeakPolarHBondContact O-CB 3.3Å; D1251-S1254 PolarHBondContact O-N 3.19Å; D1251-S1254 VanDerWaalsContact O-N 3.08Å; D1251-S1254 PolarHBondContact O-OG 3.32Å; D1251-I1255 WeakPolarHBondContact O-CD1 3.43Å; D1251-I1255 WeakPolarHBondContact O-CG1 3.21Å; D1251-I1255 PolarHBondContact O-N 3.23Å
1252L75.4Confident72.5Confident6 Ų647.4 Ų47.43%0.03126%0.261CS..Hα-helixtrans-62.5-34.8178.4-68.9173.4000112.4P1247 S1248 S1249 E1250 S1254 I1255 R1260 Y1263 L1264 F1447P1247-L1252 HydrophobicContact CB-CD1 4.35Å; P1247-L1252 HydrophobicContact CB-CD2 4.09Å; P1247-L1252 HydrophobicContact CB-CG 4.12Å; P1247-L1252 HydrophobicContact CG-CD1 4.15Å; P1247-L1252 HydrophobicContact CG-CD2 3.95Å; P1247-L1252 HydrophobicContact CG-CG 4.25Å; S1248-L1252 VanDerWaalsContact O-CG 3.29Å; S1248-L1252 WeakPolarHBondContact O-CG 3.32Å; S1248-L1252 PolarHBondContact O-N 3.01Å; S1249-L1252 PolarHBondContact O-N 3.1Å; E1250-L1252 VanDerWaalsContact C-N 3.35Å; E1250-L1252 PolarHBondContact O-N 2.94Å; L1252-S1254 VanDerWaalsContact C-N 3.29Å; L1252-S1254 PolarHBondContact O-N 3.16Å; L1252-I1255 HydrophobicContact CD2-CD1 4.3Å; L1252-I1255 PolarHBondContact O-N 3.04Å; L1252-R1260 HydrophobicContact CB-CG 4.27Å; L1252-R1260 WeakPolarHBondContact O-CD 3.41Å; L1252-Y1263 HydrophobicContact CD1-CD1 4.06Å; L1252-Y1263 HydrophobicContact CD1-CE1 3.86Å; L1252-Y1263 HydrophobicContact CD2-CD1 3.52Å; L1252-Y1263 VanDerWaalsContact CD2-CD1 3.46Å; L1252-Y1263 HydrophobicContact CD2-CE1 3.87Å; L1252-Y1263 HydrophobicContact CD2-CG 4.23Å; L1252-Y1263 HydrophobicContact CG-CD1 4.41Å; L1252-Y1263 HydrophobicContact CG-CE1 4.41Å; L1252-L1264 HydrophobicContact CD1-CD2 4.39Å; L1252-F1447 HydrophobicContact CD2-CE2 4.38Å; L1252-F1447 HydrophobicContact CD2-CZ 4.12Å
1253C76.3Confident75.2Confident53 Ų5340.4 Ų40.436%0.35822%0.224SC..Hα-helixtrans-68.4-23.6174.3-72.20000113.6S1249 E1250 D1251 I1255S1249-C1253 WeakPolarHBondContact O-CB 3.33Å; S1249-C1253 PolarHBondContact O-N 3.04Å; S1249-C1253 VanDerWaalsContact O-N 3.11Å; S1249-C1253 PolarHBondContact O-SG 3.19Å; E1250-C1253 WeakPolarHBondContact O-CB 3.32Å; E1250-C1253 PolarHBondContact O-N 3.14Å; D1251-C1253 VanDerWaalsContact C-N 3.3Å; D1251-C1253 PolarHBondContact O-N 3.25Å; C1253-I1255 VanDerWaalsContact C-N 3.35Å
1254S77Confident77.8Confident25.6 Ų25.635.3 Ų35.318%0.17919%0.189CC..Hα-helixtrans-76.4-24176.679.50000113.6E1250 D1251 L1252 C1437 T1438 A1439E1250-S1254 PolarHBondContact O-N 3.26Å; E1250-S1254 VanDerWaalsContact O-N 3.15Å; D1251-S1254 WeakPolarHBondContact O-CB 3.3Å; D1251-S1254 PolarHBondContact O-N 3.19Å; D1251-S1254 VanDerWaalsContact O-N 3.08Å; D1251-S1254 PolarHBondContact O-OG 3.32Å; L1252-S1254 VanDerWaalsContact C-N 3.29Å; L1252-S1254 PolarHBondContact O-N 3.16Å; S1254-C1437 CarbonylContact O-C 3.32Å; S1254-C1437 WeakPolarHBondContact O-CA 3.3Å; S1254-C1437 PolarHBondContact O-SG 3.01Å; S1254-C1437 VanDerWaalsContact O-SG 3.34Å; S1254-T1438 WeakPolarHBondContact CA-OG1 3.4Å; S1254-T1438 VanDerWaalsContact CB-OG1 3.29Å; S1254-T1438 WeakPolarHBondContact CB-OG1 3.33Å; S1254-T1438 PolarHBondContact O-N 2.95Å; S1254-T1438 VanDerWaalsContact O-N 3.13Å; S1254-A1439 VanDerWaalsContact O-CB 3.29Å; S1254-A1439 WeakPolarHBondContact O-CB 3.3Å; S1254-A1439 PolarHBondContact O-N 3.12Å
1255I84.3Confident79.6Confident7.2 Ų7.231.3 Ų31.34%0.03717%0.17CC..SBendtrans-86.4150.8-170.2-74.2163.6000111W1219 D1251 L1252 C1253 L1259 A1439 F1447W1219-I1255 HydrophobicContact CE3-CD1 4.42Å; W1219-I1255 HydrophobicContact CZ3-CD1 4.22Å; D1251-I1255 WeakPolarHBondContact O-CD1 3.43Å; D1251-I1255 WeakPolarHBondContact O-CG1 3.21Å; D1251-I1255 PolarHBondContact O-N 3.23Å; L1252-I1255 HydrophobicContact CD2-CD1 4.3Å; L1252-I1255 PolarHBondContact O-N 3.04Å; C1253-I1255 VanDerWaalsContact C-N 3.35Å; I1255-L1259 HydrophobicContact CG2-CB 3.63Å; I1255-L1259 HydrophobicContact CG2-CD1 4.35Å; I1255-A1439 HydrophobicContact CG1-CB 4.4Å; I1255-F1447 HydrophobicContact CD1-CB 4.4Å; I1255-F1447 HydrophobicContact CD1-CD1 3.97Å; I1255-F1447 HydrophobicContact CD1-CD2 3.57Å; I1255-F1447 VanDerWaalsContact CD1-CD2 3.46Å; I1255-F1447 HydrophobicContact CD1-CE1 4.07Å; I1255-F1447 HydrophobicContact CD1-CE2 3.68Å; I1255-F1447 HydrophobicContact CD1-CG 3.72Å; I1255-F1447 HydrophobicContact CD1-CZ 3.93Å; I1255-F1447 HydrophobicContact CG1-CD1 4.42Å; I1255-F1447 HydrophobicContact CG1-CD2 4.4Å; I1255-F1447 HydrophobicContact CG1-CG 4.42Å; I1255-F1447 HydrophobicContact CG2-CD1 3.85Å; I1255-F1447 HydrophobicContact CG2-CE1 3.91Å; I1255-F1447 HydrophobicContact CG2-CG 4.41Å; I1255-F1447 HydrophobicContact CG2-CZ 4.48Å
1256P85.9Confident81.1Confident13.2 Ų13.225 Ų259%0.08614%0.143CC..  trans-52.6134.9177.4-28.735.4000113V1258 L1259 R1260 I1348 C1437 Q1444P1256-V1258 HydrophobicContact CB-CG1 4.4Å; P1256-V1258 PolarHBondContact O-N 3.21Å; P1256-V1258 VanDerWaalsContact O-N 3.07Å; P1256-L1259 HydrophobicContact CB-CD1 4.46Å; P1256-L1259 HydrophobicContact CB-CG 4.45Å; P1256-L1259 HydrophobicContact CG-CD1 4.3Å; P1256-L1259 PolarHBondContact O-N 3.17Å; P1256-R1260 PolarHBondContact O-N 3.21Å; P1256-R1260 VanDerWaalsContact O-N 3.13Å; P1256-I1348 HydrophobicContact CB-CD1 4.09Å; P1256-I1348 HydrophobicContact CG-CD1 4.37Å; P1256-C1437 VanDerWaalsContact CD-SG 3.52Å; P1256-C1437 WeakPolarHBondContact CD-SG 3.37Å; P1256-C1437 HydrophobicContact CG-CB 4.34Å; P1256-Q1444 HydrophobicContact CG-CG 4.02Å
1257P86.6Confident81.7Confident15.2 Ų15.223.8 Ų23.810%0.09913%0.134CC..Hα-helixtrans-51.9-36.6-174.4-29.833.5000114.9Q1082 L1085 W1086 L1259 R1260 L1261Q1082-P1257 VanDerWaalsContact OE1-CD 3.23Å; Q1082-P1257 VanDerWaalsContact OE1-CG 3.24Å; L1085-P1257 HydrophobicContact CB-CB 4.07Å; W1086-P1257 HydrophobicContact CB-CB 4.14Å; W1086-P1257 HydrophobicContact CB-CG 4.27Å; W1086-P1257 HydrophobicContact CG-CB 4.48Å; W1086-P1257 HydrophobicContact CG-CG 4.44Å; P1257-L1259 VanDerWaalsContact C-N 3.33Å; P1257-L1259 PolarHBondContact O-N 3.08Å; P1257-R1260 PolarHBondContact O-N 3.05Å; P1257-L1261 WeakPolarHBondContact O-CB 3.39Å; P1257-L1261 PolarHBondContact O-N 3.22Å
1258V89.1Confident82Confident7.2 Ų7.223.7 Ų23.74%0.04413%0.132CC..Hα-helixtrans-62.8-39.4176.5111.70000112.4Y1076 L1085 P1256 L1261 I1262 L1338 A1344 I1348Y1076-V1258 HydrophobicContact CD2-CG2 4.4Å; Y1076-V1258 HydrophobicContact CG-CG2 4.4Å; L1085-V1258 HydrophobicContact CD1-CB 4.09Å; L1085-V1258 HydrophobicContact CD1-CG2 4.08Å; P1256-V1258 HydrophobicContact CB-CG1 4.4Å; P1256-V1258 PolarHBondContact O-N 3.21Å; P1256-V1258 VanDerWaalsContact O-N 3.07Å; V1258-L1261 PolarHBondContact O-N 3.27Å; V1258-I1262 HydrophobicContact CG1-CD1 3.74Å; V1258-I1262 HydrophobicContact CG1-CG1 4.46Å; V1258-I1262 HydrophobicContact CG2-CD1 4.18Å; V1258-I1262 WeakPolarHBondContact O-CD1 3.35Å; V1258-I1262 VanDerWaalsContact O-CG1 3.23Å; V1258-I1262 WeakPolarHBondContact O-CG1 3.38Å; V1258-I1262 PolarHBondContact O-N 3.25Å; V1258-L1338 HydrophobicContact CG1-CD2 4.4Å; V1258-L1338 HydrophobicContact CG2-CB 4.47Å; V1258-L1338 HydrophobicContact CG2-CD2 4.06Å; V1258-A1344 HydrophobicContact CG1-CB 3.97Å; V1258-A1344 HydrophobicContact CG2-CB 3.72Å; V1258-I1348 HydrophobicContact CG1-CD1 3.53Å; V1258-I1348 VanDerWaalsContact CG1-CD1 3.48Å
1259L88.9Confident82.6Confident0 Ų021.7 Ų21.70%012%0.118CC..Hα-helixtrans-74.8-39.3179.1-64.8-177000111.6I1255 P1256 P1257 L1261 I1262 Y1263 L1345 I1348 F1447 V1448 L1451I1255-L1259 HydrophobicContact CG2-CB 3.63Å; I1255-L1259 HydrophobicContact CG2-CD1 4.35Å; P1256-L1259 HydrophobicContact CB-CD1 4.46Å; P1256-L1259 HydrophobicContact CB-CG 4.45Å; P1256-L1259 HydrophobicContact CG-CD1 4.3Å; P1256-L1259 PolarHBondContact O-N 3.17Å; P1257-L1259 VanDerWaalsContact C-N 3.33Å; P1257-L1259 PolarHBondContact O-N 3.08Å; L1259-L1261 VanDerWaalsContact C-N 3.33Å; L1259-L1261 PolarHBondContact O-N 3.26Å; L1259-I1262 HydrophobicContact CD2-CD1 4.41Å; L1259-I1262 PolarHBondContact O-N 3.01Å; L1259-Y1263 WeakPolarHBondContact O-CB 3.38Å; L1259-Y1263 PolarHBondContact O-N 3.18Å; L1259-L1345 HydrophobicContact CD2-CD2 3.42Å; L1259-L1345 VanDerWaalsContact CD2-CD2 3.43Å; L1259-I1348 HydrophobicContact CD1-CD1 3.82Å; L1259-I1348 HydrophobicContact CD1-CG2 4.17Å; L1259-I1348 HydrophobicContact CD2-CD1 3.95Å; L1259-I1348 HydrophobicContact CG-CD1 3.61Å; L1259-F1447 HydrophobicContact CB-CD1 4.18Å; L1259-F1447 HydrophobicContact CB-CE1 4.12Å; L1259-F1447 HydrophobicContact CD1-CD1 4.26Å; L1259-V1448 HydrophobicContact CD1-CG2 3.66Å; L1259-V1448 HydrophobicContact CD2-CG2 3.91Å; L1259-V1448 HydrophobicContact CG-CG2 4.46Å; L1259-L1451 HydrophobicContact CD2-CD2 4.32Å
1260R89.5Confident82.7Confident5.4 Ų5.422.1 Ų22.12%0.0211%0.114CC..Hα-helixtrans-56.6-47.3171.1177.8177.6175.2-140.65.7110.7W1086 D1090 E1093 L1252 P1256 P1257 Y1263 L1264W1086-R1260 PolarHBondContact O-NH1 3.25Å; D1090-R1260 IonicContact OD1-CZ 3.16Å; D1090-R1260 IonicContact OD1-NH1 3.1Å; D1090-R1260 PolarHBondContact OD1-NH1 3.08Å; D1090-R1260 IonicContact OD1-NH2 3.23Å; D1090-R1260 PolarHBondContact OD1-NH2 3.08Å; E1093-R1260 IonicContact OE2-CZ 3.2Å; E1093-R1260 VanDerWaalsContact OE2-CZ 3.3Å; E1093-R1260 IonicContact OE2-NE 3.15Å; E1093-R1260 PolarHBondContact OE2-NE 3Å; E1093-R1260 VanDerWaalsContact OE2-NE 3.13Å; E1093-R1260 IonicContact OE2-NH2 3.09Å; E1093-R1260 PolarHBondContact OE2-NH2 3.04Å; L1252-R1260 HydrophobicContact CB-CG 4.27Å; L1252-R1260 WeakPolarHBondContact O-CD 3.41Å; P1256-R1260 PolarHBondContact O-N 3.21Å; P1256-R1260 VanDerWaalsContact O-N 3.13Å; P1257-R1260 PolarHBondContact O-N 3.05Å; R1260-Y1263 PolarHBondContact O-N 3.17Å; R1260-L1264 HydrophobicContact CG-CD1 3.95Å; R1260-L1264 WeakPolarHBondContact O-CB 3.34Å; R1260-L1264 VanDerWaalsContact O-CG 3.3Å; R1260-L1264 WeakPolarHBondContact O-CG 3.4Å; R1260-L1264 PolarHBondContact O-N 2.97Å
1261L90.4Very high82.1Confident3.2 Ų3.218 Ų182%0.01710%0.095CC..Hα-helixtrans-64.1-45.9177.8-177.159.9000112.5L1085 L1088 L1092 P1257 V1258 L1259 Y1263 L1264 L1265 L1338L1085-L1261 HydrophobicContact CD2-CD2 3.48Å; L1085-L1261 VanDerWaalsContact CD2-CD2 3.48Å; L1088-L1261 HydrophobicContact CB-CD1 3.96Å; L1088-L1261 HydrophobicContact CB-CD2 4.19Å; L1088-L1261 HydrophobicContact CD1-CD2 4.16Å; L1092-L1261 HydrophobicContact CD1-CD1 3.6Å; L1092-L1261 VanDerWaalsContact CD1-CD1 3.47Å; P1257-L1261 WeakPolarHBondContact O-CB 3.39Å; P1257-L1261 PolarHBondContact O-N 3.22Å; V1258-L1261 PolarHBondContact O-N 3.27Å; L1259-L1261 VanDerWaalsContact C-N 3.33Å; L1259-L1261 PolarHBondContact O-N 3.26Å; L1261-Y1263 VanDerWaalsContact C-N 3.31Å; L1261-Y1263 PolarHBondContact O-N 3.11Å; L1261-L1264 PolarHBondContact O-N 3.02Å; L1261-L1265 HydrophobicContact CD1-CD1 4.11Å; L1261-L1265 HydrophobicContact CD1-CG 4.07Å; L1261-L1265 HydrophobicContact CG-CD1 3.94Å; L1261-L1265 HydrophobicContact CG-CG 4.35Å; L1261-L1265 WeakPolarHBondContact O-CB 3.39Å; L1261-L1265 VanDerWaalsContact O-CG 3.28Å; L1261-L1265 WeakPolarHBondContact O-CG 3.34Å; L1261-L1265 PolarHBondContact O-N 3.1Å; L1261-L1338 HydrophobicContact CD2-CD1 3.89Å; L1261-L1338 HydrophobicContact CG-CD1 4.18Å
1262I90.7Very high80.9Confident0 Ų017.8 Ų17.80%010%0.103CC..Hα-helixtrans-60.4-42.5176.9-66.9161.6000110.8V1258 L1259 T1266 L1335 L1338 L1345 L1451 L1456V1258-I1262 HydrophobicContact CG1-CD1 3.74Å; V1258-I1262 HydrophobicContact CG1-CG1 4.46Å; V1258-I1262 HydrophobicContact CG2-CD1 4.18Å; V1258-I1262 WeakPolarHBondContact O-CD1 3.35Å; V1258-I1262 VanDerWaalsContact O-CG1 3.23Å; V1258-I1262 WeakPolarHBondContact O-CG1 3.38Å; V1258-I1262 PolarHBondContact O-N 3.25Å; L1259-I1262 HydrophobicContact CD2-CD1 4.41Å; L1259-I1262 PolarHBondContact O-N 3.01Å; I1262-T1266 VanDerWaalsContact O-CB 3.29Å; I1262-T1266 WeakPolarHBondContact O-CB 3.39Å; I1262-T1266 PolarHBondContact O-N 3.02Å; I1262-T1266 PolarHBondContact O-OG1 3.19Å; I1262-L1335 HydrophobicContact CB-CD2 4.45Å; I1262-L1335 HydrophobicContact CG1-CD2 4.46Å; I1262-L1335 HydrophobicContact CG2-CD2 3.87Å; I1262-L1338 HydrophobicContact CD1-CB 4.13Å; I1262-L1338 HydrophobicContact CG1-CB 4.03Å; I1262-L1338 HydrophobicContact CG1-CD1 3.97Å; I1262-L1345 HydrophobicContact CD1-CD2 3.9Å; I1262-L1345 HydrophobicContact CD1-CG 4.46Å; I1262-L1451 HydrophobicContact CB-CD2 4.28Å; I1262-L1451 HydrophobicContact CG2-CD1 4.4Å; I1262-L1451 HydrophobicContact CG2-CD2 3.82Å; I1262-L1451 HydrophobicContact CG2-CG 4.39Å; I1262-L1456 HydrophobicContact CG2-CD1 4.34Å; I1262-L1456 HydrophobicContact CG2-CD2 4.18Å
1263Y89.5Confident79Confident0.8 Ų0.822.3 Ų22.30%0.00313%0.131CC..Hα-helixtrans-60.8-50.9175.9172.4-102.4000111.9P1247 L1252 L1259 R1260 L1261 L1265 T1266 R1267 F1447 L1451 H1455P1247-Y1263 VanDerWaalsContact CD-OH 3.26Å; P1247-Y1263 WeakPolarHBondContact CD-OH 3.36Å; P1247-Y1263 HydrophobicContact CG-CD1 4.36Å; P1247-Y1263 HydrophobicContact CG-CE1 3.89Å; P1247-Y1263 HydrophobicContact CG-CE2 4.25Å; P1247-Y1263 WeakPolarHBondContact CG-OH 3.24Å; L1252-Y1263 HydrophobicContact CD1-CD1 4.06Å; L1252-Y1263 HydrophobicContact CD1-CE1 3.86Å; L1252-Y1263 HydrophobicContact CD2-CD1 3.52Å; L1252-Y1263 VanDerWaalsContact CD2-CD1 3.46Å; L1252-Y1263 HydrophobicContact CD2-CE1 3.87Å; L1252-Y1263 HydrophobicContact CD2-CG 4.23Å; L1252-Y1263 HydrophobicContact CG-CD1 4.41Å; L1252-Y1263 HydrophobicContact CG-CE1 4.41Å; L1259-Y1263 WeakPolarHBondContact O-CB 3.38Å; L1259-Y1263 PolarHBondContact O-N 3.18Å; R1260-Y1263 PolarHBondContact O-N 3.17Å; L1261-Y1263 VanDerWaalsContact C-N 3.31Å; L1261-Y1263 PolarHBondContact O-N 3.11Å; Y1263-L1265 PolarHBondContact O-N 3.35Å; Y1263-T1266 PolarHBondContact O-N 3.03Å; Y1263-T1266 VanDerWaalsContact O-N 3.13Å; Y1263-R1267 WeakPolarHBondContact O-CB 3.23Å; Y1263-R1267 PolarHBondContact O-N 3.05Å; Y1263-F1447 HydrophobicContact CD2-CZ 4.25Å; Y1263-F1447 AromaticContact CG-CZ 3.97Å; Y1263-F1447 HydrophobicContact CG-CZ 4.09Å; Y1263-L1451 HydrophobicContact CD2-CD1 4.12Å; Y1263-L1451 HydrophobicContact CG-CD1 4.48Å; Y1263-H1455 AromaticContact CE2-CD2 3.95Å; Y1263-H1455 AromaticContact CE2-CE1 3.81Å; Y1263-H1455 AromaticContact CE2-NE2 3.85Å
1264L87Confident76.9Confident1.8 Ų1.828 Ų281%0.00915%0.145CC..Hα-helixtrans-62.2-42.6-179.8-69.2170.1000112G1089 L1092 E1093 L1252 R1260 L1261 T1266 R1267 F1268G1089-L1264 VanDerWaalsContact O-CD1 3.31Å; G1089-L1264 WeakPolarHBondContact O-CD1 3.33Å; L1092-L1264 HydrophobicContact CB-CB 4.23Å; L1092-L1264 HydrophobicContact CB-CD1 4.17Å; L1092-L1264 HydrophobicContact CD1-CB 4Å; E1093-L1264 HydrophobicContact CB-CD1 4.48Å; L1252-L1264 HydrophobicContact CD1-CD2 4.39Å; R1260-L1264 HydrophobicContact CG-CD1 3.95Å; R1260-L1264 WeakPolarHBondContact O-CB 3.34Å; R1260-L1264 VanDerWaalsContact O-CG 3.3Å; R1260-L1264 WeakPolarHBondContact O-CG 3.4Å; R1260-L1264 PolarHBondContact O-N 2.97Å; L1261-L1264 PolarHBondContact O-N 3.02Å; L1264-T1266 VanDerWaalsContact C-N 3.34Å; L1264-T1266 PolarHBondContact O-N 3.03Å; L1264-R1267 WeakPolarHBondContact O-CB 3.4Å; L1264-R1267 PolarHBondContact O-N 3.2Å; L1264-R1267 VanDerWaalsContact O-N 3.15Å; L1264-F1268 VanDerWaalsContact O-CD2 3.32Å; L1264-F1268 WeakPolarHBondContact O-CD2 3.43Å; L1264-F1268 PolarHBondContact O-N 3.11Å; L1264-F1268 VanDerWaalsContact O-N 3.1Å
1265L88.3Confident74.4Confident3 Ų335.2 Ų35.22%0.01617%0.168CC..Hα-helixtrans-61.8-41173.3-73174000112.2L1092 F1179 L1261 Y1263 R1267 F1268 V1269 I1331 C1334 L1335 L1338L1092-L1265 HydrophobicContact CD1-CD2 3.92Å; L1092-L1265 HydrophobicContact CD1-CG 4.13Å; F1179-L1265 HydrophobicContact CE1-CD2 4.23Å; L1261-L1265 HydrophobicContact CD1-CD1 4.11Å; L1261-L1265 HydrophobicContact CD1-CG 4.07Å; L1261-L1265 HydrophobicContact CG-CD1 3.94Å; L1261-L1265 HydrophobicContact CG-CG 4.35Å; L1261-L1265 WeakPolarHBondContact O-CB 3.39Å; L1261-L1265 VanDerWaalsContact O-CG 3.28Å; L1261-L1265 WeakPolarHBondContact O-CG 3.34Å; L1261-L1265 PolarHBondContact O-N 3.1Å; Y1263-L1265 PolarHBondContact O-N 3.35Å; L1265-R1267 VanDerWaalsContact C-N 3.28Å; L1265-R1267 PolarHBondContact O-N 3.28Å; L1265-F1268 CarbonylContact O-C 3.3Å; L1265-F1268 WeakPolarHBondContact O-CA 3.34Å; L1265-F1268 VanDerWaalsContact O-CB 3.26Å; L1265-F1268 WeakPolarHBondContact O-CB 3.34Å; L1265-F1268 PolarHBondContact O-N 3.19Å; L1265-F1268 VanDerWaalsContact O-N 3.11Å; L1265-V1269 PolarHBondContact O-N 3.2Å; L1265-I1331 HydrophobicContact CB-CG2 4.19Å; L1265-I1331 HydrophobicContact CD2-CG1 4.34Å; L1265-I1331 HydrophobicContact CD2-CG2 4.29Å; L1265-C1334 HydrophobicContact CD1-CB 3.77Å; L1265-L1335 HydrophobicContact CB-CD2 4.15Å; L1265-L1335 HydrophobicContact CB-CG 4.42Å; L1265-L1335 HydrophobicContact CD1-CD2 4.43Å; L1265-L1338 HydrophobicContact CD1-CD1 4.07Å
1266T86.3Confident71.7Confident1.4 Ų1.442.9 Ų42.91%0.00920%0.198CC..Hα-helixtrans-68.8-35.9178.2-54.10000111.5I1262 Y1263 L1264 F1268 V1269 K1270 H1455 L1456I1262-T1266 VanDerWaalsContact O-CB 3.29Å; I1262-T1266 WeakPolarHBondContact O-CB 3.39Å; I1262-T1266 PolarHBondContact O-N 3.02Å; I1262-T1266 PolarHBondContact O-OG1 3.19Å; Y1263-T1266 PolarHBondContact O-N 3.03Å; Y1263-T1266 VanDerWaalsContact O-N 3.13Å; L1264-T1266 VanDerWaalsContact C-N 3.34Å; L1264-T1266 PolarHBondContact O-N 3.03Å; T1266-F1268 VanDerWaalsContact C-N 3.31Å; T1266-F1268 PolarHBondContact O-N 3.04Å; T1266-V1269 WeakPolarHBondContact O-CA 3.29Å; T1266-V1269 WeakPolarHBondContact O-CB 3.34Å; T1266-V1269 PolarHBondContact O-N 3.22Å; T1266-V1269 VanDerWaalsContact O-N 3.09Å; T1266-K1270 PolarHBondContact O-N 3.12Å; T1266-K1270 VanDerWaalsContact O-N 3.07Å; T1266-H1455 VanDerWaalsContact CG2-C 3.46Å; T1266-H1455 HydrophobicContact CG2-CB 3.79Å; T1266-H1455 WeakPolarHBondContact CG2-O 3.46Å; T1266-L1456 HydrophobicContact CG2-CB 4.38Å; T1266-L1456 HydrophobicContact CG2-CD1 4.19Å; T1266-L1456 HydrophobicContact CG2-CD2 4.04Å; T1266-L1456 HydrophobicContact CG2-CG 4.35Å; T1266-L1456 WeakPolarHBondContact OG1-CD1 3.22Å; T1266-L1456 VanDerWaalsContact OG1-CD2 3.25Å; T1266-L1456 WeakPolarHBondContact OG1-CD2 3.25Å
1267R81.2Confident68.8Low40.8 Ų40.847.6 Ų47.615%0.15423%0.226CC..Hα-helixtrans-61.6-33.6172.7-159-175176.8-177.80.8111.6W1096 E1101 L1246 Y1263 L1264 L1265 V1269 K1270 E1271 R1323W1096-R1267 HydrophobicContact CD2-CG 4.44Å; W1096-R1267 VanDerWaalsContact CE3-CD 3.47Å; W1096-R1267 HydrophobicContact CE3-CG 4.22Å; W1096-R1267 VanDerWaalsContact CE3-NE 3.26Å; W1096-R1267 HydrophobicContact CH2-CB 3.94Å; W1096-R1267 HydrophobicContact CH2-CG 3.47Å; W1096-R1267 VanDerWaalsContact CH2-CG 3.46Å; W1096-R1267 VanDerWaalsContact CH2-O 3.24Å; W1096-R1267 WeakPolarHBondContact CH2-O 3.28Å; W1096-R1267 VanDerWaalsContact CZ2-C 3.47Å; W1096-R1267 HydrophobicContact CZ2-CB 3.74Å; W1096-R1267 HydrophobicContact CZ2-CG 3.74Å; W1096-R1267 HydrophobicContact CZ3-CB 4.25Å; W1096-R1267 VanDerWaalsContact CZ3-CD 3.4Å; W1096-R1267 HydrophobicContact CZ3-CG 3.76Å; W1096-R1267 VanDerWaalsContact CZ3-CG 3.47Å; W1096-R1267 VanDerWaalsContact CZ3-NE 3.26Å; E1101-R1267 IonicContact OE1-NH2 3.79Å; E1101-R1267 PolarHBondContact OE1-NH2 2.86Å; L1246-R1267 VanDerWaalsContact CD2-NH2 3.28Å; Y1263-R1267 WeakPolarHBondContact O-CB 3.23Å; Y1263-R1267 PolarHBondContact O-N 3.05Å; L1264-R1267 WeakPolarHBondContact O-CB 3.4Å; L1264-R1267 PolarHBondContact O-N 3.2Å; L1264-R1267 VanDerWaalsContact O-N 3.15Å; L1265-R1267 VanDerWaalsContact C-N 3.28Å; L1265-R1267 PolarHBondContact O-N 3.28Å; R1267-V1269 VanDerWaalsContact C-N 3.28Å; R1267-V1269 PolarHBondContact O-N 3.22Å; R1267-K1270 PolarHBondContact O-N 2.88Å; R1267-K1270 VanDerWaalsContact O-N 3.1Å; R1267-E1271 IonicContact CZ-OE2 3.54Å; R1267-E1271 IonicContact NE-OE2 3.86Å; R1267-E1271 PolarHBondContact NE-OE2 2.78Å; R1267-E1271 IonicContact NH2-OE2 2.69Å; R1267-E1271 PolarHBondContact O-N 2.85Å; R1267-R1323 PolarHBondContact O-NH2 2.98Å
1268F77.5Confident65.9Low10 Ų1053.1 Ų53.14%0.04425%0.251CS..THydrogen-bonded Turntrans-68.4-20.6171.3-95-82.8000113.8L1092 Y1095 W1096 I1123 M1175 F1179 L1264 L1265 T1266 F1322 R1323 I1331L1092-F1268 HydrophobicContact CB-CE2 4.29Å; L1092-F1268 HydrophobicContact CD1-CE2 4.26Å; L1092-F1268 HydrophobicContact CD2-CD2 4.18Å; L1092-F1268 HydrophobicContact CD2-CE2 3.57Å; L1092-F1268 HydrophobicContact CD2-CZ 4.13Å; L1092-F1268 HydrophobicContact CG-CE2 4.26Å; Y1095-F1268 AromaticContact CD1-CE1 3.67Å; Y1095-F1268 HydrophobicContact CD1-CE1 3.85Å; Y1095-F1268 VanDerWaalsContact CD1-CE1 3.43Å; Y1095-F1268 AromaticContact CD1-CE2 3.52Å; Y1095-F1268 HydrophobicContact CD1-CE2 3.69Å; Y1095-F1268 AromaticContact CD1-CZ 3.13Å; Y1095-F1268 HydrophobicContact CD1-CZ 3.13Å; Y1095-F1268 HydrophobicContact CD2-CE1 4.38Å; Y1095-F1268 HydrophobicContact CD2-CZ 4.17Å; Y1095-F1268 HydrophobicContact CE1-CD1 4.16Å; Y1095-F1268 AromaticContact CE1-CE1 3.52Å; Y1095-F1268 HydrophobicContact CE1-CE1 3.52Å; Y1095-F1268 AromaticContact CE1-CE2 3.65Å; Y1095-F1268 HydrophobicContact CE1-CE2 3.95Å; Y1095-F1268 AromaticContact CE1-CZ 3.31Å; Y1095-F1268 HydrophobicContact CE1-CZ 3.31Å; Y1095-F1268 VanDerWaalsContact CE1-CZ 3.43Å; Y1095-F1268 HydrophobicContact CE2-CE1 4.19Å; Y1095-F1268 HydrophobicContact CE2-CZ 4.31Å; Y1095-F1268 HydrophobicContact CG-CE1 4.03Å; Y1095-F1268 HydrophobicContact CG-CE2 4.13Å; Y1095-F1268 AromaticContact CG-CZ 3.6Å; Y1095-F1268 HydrophobicContact CG-CZ 3.6Å; Y1095-F1268 VanDerWaalsContact CG-CZ 3.49Å; Y1095-F1268 AromaticContact CZ-CE1 3.79Å; Y1095-F1268 AromaticContact CZ-CZ 3.64Å; W1096-F1268 AromaticContact CE2-CD2 3.85Å; W1096-F1268 AromaticContact CE2-CE2 3.6Å; W1096-F1268 AromaticContact CE2-CZ 3.8Å; W1096-F1268 HydrophobicContact CZ2-CB 4.33Å; W1096-F1268 HydrophobicContact CZ2-CD1 4.09Å; W1096-F1268 AromaticContact CZ2-CD2 3.55Å; W1096-F1268 HydrophobicContact CZ2-CD2 3.73Å; W1096-F1268 VanDerWaalsContact CZ2-CD2 3.4Å; W1096-F1268 AromaticContact CZ2-CE1 3.89Å; W1096-F1268 HydrophobicContact CZ2-CE1 4.16Å; W1096-F1268 AromaticContact CZ2-CE2 3.68Å; W1096-F1268 HydrophobicContact CZ2-CE2 4.02Å; W1096-F1268 AromaticContact CZ2-CG 3.81Å; W1096-F1268 HydrophobicContact CZ2-CG 4Å; W1096-F1268 AromaticContact CZ2-CZ 3.93Å; W1096-F1268 HydrophobicContact CZ2-CZ 4.08Å; W1096-F1268 AromaticContact NE1-CD2 3.64Å; W1096-F1268 AromaticContact NE1-CE1 3.96Å; W1096-F1268 AromaticContact NE1-CE2 3.52Å; W1096-F1268 AromaticContact NE1-CZ 3.2Å; I1123-F1268 HydrophobicContact CG2-CE1 4.48Å; M1175-F1268 HydrophobicContact CE-CZ 4.48Å; F1179-F1268 HydrophobicContact CE2-CD1 4.38Å; F1179-F1268 AromaticContact CE2-CE1 3.86Å; F1179-F1268 HydrophobicContact CE2-CE1 4.11Å; F1179-F1268 HydrophobicContact CE2-CZ 4.26Å; F1179-F1268 AromaticContact CZ-CD1 3.86Å; F1179-F1268 HydrophobicContact CZ-CD1 3.93Å; F1179-F1268 HydrophobicContact CZ-CD2 4.27Å; F1179-F1268 AromaticContact CZ-CE1 3.71Å; F1179-F1268 HydrophobicContact CZ-CE1 3.71Å; F1179-F1268 HydrophobicContact CZ-CE2 4.31Å; F1179-F1268 HydrophobicContact CZ-CG 4.29Å; F1179-F1268 AromaticContact CZ-CZ 3.8Å; F1179-F1268 HydrophobicContact CZ-CZ 3.89Å; L1264-F1268 VanDerWaalsContact O-CD2 3.32Å; L1264-F1268 WeakPolarHBondContact O-CD2 3.43Å; L1264-F1268 PolarHBondContact O-N 3.11Å; L1264-F1268 VanDerWaalsContact O-N 3.1Å; L1265-F1268 CarbonylContact O-C 3.3Å; L1265-F1268 WeakPolarHBondContact O-CA 3.34Å; L1265-F1268 VanDerWaalsContact O-CB 3.26Å; L1265-F1268 WeakPolarHBondContact O-CB 3.34Å; L1265-F1268 PolarHBondContact O-N 3.19Å; L1265-F1268 VanDerWaalsContact O-N 3.11Å; T1266-F1268 VanDerWaalsContact C-N 3.31Å; T1266-F1268 PolarHBondContact O-N 3.04Å; F1268-F1322 HydrophobicContact CD1-CD2 4.05Å; F1268-F1322 AromaticContact CD1-CE2 3.77Å; F1268-F1322 HydrophobicContact CD1-CE2 3.77Å; F1268-F1322 HydrophobicContact CE1-CE2 4.09Å; F1268-R1323 VanDerWaalsContact C-NH1 3.31Å; F1268-R1323 PolarHBondContact O-NE 3.37Å; F1268-R1323 PolarHBondContact O-NH1 3.31Å; F1268-R1323 PolarHBondContact O-NH2 2.94Å; F1268-I1331 HydrophobicContact CB-CD1 4.02Å; F1268-I1331 HydrophobicContact CD1-CD1 4.32Å; F1268-I1331 HydrophobicContact CG-CD1 4.43Å
1269V79.7Confident62.9Low7 Ų758 Ų584%0.04228%0.284CS..THydrogen-bonded Turntrans-87.9-40.9174.1-179.10000111.9L1265 T1266 R1267 E1271 G1272 R1323 I1331 L1335 L1463L1265-V1269 PolarHBondContact O-N 3.2Å; T1266-V1269 WeakPolarHBondContact O-CA 3.29Å; T1266-V1269 WeakPolarHBondContact O-CB 3.34Å; T1266-V1269 PolarHBondContact O-N 3.22Å; T1266-V1269 VanDerWaalsContact O-N 3.09Å; R1267-V1269 VanDerWaalsContact C-N 3.28Å; R1267-V1269 PolarHBondContact O-N 3.22Å; V1269-E1271 PolarHBondContact O-N 3.08Å; V1269-G1272 PolarHBondContact O-N 3.13Å; V1269-R1323 PolarHBondContact O-NH1 2.91Å; V1269-I1331 HydrophobicContact CG2-CB 4.41Å; V1269-I1331 HydrophobicContact CG2-CG2 3.65Å; V1269-L1335 HydrophobicContact CG2-CD1 4.31Å; V1269-L1463 HydrophobicContact CG1-CD1 3.38Å; V1269-L1463 VanDerWaalsContact CG1-CD1 3.43Å; V1269-L1463 HydrophobicContact CG1-CD2 4.07Å; V1269-L1463 HydrophobicContact CG1-CG 3.6Å; V1269-L1463 HydrophobicContact CG2-CD1 4.45Å
1270K69.9Low59.9Low54.8 Ų54.865.9 Ų65.924%0.23832%0.321CS..SBendtrans-55.2114.3-176.8-161.8168-178.41730110.6E1244 T1266 R1267 G1272 T1273 R1323 S1454 H1455 S1459E1244-K1270 IonicContact OE1-NZ 3.74Å; E1244-K1270 PolarHBondContact OE1-NZ 3.1Å; E1244-K1270 IonicContact OE2-NZ 3.55Å; E1244-K1270 PolarHBondContact OE2-NZ 3.1Å; T1266-K1270 PolarHBondContact O-N 3.12Å; T1266-K1270 VanDerWaalsContact O-N 3.07Å; R1267-K1270 PolarHBondContact O-N 2.88Å; R1267-K1270 VanDerWaalsContact O-N 3.1Å; K1270-G1272 PolarHBondContact O-N 3.05Å; K1270-G1272 VanDerWaalsContact O-N 3.14Å; K1270-T1273 PolarHBondContact O-N 3.11Å; K1270-R1323 VanDerWaalsContact O-CZ 3.26Å; K1270-R1323 PolarHBondContact O-NH1 2.88Å; K1270-R1323 PolarHBondContact O-NH2 3.2Å; K1270-S1454 PolarHBondContact NZ-O 3.3Å; K1270-H1455 WeakPolarHBondContact CD-ND1 3.29Å; K1270-H1455 PolarHBondContact NZ-CE1 3.12Å; K1270-H1455 PolarHBondContact NZ-ND1 3.02Å; K1270-H1455 VanDerWaalsContact NZ-ND1 3.12Å; K1270-S1459 WeakPolarHBondContact CA-OG 3.41Å; K1270-S1459 VanDerWaalsContact CB-OG 3.28Å; K1270-S1459 WeakPolarHBondContact CB-OG 3.42Å; K1270-S1459 WeakPolarHBondContact CG-OG 3.4Å
1271E56.8Low57Low79 Ų7972.9 Ų72.937%0.36936%0.359SS..  trans-61.4124.7-177.5-153.4145.7-157.200109.6R1267 V1269 T1273 K1320 T1321 R1323 K1465R1267-E1271 IonicContact CZ-OE2 3.54Å; R1267-E1271 IonicContact NE-OE2 3.86Å; R1267-E1271 PolarHBondContact NE-OE2 2.78Å; R1267-E1271 IonicContact NH2-OE2 2.69Å; R1267-E1271 PolarHBondContact O-N 2.85Å; V1269-E1271 PolarHBondContact O-N 3.08Å; E1271-T1273 VanDerWaalsContact C-N 3.28Å; E1271-T1273 PolarHBondContact O-N 3.19Å; E1271-T1273 PolarHBondContact O-OG1 3.42Å; E1271-K1320 WeakPolarHBondContact OE1-CE 3.49Å; E1271-T1321 HydrophobicContact CG-CG2 4.49Å; E1271-R1323 IonicContact OE1-CZ 3.9Å; E1271-R1323 IonicContact OE1-NE 2.71Å; E1271-R1323 IonicContact OE1-NH2 2.72Å; E1271-R1323 PolarHBondContact OE1-NH2 2.85Å; E1271-K1465 VanDerWaalsContact CD-NZ 3.28Å; E1271-K1465 IonicContact OE1-NZ 2.84Å; E1271-K1465 PolarHBondContact OE1-NZ 3.06Å; E1271-K1465 IonicContact OE2-NZ 3.54Å; E1271-K1465 PolarHBondContact OE2-NZ 2.98Å
1272G48Very low54Low39.8 Ų39.880.3 Ų80.341%0.4140%0.397SS..  trans-73.964.9-174.700000112.3V1269 K1270 R1274 T1321V1269-G1272 PolarHBondContact O-N 3.13Å; K1270-G1272 PolarHBondContact O-N 3.05Å; K1270-G1272 VanDerWaalsContact O-N 3.14Å; G1272-R1274 PolarHBondContact O-N 3.11Å; G1272-T1321 WeakPolarHBondContact O-CB 3.44Å; G1272-T1321 WeakPolarHBondContact O-CG2 3.39Å
1273T35.7Very low51Low100.6 Ų100.688.1 Ų88.162%0.61744%0.439SS*.  trans-75.673.4-178-20.60000111.5K1270 E1271 R1275 S1462K1270-T1273 PolarHBondContact O-N 3.11Å; E1271-T1273 VanDerWaalsContact C-N 3.28Å; E1271-T1273 PolarHBondContact O-N 3.19Å; E1271-T1273 PolarHBondContact O-OG1 3.42Å; T1273-R1275 VanDerWaalsContact C-N 3.31Å; T1273-R1275 PolarHBondContact O-N 3.03Å; T1273-S1462 PolarHBondContact OG1-OG 3.09Å; T1273-S1462 VanDerWaalsContact OG1-OG 3.13Å
1274R31.8Very low48.2Very low171.4 Ų171.491.5 Ų91.565%0.64747%0.474SS*.  trans-65.985173.8-94.3-170.8174.9-150.70.1110.4P1125 G1272 Y1276 E1278P1125-R1274 PolarHBondContact O-NH2 2.96Å; G1272-R1274 PolarHBondContact O-N 3.11Å; R1274-Y1276 HydrophobicContact CB-CD2 4.36Å; R1274-Y1276 HydrophobicContact CB-CE2 4.47Å; R1274-Y1276 PolarHBondContact NH1-OH 3.38Å; R1274-Y1276 VanDerWaalsContact NH1-OH 3.09Å; R1274-Y1276 PolarHBondContact O-N 3.16Å; R1274-E1278 IonicContact CZ-OE1 3.59Å; R1274-E1278 IonicContact NH1-OE1 2.78Å; R1274-E1278 PolarHBondContact NH1-OE1 2.96Å
1275R26.1Very low45.3Very low177.4 Ų177.4100.2 Ų100.267%0.66952%0.515SS*.  trans-75.390.4162.2-69.8-171.7-177.4-176.51.7108.9E1241 T1273 V1277 E1318 L1319E1241-R1275 IonicContact OE1-CZ 2.74Å; E1241-R1275 VanDerWaalsContact OE1-CZ 3.3Å; E1241-R1275 IonicContact OE1-NH1 2.71Å; E1241-R1275 PolarHBondContact OE1-NH1 3.48Å; E1241-R1275 IonicContact OE1-NH2 3.3Å; E1241-R1275 PolarHBondContact OE1-NH2 2.96Å; E1241-R1275 IonicContact OE2-CZ 2.7Å; E1241-R1275 IonicContact OE2-NH1 3.94Å; E1241-R1275 PolarHBondContact OE2-NH1 2.83Å; E1241-R1275 IonicContact OE2-NH2 3.77Å; T1273-R1275 VanDerWaalsContact C-N 3.31Å; T1273-R1275 PolarHBondContact O-N 3.03Å; R1275-V1277 VanDerWaalsContact C-N 3.3Å; R1275-V1277 PolarHBondContact O-N 3.23Å; R1275-V1277 VanDerWaalsContact O-N 3.15Å; R1275-E1318 IonicContact CZ-OE1 3.33Å; R1275-E1318 IonicContact NH1-OE1 2.92Å; R1275-E1318 PolarHBondContact NH1-OE1 3.15Å; R1275-E1318 IonicContact NH2-OE1 3.57Å; R1275-L1319 PolarHBondContact NH2-O 2.71Å
1276Y26.8Very low42.7Very low168 Ų168105.3 Ų105.366%0.65955%0.548SS*.  trans-9396.4164.1-139.8-95.1000108.8K1128 R1274 E1278K1128-Y1276 PolarHBondContact NZ-OH 3.38Å; R1274-Y1276 HydrophobicContact CB-CD2 4.36Å; R1274-Y1276 HydrophobicContact CB-CE2 4.47Å; R1274-Y1276 PolarHBondContact NH1-OH 3.38Å; R1274-Y1276 VanDerWaalsContact NH1-OH 3.09Å; R1274-Y1276 PolarHBondContact O-N 3.16Å; Y1276-E1278 HydrophobicContact CD1-CB 4.19Å; Y1276-E1278 HydrophobicContact CD1-CG 4.13Å; Y1276-E1278 HydrophobicContact CE1-CB 3.86Å; Y1276-E1278 HydrophobicContact CE1-CG 4.13Å; Y1276-E1278 WeakPolarHBondContact CE1-OE1 3.35Å; Y1276-E1278 PolarHBondContact O-N 3.2Å; Y1276-E1278 VanDerWaalsContact O-N 3.11Å
1277V26Very low39.8Very low112.4 Ų112.4112.4 Ų112.468%0.68159%0.586SS**  trans-97.3115.6168.1-179.80000105.8R1275 C1279R1275-V1277 VanDerWaalsContact C-N 3.3Å; R1275-V1277 PolarHBondContact O-N 3.23Å; R1275-V1277 VanDerWaalsContact O-N 3.15Å; V1277-C1279 PolarHBondContact O-N 3.24Å; V1277-C1279 VanDerWaalsContact O-N 3.1Å
1278E24.9Very low37.2Very low131 Ų131115.1 Ų115.161%0.61261%0.611SS**  trans-62.7103.2173.7-101.3169.1-177.700109K1130 R1274 Y1276 E1280K1130-E1278 IonicContact NZ-OE1 3Å; R1274-E1278 IonicContact CZ-OE1 3.59Å; R1274-E1278 IonicContact NH1-OE1 2.78Å; R1274-E1278 PolarHBondContact NH1-OE1 2.96Å; Y1276-E1278 HydrophobicContact CD1-CB 4.19Å; Y1276-E1278 HydrophobicContact CD1-CG 4.13Å; Y1276-E1278 HydrophobicContact CE1-CB 3.86Å; Y1276-E1278 HydrophobicContact CE1-CG 4.13Å; Y1276-E1278 WeakPolarHBondContact CE1-OE1 3.35Å; Y1276-E1278 PolarHBondContact O-N 3.2Å; Y1276-E1278 VanDerWaalsContact O-N 3.11Å; E1278-E1280 PolarHBondContact O-N 3.17Å; E1278-E1280 VanDerWaalsContact O-N 3.08Å
1279C25.4Very low34.9Very low110.4 Ų110.4121.8 Ų121.875%0.74665%0.647SS**  trans-81.583.8164.7-70.80000108.7V1277 N1281V1277-C1279 PolarHBondContact O-N 3.24Å; V1277-C1279 VanDerWaalsContact O-N 3.1Å; C1279-N1281 PolarHBondContact O-N 3.33Å; C1279-N1281 VanDerWaalsContact O-N 3.12Å
1280E26.8Very low32.4Very low165 Ų165130.8 Ų130.877%0.77169%0.685SS**  trans-66.2109.8167.2-73.3-167.1133.400109.4E1278 L1282E1278-E1280 PolarHBondContact O-N 3.17Å; E1278-E1280 VanDerWaalsContact O-N 3.08Å; E1280-L1282 PolarHBondContact O-N 2.85Å; E1280-L1282 VanDerWaalsContact O-N 3.1Å
1281N27.4Very low30.4Very low153.2 Ų153.2137.9 Ų137.982%0.81971%0.711SS**  trans-69.799.1165-77.4-45.9000111.1C1279 N1283C1279-N1281 PolarHBondContact O-N 3.33Å; C1279-N1281 VanDerWaalsContact O-N 3.12Å; N1281-N1283 PolarHBondContact O-N 3.09Å
1282L27.9Very low28.9Very low157.6 Ų157.6139.6 Ų139.683%0.82572%0.722SS**  trans-62.795.8161.4-69.6170.7000111.8E1280E1280-L1282 PolarHBondContact O-N 2.85Å; E1280-L1282 VanDerWaalsContact O-N 3.1Å
1283N28.2Very low28Very low165.2 Ų165.2143.8 Ų143.888%0.88374%0.741SS**  trans-158.9113.6154.7-79.8-32.8000111N1281N1281-N1283 PolarHBondContact O-N 3.09Å
1284G29.5Very low27.6Very low71.8 Ų71.8145.1 Ų145.174%0.7475%0.748SS**  trans176.185.917200000115.5P1286G1284-P1286 WeakPolarHBondContact O-CD 3.23Å
1285E27.8Very low27.6Very low184.6 Ų184.6142.4 Ų142.486%0.86375%0.753SS**  trans22.8139.2164.7-76.3-88109.300117.1
1286P32.3Very low27.6Very low109.2 Ų109.2142.1 Ų142.171%0.70976%0.761SS**  trans-101136.9179.734.1-26.4000112.8G1284 S1288G1284-P1286 WeakPolarHBondContact O-CD 3.23Å; P1286-S1288 PolarHBondContact O-N 2.87Å
1287D26.1Very low27.6Very low151 Ų151139.4 Ų139.481%0.80776%0.763SS**  trans-107.3126.6146.2-123.1-14.8000115.3L1289D1287-L1289 PolarHBondContact O-N 2.9Å
1288S27.3Very low27.9Very low97 Ų97141.4 Ų141.468%0.67877%0.768SS**  trans70.2123.4153.7770000119.8P1286P1286-S1288 PolarHBondContact O-N 2.87Å
1289L28.1Very low28.3Very low151 Ų151139.7 Ų139.779%0.79177%0.768SS**  trans69.4106.8144.6-61.9177.3000119.8D1287D1287-L1289 PolarHBondContact O-N 2.9Å
1290F27.3Very low28.4Very low195.4 Ų195.4141.4 Ų141.486%0.85777%0.77SS**  41.5127.8129.7-78.3-82.5000118.1
1291R27.7Very low28.6Very low204.8 Ų204.8142 Ų14277%0.77377%0.773SS**  -179.2147.6114.5-150.2178.7175.3161.36.5114.6M1784R1291-M1784 PolarHBondContact NH2-O 3.36Å
1292D25Very low28.6Very low114.2 Ų114.2141.5 Ų141.561%0.61177%0.77SS**  trans-18.2143.3166.3-55.3-48.3000118
1293T29.3Very low28.9Very low129.2 Ų129.2139.6 Ų139.679%0.79377%0.767SS**  trans144.2125.9130.5-33.40000116
1294T26.9Very low28.9Very low127 Ų127137.7 Ų137.778%0.77976%0.762SS**  trans-85.9172.116544.30000113.8
1295P31.9Very low28.7Very low114.4 Ų114.4139.5 Ų139.574%0.74376%0.762SS**  trans-124.6165.7-143.537.6-24.5000115.4
1296M27Very low28.6Very low171.8 Ų171.8136.8 Ų136.885%0.84676%0.763SS**  trans129.3129.4137.2-96.7-119.2144.500116.1
1297T26.9Very low28.4Very low112.2 Ų112.2136.8 Ų136.869%0.68877%0.765SS**  114.3122125.8-43.60000117.1
1298I31.5Very low28.7Very low154.2 Ų154.2135.5 Ų135.579%0.79177%0.765SS**  trans-176.5148.5138.3-52171.6000112.6
1299P34.8Very low28.7Very low94 Ų94138.3 Ų138.361%0.6177%0.771SS**  -124.1-174.4-53.841.9-27.4000115.2
1300D26.3Very low28.7Very low147.2 Ų147.2136.1 Ų136.179%0.78777%0.768SS**  trans78.6135144.5-63-27.5000118.9
1301E30.7Very low28.7Very low178 Ų178131.7 Ų131.783%0.83276%0.762SS**  -161.8150.261.6-74.6-163148.300115
1302N28.7Very low28.9Very low142.2 Ų142.2128 Ų12876%0.7676%0.762SS**  trans-33.9146.7156.6-81-53.1000116.4T1304N1302-T1304 PolarHBondContact O-N 3.2Å; N1302-T1304 VanDerWaalsContact O-N 3.08Å
1303P32.8Very low28.9Very low118 Ų118129.5 Ų129.577%0.76677%0.769SS**  trans-116145.8143.136.6-26.4000112.9
1304T27.9Very low28.9Very low125.4 Ų125.4131.8 Ų131.877%0.76977%0.768SS**  trans-166.4116.5161.4-370000113.7N1302N1302-T1304 PolarHBondContact O-N 3.2Å; N1302-T1304 VanDerWaalsContact O-N 3.08Å
1305S26.9Very low28.9Very low107.8 Ų107.8131.1 Ų131.175%0.75476%0.764SS**  trans93.8120.2156.165.40000116.1
1306C25.6Very low28.8Very low129.2 Ų129.2131.1 Ų131.187%0.87376%0.762SS**  -136.7139.1117.4-101.10000110.3
1307S27.1Very low28.9Very low108.2 Ų108.2128.5 Ų128.576%0.75775%0.75SS**  trans-97.9162.8-176.9-38.20000111.3I1309S1307-I1309 PolarHBondContact O-N 3.24Å
1308P32Very low29Very low124.6 Ų124.6130.1 Ų130.181%0.80975%0.75SS**  trans-88.7149.2-156.427-21.4000112.7S1310P1308-S1310 PolarHBondContact O-N 3.3Å
1309I29.2Very low29Very low155.2 Ų155.2127.5 Ų127.580%0.79674%0.737SS**  trans-109.1128.1162.8-72.2172000110S1307 S1311S1307-I1309 PolarHBondContact O-N 3.24Å; I1309-S1311 PolarHBondContact O-N 3.36Å; I1309-S1311 VanDerWaalsContact O-N 3.13Å
1310S27.9Very low29.1Very low104.2 Ų104.2128.7 Ų128.773%0.72973%0.732SS**  trans3.4113169.2620000117.1P1308 V1312P1308-S1310 PolarHBondContact O-N 3.3Å; S1310-V1312 PolarHBondContact O-N 3.41Å
1311S27.4Very low30Very low104 Ų104124.5 Ų124.573%0.72771%0.712SS**  trans-69.1127.5159.253.70000112I1309 N1313I1309-S1311 PolarHBondContact O-N 3.36Å; I1309-S1311 VanDerWaalsContact O-N 3.13Å; S1311-N1313 PolarHBondContact O-N 3.07Å
1312V30.1Very low31Very low127.4 Ų127.4119.9 Ų119.977%0.77269%0.69SS**  trans-87.8120.9165176.90000109.1S1310 K1314S1310-V1312 PolarHBondContact O-N 3.41Å; V1312-K1314 VanDerWaalsContact C-N 3.3Å; V1312-K1314 PolarHBondContact O-N 3.3Å
1313N26.8Very low32.6Very low144.6 Ų144.6117.5 Ų117.577%0.77367%0.67SS**  trans-69.883.1176.3-78.1-17.5000110.6S1311 T1315S1311-N1313 PolarHBondContact O-N 3.07Å; N1313-T1315 HydrophobicContact CB-CG2 4.32Å; N1313-T1315 PolarHBondContact O-N 2.98Å; N1313-T1315 VanDerWaalsContact O-N 3.13Å
1314K28.5Very low34.5Very low177.2 Ų177.2112.9 Ų112.977%0.7764%0.639SS**  trans-72.390.8168.3-148171.3-173.5174.10108.5V1312 V1316V1312-K1314 VanDerWaalsContact C-N 3.3Å; V1312-K1314 PolarHBondContact O-N 3.3Å; K1314-V1316 PolarHBondContact O-N 3.19Å
1315T26.8Very low36.9Very low113.2 Ų113.2109.3 Ų109.369%0.69462%0.618SS**  trans-68.595.7178.245.40000109.9N1313 I1317N1313-T1315 HydrophobicContact CB-CG2 4.32Å; N1313-T1315 PolarHBondContact O-N 2.98Å; N1313-T1315 VanDerWaalsContact O-N 3.13Å; T1315-I1317 VanDerWaalsContact C-N 3.3Å; T1315-I1317 PolarHBondContact O-N 3.19Å; T1315-I1317 VanDerWaalsContact O-N 3.16Å
1316V29.2Very low39.5Very low113.8 Ų113.8107.3 Ų107.369%0.6960%0.601SS**  trans-68.5104.4170.3179.70000107.7K1314 E1318K1314-V1316 PolarHBondContact O-N 3.19Å; V1316-E1318 VanDerWaalsContact C-N 3.29Å; V1316-E1318 HydrophobicContact CG1-CG 4.25Å; V1316-E1318 PolarHBondContact O-N 3.22Å
1317I30Very low42.3Very low118.6 Ų118.6101.3 Ų101.361%0.60856%0.56SS**  trans-7893.7171.9-56178000107.1V1099 T1315 L1319V1099-I1317 HydrophobicContact CG1-CD1 3.65Å; T1315-I1317 VanDerWaalsContact C-N 3.3Å; T1315-I1317 PolarHBondContact O-N 3.19Å; T1315-I1317 VanDerWaalsContact O-N 3.16Å; I1317-L1319 VanDerWaalsContact C-N 3.28Å; I1317-L1319 HydrophobicContact CB-CD1 4.47Å; I1317-L1319 HydrophobicContact CG2-CD1 3.93Å; I1317-L1319 HydrophobicContact CG2-CG 4.23Å; I1317-L1319 PolarHBondContact O-N 3.12Å
1318E27.9Very low45.2Very low145 Ų14596.6 Ų96.668%0.67853%0.527SS*.  trans-67.789.8170.5-72.8-165129.700109.8R1275 V1316 K1320R1275-E1318 IonicContact CZ-OE1 3.33Å; R1275-E1318 IonicContact NH1-OE1 2.92Å; R1275-E1318 PolarHBondContact NH1-OE1 3.15Å; R1275-E1318 IonicContact NH2-OE1 3.57Å; V1316-E1318 VanDerWaalsContact C-N 3.29Å; V1316-E1318 HydrophobicContact CG1-CG 4.25Å; V1316-E1318 PolarHBondContact O-N 3.22Å; E1318-K1320 VanDerWaalsContact C-N 3.29Å; E1318-K1320 PolarHBondContact O-N 3.11Å
1319L31.3Very low47.9Very low99.6 Ų99.693.2 Ų93.252%0.52150%0.5SS..  trans-71.493.7169.2-11696.4000108.9W1096 R1275 I1317 T1321W1096-L1319 HydrophobicContact CE3-CD2 4.24Å; W1096-L1319 HydrophobicContact CH2-CD1 4.01Å; W1096-L1319 HydrophobicContact CH2-CD2 3.68Å; W1096-L1319 HydrophobicContact CH2-CG 4.46Å; W1096-L1319 HydrophobicContact CZ3-CD1 3.62Å; W1096-L1319 HydrophobicContact CZ3-CD2 3.31Å; W1096-L1319 HydrophobicContact CZ3-CG 4.08Å; R1275-L1319 PolarHBondContact NH2-O 2.71Å; I1317-L1319 VanDerWaalsContact C-N 3.28Å; I1317-L1319 HydrophobicContact CB-CD1 4.47Å; I1317-L1319 HydrophobicContact CG2-CD1 3.93Å; I1317-L1319 HydrophobicContact CG2-CG 4.23Å; I1317-L1319 PolarHBondContact O-N 3.12Å; L1319-T1321 VanDerWaalsContact C-N 3.34Å; L1319-T1321 WeakPolarHBondContact O-CG2 3.31Å; L1319-T1321 PolarHBondContact O-N 3.13Å; L1319-T1321 VanDerWaalsContact O-N 3.11Å
1320K38.1Very low50.7Low118.6 Ų118.685.9 Ų85.952%0.51646%0.463SS..  trans-60.7103.7171.9-135.3-176.3-178.3-171.50108.3L1117 E1271 E1318 F1322L1117-K1320 HydrophobicContact CB-CD 4.04Å; L1117-K1320 WeakPolarHBondContact O-CE 2.93Å; L1117-K1320 PolarHBondContact O-NZ 3.05Å; E1271-K1320 WeakPolarHBondContact OE1-CE 3.49Å; E1318-K1320 VanDerWaalsContact C-N 3.29Å; E1318-K1320 PolarHBondContact O-N 3.11Å; K1320-F1322 VanDerWaalsContact C-N 3.3Å; K1320-F1322 HydrophobicContact CB-CD2 4.46Å; K1320-F1322 HydrophobicContact CB-CE2 4.5Å; K1320-F1322 HydrophobicContact CD-CE2 4.01Å; K1320-F1322 HydrophobicContact CD-CZ 4.5Å; K1320-F1322 PolarHBondContact O-N 3.08Å; K1320-F1322 VanDerWaalsContact O-N 3.11Å
1321T45.4Very low53.7Low59 Ų5981 Ų8136%0.36243%0.429SS..  trans-70.2115177.547.50000109.8P1125 E1271 G1272 L1319 R1323P1125-T1321 HydrophobicContact CG-CG2 3.91Å; E1271-T1321 HydrophobicContact CG-CG2 4.49Å; G1272-T1321 WeakPolarHBondContact O-CB 3.44Å; G1272-T1321 WeakPolarHBondContact O-CG2 3.39Å; L1319-T1321 VanDerWaalsContact C-N 3.34Å; L1319-T1321 WeakPolarHBondContact O-CG2 3.31Å; L1319-T1321 PolarHBondContact O-N 3.13Å; L1319-T1321 VanDerWaalsContact O-N 3.11Å; T1321-R1323 PolarHBondContact O-N 3.22Å; T1321-R1323 VanDerWaalsContact O-N 3.14Å
1322F50.3Low56.7Low82.4 Ų82.476.1 Ų76.136%0.36139%0.394SS..  trans-63112.4171.9-86.4-91.7000109.2L1117 T1121 M1175 F1268 K1320 D1324 V1327 L1328L1117-F1322 HydrophobicContact CD2-CZ 4.4Å; T1121-F1322 CarbonylContact C-O 3.12Å; T1121-F1322 WeakPolarHBondContact CA-O 3.47Å; M1175-F1322 HydrophobicContact CE-CZ 4.27Å; F1268-F1322 HydrophobicContact CD1-CD2 4.05Å; F1268-F1322 AromaticContact CD1-CE2 3.77Å; F1268-F1322 HydrophobicContact CD1-CE2 3.77Å; F1268-F1322 HydrophobicContact CE1-CE2 4.09Å; K1320-F1322 VanDerWaalsContact C-N 3.3Å; K1320-F1322 HydrophobicContact CB-CD2 4.46Å; K1320-F1322 HydrophobicContact CB-CE2 4.5Å; K1320-F1322 HydrophobicContact CD-CE2 4.01Å; K1320-F1322 HydrophobicContact CD-CZ 4.5Å; K1320-F1322 PolarHBondContact O-N 3.08Å; K1320-F1322 VanDerWaalsContact O-N 3.11Å; F1322-D1324 VanDerWaalsContact C-N 3.3Å; F1322-V1327 HydrophobicContact CB-CG1 4.24Å; F1322-V1327 HydrophobicContact CD1-CB 4.31Å; F1322-V1327 HydrophobicContact CD1-CG1 4.04Å; F1322-V1327 HydrophobicContact CD1-CG2 4.46Å; F1322-V1327 HydrophobicContact CE1-CG1 4.15Å; F1322-V1327 HydrophobicContact CE1-CG2 4.24Å; F1322-V1327 HydrophobicContact CG-CG1 4.18Å; F1322-L1328 WeakPolarHBondContact O-CD1 3.38Å; F1322-L1328 WeakPolarHBondContact O-CD2 3.38Å; F1322-L1328 WeakPolarHBondContact O-CG 3.34Å
1323R62.3Low59.6Low91 Ų9170.1 Ų70.134%0.34336%0.357SS..  trans-88.9107.6173-72.2-175.4175.3-128.38.3110.7R1267 F1268 V1269 K1270 E1271 T1321 P1325 L1328 E1467R1267-R1323 PolarHBondContact O-NH2 2.98Å; F1268-R1323 VanDerWaalsContact C-NH1 3.31Å; F1268-R1323 PolarHBondContact O-NE 3.37Å; F1268-R1323 PolarHBondContact O-NH1 3.31Å; F1268-R1323 PolarHBondContact O-NH2 2.94Å; V1269-R1323 PolarHBondContact O-NH1 2.91Å; K1270-R1323 VanDerWaalsContact O-CZ 3.26Å; K1270-R1323 PolarHBondContact O-NH1 2.88Å; K1270-R1323 PolarHBondContact O-NH2 3.2Å; E1271-R1323 IonicContact OE1-CZ 3.9Å; E1271-R1323 IonicContact OE1-NE 2.71Å; E1271-R1323 IonicContact OE1-NH2 2.72Å; E1271-R1323 PolarHBondContact OE1-NH2 2.85Å; T1321-R1323 PolarHBondContact O-N 3.22Å; T1321-R1323 VanDerWaalsContact O-N 3.14Å; R1323-P1325 WeakPolarHBondContact O-CD 3.48Å; R1323-L1328 HydrophobicContact CB-CD1 4.18Å; R1323-L1328 HydrophobicContact CB-CD2 4.39Å; R1323-L1328 HydrophobicContact CB-CG 4.21Å; R1323-E1467 IonicContact CZ-OE2 3.15Å; R1323-E1467 IonicContact NH1-OE2 3.21Å; R1323-E1467 PolarHBondContact NH1-OE2 3.29Å; R1323-E1467 IonicContact NH2-OE2 2.7Å
1324D72.8Confident62.7Low21.4 Ų21.463.2 Ų63.211%0.11432%0.321CS..  trans-56.6124.2-179.5-178.1-40.5000111.9L1119 I1123 F1322 V1326 V1327 L1328L1119-D1324 HydrophobicContact CB-CB 3.68Å; L1119-D1324 WeakPolarHBondContact CB-OD2 3.49Å; L1119-D1324 WeakPolarHBondContact CD1-OD2 3.37Å; L1119-D1324 WeakPolarHBondContact O-CA 3.49Å; L1119-D1324 WeakPolarHBondContact O-CB 3.25Å; L1119-D1324 PolarHBondContact O-N 2.87Å; I1123-D1324 HydrophobicContact CD1-CB 4.3Å; I1123-D1324 HydrophobicContact CG1-CB 4.27Å; F1322-D1324 VanDerWaalsContact C-N 3.3Å; D1324-V1326 VanDerWaalsContact C-N 3.29Å; D1324-V1326 PolarHBondContact O-N 3.03Å; D1324-V1326 VanDerWaalsContact O-N 3.14Å; D1324-V1326 VanDerWaalsContact OD1-CA 3.3Å; D1324-V1326 WeakPolarHBondContact OD1-CA 3.39Å; D1324-V1326 VanDerWaalsContact OD1-CB 3.26Å; D1324-V1326 WeakPolarHBondContact OD1-CB 3.33Å; D1324-V1326 WeakPolarHBondContact OD1-CG2 3.31Å; D1324-V1326 PolarHBondContact OD1-N 3.02Å; D1324-V1327 HydrophobicContact CB-CB 4.1Å; D1324-V1327 HydrophobicContact CB-CG2 3.94Å; D1324-V1327 PolarHBondContact O-N 3.28Å; D1324-V1327 PolarHBondContact OD1-N 3.18Å; D1324-V1327 WeakPolarHBondContact OD2-CG2 3.38Å; D1324-L1328 VanDerWaalsContact O-CB 3.31Å; D1324-L1328 WeakPolarHBondContact O-CB 3.43Å; D1324-L1328 VanDerWaalsContact O-CG 3.24Å; D1324-L1328 WeakPolarHBondContact O-CG 3.35Å; D1324-L1328 PolarHBondContact O-N 3.24Å; D1324-L1328 VanDerWaalsContact O-N 3.15Å
1325P78.2Confident65.7Low50 Ų5054.9 Ų54.933%0.32529%0.285SS..Hα-helixtrans-59.5-31.4-179.124.3-35.4000113.6R1323 Q1329 Y1470R1323-P1325 WeakPolarHBondContact O-CD 3.48Å; P1325-Q1329 VanDerWaalsContact O-CB 3.29Å; P1325-Q1329 WeakPolarHBondContact O-CB 3.39Å; P1325-Q1329 PolarHBondContact O-N 3.08Å; P1325-Q1329 VanDerWaalsContact O-N 3.12Å; P1325-Y1470 VanDerWaalsContact CA-OH 3.23Å; P1325-Y1470 WeakPolarHBondContact CA-OH 3.33Å; P1325-Y1470 HydrophobicContact CB-CE1 4.44Å; P1325-Y1470 HydrophobicContact CB-CE2 4.17Å; P1325-Y1470 WeakPolarHBondContact CB-OH 3.43Å; P1325-Y1470 PolarHBondContact O-OH 3.23Å
1326V83.4Confident68.7Low66 Ų6649.5 Ų49.540%0.425%0.252SS..Hα-helixtrans-79.5-41.6-177.7-167.90000110.9L1176 D1324 L1328 Q1329 C1330L1176-V1326 HydrophobicContact CD1-CB 4Å; L1176-V1326 HydrophobicContact CD1-CG1 3.78Å; D1324-V1326 VanDerWaalsContact C-N 3.29Å; D1324-V1326 PolarHBondContact O-N 3.03Å; D1324-V1326 VanDerWaalsContact O-N 3.14Å; D1324-V1326 VanDerWaalsContact OD1-CA 3.3Å; D1324-V1326 WeakPolarHBondContact OD1-CA 3.39Å; D1324-V1326 VanDerWaalsContact OD1-CB 3.26Å; D1324-V1326 WeakPolarHBondContact OD1-CB 3.33Å; D1324-V1326 WeakPolarHBondContact OD1-CG2 3.31Å; D1324-V1326 PolarHBondContact OD1-N 3.02Å; V1326-L1328 VanDerWaalsContact C-N 3.32Å; V1326-L1328 PolarHBondContact O-N 3.25Å; V1326-Q1329 WeakPolarHBondContact O-CA 3.5Å; V1326-Q1329 WeakPolarHBondContact O-CB 3.2Å; V1326-Q1329 PolarHBondContact O-N 3.24Å; V1326-Q1329 VanDerWaalsContact O-N 3.16Å; V1326-C1330 PolarHBondContact O-N 3.13Å; V1326-C1330 PolarHBondContact O-SG 2.96Å
1327V84.1Confident71.6Confident3.8 Ų3.844.1 Ų44.12%0.02322%0.219CC..Hα-helixtrans-62.3-44.8174.7174.70000110.8L1119 I1123 L1176 F1179 F1322 D1324 Q1329 C1330 I1331L1119-V1327 HydrophobicContact CD1-CG2 4.34Å; I1123-V1327 HydrophobicContact CD1-CG2 3.64Å; I1123-V1327 HydrophobicContact CG1-CG2 4.07Å; L1176-V1327 HydrophobicContact CB-CG2 4.25Å; L1176-V1327 HydrophobicContact CD1-CG2 3.76Å; L1176-V1327 HydrophobicContact CG-CG2 4.48Å; F1179-V1327 HydrophobicContact CD2-CG1 3.62Å; F1179-V1327 HydrophobicContact CD2-CG2 4.37Å; F1179-V1327 HydrophobicContact CE2-CG1 3.72Å; F1179-V1327 HydrophobicContact CG-CG1 4.15Å; F1179-V1327 HydrophobicContact CZ-CG1 4.3Å; F1322-V1327 HydrophobicContact CB-CG1 4.24Å; F1322-V1327 HydrophobicContact CD1-CB 4.31Å; F1322-V1327 HydrophobicContact CD1-CG1 4.04Å; F1322-V1327 HydrophobicContact CD1-CG2 4.46Å; F1322-V1327 HydrophobicContact CE1-CG1 4.15Å; F1322-V1327 HydrophobicContact CE1-CG2 4.24Å; F1322-V1327 HydrophobicContact CG-CG1 4.18Å; D1324-V1327 HydrophobicContact CB-CB 4.1Å; D1324-V1327 HydrophobicContact CB-CG2 3.94Å; D1324-V1327 PolarHBondContact O-N 3.28Å; D1324-V1327 PolarHBondContact OD1-N 3.18Å; D1324-V1327 WeakPolarHBondContact OD2-CG2 3.38Å; V1327-Q1329 VanDerWaalsContact C-N 3.31Å; V1327-Q1329 PolarHBondContact O-N 3.32Å; V1327-C1330 WeakPolarHBondContact O-CB 3.4Å; V1327-C1330 PolarHBondContact O-N 3.11Å; V1327-C1330 VanDerWaalsContact O-N 3.11Å; V1327-I1331 HydrophobicContact CG1-CD1 3.85Å; V1327-I1331 HydrophobicContact CG1-CG1 4.48Å; V1327-I1331 WeakPolarHBondContact O-CD1 3.34Å; V1327-I1331 WeakPolarHBondContact O-CG1 3.41Å; V1327-I1331 PolarHBondContact O-N 3.08Å
1328L86.4Confident74.4Confident9.4 Ų9.438.5 Ų38.55%0.04919%0.19CC..Hα-helixtrans-60-40.7174.8-71.4175.7000111.8F1322 R1323 D1324 V1326 C1330 I1331 L1332 L1463 L1468 L1471F1322-L1328 WeakPolarHBondContact O-CD1 3.38Å; F1322-L1328 WeakPolarHBondContact O-CD2 3.38Å; F1322-L1328 WeakPolarHBondContact O-CG 3.34Å; R1323-L1328 HydrophobicContact CB-CD1 4.18Å; R1323-L1328 HydrophobicContact CB-CD2 4.39Å; R1323-L1328 HydrophobicContact CB-CG 4.21Å; D1324-L1328 VanDerWaalsContact O-CB 3.31Å; D1324-L1328 WeakPolarHBondContact O-CB 3.43Å; D1324-L1328 VanDerWaalsContact O-CG 3.24Å; D1324-L1328 WeakPolarHBondContact O-CG 3.35Å; D1324-L1328 PolarHBondContact O-N 3.24Å; D1324-L1328 VanDerWaalsContact O-N 3.15Å; V1326-L1328 VanDerWaalsContact C-N 3.32Å; V1326-L1328 PolarHBondContact O-N 3.25Å; L1328-C1330 VanDerWaalsContact C-N 3.35Å; L1328-C1330 PolarHBondContact O-N 2.66Å; L1328-I1331 PolarHBondContact O-N 2.94Å; L1328-L1332 WeakPolarHBondContact O-CB 3.36Å; L1328-L1332 VanDerWaalsContact O-CG 3.29Å; L1328-L1332 WeakPolarHBondContact O-CG 3.39Å; L1328-L1332 PolarHBondContact O-N 3.05Å; L1328-L1463 HydrophobicContact CD1-CD2 4.26Å; L1328-L1463 HydrophobicContact CD2-CD2 4.28Å; L1328-L1468 HydrophobicContact CD1-CD1 4.42Å; L1328-L1468 HydrophobicContact CD1-CD2 4.36Å; L1328-L1471 HydrophobicContact CB-CD1 3.71Å; L1328-L1471 HydrophobicContact CD1-CD1 4.16Å
1329Q89.1Confident77.3Confident52.2 Ų52.231.6 Ų31.624%0.24416%0.158CC..Hα-helixtrans-63.1-42.6173.5-169.1-173.8-44.800112P1325 V1326 V1327 I1331 L1332 E1333 L1471P1325-Q1329 VanDerWaalsContact O-CB 3.29Å; P1325-Q1329 WeakPolarHBondContact O-CB 3.39Å; P1325-Q1329 PolarHBondContact O-N 3.08Å; P1325-Q1329 VanDerWaalsContact O-N 3.12Å; V1326-Q1329 WeakPolarHBondContact O-CA 3.5Å; V1326-Q1329 WeakPolarHBondContact O-CB 3.2Å; V1326-Q1329 PolarHBondContact O-N 3.24Å; V1326-Q1329 VanDerWaalsContact O-N 3.16Å; V1327-Q1329 VanDerWaalsContact C-N 3.31Å; V1327-Q1329 PolarHBondContact O-N 3.32Å; Q1329-I1331 VanDerWaalsContact C-N 3.3Å; Q1329-I1331 PolarHBondContact O-N 3.4Å; Q1329-L1332 PolarHBondContact O-N 3.22Å; Q1329-E1333 HydrophobicContact CG-CG 4.45Å; Q1329-E1333 PolarHBondContact NE2-OE1 3.02Å; Q1329-E1333 WeakPolarHBondContact O-CB 3.32Å; Q1329-E1333 WeakPolarHBondContact O-CG 3.38Å; Q1329-E1333 PolarHBondContact O-N 3.08Å; Q1329-L1471 HydrophobicContact CB-CD2 3.68Å; Q1329-L1471 HydrophobicContact CG-CD2 4.21Å
1330C89.1Confident79.9Confident3.4 Ų3.427.5 Ų27.52%0.02314%0.136CC..Hα-helixtrans-61.6-42.8177.8-680000111.8F1179 N1180 R1183 V1326 V1327 L1328 E1333 C1334F1179-C1330 HydrophobicContact CB-CB 3.98Å; N1180-C1330 PolarHBondContact OD1-SG 2.95Å; R1183-C1330 HydrophobicContact CB-CB 4.42Å; V1326-C1330 PolarHBondContact O-N 3.13Å; V1326-C1330 PolarHBondContact O-SG 2.96Å; V1327-C1330 WeakPolarHBondContact O-CB 3.4Å; V1327-C1330 PolarHBondContact O-N 3.11Å; V1327-C1330 VanDerWaalsContact O-N 3.11Å; L1328-C1330 VanDerWaalsContact C-N 3.35Å; L1328-C1330 PolarHBondContact O-N 2.66Å; C1330-E1333 PolarHBondContact O-N 3.13Å; C1330-C1334 PolarHBondContact O-N 3.31Å; C1330-C1334 PolarHBondContact O-SG 3.17Å
1331I89.6Confident82Confident1.4 Ų1.422.7 Ų22.71%0.00712%0.117CC..Hα-helixtrans-63.9-44.9176.1-65.6162.1000111F1179 L1265 F1268 V1269 V1327 L1328 Q1329 E1333 C1334 L1335F1179-I1331 HydrophobicContact CD1-CD1 4.45Å; F1179-I1331 HydrophobicContact CD1-CG1 3.89Å; F1179-I1331 HydrophobicContact CE1-CD1 4Å; F1179-I1331 HydrophobicContact CE1-CG1 3.65Å; F1179-I1331 HydrophobicContact CZ-CD1 4.19Å; F1179-I1331 HydrophobicContact CZ-CG1 4.34Å; L1265-I1331 HydrophobicContact CB-CG2 4.19Å; L1265-I1331 HydrophobicContact CD2-CG1 4.34Å; L1265-I1331 HydrophobicContact CD2-CG2 4.29Å; F1268-I1331 HydrophobicContact CB-CD1 4.02Å; F1268-I1331 HydrophobicContact CD1-CD1 4.32Å; F1268-I1331 HydrophobicContact CG-CD1 4.43Å; V1269-I1331 HydrophobicContact CG2-CB 4.41Å; V1269-I1331 HydrophobicContact CG2-CG2 3.65Å; V1327-I1331 HydrophobicContact CG1-CD1 3.85Å; V1327-I1331 HydrophobicContact CG1-CG1 4.48Å; V1327-I1331 WeakPolarHBondContact O-CD1 3.34Å; V1327-I1331 WeakPolarHBondContact O-CG1 3.41Å; V1327-I1331 PolarHBondContact O-N 3.08Å; L1328-I1331 PolarHBondContact O-N 2.94Å; Q1329-I1331 VanDerWaalsContact C-N 3.3Å; Q1329-I1331 PolarHBondContact O-N 3.4Å; I1331-E1333 VanDerWaalsContact C-N 3.33Å; I1331-E1333 PolarHBondContact O-N 3.12Å; I1331-C1334 WeakPolarHBondContact O-CB 3.38Å; I1331-C1334 PolarHBondContact O-N 3.12Å; I1331-L1335 HydrophobicContact CG2-CD1 4.09Å; I1331-L1335 HydrophobicContact CG2-CG 4.47Å; I1331-L1335 WeakPolarHBondContact O-CG 3.32Å; I1331-L1335 PolarHBondContact O-N 3.18Å
1332L91.2Very high83.7Confident0.2 Ų0.219.9 Ų19.90%0.00110%0.1CC..Hα-helixtrans-65-36.8177.1-74.6167.7000112.6L1328 Q1329 L1335 A1336 L1460 L1463 L1471 W1474 T1475 L1478L1328-L1332 WeakPolarHBondContact O-CB 3.36Å; L1328-L1332 VanDerWaalsContact O-CG 3.29Å; L1328-L1332 WeakPolarHBondContact O-CG 3.39Å; L1328-L1332 PolarHBondContact O-N 3.05Å; Q1329-L1332 PolarHBondContact O-N 3.22Å; L1332-L1335 PolarHBondContact O-N 3.05Å; L1332-A1336 VanDerWaalsContact O-CB 3.29Å; L1332-A1336 WeakPolarHBondContact O-CB 3.36Å; L1332-A1336 PolarHBondContact O-N 3.25Å; L1332-L1460 HydrophobicContact CD2-CD2 3.67Å; L1332-L1463 HydrophobicContact CD1-CD1 4.09Å; L1332-L1463 HydrophobicContact CD2-CD1 3.91Å; L1332-L1463 HydrophobicContact CG-CD1 4.29Å; L1332-L1471 HydrophobicContact CD1-CB 3.88Å; L1332-L1471 HydrophobicContact CD1-CD1 4.07Å; L1332-L1471 HydrophobicContact CD1-CD2 4.08Å; L1332-L1471 HydrophobicContact CD1-CG 4.23Å; L1332-W1474 HydrophobicContact CB-CB 4.03Å; L1332-W1474 HydrophobicContact CB-CG 4.49Å; L1332-W1474 HydrophobicContact CD1-CB 4.32Å; L1332-T1475 WeakPolarHBondContact CD1-OG1 3.23Å; L1332-L1478 HydrophobicContact CD2-CD1 3.98Å
1333E90.8Very high85.4Confident0.6 Ų0.616.7 Ų16.70%0.0039%0.086CC..Hα-helixtrans-63.9-45.5171.9-79-171.8-145.400111.2R1183 Q1329 C1330 I1331 L1335 A1336 Y1337 W1474 K1538R1183-E1333 VanDerWaalsContact CD-OE2 3.28Å; R1183-E1333 WeakPolarHBondContact CD-OE2 3.39Å; R1183-E1333 HydrophobicContact CG-CB 3.75Å; R1183-E1333 IonicContact CZ-OE2 3.08Å; R1183-E1333 IonicContact NE-OE2 3.33Å; R1183-E1333 IonicContact NH1-OE2 3.32Å; R1183-E1333 PolarHBondContact NH1-OE2 3.12Å; R1183-E1333 VanDerWaalsContact NH1-OE2 3.16Å; Q1329-E1333 HydrophobicContact CG-CG 4.45Å; Q1329-E1333 PolarHBondContact NE2-OE1 3.02Å; Q1329-E1333 WeakPolarHBondContact O-CB 3.32Å; Q1329-E1333 WeakPolarHBondContact O-CG 3.38Å; Q1329-E1333 PolarHBondContact O-N 3.08Å; C1330-E1333 PolarHBondContact O-N 3.13Å; I1331-E1333 VanDerWaalsContact C-N 3.33Å; I1331-E1333 PolarHBondContact O-N 3.12Å; E1333-L1335 PolarHBondContact O-N 3.04Å; E1333-A1336 WeakPolarHBondContact O-CB 3.32Å; E1333-A1336 PolarHBondContact O-N 3.28Å; E1333-Y1337 HydrophobicContact CB-CE2 4.15Å; E1333-Y1337 WeakPolarHBondContact O-CD2 3.35Å; E1333-Y1337 PolarHBondContact O-N 3.24Å; E1333-W1474 HydrophobicContact CG-CD2 4.05Å; E1333-W1474 HydrophobicContact CG-CE3 4.15Å; E1333-W1474 HydrophobicContact CG-CH2 3.67Å; E1333-W1474 HydrophobicContact CG-CZ2 3.51Å; E1333-W1474 VanDerWaalsContact CG-CZ2 3.49Å; E1333-W1474 HydrophobicContact CG-CZ3 3.98Å; E1333-K1538 WeakPolarHBondContact OE1-CD 3.45Å; E1333-K1538 IonicContact OE1-NZ 3.56Å; E1333-K1538 PolarHBondContact OE1-NZ 3.17Å; E1333-K1538 VanDerWaalsContact OE2-CE 3.26Å; E1333-K1538 WeakPolarHBondContact OE2-CE 3.43Å; E1333-K1538 IonicContact OE2-NZ 3.44Å; E1333-K1538 PolarHBondContact OE2-NZ 3.01Å
1334C91.6Very high86.5Confident1 Ų112.5 Ų12.51%0.0077%0.071CC..Hα-helixtrans-55.6-48.7172.4-69.20000111.8R1183 L1265 C1330 I1331 A1336 Y1337 L1338R1183-C1334 WeakPolarHBondContact CA-SG 3.28Å; L1265-C1334 HydrophobicContact CD1-CB 3.77Å; C1330-C1334 PolarHBondContact O-N 3.31Å; C1330-C1334 PolarHBondContact O-SG 3.17Å; I1331-C1334 WeakPolarHBondContact O-CB 3.38Å; I1331-C1334 PolarHBondContact O-N 3.12Å; C1334-A1336 VanDerWaalsContact C-N 3.32Å; C1334-A1336 PolarHBondContact O-N 3.3Å; C1334-Y1337 PolarHBondContact O-N 3.07Å; C1334-Y1337 VanDerWaalsContact O-N 3.16Å; C1334-L1338 WeakPolarHBondContact O-CB 3.44Å; C1334-L1338 WeakPolarHBondContact O-CD1 3.39Å; C1334-L1338 VanDerWaalsContact O-CG 3.28Å; C1334-L1338 WeakPolarHBondContact O-CG 3.38Å; C1334-L1338 PolarHBondContact O-N 3.17Å
1335L92.2Very high87.3Confident1.6 Ų1.611.5 Ų11.51%0.0087%0.066CC..Hα-helixtrans-63-36.8178.1-69172.5000112.1I1262 L1265 V1269 I1331 L1332 E1333 L1338 C1339 L1456 L1478I1262-L1335 HydrophobicContact CB-CD2 4.45Å; I1262-L1335 HydrophobicContact CG1-CD2 4.46Å; I1262-L1335 HydrophobicContact CG2-CD2 3.87Å; L1265-L1335 HydrophobicContact CB-CD2 4.15Å; L1265-L1335 HydrophobicContact CB-CG 4.42Å; L1265-L1335 HydrophobicContact CD1-CD2 4.43Å; V1269-L1335 HydrophobicContact CG2-CD1 4.31Å; I1331-L1335 HydrophobicContact CG2-CD1 4.09Å; I1331-L1335 HydrophobicContact CG2-CG 4.47Å; I1331-L1335 WeakPolarHBondContact O-CG 3.32Å; I1331-L1335 PolarHBondContact O-N 3.18Å; L1332-L1335 PolarHBondContact O-N 3.05Å; E1333-L1335 PolarHBondContact O-N 3.04Å; L1335-L1338 PolarHBondContact O-N 2.7Å; L1335-C1339 WeakPolarHBondContact O-CA 3.42Å; L1335-C1339 VanDerWaalsContact O-CB 3.25Å; L1335-C1339 WeakPolarHBondContact O-CB 3.26Å; L1335-C1339 PolarHBondContact O-N 3.03Å; L1335-C1339 PolarHBondContact O-SG 3.2Å; L1335-C1339 VanDerWaalsContact O-SG 3.35Å; L1335-L1456 HydrophobicContact CD2-CD1 4.44Å; L1335-L1456 HydrophobicContact CD2-CD2 4.42Å; L1335-L1478 HydrophobicContact CB-CD1 4.05Å
1336A90Very high87.6Confident0 Ų011.3 Ų11.30%06%0.059CC..Iπ-helixtrans-64.9-41.6174.300000112.5L1332 E1333 C1334 H1340 T1341 W1474 L1478 F1531L1332-A1336 VanDerWaalsContact O-CB 3.29Å; L1332-A1336 WeakPolarHBondContact O-CB 3.36Å; L1332-A1336 PolarHBondContact O-N 3.25Å; E1333-A1336 WeakPolarHBondContact O-CB 3.32Å; E1333-A1336 PolarHBondContact O-N 3.28Å; C1334-A1336 VanDerWaalsContact C-N 3.32Å; C1334-A1336 PolarHBondContact O-N 3.3Å; A1336-H1340 WeakPolarHBondContact O-CA 3.27Å; A1336-H1340 WeakPolarHBondContact O-CB 3.36Å; A1336-H1340 PolarHBondContact O-N 3.02Å; A1336-H1340 VanDerWaalsContact O-N 3.15Å; A1336-T1341 PolarHBondContact O-N 3.2Å; A1336-T1341 PolarHBondContact O-OG1 3.34Å; A1336-W1474 HydrophobicContact CB-CE3 3.7Å; A1336-W1474 HydrophobicContact CB-CZ3 3.84Å; A1336-L1478 HydrophobicContact CB-CD1 4.45Å; A1336-L1478 HydrophobicContact CB-CD2 4.4Å; A1336-F1531 HydrophobicContact CB-CE1 4.22Å; A1336-F1531 HydrophobicContact CB-CE2 4.36Å; A1336-F1531 HydrophobicContact CB-CZ 3.65Å
1337Y89.1Confident87.7Confident1.4 Ų1.411.6 Ų11.61%0.0056%0.056CC..Iπ-helixtrans-65-50.8174.1-67.3-55.4000111.6Y1076 C1186 Q1187 A1190 E1333 C1334 T1341 G1342 L1539 L1542Y1076-Y1337 VanDerWaalsContact OH-C 3.24Å; Y1076-Y1337 PolarHBondContact OH-O 3.27Å; C1186-Y1337 HydrophobicContact CB-CD2 4.2Å; Q1187-Y1337 HydrophobicContact CB-CD1 4.46Å; Q1187-Y1337 HydrophobicContact CB-CD2 4.09Å; Q1187-Y1337 HydrophobicContact CB-CE1 4.17Å; Q1187-Y1337 HydrophobicContact CB-CE2 3.65Å; Q1187-Y1337 HydrophobicContact CB-CG 4.45Å; Q1187-Y1337 HydrophobicContact CG-CE1 4.04Å; Q1187-Y1337 HydrophobicContact CG-CE2 4.15Å; Q1187-Y1337 PolarHBondContact OE1-OH 2.88Å; A1190-Y1337 HydrophobicContact CB-CD1 3.99Å; A1190-Y1337 HydrophobicContact CB-CG 4.4Å; E1333-Y1337 HydrophobicContact CB-CE2 4.15Å; E1333-Y1337 WeakPolarHBondContact O-CD2 3.35Å; E1333-Y1337 PolarHBondContact O-N 3.24Å; C1334-Y1337 PolarHBondContact O-N 3.07Å; C1334-Y1337 VanDerWaalsContact O-N 3.16Å; Y1337-T1341 WeakPolarHBondContact O-CB 3.48Å; Y1337-T1341 PolarHBondContact O-N 2.99Å; Y1337-G1342 PolarHBondContact O-N 2.81Å; Y1337-L1539 HydrophobicContact CD1-CD2 4.12Å; Y1337-L1539 HydrophobicContact CE1-CD2 3.51Å; Y1337-L1539 VanDerWaalsContact CE1-CD2 3.46Å; Y1337-L1542 HydrophobicContact CD1-CD1 4.14Å; Y1337-L1542 HydrophobicContact CE1-CD1 3.69Å; Y1337-L1542 VanDerWaalsContact CE1-CD1 3.5Å
1338L89.9Confident87.7Confident0 Ų012.4 Ų12.40%06%0.06CC..Iπ-helixtrans-69.8-52.6-174.8-63.4172.4000112.9Y1076 L1085 V1258 L1261 I1262 L1265 C1334 L1335 A1344Y1076-L1338 HydrophobicContact CD1-CD2 4.45Å; Y1076-L1338 HydrophobicContact CE1-CD2 4.02Å; Y1076-L1338 HydrophobicContact CE2-CD2 4.33Å; L1085-L1338 HydrophobicContact CD2-CD2 3.89Å; V1258-L1338 HydrophobicContact CG1-CD2 4.4Å; V1258-L1338 HydrophobicContact CG2-CB 4.47Å; V1258-L1338 HydrophobicContact CG2-CD2 4.06Å; L1261-L1338 HydrophobicContact CD2-CD1 3.89Å; L1261-L1338 HydrophobicContact CG-CD1 4.18Å; I1262-L1338 HydrophobicContact CD1-CB 4.13Å; I1262-L1338 HydrophobicContact CG1-CB 4.03Å; I1262-L1338 HydrophobicContact CG1-CD1 3.97Å; L1265-L1338 HydrophobicContact CD1-CD1 4.07Å; C1334-L1338 WeakPolarHBondContact O-CB 3.44Å; C1334-L1338 WeakPolarHBondContact O-CD1 3.39Å; C1334-L1338 VanDerWaalsContact O-CG 3.28Å; C1334-L1338 WeakPolarHBondContact O-CG 3.38Å; C1334-L1338 PolarHBondContact O-N 3.17Å; L1335-L1338 PolarHBondContact O-N 2.7Å; L1338-A1344 VanDerWaalsContact O-CB 3.28Å; L1338-A1344 WeakPolarHBondContact O-CB 3.35Å; L1338-A1344 PolarHBondContact O-N 2.9Å; L1338-A1344 VanDerWaalsContact O-N 3.13Å
1339C88.5Confident87.7Confident0.8 Ų0.812.2 Ų12.21%0.0056%0.059CC..Iπ-helixtrans-82.3-39-171.7-58.40000113L1335 D1343 L1345 L1478 H1481L1335-C1339 WeakPolarHBondContact O-CA 3.42Å; L1335-C1339 VanDerWaalsContact O-CB 3.25Å; L1335-C1339 WeakPolarHBondContact O-CB 3.26Å; L1335-C1339 PolarHBondContact O-N 3.03Å; L1335-C1339 PolarHBondContact O-SG 3.2Å; L1335-C1339 VanDerWaalsContact O-SG 3.35Å; C1339-D1343 VanDerWaalsContact O-CA 3.29Å; C1339-D1343 WeakPolarHBondContact O-CA 3.36Å; C1339-L1345 HydrophobicContact CB-CD1 4.33Å; C1339-L1478 HydrophobicContact CB-CD2 4.3Å; C1339-H1481 PolarHBondContact O-CE1 3.35Å; C1339-H1481 PolarHBondContact O-ND1 3.32Å; C1339-H1481 PolarHBondContact O-NE2 3.35Å; C1339-H1481 VanDerWaalsContact O-NE2 3.12Å
1340H85.2Confident87.4Confident13.2 Ų13.211.9 Ų11.96%0.0616%0.06CC..Iπ-helixtrans-105.2-52.4-171.7-178.8-11.8000113.1K1197 A1336 G1342 D1343 L1478 H1481 S1529 F1531K1197-H1340 WeakPolarHBondContact CE-CE1 3.46Å; K1197-H1340 VanDerWaalsContact CE-NE2 3.29Å; K1197-H1340 WeakPolarHBondContact CE-NE2 3.44Å; K1197-H1340 PolarHBondContact NZ-CE1 3.17Å; K1197-H1340 PolarHBondContact NZ-NE2 3.27Å; A1336-H1340 WeakPolarHBondContact O-CA 3.27Å; A1336-H1340 WeakPolarHBondContact O-CB 3.36Å; A1336-H1340 PolarHBondContact O-N 3.02Å; A1336-H1340 VanDerWaalsContact O-N 3.15Å; H1340-G1342 VanDerWaalsContact C-N 3.33Å; H1340-G1342 PolarHBondContact O-N 3.06Å; H1340-D1343 PolarHBondContact O-N 2.86Å; H1340-D1343 VanDerWaalsContact O-N 3.16Å; H1340-L1478 HydrophobicContact CB-CD2 4.46Å; H1340-H1481 AromaticContact CD2-CG 3.86Å; H1340-H1481 AromaticContact ND1-CG 3.67Å; H1340-H1481 AromaticContact ND1-ND1 3.76Å; H1340-S1529 PolarHBondContact CE1-O 3.44Å; H1340-S1529 PolarHBondContact NE2-O 3.04Å; H1340-F1531 HydrophobicContact CB-CE2 4.09Å; H1340-F1531 HydrophobicContact CB-CZ 4.44Å; H1340-F1531 AromaticContact CD2-CD2 3.58Å; H1340-F1531 VanDerWaalsContact CD2-CD2 3.5Å; H1340-F1531 WeakPolarHBondContact CD2-CD2 3.36Å; H1340-F1531 AromaticContact CD2-CE2 3.41Å; H1340-F1531 WeakPolarHBondContact CD2-CE2 3.45Å; H1340-F1531 AromaticContact CE1-CD2 3.57Å; H1340-F1531 WeakPolarHBondContact CE1-CD2 3.41Å; H1340-F1531 AromaticContact CE1-CE2 3.62Å; H1340-F1531 WeakPolarHBondContact CE1-CE2 3.33Å; H1340-F1531 AromaticContact CG-CE2 3.56Å; H1340-F1531 AromaticContact ND1-CD2 3.89Å; H1340-F1531 AromaticContact ND1-CE2 3.62Å; H1340-F1531 WeakPolarHBondContact ND1-CE2 3.5Å; H1340-F1531 AromaticContact NE2-CD2 3.56Å; H1340-F1531 AromaticContact NE2-CE2 3.59Å; H1340-F1531 WeakPolarHBondContact NE2-CE2 2.97Å
1341T83.3Confident87.2Confident17 Ų1716.9 Ų16.910%0.1048%0.082CC..Iπ-helixtrans-69.9-42.9-175.6-52.20000111.3A1190 P1194 A1336 Y1337A1190-T1341 HydrophobicContact CB-CG2 4.03Å; P1194-T1341 WeakPolarHBondContact CA-O 3.45Å; P1194-T1341 WeakPolarHBondContact CB-O 3.2Å; P1194-T1341 HydrophobicContact CG-CG2 4.11Å; A1336-T1341 PolarHBondContact O-N 3.2Å; A1336-T1341 PolarHBondContact O-OG1 3.34Å; Y1337-T1341 WeakPolarHBondContact O-CB 3.48Å; Y1337-T1341 PolarHBondContact O-N 2.99Å
1342G81.4Confident86.9Confident0.6 Ų0.616.9 Ų16.91%0.0068%0.082CC..SBendtrans-98.12.717500000115.5P1191 Y1337 H1340 A1344 Q1347P1191-G1342 VanDerWaalsContact CD-CA 3.48Å; Y1337-G1342 PolarHBondContact O-N 2.81Å; H1340-G1342 VanDerWaalsContact C-N 3.33Å; H1340-G1342 PolarHBondContact O-N 3.06Å; G1342-A1344 PolarHBondContact O-N 3.01Å; G1342-Q1347 PolarHBondContact O-NE2 3.13Å
1343D85.1Confident86.4Confident15.8 Ų15.820 Ų208%0.08410%0.096CC..  trans50.732.1169.3-161.524.5000114.7T1195 C1339 H1340 L1345 R1346 Q1347 H1481T1195-D1343 WeakPolarHBondContact CB-OD2 3.1Å; T1195-D1343 HydrophobicContact CG2-CB 4.15Å; T1195-D1343 WeakPolarHBondContact OG1-CB 3.35Å; T1195-D1343 VanDerWaalsContact OG1-CG 3.25Å; T1195-D1343 PolarHBondContact OG1-OD2 3.1Å; C1339-D1343 VanDerWaalsContact O-CA 3.29Å; C1339-D1343 WeakPolarHBondContact O-CA 3.36Å; H1340-D1343 PolarHBondContact O-N 2.86Å; H1340-D1343 VanDerWaalsContact O-N 3.16Å; D1343-L1345 VanDerWaalsContact C-N 3.31Å; D1343-L1345 PolarHBondContact O-N 3.15Å; D1343-R1346 PolarHBondContact O-N 3.23Å; D1343-R1346 VanDerWaalsContact O-N 3.13Å; D1343-R1346 WeakPolarHBondContact OD1-CB 3.31Å; D1343-Q1347 WeakPolarHBondContact O-CG 3.25Å; D1343-Q1347 PolarHBondContact O-N 3.18Å; D1343-H1481 IonicContact OD1-CE1 3.06Å
1344A86.2Confident85.9Confident3.4 Ų3.425.7 Ų25.73%0.02812%0.121CC..Hα-helixtrans-62-37.6-164.400000113.1Y1076 V1258 L1338 G1342 R1346 Q1347 I1348Y1076-A1344 HydrophobicContact CD2-CB 4.04Å; Y1076-A1344 HydrophobicContact CE2-CB 4.19Å; V1258-A1344 HydrophobicContact CG1-CB 3.97Å; V1258-A1344 HydrophobicContact CG2-CB 3.72Å; L1338-A1344 VanDerWaalsContact O-CB 3.28Å; L1338-A1344 WeakPolarHBondContact O-CB 3.35Å; L1338-A1344 PolarHBondContact O-N 2.9Å; L1338-A1344 VanDerWaalsContact O-N 3.13Å; G1342-A1344 PolarHBondContact O-N 3.01Å; A1344-R1346 VanDerWaalsContact C-N 3.32Å; A1344-R1346 PolarHBondContact O-N 3.31Å; A1344-Q1347 PolarHBondContact O-N 3.28Å; A1344-I1348 VanDerWaalsContact O-CG1 3.31Å; A1344-I1348 WeakPolarHBondContact O-CG1 3.44Å; A1344-I1348 PolarHBondContact O-N 3.16Å; A1344-I1348 VanDerWaalsContact O-N 3.08Å
1345L87.8Confident85.3Confident0 Ų029 Ų290%014%0.136CC..Hα-helixtrans-59.9-44.8177.1-57.6-178.7000111.2L1259 I1262 C1339 D1343 I1348 L1349 V1448 L1451 I1452 L1456 F1485L1259-L1345 HydrophobicContact CD2-CD2 3.42Å; L1259-L1345 VanDerWaalsContact CD2-CD2 3.43Å; I1262-L1345 HydrophobicContact CD1-CD2 3.9Å; I1262-L1345 HydrophobicContact CD1-CG 4.46Å; C1339-L1345 HydrophobicContact CB-CD1 4.33Å; D1343-L1345 VanDerWaalsContact C-N 3.31Å; D1343-L1345 PolarHBondContact O-N 3.15Å; L1345-I1348 PolarHBondContact O-N 3.04Å; L1345-L1349 VanDerWaalsContact O-CB 3.28Å; L1345-L1349 WeakPolarHBondContact O-CB 3.31Å; L1345-L1349 WeakPolarHBondContact O-CG 3.25Å; L1345-L1349 PolarHBondContact O-N 3.29Å; L1345-L1349 VanDerWaalsContact O-N 3.09Å; L1345-V1448 HydrophobicContact CB-CG1 4.27Å; L1345-V1448 HydrophobicContact CD2-CG1 4.46Å; L1345-L1451 HydrophobicContact CD2-CD2 4.15Å; L1345-I1452 HydrophobicContact CD1-CD1 4.2Å; L1345-I1452 HydrophobicContact CD1-CG1 4.21Å; L1345-L1456 HydrophobicContact CD1-CD1 3.96Å; L1345-L1456 HydrophobicContact CD1-CD2 4.18Å; L1345-F1485 HydrophobicContact CB-CD1 4.42Å; L1345-F1485 HydrophobicContact CB-CE1 3.71Å; L1345-F1485 HydrophobicContact CB-CZ 3.74Å; L1345-F1485 HydrophobicContact CD1-CE2 4.44Å; L1345-F1485 HydrophobicContact CD1-CZ 4.34Å
1346R86.1Confident84.3Confident45.8 Ų45.832.3 Ų32.317%0.17315%0.152CC..Hα-helixtrans-74.6-36-178.5-158.192-170.3-1598111.9V1198 D1343 A1344 I1348 L1349 T1350 S1484 F1485V1198-R1346 HydrophobicContact CG2-CG 4.41Å; D1343-R1346 PolarHBondContact O-N 3.23Å; D1343-R1346 VanDerWaalsContact O-N 3.13Å; D1343-R1346 WeakPolarHBondContact OD1-CB 3.31Å; A1344-R1346 VanDerWaalsContact C-N 3.32Å; A1344-R1346 PolarHBondContact O-N 3.31Å; R1346-I1348 VanDerWaalsContact C-N 3.32Å; R1346-I1348 PolarHBondContact O-N 3.37Å; R1346-L1349 PolarHBondContact O-N 3.04Å; R1346-T1350 HydrophobicContact CG-CG2 4.49Å; R1346-T1350 WeakPolarHBondContact O-CB 3.34Å; R1346-T1350 WeakPolarHBondContact O-CG2 3.29Å; R1346-T1350 PolarHBondContact O-N 3.09Å; R1346-T1350 PolarHBondContact O-OG1 3.12Å; R1346-S1484 PolarHBondContact NH1-O 3.07Å; R1346-S1484 PolarHBondContact NH2-O 2.82Å; R1346-S1484 VanDerWaalsContact NH2-O 3.11Å; R1346-F1485 HydrophobicContact CB-CE1 4.03Å; R1346-F1485 HydrophobicContact CB-CZ 4.19Å; R1346-F1485 HydrophobicContact CG-CE1 4.16Å; R1346-F1485 HydrophobicContact CG-CZ 4.48Å
1347Q84.7Confident83.2Confident72.4 Ų72.438.3 Ų38.334%0.33818%0.18SC..Hα-helixtrans-62.6-41.8174.6-70.2-176.830.400111.8G1342 D1343 A1344 T1350 K1351G1342-Q1347 PolarHBondContact O-NE2 3.13Å; D1343-Q1347 WeakPolarHBondContact O-CG 3.25Å; D1343-Q1347 PolarHBondContact O-N 3.18Å; A1344-Q1347 PolarHBondContact O-N 3.28Å; Q1347-T1350 PolarHBondContact O-OG1 2.91Å; Q1347-K1351 VanDerWaalsContact O-CB 3.28Å; Q1347-K1351 WeakPolarHBondContact O-CB 3.31Å; Q1347-K1351 PolarHBondContact O-N 3.09Å
1348I84.9Confident82.2Confident21.2 Ų21.244.8 Ų44.811%0.10921%0.208CC..Hα-helixtrans-69.5-45.7177.2-66.7170.1000110.9P1256 V1258 L1259 A1344 L1345 R1346 T1350 K1351 A1352 Q1444 V1448P1256-I1348 HydrophobicContact CB-CD1 4.09Å; P1256-I1348 HydrophobicContact CG-CD1 4.37Å; V1258-I1348 HydrophobicContact CG1-CD1 3.53Å; V1258-I1348 VanDerWaalsContact CG1-CD1 3.48Å; L1259-I1348 HydrophobicContact CD1-CD1 3.82Å; L1259-I1348 HydrophobicContact CD1-CG2 4.17Å; L1259-I1348 HydrophobicContact CD2-CD1 3.95Å; L1259-I1348 HydrophobicContact CG-CD1 3.61Å; A1344-I1348 VanDerWaalsContact O-CG1 3.31Å; A1344-I1348 WeakPolarHBondContact O-CG1 3.44Å; A1344-I1348 PolarHBondContact O-N 3.16Å; A1344-I1348 VanDerWaalsContact O-N 3.08Å; L1345-I1348 PolarHBondContact O-N 3.04Å; R1346-I1348 VanDerWaalsContact C-N 3.32Å; R1346-I1348 PolarHBondContact O-N 3.37Å; I1348-T1350 VanDerWaalsContact C-N 3.35Å; I1348-T1350 PolarHBondContact O-N 3.31Å; I1348-K1351 WeakPolarHBondContact O-CB 3.18Å; I1348-K1351 PolarHBondContact O-N 3.24Å; I1348-K1351 VanDerWaalsContact O-N 3.13Å; I1348-A1352 WeakPolarHBondContact O-CB 3.39Å; I1348-A1352 PolarHBondContact O-N 3.2Å; I1348-Q1444 HydrophobicContact CG2-CB 4.2Å; I1348-V1448 HydrophobicContact CG2-CG2 4.44Å
1349L85.5Confident80.7Confident4.8 Ų4.851.5 Ų51.53%0.02524%0.243CC..Hα-helixtrans-55.4-51.1174.9-111133.7000111.8L1345 R1346 K1351 A1352 E1353 K1445 V1448 Y1449 F1485L1345-L1349 VanDerWaalsContact O-CB 3.28Å; L1345-L1349 WeakPolarHBondContact O-CB 3.31Å; L1345-L1349 WeakPolarHBondContact O-CG 3.25Å; L1345-L1349 PolarHBondContact O-N 3.29Å; L1345-L1349 VanDerWaalsContact O-N 3.09Å; R1346-L1349 PolarHBondContact O-N 3.04Å; L1349-K1351 VanDerWaalsContact C-N 3.3Å; L1349-K1351 PolarHBondContact O-N 3.09Å; L1349-A1352 PolarHBondContact O-N 3.18Å; L1349-A1352 VanDerWaalsContact O-N 3.12Å; L1349-E1353 VanDerWaalsContact O-CG 3.3Å; L1349-E1353 WeakPolarHBondContact O-CG 3.31Å; L1349-E1353 PolarHBondContact O-N 3.07Å; L1349-K1445 HydrophobicContact CD1-CB 4.23Å; L1349-K1445 HydrophobicContact CD1-CD 4.35Å; L1349-K1445 HydrophobicContact CD1-CG 3.78Å; L1349-K1445 HydrophobicContact CD2-CB 4.41Å; L1349-K1445 HydrophobicContact CD2-CG 3.98Å; L1349-V1448 HydrophobicContact CD1-CB 4.36Å; L1349-V1448 HydrophobicContact CD1-CG1 3.91Å; L1349-V1448 HydrophobicContact CD2-CB 4.15Å; L1349-V1448 HydrophobicContact CD2-CG1 4.08Å; L1349-V1448 HydrophobicContact CG-CB 4.42Å; L1349-V1448 HydrophobicContact CG-CG1 4Å; L1349-Y1449 HydrophobicContact CD1-CE1 4.17Å; L1349-Y1449 HydrophobicContact CD1-CE2 4.06Å; L1349-Y1449 HydrophobicContact CD2-CE1 4.18Å; L1349-Y1449 HydrophobicContact CD2-CE2 4.42Å; L1349-F1485 HydrophobicContact CD1-CD1 3.67Å; L1349-F1485 HydrophobicContact CD1-CE1 4Å; L1349-F1485 HydrophobicContact CD2-CD1 4.3Å
1350T83.7Confident79Confident45 Ų4555.5 Ų55.528%0.27627%0.271SS..Hα-helixtrans-67.7-23.3180-14.90000113R1346 Q1347 I1348 E1353 K1354R1346-T1350 HydrophobicContact CG-CG2 4.49Å; R1346-T1350 WeakPolarHBondContact O-CB 3.34Å; R1346-T1350 WeakPolarHBondContact O-CG2 3.29Å; R1346-T1350 PolarHBondContact O-N 3.09Å; R1346-T1350 PolarHBondContact O-OG1 3.12Å; Q1347-T1350 PolarHBondContact O-OG1 2.91Å; I1348-T1350 VanDerWaalsContact C-N 3.35Å; I1348-T1350 PolarHBondContact O-N 3.31Å; T1350-E1353 WeakPolarHBondContact CA-OE2 3.5Å; T1350-K1354 HydrophobicContact CG2-CD 4.27Å; T1350-K1354 VanDerWaalsContact CG2-NZ 3.34Å; T1350-K1354 WeakPolarHBondContact O-CB 3.28Å; T1350-K1354 VanDerWaalsContact O-CD 3.26Å; T1350-K1354 WeakPolarHBondContact O-CD 3.4Å; T1350-K1354 VanDerWaalsContact O-CE 3.28Å; T1350-K1354 WeakPolarHBondContact O-CE 3.36Å; T1350-K1354 VanDerWaalsContact O-CG 3.25Å; T1350-K1354 WeakPolarHBondContact O-CG 3.32Å; T1350-K1354 PolarHBondContact O-N 3.28Å; T1350-K1354 VanDerWaalsContact O-N 3.12Å; T1350-K1354 PolarHBondContact O-NZ 3.11Å
1351K84.2Confident77.5Confident108.4 Ų108.459.8 Ų59.847%0.47130%0.298SS..Hα-helixtrans-74.4-48.5170.5-177-171.1168.9-166.70110.3Q1347 I1348 L1349 E1353 K1354 E1355Q1347-K1351 VanDerWaalsContact O-CB 3.28Å; Q1347-K1351 WeakPolarHBondContact O-CB 3.31Å; Q1347-K1351 PolarHBondContact O-N 3.09Å; I1348-K1351 WeakPolarHBondContact O-CB 3.18Å; I1348-K1351 PolarHBondContact O-N 3.24Å; I1348-K1351 VanDerWaalsContact O-N 3.13Å; L1349-K1351 VanDerWaalsContact C-N 3.3Å; L1349-K1351 PolarHBondContact O-N 3.09Å; K1351-E1353 PolarHBondContact O-N 3.12Å; K1351-K1354 PolarHBondContact O-N 3.17Å; K1351-K1354 VanDerWaalsContact O-N 3.13Å; K1351-E1355 VanDerWaalsContact CE-CD 3.44Å; K1351-E1355 WeakPolarHBondContact CE-OE1 3.4Å; K1351-E1355 WeakPolarHBondContact CE-OE2 3.32Å; K1351-E1355 IonicContact NZ-OE1 3.41Å; K1351-E1355 IonicContact NZ-OE2 3.35Å; K1351-E1355 WeakPolarHBondContact O-CG 3.4Å; K1351-E1355 PolarHBondContact O-N 2.99Å; K1351-E1355 VanDerWaalsContact O-N 3.1Å
1352A82.5Confident75.7Confident0.8 Ų0.864.3 Ų64.31%0.00733%0.326CS..Hα-helixtrans-58.9-46.6-179.800000112.1I1348 L1349 K1354 E1355 E1356 P1441 K1445I1348-A1352 WeakPolarHBondContact O-CB 3.39Å; I1348-A1352 PolarHBondContact O-N 3.2Å; L1349-A1352 PolarHBondContact O-N 3.18Å; L1349-A1352 VanDerWaalsContact O-N 3.12Å; A1352-K1354 VanDerWaalsContact C-N 3.29Å; A1352-K1354 PolarHBondContact O-N 3.12Å; A1352-E1355 PolarHBondContact O-N 3.04Å; A1352-E1355 VanDerWaalsContact O-N 3.13Å; A1352-E1356 WeakPolarHBondContact O-CB 3.49Å; A1352-E1356 PolarHBondContact O-N 3.14Å; A1352-P1441 HydrophobicContact CB-CB 4.07Å; A1352-P1441 VanDerWaalsContact CB-O 3.28Å; A1352-P1441 WeakPolarHBondContact CB-O 3.34Å; A1352-K1445 HydrophobicContact CB-CB 4.15Å
1353E81.2Confident73.7Confident65.6 Ų65.667.8 Ų67.831%0.30736%0.362SS..Hα-helixtrans-59.2-39.3176.4-70166.6171.800112.5L1349 T1350 K1351 E1355 E1356 Q1357 K1445L1349-E1353 VanDerWaalsContact O-CG 3.3Å; L1349-E1353 WeakPolarHBondContact O-CG 3.31Å; L1349-E1353 PolarHBondContact O-N 3.07Å; T1350-E1353 WeakPolarHBondContact CA-OE2 3.5Å; K1351-E1353 PolarHBondContact O-N 3.12Å; E1353-E1355 VanDerWaalsContact C-N 3.33Å; E1353-E1355 PolarHBondContact O-N 3.31Å; E1353-E1356 PolarHBondContact O-N 3.25Å; E1353-Q1357 WeakPolarHBondContact O-CB 3.33Å; E1353-Q1357 VanDerWaalsContact O-CG 3.26Å; E1353-Q1357 WeakPolarHBondContact O-CG 3.31Å; E1353-Q1357 PolarHBondContact O-N 3.01Å; E1353-K1445 HydrophobicContact CG-CD 4.25Å
1354K81.9Confident71.1Confident121.8 Ų121.871.5 Ų71.553%0.5339%0.389SS..Hα-helixtrans-71.7-23.8176.8-73.2172.2-171.7160.20113.2T1350 K1351 A1352 K1358T1350-K1354 HydrophobicContact CG2-CD 4.27Å; T1350-K1354 VanDerWaalsContact CG2-NZ 3.34Å; T1350-K1354 WeakPolarHBondContact O-CB 3.28Å; T1350-K1354 VanDerWaalsContact O-CD 3.26Å; T1350-K1354 WeakPolarHBondContact O-CD 3.4Å; T1350-K1354 VanDerWaalsContact O-CE 3.28Å; T1350-K1354 WeakPolarHBondContact O-CE 3.36Å; T1350-K1354 VanDerWaalsContact O-CG 3.25Å; T1350-K1354 WeakPolarHBondContact O-CG 3.32Å; T1350-K1354 PolarHBondContact O-N 3.28Å; T1350-K1354 VanDerWaalsContact O-N 3.12Å; T1350-K1354 PolarHBondContact O-NZ 3.11Å; K1351-K1354 PolarHBondContact O-N 3.17Å; K1351-K1354 VanDerWaalsContact O-N 3.13Å; A1352-K1354 VanDerWaalsContact C-N 3.29Å; A1352-K1354 PolarHBondContact O-N 3.12Å; K1354-K1358 VanDerWaalsContact O-CD 3.29Å; K1354-K1358 WeakPolarHBondContact O-CD 3.36Å; K1354-K1358 VanDerWaalsContact O-CE 3.27Å; K1354-K1358 WeakPolarHBondContact O-CE 3.5Å; K1354-K1358 VanDerWaalsContact O-CG 3.28Å; K1354-K1358 WeakPolarHBondContact O-CG 3.4Å; K1354-K1358 PolarHBondContact O-N 3.09Å
1355E78.8Confident68.4Low69.2 Ų69.276.9 Ų76.932%0.32343%0.426SS..Hα-helixtrans-84.9-38.3176.3-72.8173.7-178.400110.8K1351 A1352 E1353 Q1357 K1358 L1359 P1441K1351-E1355 VanDerWaalsContact CE-CD 3.44Å; K1351-E1355 WeakPolarHBondContact CE-OE1 3.4Å; K1351-E1355 WeakPolarHBondContact CE-OE2 3.32Å; K1351-E1355 IonicContact NZ-OE1 3.41Å; K1351-E1355 IonicContact NZ-OE2 3.35Å; K1351-E1355 WeakPolarHBondContact O-CG 3.4Å; K1351-E1355 PolarHBondContact O-N 2.99Å; K1351-E1355 VanDerWaalsContact O-N 3.1Å; A1352-E1355 PolarHBondContact O-N 3.04Å; A1352-E1355 VanDerWaalsContact O-N 3.13Å; E1353-E1355 VanDerWaalsContact C-N 3.33Å; E1353-E1355 PolarHBondContact O-N 3.31Å; E1355-Q1357 PolarHBondContact O-N 2.79Å; E1355-K1358 PolarHBondContact O-N 3.14Å; E1355-L1359 PolarHBondContact O-N 3.11Å; E1355-L1359 VanDerWaalsContact O-N 3.13Å; E1355-P1441 HydrophobicContact CB-CB 4.3Å; E1355-P1441 HydrophobicContact CB-CG 4.12Å; E1355-P1441 VanDerWaalsContact OE2-CG 3.32Å; E1355-P1441 WeakPolarHBondContact OE2-CG 3.45Å
1356E70.2Confident65.6Low70.2 Ų70.282.5 Ų82.533%0.32847%0.466SS..Hα-helixtrans-58.4-45.8168.9-106.7176.5163.500111.9A1352 E1353 K1358 L1359 S1360 K1445A1352-E1356 WeakPolarHBondContact O-CB 3.49Å; A1352-E1356 PolarHBondContact O-N 3.14Å; E1353-E1356 PolarHBondContact O-N 3.25Å; E1356-K1358 VanDerWaalsContact C-N 3.32Å; E1356-K1358 PolarHBondContact O-N 3.11Å; E1356-L1359 WeakPolarHBondContact O-CB 3.33Å; E1356-L1359 PolarHBondContact O-N 3Å; E1356-L1359 VanDerWaalsContact O-N 3.13Å; E1356-S1360 PolarHBondContact O-N 3.31Å; E1356-S1360 VanDerWaalsContact O-N 3.11Å; E1356-S1360 PolarHBondContact O-OG 3.38Å; E1356-S1360 VanDerWaalsContact O-OG 3.11Å; E1356-K1445 IonicContact OE1-NZ 3.44Å; E1356-K1445 PolarHBondContact OE1-NZ 3.06Å; E1356-K1445 IonicContact OE2-NZ 3.47Å; E1356-K1445 PolarHBondContact OE2-NZ 3.14Å
1357Q67.8Low63Low127.6 Ų127.685.6 Ų85.660%0.59649%0.494SS*.Hα-helixtrans-64.5-33177.7-75.1176.77.500113.7E1353 E1355 L1359 S1360 T1361E1353-Q1357 WeakPolarHBondContact O-CB 3.33Å; E1353-Q1357 VanDerWaalsContact O-CG 3.26Å; E1353-Q1357 WeakPolarHBondContact O-CG 3.31Å; E1353-Q1357 PolarHBondContact O-N 3.01Å; E1355-Q1357 PolarHBondContact O-N 2.79Å; Q1357-L1359 VanDerWaalsContact C-N 3.3Å; Q1357-L1359 PolarHBondContact O-N 3.36Å; Q1357-S1360 WeakPolarHBondContact CA-OG 3.24Å; Q1357-S1360 PolarHBondContact O-N 3.12Å; Q1357-S1360 PolarHBondContact O-OG 3.22Å; Q1357-S1360 VanDerWaalsContact O-OG 3.14Å; Q1357-T1361 WeakPolarHBondContact O-CB 3.43Å; Q1357-T1361 WeakPolarHBondContact O-CG2 3.46Å; Q1357-T1361 PolarHBondContact O-N 3.24Å; Q1357-T1361 VanDerWaalsContact O-N 3.12Å; Q1357-T1361 PolarHBondContact O-OG1 3.08Å; Q1357-T1361 VanDerWaalsContact O-OG1 3.09Å
1358K67.1Low60.3Low137.4 Ų137.488.8 Ų88.860%0.59752%0.519SS*.Hα-helixtrans-68.8-38.1174.4-75.8170.9-176.21750111.7K1354 E1355 E1356 T1361 T1362K1354-K1358 VanDerWaalsContact O-CD 3.29Å; K1354-K1358 WeakPolarHBondContact O-CD 3.36Å; K1354-K1358 VanDerWaalsContact O-CE 3.27Å; K1354-K1358 WeakPolarHBondContact O-CE 3.5Å; K1354-K1358 VanDerWaalsContact O-CG 3.28Å; K1354-K1358 WeakPolarHBondContact O-CG 3.4Å; K1354-K1358 PolarHBondContact O-N 3.09Å; E1355-K1358 PolarHBondContact O-N 3.14Å; E1356-K1358 VanDerWaalsContact C-N 3.32Å; E1356-K1358 PolarHBondContact O-N 3.11Å; K1358-T1361 WeakPolarHBondContact CA-OG1 3.46Å; K1358-T1361 PolarHBondContact O-N 3.09Å; K1358-T1361 PolarHBondContact O-OG1 3.19Å; K1358-T1362 PolarHBondContact O-N 3.09Å; K1358-T1362 PolarHBondContact O-OG1 3.24Å
1359L57.6Low57.6Low140.8 Ų140.893.2 Ų93.274%0.73755%0.552SS**Hα-helixtrans-67.6-39.8179.4-15369.7000111.5E1355 E1356 Q1357 T1361 T1362 G1363E1355-L1359 PolarHBondContact O-N 3.11Å; E1355-L1359 VanDerWaalsContact O-N 3.13Å; E1356-L1359 WeakPolarHBondContact O-CB 3.33Å; E1356-L1359 PolarHBondContact O-N 3Å; E1356-L1359 VanDerWaalsContact O-N 3.13Å; Q1357-L1359 VanDerWaalsContact C-N 3.3Å; Q1357-L1359 PolarHBondContact O-N 3.36Å; L1359-T1361 VanDerWaalsContact C-N 3.34Å; L1359-T1361 PolarHBondContact O-N 3.46Å; L1359-T1362 PolarHBondContact O-N 3.15Å; L1359-T1362 PolarHBondContact O-OG1 3.3Å; L1359-T1362 VanDerWaalsContact O-OG1 3.09Å; L1359-G1363 PolarHBondContact O-N 3.12Å
1360S54.4Low54.9Low84.8 Ų84.8100.6 Ų100.659%0.59359%0.589SS**Hα-helixtrans-70.3-31.6177.762.10000113.9E1356 Q1357 T1362 G1363E1356-S1360 PolarHBondContact O-N 3.31Å; E1356-S1360 VanDerWaalsContact O-N 3.11Å; E1356-S1360 PolarHBondContact O-OG 3.38Å; E1356-S1360 VanDerWaalsContact O-OG 3.11Å; Q1357-S1360 WeakPolarHBondContact CA-OG 3.24Å; Q1357-S1360 PolarHBondContact O-N 3.12Å; Q1357-S1360 PolarHBondContact O-OG 3.22Å; Q1357-S1360 VanDerWaalsContact O-OG 3.14Å; S1360-T1362 VanDerWaalsContact C-N 3.32Å; S1360-T1362 PolarHBondContact O-N 3.03Å; S1360-G1363 PolarHBondContact O-N 3.21Å
1361T53.7Low52.2Low103 Ų103104 Ų10463%0.63262%0.615SS**Hα-helixtrans-80.7-13-179.945.60000114.5Q1357 K1358 L1359 G1363Q1357-T1361 WeakPolarHBondContact O-CB 3.43Å; Q1357-T1361 WeakPolarHBondContact O-CG2 3.46Å; Q1357-T1361 PolarHBondContact O-N 3.24Å; Q1357-T1361 VanDerWaalsContact O-N 3.12Å; Q1357-T1361 PolarHBondContact O-OG1 3.08Å; Q1357-T1361 VanDerWaalsContact O-OG1 3.09Å; K1358-T1361 WeakPolarHBondContact CA-OG1 3.46Å; K1358-T1361 PolarHBondContact O-N 3.09Å; K1358-T1361 PolarHBondContact O-OG1 3.19Å; L1359-T1361 VanDerWaalsContact C-N 3.34Å; L1359-T1361 PolarHBondContact O-N 3.46Å; T1361-G1363 PolarHBondContact O-N 3.41Å
1362T45.9Very low49.4Very low112.6 Ų112.6104.5 Ų104.569%0.69163%0.628SS**THydrogen-bonded Turntrans-90.9-4.6177.528.30000114.3K1358 L1359 S1360 S1364K1358-T1362 PolarHBondContact O-N 3.09Å; K1358-T1362 PolarHBondContact O-OG1 3.24Å; L1359-T1362 PolarHBondContact O-N 3.15Å; L1359-T1362 PolarHBondContact O-OG1 3.3Å; L1359-T1362 VanDerWaalsContact O-OG1 3.09Å; S1360-T1362 VanDerWaalsContact C-N 3.32Å; S1360-T1362 PolarHBondContact O-N 3.03Å; T1362-S1364 VanDerWaalsContact C-N 3.34Å; T1362-S1364 PolarHBondContact O-N 3.12Å
1363G37.7Very low46.9Very low72.6 Ų72.6111.8 Ų111.875%0.74867%0.666SS**SBendtrans-83.4-4.9-176.300000117L1359 S1360 T1361L1359-G1363 PolarHBondContact O-N 3.12Å; S1360-G1363 PolarHBondContact O-N 3.21Å; T1361-G1363 PolarHBondContact O-N 3.41Å
1364S31.5Very low44.4Very low95 Ų95114.4 Ų114.466%0.66469%0.687SS**  trans-132.282.1-166.552.20000114.7T1362T1362-S1364 VanDerWaalsContact C-N 3.34Å; T1362-S1364 PolarHBondContact O-N 3.12Å
1365S30.1Very low41.8Very low115.8 Ų115.8114.8 Ų114.881%0.8170%0.7SS**  trans-134.6102165.812.90000113.9S1367S1365-S1367 PolarHBondContact O-N 3.27Å
1366S28.9Very low39.4Very low118.4 Ų118.4120 Ų12083%0.82873%0.726SS**  trans-130.8102.2164.956.20000114.3
1367S29.9Very low37.3Very low109.4 Ų109.4121.2 Ų121.277%0.76575%0.747SS**  trans165128.3155.261.30000114.8S1365 S1369S1365-S1367 PolarHBondContact O-N 3.27Å; S1367-S1369 PolarHBondContact O-N 3.19Å; S1367-S1369 VanDerWaalsContact O-N 3.17Å
1368T28.2Very low35.3Very low140.4 Ų140.4119 Ų11986%0.86176%0.759SS**  trans-72.3125.6173.110.50000113.7I1370T1368-I1370 HydrophobicContact CG2-CG1 4.12Å
1369S29.2Very low33.4Very low114 Ų114115.9 Ų115.980%0.79777%0.767SS**  trans-151.7123155.750.10000113.1S1367 S1371S1367-S1369 PolarHBondContact O-N 3.19Å; S1367-S1369 VanDerWaalsContact O-N 3.17Å; S1369-S1371 PolarHBondContact O-N 3.23Å
1370I27.6Very low32.1Very low159 Ų159116 Ų11682%0.81577%0.773SS**  trans-66.3130.5172.9-64.1160000110.1T1368 T1372T1368-I1370 HydrophobicContact CG2-CG1 4.12Å; I1370-T1372 HydrophobicContact CG2-CG2 4.02Å
1371S28Very low30.7Very low116.6 Ų116.6118.3 Ų118.382%0.81578%0.783SS**  trans-138.7132.6157.9-73.20000111.2S1369S1369-S1371 PolarHBondContact O-N 3.23Å
1372T26.1Very low29.6Very low120 Ų120119.6 Ų119.674%0.73679%0.791SS**  trans-97.3133.9178.448.20000112I1370I1370-T1372 HydrophobicContact CG2-CG2 4.02Å
1373N29.1Very low28.8Very low152.6 Ų152.6120 Ų12082%0.81680%0.799SS**  trans-167.3126144.8-84-24.5000111.7
1374T27.8Very low28.3Very low122.2 Ų122.2119.8 Ų119.875%0.7580%0.797SS**  91119116.7-49.10000112.6
1375V28.1Very low28.2Very low129.6 Ų129.6121.9 Ų121.979%0.78581%0.806SS**  trans-163.2133150.2160.30000110.9
1376M28Very low28.1Very low178.6 Ų178.6120.8 Ų120.888%0.8880%0.803SS**  trans-111.3140.9152.7-81.4-70.2-138.100114.6
1377A26.9Very low28.1Very low94 Ų94122.4 Ų122.478%0.77780%0.802SS**  trans-136.1137.3-177.600000109.4G1379A1377-G1379 VanDerWaalsContact C-N 3.31Å; A1377-G1379 PolarHBondContact O-N 3.44Å
1378G26.7Very low28.2Very low82 Ų82124.4 Ų124.485%0.84580%0.803SS**  trans148.6117.1160.800000112V1380G1378-V1380 PolarHBondContact O-N 2.91Å
1379G26.4Very low28.2Very low73.4 Ų73.4125.4 Ų125.476%0.75780%0.799SS**  cis149.285.8-16.400000113.5A1377 T1381A1377-G1379 VanDerWaalsContact C-N 3.31Å; A1377-G1379 PolarHBondContact O-N 3.44Å; G1379-T1381 PolarHBondContact O-N 3.29Å; G1379-T1381 VanDerWaalsContact O-N 3.16Å
1380V29.3Very low28.2Very low141.8 Ų141.8124.3 Ų124.386%0.85979%0.792SS**  trans-109.4124.3163.6-177.80000110.6G1378 T1382G1378-V1380 PolarHBondContact O-N 2.91Å; V1380-T1382 HydrophobicContact CG1-CG2 3.99Å
1381T26.4Very low28.3Very low132.8 Ų132.8122.6 Ų122.682%0.81579%0.789SS**  trans-106.3127.2-178.549.10000112.3G1379G1379-T1381 PolarHBondContact O-N 3.29Å; G1379-T1381 VanDerWaalsContact O-N 3.16Å
1382T30.6Very low28.4Very low131 Ų131122.8 Ų122.880%0.80479%0.786SS**  trans-133119.1159.236.80000107.9V1380 G1384 F1571V1380-T1382 HydrophobicContact CG1-CG2 3.99Å; T1382-G1384 PolarHBondContact O-N 3.26Å; T1382-F1571 HydrophobicContact CG2-CZ 4.46Å
1383S27.5Very low28.7Very low120.8 Ų120.8123 Ų12385%0.84579%0.787SS**  trans-49123.2133.3-174.40000112
1384G29.1Very low28.7Very low69 Ų69122.4 Ų122.471%0.71179%0.789SS**  trans-167.198.1-174.500000112.1T1382 A1386T1382-G1384 PolarHBondContact O-N 3.26Å; G1384-A1386 PolarHBondContact O-N 3.28Å
1385V28.5Very low28.8Very low139.4 Ų139.4120 Ų12085%0.84579%0.788SS**  trans-91.7125.2175.7-137.70000112N1387V1385-N1387 HydrophobicContact CG1-CB 4.16Å
1386A28.4Very low29Very low91 Ų91119.9 Ų119.975%0.75279%0.79SS**  trans-137.1137.9148.300000111G1384 I1388G1384-A1386 PolarHBondContact O-N 3.28Å; A1386-I1388 HydrophobicContact CB-CD1 4.02Å; A1386-I1388 HydrophobicContact CB-CG1 4.46Å; A1386-I1388 PolarHBondContact O-N 3.49Å
1387N29.2Very low29Very low152 Ų152119.7 Ų119.781%0.81379%0.792SS**  trans-141.7131.3167.8-105.9-16.6000111V1385 M1389V1385-N1387 HydrophobicContact CG1-CB 4.16Å; N1387-M1389 PolarHBondContact O-N 3.04Å
1388I30.1Very low29Very low151.6 Ų151.6118.8 Ų118.878%0.77779%0.792SS**  trans9.6108.8148.3-67.5166.4000110.6A1386 S1390A1386-I1388 HydrophobicContact CB-CD1 4.02Å; A1386-I1388 HydrophobicContact CB-CG1 4.46Å; A1386-I1388 PolarHBondContact O-N 3.49Å; I1388-S1390 PolarHBondContact O-N 2.96Å
1389M29Very low29Very low161 Ų161123 Ų12379%0.79379%0.793SS**  trans-119.6129.7145.1-117.2155.258.100112.1N1387 T1391 L1578N1387-M1389 PolarHBondContact O-N 3.04Å; M1389-T1391 PolarHBondContact O-N 3.19Å; M1389-L1578 HydrophobicContact CE-CD1 3.46Å; M1389-L1578 VanDerWaalsContact CE-CD1 3.46Å; M1389-L1578 HydrophobicContact CE-CD2 3.84Å; M1389-L1578 HydrophobicContact CE-CG 4.3Å; M1389-L1578 HydrophobicContact SD-CD2 4.17Å
1390S30.3Very low29Very low92.8 Ų92.8125.3 Ų125.365%0.64980%0.798SS**  cis-140.9137.9-1846.30000110.8I1388 T1392I1388-S1390 PolarHBondContact O-N 2.96Å; S1390-T1392 PolarHBondContact O-N 3.31Å; S1390-T1392 VanDerWaalsContact O-N 3.15Å
1391T28.9Very low28.9Very low121.8 Ų121.8123.8 Ų123.875%0.74779%0.793SS**  trans15.7123.5162.253.60000116.3M1389 T1393M1389-T1391 PolarHBondContact O-N 3.19Å; T1391-T1393 PolarHBondContact O-N 3.41Å
1392T30Very low28.9Very low120.8 Ų120.8125.4 Ų125.474%0.74180%0.796SS**  -152.8143.553.418.50000109.2S1390 T1394S1390-T1392 PolarHBondContact O-N 3.31Å; S1390-T1392 VanDerWaalsContact O-N 3.15Å; T1392-T1394 PolarHBondContact O-N 2.96Å; T1392-T1394 VanDerWaalsContact O-N 3.08Å
1393T31.5Very low28.8Very low125.8 Ų125.8127 Ų12777%0.77280%0.798SS**  trans160.8139.2134.345.30000113.6T1391T1391-T1393 PolarHBondContact O-N 3.41Å
1394T30.8Very low28.7Very low140 Ų140124.2 Ų124.286%0.85979%0.788SS**  trans-82.5124.4155.951.80000115T1392T1392-T1394 PolarHBondContact O-N 2.96Å; T1392-T1394 VanDerWaalsContact O-N 3.08Å
1395G29.1Very low28.6Very low70.2 Ų70.2129.4 Ų129.472%0.72480%0.799SS**  trans-179.2106.6165.800000114.2L1397G1395-L1397 PolarHBondContact O-N 3.1Å
1396P31.6Very low28.6Very low127.2 Ų127.2129.6 Ų129.683%0.82680%0.801SS**  trans-89.7122.8-172.533.9-32.3000113.4
1397L27.9Very low28.5Very low175.2 Ų175.2129 Ų12992%0.91780%0.803SS**  trans-101.2117.3154.1-74.2172.5000110.7G1395G1395-L1397 PolarHBondContact O-N 3.1Å
1398G27.1Very low28.4Very low75.4 Ų75.4127.4 Ų127.478%0.77780%0.804SS**  trans-100.1135-176.900000112.6S1400G1398-S1400 PolarHBondContact O-N 3.16Å
1399I27.9Very low28.3Very low169.4 Ų169.4129.6 Ų129.687%0.86981%0.808SS**  trans-112.1103.2168.85.7169.5000109.1
1400S26.1Very low28.3Very low122.8 Ų122.8129.8 Ų129.886%0.85981%0.811SS**  trans-137.6101168.2-78.20000111.2G1398G1398-S1400 PolarHBondContact O-N 3.16Å
1401S27Very low28.1Very low109.6 Ų109.6129.4 Ų129.477%0.76681%0.813SS**  trans155.4124.2139.4164.40000111.1
1402L25.9Very low28.2Very low166.4 Ų166.4128.8 Ų128.887%0.87181%0.814SS**  trans-162.5106.5154.8-105.9134.8000110
1403I27.9Very low28.1Very low164 Ų164131.5 Ų131.584%0.84182%0.818SS**  trans-161.4127.9155.8-58.2168000110.1
1404G26Very low27.9Very low62.8 Ų62.8133.9 Ų133.965%0.64782%0.822SS**  trans132.1108.1158.700000113.3
1405L27.5Very low27.8Very low178.2 Ų178.2132.9 Ų132.993%0.93382%0.816SS**  trans-132.185.9143.3-79.5170.4000111.4G1407L1405-G1407 PolarHBondContact O-N 3.39Å
1406T27.5Very low27.7Very low143 Ų143136.9 Ų136.988%0.87782%0.82SS**  trans-135.1123.6151.843.60000109.2S1408T1406-S1408 PolarHBondContact O-N 3.16Å
1407G27.6Very low27.7Very low78.2 Ų78.2138.5 Ų138.581%0.80682%0.816SS**  trans112.3105.1158.900000114.4L1405 K1409L1405-G1407 PolarHBondContact O-N 3.39Å; G1407-K1409 PolarHBondContact O-N 3.31Å
1408S27.5Very low27.7Very low118.4 Ų118.4136.4 Ų136.483%0.82881%0.806SS**  trans-91.9133146.4-136.90000111.4T1406 I1410T1406-S1408 PolarHBondContact O-N 3.16Å; S1408-I1410 PolarHBondContact O-N 3.47Å
1409K26.7Very low27.9Very low198.4 Ų198.4138.6 Ų138.686%0.86381%0.806SS**  trans-126.7116.5164.3-112.4178-178.6-179.20111.3G1407 A1411G1407-K1409 PolarHBondContact O-N 3.31Å; K1409-A1411 PolarHBondContact O-N 3.26Å
1410I29Very low27.9Very low166.2 Ų166.2135.6 Ų135.685%0.85280%0.8SS**  trans-141.8129.4164-59.7167.2000109.3S1408 S1412S1408-I1410 PolarHBondContact O-N 3.47Å; I1410-S1412 PolarHBondContact O-N 3.17Å
1411A27.7Very low28.2Very low84.6 Ų84.6135.6 Ų135.670%0.69980%0.795SS**  trans-130.8144.3-15400000109.9K1409K1409-A1411 PolarHBondContact O-N 3.26Å
1412S29.4Very low28.3Very low109 Ų109140.1 Ų140.176%0.76280%0.801SS**  trans67.1121.8149.944.10000115.8I1410I1410-S1412 PolarHBondContact O-N 3.17Å
1413Q28.2Very low28.5Very low176.8 Ų176.8134.9 Ų134.983%0.82679%0.788SS**  168.5130.1111.5-135177.67.700112.5T1415Q1413-T1415 PolarHBondContact O-N 3.23Å
1414M28.2Very low28.5Very low175.4 Ų175.4135.4 Ų135.486%0.86479%0.787SS**  trans-154.6140.7137.7-98.9177.8170.600112.4
1415T28Very low28.7Very low119 Ų119139.8 Ų139.873%0.7380%0.795SS**  trans-76.3145166-4.90000113.7Q1413 Q1417Q1413-T1415 PolarHBondContact O-N 3.23Å; T1415-Q1417 PolarHBondContact O-N 2.73Å
1416I27.8Very low28.9Very low155.2 Ų155.2137.5 Ų137.580%0.79678%0.782SS**  trans68.6117.5154.3-58172000114
1417Q29.9Very low29.1Very low160.4 Ų160.4136.6 Ų136.675%0.7577%0.768SS**  trans-167.5144.7140.4-104.8176-5800112T1415T1415-Q1417 PolarHBondContact O-N 2.73Å
1418D27.8Very low29.3Very low131.4 Ų131.4139.9 Ų139.970%0.70377%0.767SS**  trans46.8148.6156.6-70.1-30000118.6S1420D1418-S1420 VanDerWaalsContact C-N 3.29Å; D1418-S1420 PolarHBondContact O-N 3.4Å; D1418-S1420 VanDerWaalsContact O-N 3.11Å
1419P32.6Very low29.5Very low120.4 Ų120.4139.5 Ų139.578%0.78276%0.759SS**  trans-102.5124-165.236.3-31000115.3T1421P1419-T1421 VanDerWaalsContact C-N 3.31Å; P1419-T1421 PolarHBondContact O-N 3.05Å
1420S27.3Very low29.7Very low107.8 Ų107.8136.9 Ų136.975%0.75475%0.748SS**  trans-151.8108159.269.30000114.2D1418 K1422D1418-S1420 VanDerWaalsContact C-N 3.29Å; D1418-S1420 PolarHBondContact O-N 3.4Å; D1418-S1420 VanDerWaalsContact O-N 3.11Å; S1420-K1422 PolarHBondContact O-N 3.16Å
1421T32.8Very low30Very low121.6 Ų121.6133.8 Ų133.875%0.74674%0.737SS**  trans170115.5157.5-37.40000113.9P1419 G1423P1419-T1421 VanDerWaalsContact C-N 3.31Å; P1419-T1421 PolarHBondContact O-N 3.05Å; T1421-G1423 VanDerWaalsContact C-N 3.33Å; T1421-G1423 PolarHBondContact O-N 3.39Å
1422K28.4Very low30.4Very low204.2 Ų204.2134 Ų13489%0.88873%0.726SS**SBendtrans-34.9107.8173.2-74.9175.2-179.9178.80113S1420 I1426S1420-K1422 PolarHBondContact O-N 3.16Å; K1422-I1426 WeakPolarHBondContact O-CG1 3.35Å
1423G29.9Very low30.8Very low58.2 Ų58.2134.2 Ų134.260%0.672%0.722SS**  trans174.914.3177.800000116.2T1421 L1425 I1426T1421-G1423 VanDerWaalsContact C-N 3.33Å; T1421-G1423 PolarHBondContact O-N 3.39Å; G1423-L1425 PolarHBondContact O-N 3.11Å; G1423-L1425 VanDerWaalsContact O-N 3.15Å; G1423-I1426 PolarHBondContact O-N 2.9Å
1424Q29.4Very low31.3Very low173.8 Ų173.8129.3 Ų129.381%0.81271%0.708SS**  trans-92.424.4176.2-106.7179.4-14.400114.4I1426 Q1427 N1428Q1424-I1426 VanDerWaalsContact C-N 3.25Å; Q1424-I1426 PolarHBondContact O-N 3.21Å; Q1424-Q1427 PolarHBondContact O-N 3.31Å; Q1424-N1428 PolarHBondContact O-N 2.96Å
1425L29.5Very low32.3Very low155.8 Ų155.8127.9 Ų127.982%0.81669%0.693SS**SBendtrans-110.154.6169.7-149.874.2000111.6G1423 T1429G1423-L1425 PolarHBondContact O-N 3.11Å; G1423-L1425 VanDerWaalsContact O-N 3.15Å; L1425-T1429 WeakPolarHBondContact O-CG2 3.45Å; L1425-T1429 PolarHBondContact O-OG1 3.25Å
1426I31.9Very low33.7Very low129.4 Ų129.4127.8 Ų127.866%0.66469%0.688SS**SBendtrans-132.333.5-177.6-42.1174.5000113K1422 G1423 Q1424 T1429 K1430K1422-I1426 WeakPolarHBondContact O-CG1 3.35Å; G1423-I1426 PolarHBondContact O-N 2.9Å; Q1424-I1426 VanDerWaalsContact C-N 3.25Å; Q1424-I1426 PolarHBondContact O-N 3.21Å; I1426-T1429 PolarHBondContact O-OG1 3.33Å; I1426-K1430 HydrophobicContact CG2-CD 4.19Å; I1426-K1430 PolarHBondContact O-N 2.96Å
1427Q31.9Very low35.5Very low124.2 Ų124.2122.7 Ų122.758%0.5867%0.666SS**  trans-121.12.6169.5-77.6-162.49.800115N782 Q1424 T1429 K1430 R1435N782-Q1427 PolarHBondContact ND2-NE2 2.76Å; N782-Q1427 PolarHBondContact ND2-OE1 2.98Å; N782-Q1427 PolarHBondContact OD1-NE2 3.09Å; N782-Q1427 PolarHBondContact OD1-OE1 3.43Å; Q1424-Q1427 PolarHBondContact O-N 3.31Å; Q1427-T1429 VanDerWaalsContact C-N 3.26Å; Q1427-T1429 PolarHBondContact O-N 3Å; Q1427-T1429 VanDerWaalsContact O-N 3.12Å; Q1427-K1430 PolarHBondContact O-N 3.24Å; Q1427-K1430 VanDerWaalsContact O-N 3.11Å; Q1427-K1430 VanDerWaalsContact OE1-NZ 3.12Å; Q1427-R1435 PolarHBondContact O-NH2 2.91Å; Q1427-R1435 VanDerWaalsContact O-NH2 3.13Å
1428N30.4Very low37.7Very low147.4 Ų147.4120.5 Ų120.579%0.78866%0.664SS**  trans-85.213.9-179.5-74.2-4.2000114.1Q1424 K1430Q1424-N1428 PolarHBondContact O-N 2.96Å; N1428-K1430 PolarHBondContact O-N 3.24Å
1429T32.3Very low40Very low109.8 Ų109.8114.8 Ų114.867%0.67463%0.634SS**  trans-96.711.6177.147.30000113.4L1425 I1426 Q1427 T1431 R1435L1425-T1429 WeakPolarHBondContact O-CG2 3.45Å; L1425-T1429 PolarHBondContact O-OG1 3.25Å; I1426-T1429 PolarHBondContact O-OG1 3.33Å; Q1427-T1429 VanDerWaalsContact C-N 3.26Å; Q1427-T1429 PolarHBondContact O-N 3Å; Q1427-T1429 VanDerWaalsContact O-N 3.12Å; T1429-T1431 PolarHBondContact O-N 3.13Å; T1429-R1435 VanDerWaalsContact C-NH2 3.26Å; T1429-R1435 PolarHBondContact O-NE 3.35Å; T1429-R1435 PolarHBondContact O-NH1 3Å; T1429-R1435 PolarHBondContact O-NH2 3.07Å
1430K31.6Very low42.3Very low145.2 Ų145.2112 Ų11263%0.63162%0.615SS**SBendtrans-99.682.7176.7-70.7179.6179.2173.80112.1A819 I1426 Q1427 N1428A819-K1430 HydrophobicContact CB-CB 4.47Å; I1426-K1430 HydrophobicContact CG2-CD 4.19Å; I1426-K1430 PolarHBondContact O-N 2.96Å; Q1427-K1430 PolarHBondContact O-N 3.24Å; Q1427-K1430 VanDerWaalsContact O-N 3.11Å; Q1427-K1430 VanDerWaalsContact OE1-NZ 3.12Å; N1428-K1430 PolarHBondContact O-N 3.24Å
1431T34.1Very low44.9Very low100 Ų100108.7 Ų108.761%0.61359%0.591SS**  trans-21.39717047.40000114.4T1429 T1433 S1434T1429-T1431 PolarHBondContact O-N 3.13Å; T1431-T1433 VanDerWaalsContact C-N 3.27Å; T1431-T1433 PolarHBondContact O-N 3.11Å; T1431-T1433 VanDerWaalsContact O-N 3.11Å; T1431-S1434 PolarHBondContact O-N 2.74Å; T1431-S1434 PolarHBondContact O-OG 3.23Å
1432L36.7Very low47.2Very low89.8 Ų89.8110.4 Ų110.447%0.4758%0.584SS.*G310 helixtrans-54.3-4.8171.2-125.680.2000115.6L811 T812 A815 L1083 W1086 S1434 R1435L811-L1432 HydrophobicContact CB-CD2 4.01Å; T812-L1432 HydrophobicContact CG2-CB 3.98Å; T812-L1432 HydrophobicContact CG2-CD2 3.89Å; T812-L1432 HydrophobicContact CG2-CG 4.5Å; A815-L1432 HydrophobicContact CB-CB 3.93Å; A815-L1432 HydrophobicContact CB-CD1 3.21Å; A815-L1432 HydrophobicContact CB-CD2 4.45Å; A815-L1432 HydrophobicContact CB-CG 4.14Å; L1083-L1432 HydrophobicContact CB-CD2 3.97Å; L1083-L1432 HydrophobicContact CD1-CD2 3.7Å; L1083-L1432 HydrophobicContact CD2-CD2 3.35Å; L1083-L1432 HydrophobicContact CD2-CG 3.75Å; L1083-L1432 HydrophobicContact CG-CD2 3.82Å; W1086-L1432 HydrophobicContact CE3-CD1 3.4Å; W1086-L1432 VanDerWaalsContact CE3-CD1 3.4Å; W1086-L1432 HydrophobicContact CE3-CG 4.14Å; W1086-L1432 HydrophobicContact CZ3-CB 4.42Å; W1086-L1432 HydrophobicContact CZ3-CD1 3.76Å; W1086-L1432 HydrophobicContact CZ3-CG 4.31Å; L1432-S1434 VanDerWaalsContact C-N 3.27Å; L1432-S1434 PolarHBondContact O-N 3.13Å; L1432-S1434 VanDerWaalsContact O-N 3.09Å; L1432-R1435 PolarHBondContact O-N 3.26Å; L1432-R1435 VanDerWaalsContact O-N 3.08Å
1433T37.6Very low49.8Very low111.4 Ų111.4101.2 Ų101.268%0.68355%0.546SS*.SBendtrans-83.28.2-179.549.50000115T1431 R1435T1431-T1433 VanDerWaalsContact C-N 3.27Å; T1431-T1433 PolarHBondContact O-N 3.11Å; T1431-T1433 VanDerWaalsContact O-N 3.11Å; T1433-R1435 PolarHBondContact O-N 3.08Å; T1433-R1435 VanDerWaalsContact O-N 3.09Å
1434S38.6Very low52.3Low75.2 Ų75.299.1 Ų99.153%0.52652%0.521SS..  trans-126.140.1-176690000115.1T1431 L1432 N1436T1431-S1434 PolarHBondContact O-N 2.74Å; T1431-S1434 PolarHBondContact O-OG 3.23Å; L1432-S1434 VanDerWaalsContact C-N 3.27Å; L1432-S1434 PolarHBondContact O-N 3.13Å; L1432-S1434 VanDerWaalsContact O-N 3.09Å; S1434-N1436 PolarHBondContact O-N 3.15Å
1435R50.1Low54.9Low145.6 Ų145.692.7 Ų92.755%0.54949%0.49SS..  trans-85.843174.9-97.4-179.5169.1150.3-5.1112.9W1086 Q1427 T1429 L1432 T1433W1086-R1435 VanDerWaalsContact CH2-CZ 3.46Å; W1086-R1435 VanDerWaalsContact CZ3-NH1 3.28Å; Q1427-R1435 PolarHBondContact O-NH2 2.91Å; Q1427-R1435 VanDerWaalsContact O-NH2 3.13Å; T1429-R1435 VanDerWaalsContact C-NH2 3.26Å; T1429-R1435 PolarHBondContact O-NE 3.35Å; T1429-R1435 PolarHBondContact O-NH1 3Å; T1429-R1435 PolarHBondContact O-NH2 3.07Å; L1432-R1435 PolarHBondContact O-N 3.26Å; L1432-R1435 VanDerWaalsContact O-N 3.08Å; T1433-R1435 PolarHBondContact O-N 3.08Å; T1433-R1435 VanDerWaalsContact O-N 3.09Å
1436N56.6Low57.6Low117 Ų11786.5 Ų86.563%0.62646%0.458SS*.  trans-90.5105.3178.1-67.6-3.1000111S1434 T1438S1434-N1436 PolarHBondContact O-N 3.15Å; N1436-T1438 PolarHBondContact O-N 3.18Å; N1436-T1438 VanDerWaalsContact O-N 3.09Å
1437C66.8Low60.2Low49 Ų4980.5 Ų80.533%0.33143%0.427SS..  trans-85122.9173.3175.80000109.8S1254 P1256 Q1444S1254-C1437 CarbonylContact O-C 3.32Å; S1254-C1437 WeakPolarHBondContact O-CA 3.3Å; S1254-C1437 PolarHBondContact O-SG 3.01Å; S1254-C1437 VanDerWaalsContact O-SG 3.34Å; P1256-C1437 VanDerWaalsContact CD-SG 3.52Å; P1256-C1437 WeakPolarHBondContact CD-SG 3.37Å; P1256-C1437 HydrophobicContact CG-CB 4.34Å; C1437-Q1444 PolarHBondContact SG-NE2 3.23Å; C1437-Q1444 VanDerWaalsContact SG-NE2 3.39Å
1438T74.3Confident62.9Low114 Ų11474.6 Ų74.670%0.69940%0.4SS*.  trans-102.5-19.1179.752.60000112.7S1254 N1436 T1440S1254-T1438 WeakPolarHBondContact CA-OG1 3.4Å; S1254-T1438 VanDerWaalsContact CB-OG1 3.29Å; S1254-T1438 WeakPolarHBondContact CB-OG1 3.33Å; S1254-T1438 PolarHBondContact O-N 2.95Å; S1254-T1438 VanDerWaalsContact O-N 3.13Å; N1436-T1438 PolarHBondContact O-N 3.18Å; N1436-T1438 VanDerWaalsContact O-N 3.09Å; T1438-T1440 PolarHBondContact O-N 3.16Å
1439A76.3Confident65.5Low10.2 Ų10.268.6 Ų68.68%0.08437%0.366CS..SBendtrans-58.9134.9176.300000111.5D1221 S1254 I1255 A1443 Q1444D1221-A1439 WeakPolarHBondContact OD2-CA 3.47Å; S1254-A1439 VanDerWaalsContact O-CB 3.29Å; S1254-A1439 WeakPolarHBondContact O-CB 3.3Å; S1254-A1439 PolarHBondContact O-N 3.12Å; I1255-A1439 HydrophobicContact CG1-CB 4.4Å; A1439-A1443 HydrophobicContact CB-CB 4.26Å; A1439-Q1444 HydrophobicContact CB-CG 4.07Å; A1439-Q1444 PolarHBondContact O-NE2 3.17Å
1440T82.3Confident68.1Low61.8 Ų61.864.5 Ų64.538%0.37934%0.338SS..  trans-61.6156.6176.366.60000111.1D1221 T1438 R1442 A1443 Q1444D1221-T1440 WeakPolarHBondContact OD1-CB 3.3Å; D1221-T1440 WeakPolarHBondContact OD1-CG2 3.15Å; D1221-T1440 PolarHBondContact OD1-OG1 3.06Å; D1221-T1440 VanDerWaalsContact OD2-CB 3.27Å; D1221-T1440 WeakPolarHBondContact OD2-CB 3.43Å; D1221-T1440 WeakPolarHBondContact OD2-CG2 3.34Å; D1221-T1440 PolarHBondContact OD2-N 3.07Å; D1221-T1440 VanDerWaalsContact OD2-N 3.09Å; D1221-T1440 PolarHBondContact OD2-OG1 3.13Å; T1438-T1440 PolarHBondContact O-N 3.16Å; T1440-R1442 PolarHBondContact O-N 3.19Å; T1440-R1442 VanDerWaalsContact O-N 3.14Å; T1440-R1442 PolarHBondContact OG1-N 3.09Å; T1440-A1443 PolarHBondContact O-N 3.22Å; T1440-A1443 VanDerWaalsContact O-N 3.1Å; T1440-A1443 WeakPolarHBondContact OG1-CB 3.38Å; T1440-A1443 PolarHBondContact OG1-N 2.92Å; T1440-A1443 VanDerWaalsContact OG1-N 3.12Å; T1440-Q1444 WeakPolarHBondContact O-CG 3.43Å; T1440-Q1444 PolarHBondContact O-N 3.16Å
1441P80.8Confident70.8Confident40 Ų4057.6 Ų57.626%0.2631%0.308SS..Hα-helixtrans-55.8-32175.1-26.135.4000113A1352 E1355 Q1444 K1445A1352-P1441 HydrophobicContact CB-CB 4.07Å; A1352-P1441 VanDerWaalsContact CB-O 3.28Å; A1352-P1441 WeakPolarHBondContact CB-O 3.34Å; E1355-P1441 HydrophobicContact CB-CB 4.3Å; E1355-P1441 HydrophobicContact CB-CG 4.12Å; E1355-P1441 VanDerWaalsContact OE2-CG 3.32Å; E1355-P1441 WeakPolarHBondContact OE2-CG 3.45Å; P1441-Q1444 PolarHBondContact O-N 3Å; P1441-K1445 VanDerWaalsContact O-CB 3.3Å; P1441-K1445 WeakPolarHBondContact O-CB 3.34Å; P1441-K1445 PolarHBondContact O-N 3.09Å; P1441-K1445 VanDerWaalsContact O-N 3.12Å
1442R81.6Confident73.4Confident155.6 Ų155.652.9 Ų52.959%0.58728%0.279SS*.Hα-helixtrans-69.1-45.4175.1-168.5177.1-175.8-173.8-0.6112T1440 Q1444 K1445 N1446T1440-R1442 PolarHBondContact O-N 3.19Å; T1440-R1442 VanDerWaalsContact O-N 3.14Å; T1440-R1442 PolarHBondContact OG1-N 3.09Å; R1442-Q1444 VanDerWaalsContact C-N 3.34Å; R1442-Q1444 PolarHBondContact O-N 3.2Å; R1442-K1445 WeakPolarHBondContact O-CB 3.38Å; R1442-K1445 PolarHBondContact O-N 3.26Å; R1442-N1446 WeakPolarHBondContact O-CB 3.36Å; R1442-N1446 PolarHBondContact O-N 3.18Å; R1442-N1446 PolarHBondContact O-OD1 3.03Å
1443A82.6Confident75.8Confident12.2 Ų12.250 Ų5010%0.10126%0.263CS..Hα-helixtrans-61.3-41.9173.800000112D1221 A1439 T1440 K1445 N1446 F1447D1221-A1443 HydrophobicContact CB-CB 4.38Å; D1221-A1443 WeakPolarHBondContact OD2-CB 3.19Å; A1439-A1443 HydrophobicContact CB-CB 4.26Å; T1440-A1443 PolarHBondContact O-N 3.22Å; T1440-A1443 VanDerWaalsContact O-N 3.1Å; T1440-A1443 WeakPolarHBondContact OG1-CB 3.38Å; T1440-A1443 PolarHBondContact OG1-N 2.92Å; T1440-A1443 VanDerWaalsContact OG1-N 3.12Å; A1443-K1445 VanDerWaalsContact C-N 3.31Å; A1443-K1445 PolarHBondContact O-N 3.04Å; A1443-N1446 PolarHBondContact O-N 3.16Å; A1443-F1447 VanDerWaalsContact O-CB 3.27Å; A1443-F1447 WeakPolarHBondContact O-CB 3.38Å; A1443-F1447 PolarHBondContact O-N 3.18Å
1444Q82.7Confident78.1Confident14 Ų1445.9 Ų45.97%0.06524%0.24CC..Hα-helixtrans-59.4-44.7174.8-67.3173.544.300112.1P1256 I1348 C1437 A1439 T1440 P1441 R1442 F1447 V1448P1256-Q1444 HydrophobicContact CG-CG 4.02Å; I1348-Q1444 HydrophobicContact CG2-CB 4.2Å; C1437-Q1444 PolarHBondContact SG-NE2 3.23Å; C1437-Q1444 VanDerWaalsContact SG-NE2 3.39Å; A1439-Q1444 HydrophobicContact CB-CG 4.07Å; A1439-Q1444 PolarHBondContact O-NE2 3.17Å; T1440-Q1444 WeakPolarHBondContact O-CG 3.43Å; T1440-Q1444 PolarHBondContact O-N 3.16Å; P1441-Q1444 PolarHBondContact O-N 3Å; R1442-Q1444 VanDerWaalsContact C-N 3.34Å; R1442-Q1444 PolarHBondContact O-N 3.2Å; Q1444-F1447 PolarHBondContact O-N 3.11Å; Q1444-V1448 WeakPolarHBondContact O-CG2 3.28Å; Q1444-V1448 PolarHBondContact O-N 3.11Å; Q1444-V1448 VanDerWaalsContact O-N 3.11Å
1445K85Confident80.4Confident38.4 Ų38.442.6 Ų42.617%0.16722%0.216CC..Hα-helixtrans-62.4-47.5176.4175.9177.2176.5-176.10111.8L1349 A1352 E1353 E1356 P1441 R1442 A1443 F1447 V1448 Y1449L1349-K1445 HydrophobicContact CD1-CB 4.23Å; L1349-K1445 HydrophobicContact CD1-CD 4.35Å; L1349-K1445 HydrophobicContact CD1-CG 3.78Å; L1349-K1445 HydrophobicContact CD2-CB 4.41Å; L1349-K1445 HydrophobicContact CD2-CG 3.98Å; A1352-K1445 HydrophobicContact CB-CB 4.15Å; E1353-K1445 HydrophobicContact CG-CD 4.25Å; E1356-K1445 IonicContact OE1-NZ 3.44Å; E1356-K1445 PolarHBondContact OE1-NZ 3.06Å; E1356-K1445 IonicContact OE2-NZ 3.47Å; E1356-K1445 PolarHBondContact OE2-NZ 3.14Å; P1441-K1445 VanDerWaalsContact O-CB 3.3Å; P1441-K1445 WeakPolarHBondContact O-CB 3.34Å; P1441-K1445 PolarHBondContact O-N 3.09Å; P1441-K1445 VanDerWaalsContact O-N 3.12Å; R1442-K1445 WeakPolarHBondContact O-CB 3.38Å; R1442-K1445 PolarHBondContact O-N 3.26Å; A1443-K1445 VanDerWaalsContact C-N 3.31Å; A1443-K1445 PolarHBondContact O-N 3.04Å; K1445-F1447 VanDerWaalsContact C-N 3.34Å; K1445-F1447 PolarHBondContact O-N 3.02Å; K1445-V1448 PolarHBondContact O-N 3.36Å; K1445-Y1449 HydrophobicContact CD-CE2 4.33Å; K1445-Y1449 HydrophobicContact CG-CD2 4.31Å; K1445-Y1449 HydrophobicContact CG-CE2 3.73Å; K1445-Y1449 WeakPolarHBondContact O-CD2 3.38Å; K1445-Y1449 PolarHBondContact O-N 3.2Å
1446N85.4Confident82.2Confident26 Ų2635.7 Ų35.714%0.13919%0.19CC..Hα-helixtrans-62.3-41.5176.4-72.18.2000112Y1216 T1217 D1218 W1219 R1442 A1443 V1448 Y1449 Y1450Y1216-N1446 VanDerWaalsContact CB-CG 3.45Å; T1217-N1446 PolarHBondContact O-ND2 2.87Å; D1218-N1446 PolarHBondContact O-ND2 3.04Å; W1219-N1446 HydrophobicContact CB-CB 4.36Å; R1442-N1446 WeakPolarHBondContact O-CB 3.36Å; R1442-N1446 PolarHBondContact O-N 3.18Å; R1442-N1446 PolarHBondContact O-OD1 3.03Å; A1443-N1446 PolarHBondContact O-N 3.16Å; N1446-V1448 VanDerWaalsContact C-N 3.33Å; N1446-V1448 PolarHBondContact O-N 3Å; N1446-Y1449 PolarHBondContact O-N 3.05Å; N1446-Y1449 VanDerWaalsContact O-N 3.12Å; N1446-Y1450 WeakPolarHBondContact O-CB 3.48Å; N1446-Y1450 PolarHBondContact O-N 3.24Å
1447F86.7Confident83.9Confident3.8 Ų3.830.2 Ų30.22%0.01716%0.16CC..Hα-helixtrans-64.7-36.5177.6-171.5-101.1000112.6W1219 P1247 L1252 I1255 L1259 Y1263 A1443 Q1444 K1445 Y1449 Y1450 L1451W1219-F1447 HydrophobicContact CB-CB 4.29Å; W1219-F1447 HydrophobicContact CB-CD2 4.24Å; W1219-F1447 HydrophobicContact CD2-CD2 4.06Å; W1219-F1447 AromaticContact CE3-CD2 3.33Å; W1219-F1447 HydrophobicContact CE3-CD2 3.33Å; W1219-F1447 AromaticContact CE3-CE2 3.79Å; W1219-F1447 HydrophobicContact CE3-CE2 3.79Å; W1219-F1447 HydrophobicContact CE3-CG 4.34Å; W1219-F1447 HydrophobicContact CG-CD2 4.25Å; W1219-F1447 HydrophobicContact CH2-CD2 4.12Å; W1219-F1447 AromaticContact CH2-CE2 3.72Å; W1219-F1447 HydrophobicContact CH2-CE2 3.72Å; W1219-F1447 AromaticContact CZ3-CD2 3.35Å; W1219-F1447 HydrophobicContact CZ3-CD2 3.35Å; W1219-F1447 AromaticContact CZ3-CE2 3.26Å; W1219-F1447 HydrophobicContact CZ3-CE2 3.26Å; W1219-F1447 HydrophobicContact CZ3-CZ 4.38Å; P1247-F1447 HydrophobicContact CB-CE2 4.32Å; P1247-F1447 HydrophobicContact CG-CE2 4.11Å; L1252-F1447 HydrophobicContact CD2-CE2 4.38Å; L1252-F1447 HydrophobicContact CD2-CZ 4.12Å; I1255-F1447 HydrophobicContact CD1-CB 4.4Å; I1255-F1447 HydrophobicContact CD1-CD1 3.97Å; I1255-F1447 HydrophobicContact CD1-CD2 3.57Å; I1255-F1447 VanDerWaalsContact CD1-CD2 3.46Å; I1255-F1447 HydrophobicContact CD1-CE1 4.07Å; I1255-F1447 HydrophobicContact CD1-CE2 3.68Å; I1255-F1447 HydrophobicContact CD1-CG 3.72Å; I1255-F1447 HydrophobicContact CD1-CZ 3.93Å; I1255-F1447 HydrophobicContact CG1-CD1 4.42Å; I1255-F1447 HydrophobicContact CG1-CD2 4.4Å; I1255-F1447 HydrophobicContact CG1-CG 4.42Å; I1255-F1447 HydrophobicContact CG2-CD1 3.85Å; I1255-F1447 HydrophobicContact CG2-CE1 3.91Å; I1255-F1447 HydrophobicContact CG2-CG 4.41Å; I1255-F1447 HydrophobicContact CG2-CZ 4.48Å; L1259-F1447 HydrophobicContact CB-CD1 4.18Å; L1259-F1447 HydrophobicContact CB-CE1 4.12Å; L1259-F1447 HydrophobicContact CD1-CD1 4.26Å; Y1263-F1447 HydrophobicContact CD2-CZ 4.25Å; Y1263-F1447 AromaticContact CG-CZ 3.97Å; Y1263-F1447 HydrophobicContact CG-CZ 4.09Å; A1443-F1447 VanDerWaalsContact O-CB 3.27Å; A1443-F1447 WeakPolarHBondContact O-CB 3.38Å; A1443-F1447 PolarHBondContact O-N 3.18Å; Q1444-F1447 PolarHBondContact O-N 3.11Å; K1445-F1447 VanDerWaalsContact C-N 3.34Å; K1445-F1447 PolarHBondContact O-N 3.02Å; F1447-Y1449 PolarHBondContact O-N 3.35Å; F1447-Y1450 AromaticContact CD2-CD1 3.83Å; F1447-Y1450 HydrophobicContact CD2-CD1 4.19Å; F1447-Y1450 AromaticContact CE2-CD1 3.88Å; F1447-Y1450 HydrophobicContact CE2-CD1 4.11Å; F1447-Y1450 HydrophobicContact CE2-CE1 4.29Å; F1447-Y1450 PolarHBondContact O-N 2.91Å; F1447-L1451 HydrophobicContact CE1-CB 4.44Å; F1447-L1451 HydrophobicContact CE1-CD2 4.42Å; F1447-L1451 VanDerWaalsContact O-CB 3.25Å; F1447-L1451 WeakPolarHBondContact O-CB 3.32Å; F1447-L1451 PolarHBondContact O-N 3.03Å
1448V87.3Confident85Confident0 Ų029.5 Ų29.50%016%0.155CC..Hα-helixtrans-62-42.9173.3170.90000111.2L1259 L1345 I1348 L1349 Q1444 K1445 N1446 L1451 I1452L1259-V1448 HydrophobicContact CD1-CG2 3.66Å; L1259-V1448 HydrophobicContact CD2-CG2 3.91Å; L1259-V1448 HydrophobicContact CG-CG2 4.46Å; L1345-V1448 HydrophobicContact CB-CG1 4.27Å; L1345-V1448 HydrophobicContact CD2-CG1 4.46Å; I1348-V1448 HydrophobicContact CG2-CG2 4.44Å; L1349-V1448 HydrophobicContact CD1-CB 4.36Å; L1349-V1448 HydrophobicContact CD1-CG1 3.91Å; L1349-V1448 HydrophobicContact CD2-CB 4.15Å; L1349-V1448 HydrophobicContact CD2-CG1 4.08Å; L1349-V1448 HydrophobicContact CG-CB 4.42Å; L1349-V1448 HydrophobicContact CG-CG1 4Å; Q1444-V1448 WeakPolarHBondContact O-CG2 3.28Å; Q1444-V1448 PolarHBondContact O-N 3.11Å; Q1444-V1448 VanDerWaalsContact O-N 3.11Å; K1445-V1448 PolarHBondContact O-N 3.36Å; N1446-V1448 VanDerWaalsContact C-N 3.33Å; N1446-V1448 PolarHBondContact O-N 3Å; V1448-L1451 PolarHBondContact O-N 2.88Å; V1448-I1452 HydrophobicContact CG1-CD1 3.79Å; V1448-I1452 HydrophobicContact CG1-CG1 4.48Å; V1448-I1452 WeakPolarHBondContact O-CB 3.41Å; V1448-I1452 VanDerWaalsContact O-CG1 3.27Å; V1448-I1452 WeakPolarHBondContact O-CG1 3.25Å; V1448-I1452 PolarHBondContact O-N 3.01Å
1449Y87Confident85.7Confident21.4 Ų21.424.2 Ų24.28%0.08412%0.123CC..Hα-helixtrans-64.5-46.9175.5-63.4-49.5000112.1P1214 Y1216 L1349 K1445 N1446 F1447 L1451 I1452 H1453 P1486P1214-Y1449 HydrophobicContact CB-CD2 3.79Å; P1214-Y1449 HydrophobicContact CB-CE1 4.42Å; P1214-Y1449 HydrophobicContact CB-CE2 3.79Å; P1214-Y1449 HydrophobicContact CB-CG 4.32Å; P1214-Y1449 HydrophobicContact CG-CD1 3.78Å; P1214-Y1449 HydrophobicContact CG-CD2 3.72Å; P1214-Y1449 HydrophobicContact CG-CE1 3.94Å; P1214-Y1449 HydrophobicContact CG-CE2 3.62Å; P1214-Y1449 HydrophobicContact CG-CG 3.9Å; Y1216-Y1449 HydrophobicContact CD1-CD2 4.12Å; Y1216-Y1449 HydrophobicContact CD1-CG 4.34Å; L1349-Y1449 HydrophobicContact CD1-CE1 4.17Å; L1349-Y1449 HydrophobicContact CD1-CE2 4.06Å; L1349-Y1449 HydrophobicContact CD2-CE1 4.18Å; L1349-Y1449 HydrophobicContact CD2-CE2 4.42Å; K1445-Y1449 HydrophobicContact CD-CE2 4.33Å; K1445-Y1449 HydrophobicContact CG-CD2 4.31Å; K1445-Y1449 HydrophobicContact CG-CE2 3.73Å; K1445-Y1449 WeakPolarHBondContact O-CD2 3.38Å; K1445-Y1449 PolarHBondContact O-N 3.2Å; N1446-Y1449 PolarHBondContact O-N 3.05Å; N1446-Y1449 VanDerWaalsContact O-N 3.12Å; F1447-Y1449 PolarHBondContact O-N 3.35Å; Y1449-L1451 VanDerWaalsContact C-N 3.34Å; Y1449-L1451 PolarHBondContact O-N 3.21Å; Y1449-I1452 PolarHBondContact O-N 3.16Å; Y1449-H1453 VanDerWaalsContact O-CB 3.27Å; Y1449-H1453 WeakPolarHBondContact O-CB 3.41Å; Y1449-H1453 PolarHBondContact O-CD2 3.35Å; Y1449-H1453 PolarHBondContact O-N 3.06Å; Y1449-H1453 PolarHBondContact O-ND1 3.34Å; Y1449-P1486 HydrophobicContact CE1-CB 3.9Å; Y1449-P1486 HydrophobicContact CE1-CG 3.99Å; Y1449-P1486 WeakPolarHBondContact CE1-O 3.47Å; Y1449-P1486 WeakPolarHBondContact OH-CG 3.44Å
1450Y86.8Confident86.4Confident23.4 Ų23.423.9 Ų23.99%0.09212%0.12CC..Hα-helixtrans-57-46.1175.6171.5-105.4000112.5W1219 K1245 P1247 N1446 F1447 I1452 H1453 S1454 H1455W1219-Y1450 HydrophobicContact CB-CD1 4.18Å; W1219-Y1450 HydrophobicContact CB-CD2 4.5Å; W1219-Y1450 HydrophobicContact CB-CG 3.99Å; W1219-Y1450 HydrophobicContact CD2-CD1 4.22Å; W1219-Y1450 HydrophobicContact CD2-CE1 4.34Å; W1219-Y1450 HydrophobicContact CD2-CG 4.35Å; W1219-Y1450 AromaticContact CE2-CD1 3.71Å; W1219-Y1450 AromaticContact CE2-CE1 3.57Å; W1219-Y1450 AromaticContact CE2-CZ 3.86Å; W1219-Y1450 HydrophobicContact CE3-CD1 4.4Å; W1219-Y1450 HydrophobicContact CE3-CD2 4.21Å; W1219-Y1450 AromaticContact CE3-CG 3.86Å; W1219-Y1450 HydrophobicContact CE3-CG 3.86Å; W1219-Y1450 HydrophobicContact CG-CD1 4.44Å; W1219-Y1450 HydrophobicContact CG-CG 4.47Å; W1219-Y1450 HydrophobicContact CH2-CD1 4.21Å; W1219-Y1450 AromaticContact CH2-CD2 3.3Å; W1219-Y1450 HydrophobicContact CH2-CD2 3.3Å; W1219-Y1450 AromaticContact CH2-CE1 3.52Å; W1219-Y1450 HydrophobicContact CH2-CE1 3.52Å; W1219-Y1450 AromaticContact CH2-CE2 3.53Å; W1219-Y1450 HydrophobicContact CH2-CE2 3.53Å; W1219-Y1450 AromaticContact CH2-CG 3.77Å; W1219-Y1450 HydrophobicContact CH2-CG 3.77Å; W1219-Y1450 AromaticContact CZ2-CD1 3.73Å; W1219-Y1450 HydrophobicContact CZ2-CD1 4.03Å; W1219-Y1450 AromaticContact CZ2-CD2 3.93Å; W1219-Y1450 HydrophobicContact CZ2-CD2 3.93Å; W1219-Y1450 AromaticContact CZ2-CE1 3.13Å; W1219-Y1450 HydrophobicContact CZ2-CE1 3.68Å; W1219-Y1450 AromaticContact CZ2-CE2 3.84Å; W1219-Y1450 HydrophobicContact CZ2-CE2 4.07Å; W1219-Y1450 HydrophobicContact CZ2-CG 4.32Å; W1219-Y1450 AromaticContact CZ2-CZ 3.71Å; W1219-Y1450 VanDerWaalsContact CZ2-CZ 3.46Å; W1219-Y1450 HydrophobicContact CZ3-CD1 4.44Å; W1219-Y1450 AromaticContact CZ3-CD2 3.47Å; W1219-Y1450 HydrophobicContact CZ3-CD2 3.47Å; W1219-Y1450 VanDerWaalsContact CZ3-CD2 3.47Å; W1219-Y1450 HydrophobicContact CZ3-CE1 4.36Å; W1219-Y1450 HydrophobicContact CZ3-CE2 4.19Å; W1219-Y1450 AromaticContact CZ3-CG 3.6Å; W1219-Y1450 HydrophobicContact CZ3-CG 3.6Å; W1219-Y1450 AromaticContact NE1-CD2 3.93Å; W1219-Y1450 AromaticContact NE1-CE2 3.94Å; W1219-Y1450 AromaticContact NE1-CZ 3.99Å; K1245-Y1450 PolarHBondContact O-OH 3.31Å; P1247-Y1450 HydrophobicContact CG-CE1 4.12Å; N1446-Y1450 WeakPolarHBondContact O-CB 3.48Å; N1446-Y1450 PolarHBondContact O-N 3.24Å; F1447-Y1450 AromaticContact CD2-CD1 3.83Å; F1447-Y1450 HydrophobicContact CD2-CD1 4.19Å; F1447-Y1450 AromaticContact CE2-CD1 3.88Å; F1447-Y1450 HydrophobicContact CE2-CD1 4.11Å; F1447-Y1450 HydrophobicContact CE2-CE1 4.29Å; F1447-Y1450 PolarHBondContact O-N 2.91Å; Y1450-I1452 VanDerWaalsContact C-N 3.35Å; Y1450-I1452 PolarHBondContact O-N 3.25Å; Y1450-H1453 PolarHBondContact O-N 3.08Å; Y1450-S1454 WeakPolarHBondContact CD2-OG 3.41Å; Y1450-S1454 WeakPolarHBondContact CE2-OG 3.37Å; Y1450-S1454 VanDerWaalsContact O-CB 3.28Å; Y1450-S1454 WeakPolarHBondContact O-CB 3.26Å; Y1450-S1454 PolarHBondContact O-N 3.35Å; Y1450-S1454 PolarHBondContact O-OG 3.25Å; Y1450-H1455 AromaticContact CE1-CD2 3.77Å; Y1450-H1455 AromaticContact CE1-NE2 3.57Å; Y1450-H1455 WeakPolarHBondContact CE1-NE2 3.38Å; Y1450-H1455 AromaticContact CE2-NE2 3.91Å; Y1450-H1455 AromaticContact CZ-CD2 3.86Å; Y1450-H1455 AromaticContact CZ-NE2 3.3Å; Y1450-H1455 VanDerWaalsContact CZ-NE2 3.3Å; Y1450-H1455 PolarHBondContact OH-NE2 3.15Å
1451L88.2Confident86.9Confident0 Ų021.2 Ų21.20%010%0.103CC..Iπ-helixtrans-60.2-45.4177.6175.560.8000111.8L1259 I1262 Y1263 L1345 F1447 V1448 Y1449 H1455 L1456L1259-L1451 HydrophobicContact CD2-CD2 4.32Å; I1262-L1451 HydrophobicContact CB-CD2 4.28Å; I1262-L1451 HydrophobicContact CG2-CD1 4.4Å; I1262-L1451 HydrophobicContact CG2-CD2 3.82Å; I1262-L1451 HydrophobicContact CG2-CG 4.39Å; Y1263-L1451 HydrophobicContact CD2-CD1 4.12Å; Y1263-L1451 HydrophobicContact CG-CD1 4.48Å; L1345-L1451 HydrophobicContact CD2-CD2 4.15Å; F1447-L1451 HydrophobicContact CE1-CB 4.44Å; F1447-L1451 HydrophobicContact CE1-CD2 4.42Å; F1447-L1451 VanDerWaalsContact O-CB 3.25Å; F1447-L1451 WeakPolarHBondContact O-CB 3.32Å; F1447-L1451 PolarHBondContact O-N 3.03Å; V1448-L1451 PolarHBondContact O-N 2.88Å; Y1449-L1451 VanDerWaalsContact C-N 3.34Å; Y1449-L1451 PolarHBondContact O-N 3.21Å; L1451-H1455 HydrophobicContact CD1-CB 4.39Å; L1451-H1455 WeakPolarHBondContact O-CB 3.43Å; L1451-H1455 PolarHBondContact O-N 3.12Å; L1451-L1456 HydrophobicContact CD1-CG 4.5Å; L1451-L1456 HydrophobicContact CD2-CD1 4.47Å; L1451-L1456 HydrophobicContact CG-CD1 3.97Å; L1451-L1456 HydrophobicContact CG-CG 4.26Å; L1451-L1456 WeakPolarHBondContact O-CB 3.34Å; L1451-L1456 PolarHBondContact O-N 3.1Å
1452I88Confident87.3Confident1.2 Ų1.220.5 Ų20.51%0.00610%0.098CC..Iπ-helixtrans-67.5-46.3179.3-68.2169.8000111L1345 V1448 Y1449 Y1450 L1456 I1457 C1482 F1485L1345-I1452 HydrophobicContact CD1-CD1 4.2Å; L1345-I1452 HydrophobicContact CD1-CG1 4.21Å; V1448-I1452 HydrophobicContact CG1-CD1 3.79Å; V1448-I1452 HydrophobicContact CG1-CG1 4.48Å; V1448-I1452 WeakPolarHBondContact O-CB 3.41Å; V1448-I1452 VanDerWaalsContact O-CG1 3.27Å; V1448-I1452 WeakPolarHBondContact O-CG1 3.25Å; V1448-I1452 PolarHBondContact O-N 3.01Å; Y1449-I1452 PolarHBondContact O-N 3.16Å; Y1450-I1452 VanDerWaalsContact C-N 3.35Å; Y1450-I1452 PolarHBondContact O-N 3.25Å; I1452-L1456 HydrophobicContact CG1-CD1 4.02Å; I1452-L1456 HydrophobicContact CG1-CD2 4.44Å; I1452-I1457 HydrophobicContact CG2-CD1 3.68Å; I1452-I1457 HydrophobicContact CG2-CG1 4.11Å; I1452-I1457 WeakPolarHBondContact O-CG1 3.33Å; I1452-I1457 PolarHBondContact O-N 3.23Å; I1452-I1457 VanDerWaalsContact O-N 3.13Å; I1452-C1482 HydrophobicContact CG2-CB 4.36Å; I1452-F1485 HydrophobicContact CD1-CB 3.73Å; I1452-F1485 HydrophobicContact CD1-CD1 3.77Å; I1452-F1485 HydrophobicContact CD1-CD2 4.05Å; I1452-F1485 HydrophobicContact CD1-CE1 4.2Å; I1452-F1485 HydrophobicContact CD1-CE2 4.41Å; I1452-F1485 HydrophobicContact CD1-CG 3.57Å; I1452-F1485 VanDerWaalsContact CD1-CG 3.42Å
1453H87.1Confident87.6Confident29.6 Ų29.613.6 Ų13.614%0.1377%0.073CC..Iπ-helixtrans-76-45.8-172.3-77.2174.7000113.7F1213 Y1216 Y1449 Y1450 P1458 P1486 G1487 G1488 V1491F1213-H1453 AromaticContact CD1-CE1 3.91Å; F1213-H1453 AromaticContact CD2-CE1 3.93Å; F1213-H1453 AromaticContact CE1-CE1 3.97Å; F1213-H1453 AromaticContact CE1-ND1 3.85Å; F1213-H1453 AromaticContact CE2-CD2 3.95Å; F1213-H1453 AromaticContact CE2-CE1 3.72Å; F1213-H1453 VanDerWaalsContact CE2-CE1 3.47Å; F1213-H1453 WeakPolarHBondContact CE2-CE1 3.31Å; F1213-H1453 AromaticContact CE2-CG 3.81Å; F1213-H1453 AromaticContact CE2-ND1 3.47Å; F1213-H1453 VanDerWaalsContact CE2-ND1 3.33Å; F1213-H1453 WeakPolarHBondContact CE2-ND1 3.24Å; F1213-H1453 AromaticContact CZ-CE1 3.84Å; F1213-H1453 AromaticContact CZ-ND1 3.54Å; F1213-H1453 WeakPolarHBondContact CZ-ND1 3.4Å; Y1216-H1453 AromaticContact CE1-CE1 3.88Å; Y1216-H1453 AromaticContact CE1-ND1 3.39Å; Y1216-H1453 VanDerWaalsContact CE1-ND1 3.31Å; Y1216-H1453 WeakPolarHBondContact CE1-ND1 3.25Å; Y1216-H1453 AromaticContact CZ-ND1 3.49Å; Y1216-H1453 VanDerWaalsContact OH-CB 3.29Å; Y1216-H1453 WeakPolarHBondContact OH-CB 3.46Å; Y1216-H1453 PolarHBondContact OH-ND1 2.99Å; Y1449-H1453 VanDerWaalsContact O-CB 3.27Å; Y1449-H1453 WeakPolarHBondContact O-CB 3.41Å; Y1449-H1453 PolarHBondContact O-CD2 3.35Å; Y1449-H1453 PolarHBondContact O-N 3.06Å; Y1449-H1453 PolarHBondContact O-ND1 3.34Å; Y1450-H1453 PolarHBondContact O-N 3.08Å; H1453-P1458 VanDerWaalsContact O-CD 3.28Å; H1453-P1458 WeakPolarHBondContact O-CD 3.44Å; H1453-P1458 VanDerWaalsContact O-CG 3.29Å; H1453-P1458 WeakPolarHBondContact O-CG 3.42Å; H1453-P1486 PolarHBondContact CE1-O 3.17Å; H1453-P1486 PolarHBondContact NE2-O 2.92Å; H1453-G1487 VanDerWaalsContact NE2-C 3.3Å; H1453-G1487 WeakPolarHBondContact NE2-CA 3.14Å; H1453-G1488 PolarHBondContact NE2-N 3.14Å; H1453-V1491 HydrophobicContact CB-CG2 3.88Å; H1453-V1491 VanDerWaalsContact CD2-CG2 3.47Å; H1453-V1491 WeakPolarHBondContact CD2-CG2 3.29Å; H1453-V1491 WeakPolarHBondContact O-CG1 3.35Å
1454S85.4Confident88.1Confident26 Ų2613.1 Ų13.118%0.1827%0.069CC..Iπ-helixtrans-96.5-18.5-169.2-52.80000113.9E1244 K1270 Y1450E1244-S1454 WeakPolarHBondContact OE1-CB 3.45Å; E1244-S1454 PolarHBondContact OE1-OG 3.2Å; K1270-S1454 PolarHBondContact NZ-O 3.3Å; Y1450-S1454 WeakPolarHBondContact CD2-OG 3.41Å; Y1450-S1454 WeakPolarHBondContact CE2-OG 3.37Å; Y1450-S1454 VanDerWaalsContact O-CB 3.28Å; Y1450-S1454 WeakPolarHBondContact O-CB 3.26Å; Y1450-S1454 PolarHBondContact O-N 3.35Å; Y1450-S1454 PolarHBondContact O-OG 3.25Å
1455H86.6Confident88.3Confident4.8 Ų4.814 Ų142%0.0227%0.072CC..Iπ-helixtrans-127.4-58.2-174.4-61.3-76.5000112.8E1244 Y1263 T1266 K1270 Y1450 L1451 P1458 S1459E1244-H1455 IonicContact OE2-CE1 3.61Å; Y1263-H1455 AromaticContact CE2-CD2 3.95Å; Y1263-H1455 AromaticContact CE2-CE1 3.81Å; Y1263-H1455 AromaticContact CE2-NE2 3.85Å; T1266-H1455 VanDerWaalsContact CG2-C 3.46Å; T1266-H1455 HydrophobicContact CG2-CB 3.79Å; T1266-H1455 WeakPolarHBondContact CG2-O 3.46Å; K1270-H1455 WeakPolarHBondContact CD-ND1 3.29Å; K1270-H1455 PolarHBondContact NZ-CE1 3.12Å; K1270-H1455 PolarHBondContact NZ-ND1 3.02Å; K1270-H1455 VanDerWaalsContact NZ-ND1 3.12Å; Y1450-H1455 AromaticContact CE1-CD2 3.77Å; Y1450-H1455 AromaticContact CE1-NE2 3.57Å; Y1450-H1455 WeakPolarHBondContact CE1-NE2 3.38Å; Y1450-H1455 AromaticContact CE2-NE2 3.91Å; Y1450-H1455 AromaticContact CZ-CD2 3.86Å; Y1450-H1455 AromaticContact CZ-NE2 3.3Å; Y1450-H1455 VanDerWaalsContact CZ-NE2 3.3Å; Y1450-H1455 PolarHBondContact OH-NE2 3.15Å; L1451-H1455 HydrophobicContact CD1-CB 4.39Å; L1451-H1455 WeakPolarHBondContact O-CB 3.43Å; L1451-H1455 PolarHBondContact O-N 3.12Å; H1455-P1458 WeakPolarHBondContact O-CD 3.42Å; H1455-S1459 WeakPolarHBondContact O-CB 3.28Å; H1455-S1459 PolarHBondContact O-N 2.97Å; H1455-S1459 PolarHBondContact O-OG 3.14Å; H1455-S1459 VanDerWaalsContact O-OG 3.08Å
1456L89.6Confident88.4Confident2.2 Ų2.214.4 Ų14.41%0.0128%0.08CC..Iπ-helixtrans-67.2-53.2-169-153.274.5000112.9I1262 T1266 L1335 L1345 L1451 I1452 S1459 L1460 C1482I1262-L1456 HydrophobicContact CG2-CD1 4.34Å; I1262-L1456 HydrophobicContact CG2-CD2 4.18Å; T1266-L1456 HydrophobicContact CG2-CB 4.38Å; T1266-L1456 HydrophobicContact CG2-CD1 4.19Å; T1266-L1456 HydrophobicContact CG2-CD2 4.04Å; T1266-L1456 HydrophobicContact CG2-CG 4.35Å; T1266-L1456 WeakPolarHBondContact OG1-CD1 3.22Å; T1266-L1456 VanDerWaalsContact OG1-CD2 3.25Å; T1266-L1456 WeakPolarHBondContact OG1-CD2 3.25Å; L1335-L1456 HydrophobicContact CD2-CD1 4.44Å; L1335-L1456 HydrophobicContact CD2-CD2 4.42Å; L1345-L1456 HydrophobicContact CD1-CD1 3.96Å; L1345-L1456 HydrophobicContact CD1-CD2 4.18Å; L1451-L1456 HydrophobicContact CD1-CG 4.5Å; L1451-L1456 HydrophobicContact CD2-CD1 4.47Å; L1451-L1456 HydrophobicContact CG-CD1 3.97Å; L1451-L1456 HydrophobicContact CG-CG 4.26Å; L1451-L1456 WeakPolarHBondContact O-CB 3.34Å; L1451-L1456 PolarHBondContact O-N 3.1Å; I1452-L1456 HydrophobicContact CG1-CD1 4.02Å; I1452-L1456 HydrophobicContact CG1-CD2 4.44Å; L1456-S1459 PolarHBondContact O-N 3.22Å; L1456-L1460 HydrophobicContact CD1-CD1 3.94Å; L1456-L1460 HydrophobicContact CD1-CG 4.29Å; L1456-L1460 HydrophobicContact CG-CD1 3.99Å; L1456-L1460 WeakPolarHBondContact O-CB 3.34Å; L1456-L1460 WeakPolarHBondContact O-CD1 3.38Å; L1456-L1460 WeakPolarHBondContact O-CG 3.4Å; L1456-L1460 PolarHBondContact O-N 3.15Å; L1456-L1460 VanDerWaalsContact O-N 3.11Å; L1456-C1482 VanDerWaalsContact CD2-SG 3.51Å; L1456-C1482 WeakPolarHBondContact CD2-SG 3.18Å
1457I91.3Very high88.4Confident0.4 Ų0.419 Ų190%0.00210%0.101CC..Hα-helixtrans-64.4-48.6179.3-65173.5000111.5I1452 S1459 L1460 W1461 C1482 L1483 G1488 V1491 F1492 L1495I1452-I1457 HydrophobicContact CG2-CD1 3.68Å; I1452-I1457 HydrophobicContact CG2-CG1 4.11Å; I1452-I1457 WeakPolarHBondContact O-CG1 3.33Å; I1452-I1457 PolarHBondContact O-N 3.23Å; I1452-I1457 VanDerWaalsContact O-N 3.13Å; I1457-S1459 PolarHBondContact O-N 3.27Å; I1457-L1460 PolarHBondContact O-N 3.17Å; I1457-W1461 VanDerWaalsContact O-CB 3.27Å; I1457-W1461 WeakPolarHBondContact O-CB 3.35Å; I1457-W1461 PolarHBondContact O-N 3.25Å; I1457-C1482 HydrophobicContact CD1-CB 4.07Å; I1457-C1482 HydrophobicContact CG1-CB 3.7Å; I1457-L1483 HydrophobicContact CD1-CD2 4.42Å; I1457-G1488 WeakPolarHBondContact CD1-O 3.28Å; I1457-V1491 HydrophobicContact CB-CG1 4.25Å; I1457-V1491 HydrophobicContact CD1-CB 4.31Å; I1457-V1491 HydrophobicContact CD1-CG1 4.43Å; I1457-V1491 HydrophobicContact CG2-CG1 4.07Å; I1457-F1492 HydrophobicContact CG2-CB 4.14Å; I1457-F1492 HydrophobicContact CG2-CD2 4.28Å; I1457-L1495 HydrophobicContact CG2-CD1 3.83Å
1458P90.2Very high88.4Confident35.4 Ų35.419.9 Ų19.923%0.2311%0.106CC..Hα-helixtrans-60.7-42177.7-2635.7000114.1H1453 H1455 W1461 S1462 L1495H1453-P1458 VanDerWaalsContact O-CD 3.28Å; H1453-P1458 WeakPolarHBondContact O-CD 3.44Å; H1453-P1458 VanDerWaalsContact O-CG 3.29Å; H1453-P1458 WeakPolarHBondContact O-CG 3.42Å; H1455-P1458 WeakPolarHBondContact O-CD 3.42Å; P1458-W1461 PolarHBondContact O-N 3.23Å; P1458-S1462 WeakPolarHBondContact O-CB 3.33Å; P1458-S1462 PolarHBondContact O-N 3.06Å; P1458-S1462 PolarHBondContact O-OG 3.33Å; P1458-L1495 HydrophobicContact CG-CD1 4.36Å
1459S88.4Confident88.3Confident2.4 Ų2.422.2 Ų22.22%0.01712%0.122CC..Hα-helixtrans-70.8-39-178.8-58.30000112.2K1270 H1455 L1456 I1457 W1461 S1462 L1463K1270-S1459 WeakPolarHBondContact CA-OG 3.41Å; K1270-S1459 VanDerWaalsContact CB-OG 3.28Å; K1270-S1459 WeakPolarHBondContact CB-OG 3.42Å; K1270-S1459 WeakPolarHBondContact CG-OG 3.4Å; H1455-S1459 WeakPolarHBondContact O-CB 3.28Å; H1455-S1459 PolarHBondContact O-N 2.97Å; H1455-S1459 PolarHBondContact O-OG 3.14Å; H1455-S1459 VanDerWaalsContact O-OG 3.08Å; L1456-S1459 PolarHBondContact O-N 3.22Å; I1457-S1459 PolarHBondContact O-N 3.27Å; S1459-W1461 VanDerWaalsContact C-N 3.29Å; S1459-W1461 PolarHBondContact O-N 2.93Å; S1459-S1462 PolarHBondContact O-N 3.15Å; S1459-S1462 PolarHBondContact O-OG 3.02Å; S1459-S1462 VanDerWaalsContact O-OG 3.06Å; S1459-L1463 WeakPolarHBondContact O-CB 3.39Å; S1459-L1463 WeakPolarHBondContact O-CG 3.22Å; S1459-L1463 PolarHBondContact O-N 3.39Å
1460L91.9Very high88.2Confident2.4 Ų2.425.7 Ų25.71%0.01314%0.136CC..Hα-helixtrans-68.4-34.7173.8-66.4169.9000111.7L1332 L1456 I1457 S1462 L1463 T1475 L1478 V1479L1332-L1460 HydrophobicContact CD2-CD2 3.67Å; L1456-L1460 HydrophobicContact CD1-CD1 3.94Å; L1456-L1460 HydrophobicContact CD1-CG 4.29Å; L1456-L1460 HydrophobicContact CG-CD1 3.99Å; L1456-L1460 WeakPolarHBondContact O-CB 3.34Å; L1456-L1460 WeakPolarHBondContact O-CD1 3.38Å; L1456-L1460 WeakPolarHBondContact O-CG 3.4Å; L1456-L1460 PolarHBondContact O-N 3.15Å; L1456-L1460 VanDerWaalsContact O-N 3.11Å; I1457-L1460 PolarHBondContact O-N 3.17Å; L1460-S1462 VanDerWaalsContact C-N 3.34Å; L1460-S1462 PolarHBondContact O-N 2.84Å; L1460-L1463 HydrophobicContact CD2-CD1 4.37Å; L1460-L1463 PolarHBondContact O-N 3.06Å; L1460-T1475 HydrophobicContact CB-CG2 4.05Å; L1460-T1475 HydrophobicContact CD2-CG2 4.04Å; L1460-T1475 VanDerWaalsContact O-CG2 3.26Å; L1460-T1475 WeakPolarHBondContact O-CG2 3.28Å; L1460-L1478 HydrophobicContact CD1-CB 3.9Å; L1460-L1478 HydrophobicContact CD2-CB 4.34Å; L1460-L1478 HydrophobicContact CD2-CD1 4.3Å; L1460-V1479 HydrophobicContact CB-CG2 3.49Å; L1460-V1479 VanDerWaalsContact CB-CG2 3.47Å; L1460-V1479 HydrophobicContact CD1-CG2 4.16Å; L1460-V1479 HydrophobicContact CG-CG2 4.43Å
1461W92.9Very high88.3Confident7 Ų724.6 Ų24.63%0.02713%0.132CC..Hα-helixtrans-64.6-39.7172.8179.5-115000112.6I1457 P1458 S1459 L1463 L1464 F1492 L1495 I1496 D1499 K1514 V1515I1457-W1461 VanDerWaalsContact O-CB 3.27Å; I1457-W1461 WeakPolarHBondContact O-CB 3.35Å; I1457-W1461 PolarHBondContact O-N 3.25Å; P1458-W1461 PolarHBondContact O-N 3.23Å; S1459-W1461 VanDerWaalsContact C-N 3.29Å; S1459-W1461 PolarHBondContact O-N 2.93Å; W1461-L1463 VanDerWaalsContact C-N 3.28Å; W1461-L1463 PolarHBondContact O-N 3.33Å; W1461-L1464 HydrophobicContact CE3-CD1 3.81Å; W1461-L1464 HydrophobicContact CZ3-CD1 4.17Å; W1461-L1464 PolarHBondContact O-N 3.2Å; W1461-F1492 HydrophobicContact CE3-CD2 4.48Å; W1461-F1492 AromaticContact CE3-CE2 3.72Å; W1461-F1492 HydrophobicContact CE3-CE2 3.72Å; W1461-F1492 HydrophobicContact CE3-CZ 4.44Å; W1461-F1492 AromaticContact CZ3-CE2 3.86Å; W1461-F1492 HydrophobicContact CZ3-CE2 3.86Å; W1461-F1492 HydrophobicContact CZ3-CZ 4.22Å; W1461-L1495 HydrophobicContact CB-CD1 4.23Å; W1461-L1495 HydrophobicContact CB-CD2 4.23Å; W1461-L1495 HydrophobicContact CD2-CD2 3.48Å; W1461-L1495 VanDerWaalsContact CD2-CD2 3.48Å; W1461-L1495 HydrophobicContact CD2-CG 4.45Å; W1461-L1495 VanDerWaalsContact CE2-CD2 3.43Å; W1461-L1495 HydrophobicContact CE3-CD2 4.13Å; W1461-L1495 HydrophobicContact CG-CD1 4.22Å; W1461-L1495 HydrophobicContact CG-CD2 3.54Å; W1461-L1495 HydrophobicContact CG-CG 4.08Å; W1461-L1495 HydrophobicContact CZ2-CD2 4.03Å; W1461-I1496 HydrophobicContact CH2-CG1 3.89Å; W1461-I1496 HydrophobicContact CZ2-CG1 4.22Å; W1461-I1496 HydrophobicContact CZ3-CG1 4.35Å; W1461-D1499 PolarHBondContact NE1-OD2 3.36Å; W1461-K1514 HydrophobicContact CD2-CD 4.2Å; W1461-K1514 VanDerWaalsContact CE2-CD 3.4Å; W1461-K1514 HydrophobicContact CE3-CB 4.48Å; W1461-K1514 HydrophobicContact CE3-CD 4.45Å; W1461-K1514 HydrophobicContact CG-CD 4.44Å; W1461-K1514 HydrophobicContact CH2-CB 3.84Å; W1461-K1514 HydrophobicContact CH2-CD 4.33Å; W1461-K1514 HydrophobicContact CZ2-CB 4.05Å; W1461-K1514 HydrophobicContact CZ2-CD 3.73Å; W1461-K1514 HydrophobicContact CZ2-CG 4.41Å; W1461-K1514 HydrophobicContact CZ3-CB 4.07Å; W1461-K1514 VanDerWaalsContact NE1-NZ 3.14Å; W1461-V1515 HydrophobicContact CH2-CG2 3.79Å; W1461-V1515 HydrophobicContact CZ3-CG2 4.44Å
1462S88.7Confident88.4Confident24 Ų2424.8 Ų24.817%0.16813%0.133CC..Hα-helixtrans-69-20.7177.972.30000114.1T1273 P1458 S1459 L1460 L1464 K1465T1273-S1462 PolarHBondContact OG1-OG 3.09Å; T1273-S1462 VanDerWaalsContact OG1-OG 3.13Å; P1458-S1462 WeakPolarHBondContact O-CB 3.33Å; P1458-S1462 PolarHBondContact O-N 3.06Å; P1458-S1462 PolarHBondContact O-OG 3.33Å; S1459-S1462 PolarHBondContact O-N 3.15Å; S1459-S1462 PolarHBondContact O-OG 3.02Å; S1459-S1462 VanDerWaalsContact O-OG 3.06Å; L1460-S1462 VanDerWaalsContact C-N 3.34Å; L1460-S1462 PolarHBondContact O-N 2.84Å; S1462-L1464 VanDerWaalsContact C-N 3.35Å; S1462-K1465 VanDerWaalsContact O-CE 3.26Å; S1462-K1465 WeakPolarHBondContact O-CE 3.37Å; S1462-K1465 PolarHBondContact O-NZ 2.75Å
1463L88.9Confident88.5Confident10.2 Ų10.225.1 Ų25.15%0.05314%0.135CC..THydrogen-bonded Turntrans-79.4-16.1176.8-93.4164.1000114.3V1269 L1328 L1332 S1459 L1460 W1461 K1465 L1468 L1471 T1475V1269-L1463 HydrophobicContact CG1-CD1 3.38Å; V1269-L1463 VanDerWaalsContact CG1-CD1 3.43Å; V1269-L1463 HydrophobicContact CG1-CD2 4.07Å; V1269-L1463 HydrophobicContact CG1-CG 3.6Å; V1269-L1463 HydrophobicContact CG2-CD1 4.45Å; L1328-L1463 HydrophobicContact CD1-CD2 4.26Å; L1328-L1463 HydrophobicContact CD2-CD2 4.28Å; L1332-L1463 HydrophobicContact CD1-CD1 4.09Å; L1332-L1463 HydrophobicContact CD2-CD1 3.91Å; L1332-L1463 HydrophobicContact CG-CD1 4.29Å; S1459-L1463 WeakPolarHBondContact O-CB 3.39Å; S1459-L1463 WeakPolarHBondContact O-CG 3.22Å; S1459-L1463 PolarHBondContact O-N 3.39Å; L1460-L1463 HydrophobicContact CD2-CD1 4.37Å; L1460-L1463 PolarHBondContact O-N 3.06Å; W1461-L1463 VanDerWaalsContact C-N 3.28Å; W1461-L1463 PolarHBondContact O-N 3.33Å; L1463-K1465 VanDerWaalsContact C-N 3.31Å; L1463-K1465 PolarHBondContact O-N 3.18Å; L1463-L1468 HydrophobicContact CD1-CD1 3.7Å; L1463-L1468 HydrophobicContact CD2-CD1 4.26Å; L1463-L1471 HydrophobicContact CD1-CD1 4.04Å; L1463-L1471 HydrophobicContact CD2-CD1 4.42Å; L1463-L1471 HydrophobicContact CG-CD1 4.39Å; L1463-T1475 HydrophobicContact CB-CG2 4.12Å; L1463-T1475 HydrophobicContact CD1-CG2 4.4Å
1464L91.2Very high88.6Confident1.6 Ų1.623.8 Ų23.81%0.00813%0.129CC..  trans-76.171.4-177.4-65.5173.1000111.5W1461 S1462 A1472 T1475 V1476 K1514 V1517 L1518W1461-L1464 HydrophobicContact CE3-CD1 3.81Å; W1461-L1464 HydrophobicContact CZ3-CD1 4.17Å; W1461-L1464 PolarHBondContact O-N 3.2Å; S1462-L1464 VanDerWaalsContact C-N 3.35Å; L1464-A1472 HydrophobicContact CD2-CB 4.4Å; L1464-T1475 HydrophobicContact CD2-CG2 3.74Å; L1464-T1475 HydrophobicContact CG-CG2 4.11Å; L1464-V1476 HydrophobicContact CD2-CG2 3.8Å; L1464-K1514 HydrophobicContact CB-CB 4.16Å; L1464-K1514 HydrophobicContact CB-CG 4.14Å; L1464-K1514 VanDerWaalsContact O-CA 3.26Å; L1464-K1514 WeakPolarHBondContact O-CA 3.27Å; L1464-K1514 VanDerWaalsContact O-CG 3.23Å; L1464-K1514 WeakPolarHBondContact O-CG 3.33Å; L1464-V1517 HydrophobicContact CD2-CG1 4.21Å; L1464-L1518 HydrophobicContact CD1-CB 4.33Å; L1464-L1518 HydrophobicContact CD1-CD1 4.2Å
1465K88.8Confident88.9Confident33.2 Ų33.222.6 Ų22.614%0.14412%0.12CC..  trans-112.1149.4176.1-62.3176-177.3167.80109.9E1271 S1462 L1463 E1467 L1468 S1469E1271-K1465 VanDerWaalsContact CD-NZ 3.28Å; E1271-K1465 IonicContact OE1-NZ 2.84Å; E1271-K1465 PolarHBondContact OE1-NZ 3.06Å; E1271-K1465 IonicContact OE2-NZ 3.54Å; E1271-K1465 PolarHBondContact OE2-NZ 2.98Å; S1462-K1465 VanDerWaalsContact O-CE 3.26Å; S1462-K1465 WeakPolarHBondContact O-CE 3.37Å; S1462-K1465 PolarHBondContact O-NZ 2.75Å; L1463-K1465 VanDerWaalsContact C-N 3.31Å; L1463-K1465 PolarHBondContact O-N 3.18Å; K1465-E1467 VanDerWaalsContact C-N 3.31Å; K1465-E1467 HydrophobicContact CB-CG 3.99Å; K1465-E1467 VanDerWaalsContact CD-OE1 3.26Å; K1465-E1467 WeakPolarHBondContact CD-OE1 3.3Å; K1465-E1467 PolarHBondContact O-N 3.2Å; K1465-L1468 HydrophobicContact CB-CB 4.4Å; K1465-L1468 HydrophobicContact CB-CD1 4.39Å; K1465-L1468 HydrophobicContact CB-CG 4.32Å; K1465-L1468 HydrophobicContact CD-CD1 4.35Å; K1465-L1468 CarbonylContact O-C 3.52Å; K1465-L1468 WeakPolarHBondContact O-CA 3.32Å; K1465-L1468 PolarHBondContact O-N 3.08Å; K1465-L1468 VanDerWaalsContact O-N 3.09Å; K1465-S1469 PolarHBondContact O-N 3.09Å
1466S86.5Confident89.2Confident48 Ų4822.4 Ų22.434%0.33612%0.119SC..G310 helixtrans-66.3-34.9-179.761.30000112.3L1468 S1469 E1513S1466-L1468 PolarHBondContact O-N 3.18Å; S1466-S1469 VanDerWaalsContact O-CB 3.3Å; S1466-S1469 WeakPolarHBondContact O-CB 3.37Å; S1466-S1469 PolarHBondContact O-N 3.19Å; S1466-S1469 VanDerWaalsContact O-N 3.13Å; S1466-S1469 PolarHBondContact O-OG 3.03Å; S1466-E1513 WeakPolarHBondContact CA-OE1 3.19Å; S1466-E1513 VanDerWaalsContact CB-OE1 3.23Å; S1466-E1513 WeakPolarHBondContact CB-OE1 3.41Å; S1466-E1513 PolarHBondContact N-OE1 3.27Å; S1466-E1513 PolarHBondContact OG-OE1 3.02Å
1467E85.3Confident89.2Confident121 Ų12122.3 Ų22.357%0.56512%0.119SC*.G310 helixtrans-54.2-35169.1-48.1179.6159.600112.4R1323 K1465 Y1470R1323-E1467 IonicContact CZ-OE2 3.15Å; R1323-E1467 IonicContact NH1-OE2 3.21Å; R1323-E1467 PolarHBondContact NH1-OE2 3.29Å; R1323-E1467 IonicContact NH2-OE2 2.7Å; K1465-E1467 VanDerWaalsContact C-N 3.31Å; K1465-E1467 HydrophobicContact CB-CG 3.99Å; K1465-E1467 VanDerWaalsContact CD-OE1 3.26Å; K1465-E1467 WeakPolarHBondContact CD-OE1 3.3Å; K1465-E1467 PolarHBondContact O-N 3.2Å; E1467-Y1470 WeakPolarHBondContact O-CE1 3.33Å
1468L85.4Confident89.1Confident24.2 Ų24.222.3 Ų22.313%0.12712%0.119CC..G310 helixtrans-103.119.1-176.4-59.1179000112.5L1328 L1463 K1465 S1466 Y1470 L1471L1328-L1468 HydrophobicContact CD1-CD1 4.42Å; L1328-L1468 HydrophobicContact CD1-CD2 4.36Å; L1463-L1468 HydrophobicContact CD1-CD1 3.7Å; L1463-L1468 HydrophobicContact CD2-CD1 4.26Å; K1465-L1468 HydrophobicContact CB-CB 4.4Å; K1465-L1468 HydrophobicContact CB-CD1 4.39Å; K1465-L1468 HydrophobicContact CB-CG 4.32Å; K1465-L1468 HydrophobicContact CD-CD1 4.35Å; K1465-L1468 CarbonylContact O-C 3.52Å; K1465-L1468 WeakPolarHBondContact O-CA 3.32Å; K1465-L1468 PolarHBondContact O-N 3.08Å; K1465-L1468 VanDerWaalsContact O-N 3.09Å; S1466-L1468 PolarHBondContact O-N 3.18Å; L1468-Y1470 HydrophobicContact CD2-CE1 4.36Å; L1468-Y1470 WeakPolarHBondContact CD2-OH 3.37Å; L1468-Y1470 PolarHBondContact O-N 3.06Å; L1468-Y1470 VanDerWaalsContact O-N 3.1Å; L1468-L1471 HydrophobicContact CB-CD1 4.24Å; L1468-L1471 HydrophobicContact CB-CG 4.47Å; L1468-L1471 HydrophobicContact CD1-CD1 4.43Å; L1468-L1471 HydrophobicContact CD2-CD1 4.32Å; L1468-L1471 HydrophobicContact CG-CD1 4.48Å; L1468-L1471 WeakPolarHBondContact O-CA 3.3Å; L1468-L1471 VanDerWaalsContact O-CB 3.3Å; L1468-L1471 WeakPolarHBondContact O-CB 3.42Å; L1468-L1471 PolarHBondContact O-N 3.07Å
1469S86.6Confident89.3Confident48.8 Ų48.820.7 Ų20.734%0.34111%0.109SC..Hα-helixtrans-59.4-25.5-170.454.50000114.9K1465 S1466 L1471 A1472 R1520K1465-S1469 PolarHBondContact O-N 3.09Å; S1466-S1469 VanDerWaalsContact O-CB 3.3Å; S1466-S1469 WeakPolarHBondContact O-CB 3.37Å; S1466-S1469 PolarHBondContact O-N 3.19Å; S1466-S1469 VanDerWaalsContact O-N 3.13Å; S1466-S1469 PolarHBondContact O-OG 3.03Å; S1469-L1471 VanDerWaalsContact C-N 3.29Å; S1469-L1471 PolarHBondContact O-N 3.18Å; S1469-A1472 WeakPolarHBondContact O-CB 3.41Å; S1469-A1472 PolarHBondContact O-N 3.05Å; S1469-A1472 VanDerWaalsContact O-N 3.09Å; S1469-R1520 PolarHBondContact OG-NH2 3.44Å; S1469-R1520 VanDerWaalsContact OG-NH2 3.13Å
1470Y85.2Confident89.4Confident94.4 Ų94.420.6 Ų20.637%0.3711%0.108SC..Hα-helixtrans-65.8-29.3172.863.6-80.7000112.6P1325 E1467 L1468 A1472 S1473P1325-Y1470 VanDerWaalsContact CA-OH 3.23Å; P1325-Y1470 WeakPolarHBondContact CA-OH 3.33Å; P1325-Y1470 HydrophobicContact CB-CE1 4.44Å; P1325-Y1470 HydrophobicContact CB-CE2 4.17Å; P1325-Y1470 WeakPolarHBondContact CB-OH 3.43Å; P1325-Y1470 PolarHBondContact O-OH 3.23Å; E1467-Y1470 WeakPolarHBondContact O-CE1 3.33Å; L1468-Y1470 HydrophobicContact CD2-CE1 4.36Å; L1468-Y1470 WeakPolarHBondContact CD2-OH 3.37Å; L1468-Y1470 PolarHBondContact O-N 3.06Å; L1468-Y1470 VanDerWaalsContact O-N 3.1Å; Y1470-A1472 VanDerWaalsContact C-N 3.29Å; Y1470-A1472 PolarHBondContact O-N 3.02Å; Y1470-S1473 PolarHBondContact O-OG 3.2Å
1471L89Confident89.1Confident0.4 Ų0.420.8 Ų20.80%0.00211%0.109CC..Hα-helixtrans-73.1-21172-59.9-176.2000112.8L1328 Q1329 L1332 L1463 L1468 S1469 S1473 W1474 T1475L1328-L1471 HydrophobicContact CB-CD1 3.71Å; L1328-L1471 HydrophobicContact CD1-CD1 4.16Å; Q1329-L1471 HydrophobicContact CB-CD2 3.68Å; Q1329-L1471 HydrophobicContact CG-CD2 4.21Å; L1332-L1471 HydrophobicContact CD1-CB 3.88Å; L1332-L1471 HydrophobicContact CD1-CD1 4.07Å; L1332-L1471 HydrophobicContact CD1-CD2 4.08Å; L1332-L1471 HydrophobicContact CD1-CG 4.23Å; L1463-L1471 HydrophobicContact CD1-CD1 4.04Å; L1463-L1471 HydrophobicContact CD2-CD1 4.42Å; L1463-L1471 HydrophobicContact CG-CD1 4.39Å; L1468-L1471 HydrophobicContact CB-CD1 4.24Å; L1468-L1471 HydrophobicContact CB-CG 4.47Å; L1468-L1471 HydrophobicContact CD1-CD1 4.43Å; L1468-L1471 HydrophobicContact CD2-CD1 4.32Å; L1468-L1471 HydrophobicContact CG-CD1 4.48Å; L1468-L1471 WeakPolarHBondContact O-CA 3.3Å; L1468-L1471 VanDerWaalsContact O-CB 3.3Å; L1468-L1471 WeakPolarHBondContact O-CB 3.42Å; L1468-L1471 PolarHBondContact O-N 3.07Å; S1469-L1471 VanDerWaalsContact C-N 3.29Å; S1469-L1471 PolarHBondContact O-N 3.18Å; L1471-S1473 PolarHBondContact O-N 3.05Å; L1471-S1473 VanDerWaalsContact O-N 3.14Å; L1471-W1474 PolarHBondContact O-N 3.02Å; L1471-T1475 WeakPolarHBondContact O-CB 3.47Å; L1471-T1475 PolarHBondContact O-N 2.85Å; L1471-T1475 PolarHBondContact O-OG1 3.23Å; L1471-T1475 VanDerWaalsContact O-OG1 3.14Å
1472A89.5Confident88.9Confident2.8 Ų2.820.5 Ų20.52%0.02311%0.108CC..Hα-helixtrans-59.9-31.7-178.300000112.1L1464 S1469 Y1470 W1474 T1475 V1476 V1517 E1521L1464-A1472 HydrophobicContact CD2-CB 4.4Å; S1469-A1472 WeakPolarHBondContact O-CB 3.41Å; S1469-A1472 PolarHBondContact O-N 3.05Å; S1469-A1472 VanDerWaalsContact O-N 3.09Å; Y1470-A1472 VanDerWaalsContact C-N 3.29Å; Y1470-A1472 PolarHBondContact O-N 3.02Å; A1472-W1474 PolarHBondContact O-N 3.2Å; A1472-W1474 VanDerWaalsContact O-N 3.14Å; A1472-T1475 PolarHBondContact O-N 3.22Å; A1472-T1475 VanDerWaalsContact O-N 3.16Å; A1472-V1476 HydrophobicContact CB-CG2 4.28Å; A1472-V1476 WeakPolarHBondContact O-CB 3.42Å; A1472-V1476 WeakPolarHBondContact O-CG2 3.31Å; A1472-V1476 PolarHBondContact O-N 3.25Å; A1472-V1517 HydrophobicContact CB-CG1 3.48Å; A1472-V1517 VanDerWaalsContact CB-CG1 3.47Å; A1472-E1521 HydrophobicContact CB-CG 3.66Å
1473S89.4Confident88.9Confident8 Ų819.4 Ų19.46%0.05610%0.1CC..Hα-helixtrans-57.4-24.4173.4670000114.3Y1470 L1471 P1477 E1521 S1534 A1535Y1470-S1473 PolarHBondContact O-OG 3.2Å; L1471-S1473 PolarHBondContact O-N 3.05Å; L1471-S1473 VanDerWaalsContact O-N 3.14Å; S1473-P1477 WeakPolarHBondContact O-CD 3.29Å; S1473-P1477 WeakPolarHBondContact O-CG 3.35Å; S1473-E1521 VanDerWaalsContact CA-OE2 3.26Å; S1473-E1521 WeakPolarHBondContact CA-OE2 3.34Å; S1473-E1521 VanDerWaalsContact CB-OE2 3.26Å; S1473-E1521 WeakPolarHBondContact CB-OE2 3.25Å; S1473-E1521 PolarHBondContact N-OE2 2.95Å; S1473-S1534 PolarHBondContact OG-OG 3.12Å; S1473-A1535 VanDerWaalsContact O-CB 3.27Å; S1473-A1535 WeakPolarHBondContact O-CB 3.29Å
1474W89.7Confident88.7Confident3.2 Ų3.219.5 Ų19.51%0.01210%0.102CC..Hα-helixtrans-98.2-43.4171.4-62.996.6000112.4L1332 E1333 A1336 L1471 A1472 P1477 L1478 F1531 A1535 K1538 L1539L1332-W1474 HydrophobicContact CB-CB 4.03Å; L1332-W1474 HydrophobicContact CB-CG 4.49Å; L1332-W1474 HydrophobicContact CD1-CB 4.32Å; E1333-W1474 HydrophobicContact CG-CD2 4.05Å; E1333-W1474 HydrophobicContact CG-CE3 4.15Å; E1333-W1474 HydrophobicContact CG-CH2 3.67Å; E1333-W1474 HydrophobicContact CG-CZ2 3.51Å; E1333-W1474 VanDerWaalsContact CG-CZ2 3.49Å; E1333-W1474 HydrophobicContact CG-CZ3 3.98Å; A1336-W1474 HydrophobicContact CB-CE3 3.7Å; A1336-W1474 HydrophobicContact CB-CZ3 3.84Å; L1471-W1474 PolarHBondContact O-N 3.02Å; A1472-W1474 PolarHBondContact O-N 3.2Å; A1472-W1474 VanDerWaalsContact O-N 3.14Å; W1474-P1477 WeakPolarHBondContact O-CD 3.39Å; W1474-L1478 WeakPolarHBondContact O-CB 3.21Å; W1474-L1478 VanDerWaalsContact O-CG 3.31Å; W1474-L1478 WeakPolarHBondContact O-CG 3.29Å; W1474-L1478 PolarHBondContact O-N 3.07Å; W1474-F1531 HydrophobicContact CD2-CE1 4.45Å; W1474-F1531 HydrophobicContact CE3-CD1 4.32Å; W1474-F1531 AromaticContact CE3-CE1 3.78Å; W1474-F1531 HydrophobicContact CE3-CE1 3.83Å; W1474-F1531 HydrophobicContact CE3-CZ 4.41Å; W1474-F1531 HydrophobicContact CZ3-CD1 4.47Å; W1474-F1531 HydrophobicContact CZ3-CE1 4.37Å; W1474-A1535 HydrophobicContact CD2-CB 3.51Å; W1474-A1535 VanDerWaalsContact CD2-CB 3.44Å; W1474-A1535 VanDerWaalsContact CE2-CB 3.45Å; W1474-A1535 HydrophobicContact CE3-CB 3.75Å; W1474-A1535 HydrophobicContact CG-CB 4.04Å; W1474-A1535 HydrophobicContact CH2-CB 3.95Å; W1474-A1535 WeakPolarHBondContact CH2-O 3.2Å; W1474-A1535 VanDerWaalsContact CZ2-CA 3.42Å; W1474-A1535 HydrophobicContact CZ2-CB 3.74Å; W1474-A1535 HydrophobicContact CZ3-CB 3.96Å; W1474-K1538 HydrophobicContact CH2-CB 4.13Å; W1474-K1538 HydrophobicContact CH2-CD 4.25Å; W1474-K1538 HydrophobicContact CZ2-CB 4.18Å; W1474-K1538 HydrophobicContact CZ2-CD 3.8Å; W1474-K1538 HydrophobicContact CZ2-CG 4.49Å; W1474-L1539 HydrophobicContact CH2-CD1 4.45Å; W1474-L1539 HydrophobicContact CH2-CD2 4.45Å; W1474-L1539 HydrophobicContact CH2-CG 4.14Å; W1474-L1539 HydrophobicContact CZ3-CD1 3.93Å; W1474-L1539 HydrophobicContact CZ3-CD2 4.31Å; W1474-L1539 HydrophobicContact CZ3-CG 3.98Å
1475T91.8Very high88.4Confident0.4 Ų0.419.5 Ų19.50%0.00210%0.102CC..Hα-helixtrans-65.9-43.1-174.2-530000112.2L1332 L1460 L1463 L1464 L1471 A1472 L1478 V1479L1332-T1475 WeakPolarHBondContact CD1-OG1 3.23Å; L1460-T1475 HydrophobicContact CB-CG2 4.05Å; L1460-T1475 HydrophobicContact CD2-CG2 4.04Å; L1460-T1475 VanDerWaalsContact O-CG2 3.26Å; L1460-T1475 WeakPolarHBondContact O-CG2 3.28Å; L1463-T1475 HydrophobicContact CB-CG2 4.12Å; L1463-T1475 HydrophobicContact CD1-CG2 4.4Å; L1464-T1475 HydrophobicContact CD2-CG2 3.74Å; L1464-T1475 HydrophobicContact CG-CG2 4.11Å; L1471-T1475 WeakPolarHBondContact O-CB 3.47Å; L1471-T1475 PolarHBondContact O-N 2.85Å; L1471-T1475 PolarHBondContact O-OG1 3.23Å; L1471-T1475 VanDerWaalsContact O-OG1 3.14Å; A1472-T1475 PolarHBondContact O-N 3.22Å; A1472-T1475 VanDerWaalsContact O-N 3.16Å; T1475-L1478 WeakPolarHBondContact O-CB 3.36Å; T1475-L1478 PolarHBondContact O-N 3.24Å; T1475-V1479 HydrophobicContact CG2-CG2 4.35Å; T1475-V1479 WeakPolarHBondContact O-CG2 3.34Å; T1475-V1479 PolarHBondContact O-N 3.26Å
1476V92.5Very high88Confident0 Ų019.2 Ų19.20%010%0.103CC..Hα-helixtrans-65.9-50.7-175.9174.10000111.8L1464 A1472 L1478 V1479 L1480 L1518 E1521 L1522 I1526L1464-V1476 HydrophobicContact CD2-CG2 3.8Å; A1472-V1476 HydrophobicContact CB-CG2 4.28Å; A1472-V1476 WeakPolarHBondContact O-CB 3.42Å; A1472-V1476 WeakPolarHBondContact O-CG2 3.31Å; A1472-V1476 PolarHBondContact O-N 3.25Å; V1476-L1478 VanDerWaalsContact C-N 3.26Å; V1476-L1478 PolarHBondContact O-N 3.09Å; V1476-V1479 PolarHBondContact O-N 3.32Å; V1476-V1479 VanDerWaalsContact O-N 3.1Å; V1476-L1480 HydrophobicContact CG1-CD1 4.25Å; V1476-L1480 HydrophobicContact CG1-CG 4.33Å; V1476-L1480 WeakPolarHBondContact O-CG 3.35Å; V1476-L1480 PolarHBondContact O-N 3.17Å; V1476-L1518 HydrophobicContact CG1-CG 4.19Å; V1476-L1518 HydrophobicContact CG2-CB 4.36Å; V1476-L1518 HydrophobicContact CG2-CG 4.29Å; V1476-E1521 HydrophobicContact CB-CB 4.38Å; V1476-E1521 HydrophobicContact CG1-CB 4.43Å; V1476-E1521 HydrophobicContact CG2-CB 4.25Å; V1476-E1521 HydrophobicContact CG2-CG 4.46Å; V1476-L1522 HydrophobicContact CG1-CD2 4.37Å; V1476-I1526 HydrophobicContact CG1-CG2 4.17Å
1477P89.6Confident87.8Confident0 Ų017.1 Ų17.10%09%0.089CC..Hα-helixtrans-58.3-36173.8-27.637.6000113.7S1473 W1474 H1481 I1526 G1530 F1531S1473-P1477 WeakPolarHBondContact O-CD 3.29Å; S1473-P1477 WeakPolarHBondContact O-CG 3.35Å; W1474-P1477 WeakPolarHBondContact O-CD 3.39Å; P1477-H1481 VanDerWaalsContact O-CB 3.27Å; P1477-H1481 WeakPolarHBondContact O-CB 3.43Å; P1477-H1481 PolarHBondContact O-N 3.3Å; P1477-I1526 HydrophobicContact CG-CD1 4.22Å; P1477-I1526 HydrophobicContact CG-CG1 4.17Å; P1477-I1526 HydrophobicContact CG-CG2 4.38Å; P1477-G1530 WeakPolarHBondContact CB-O 3.19Å; P1477-F1531 HydrophobicContact CB-CD1 3.64Å; P1477-F1531 HydrophobicContact CB-CD2 4.28Å; P1477-F1531 HydrophobicContact CB-CE1 3.58Å; P1477-F1531 HydrophobicContact CB-CE2 4.23Å; P1477-F1531 HydrophobicContact CB-CG 4.01Å; P1477-F1531 HydrophobicContact CB-CZ 3.89Å; P1477-F1531 HydrophobicContact CG-CD1 3.64Å; P1477-F1531 HydrophobicContact CG-CE1 3.93Å; P1477-F1531 HydrophobicContact CG-CG 4.2Å; P1477-F1531 HydrophobicContact CG-CZ 4.39Å
1478L90.6Very high87.9Confident1.8 Ų1.811.4 Ų11.41%0.0096%0.062CC..Hα-helixtrans-64.5-46.9174.4-82.5171.6000112.2L1332 L1335 A1336 C1339 H1340 L1460 W1474 T1475 V1476 L1480 H1481 C1482 F1531L1332-L1478 HydrophobicContact CD2-CD1 3.98Å; L1335-L1478 HydrophobicContact CB-CD1 4.05Å; A1336-L1478 HydrophobicContact CB-CD1 4.45Å; A1336-L1478 HydrophobicContact CB-CD2 4.4Å; C1339-L1478 HydrophobicContact CB-CD2 4.3Å; H1340-L1478 HydrophobicContact CB-CD2 4.46Å; L1460-L1478 HydrophobicContact CD1-CB 3.9Å; L1460-L1478 HydrophobicContact CD2-CB 4.34Å; L1460-L1478 HydrophobicContact CD2-CD1 4.3Å; W1474-L1478 WeakPolarHBondContact O-CB 3.21Å; W1474-L1478 VanDerWaalsContact O-CG 3.31Å; W1474-L1478 WeakPolarHBondContact O-CG 3.29Å; W1474-L1478 PolarHBondContact O-N 3.07Å; T1475-L1478 WeakPolarHBondContact O-CB 3.36Å; T1475-L1478 PolarHBondContact O-N 3.24Å; V1476-L1478 VanDerWaalsContact C-N 3.26Å; V1476-L1478 PolarHBondContact O-N 3.09Å; L1478-L1480 PolarHBondContact O-N 2.77Å; L1478-H1481 PolarHBondContact O-N 2.98Å; L1478-C1482 PolarHBondContact O-N 3.02Å; L1478-C1482 PolarHBondContact O-SG 3.15Å; L1478-F1531 HydrophobicContact CD2-CZ 4.44Å; L1478-F1531 HydrophobicContact CG-CZ 4.39Å
1479V92.5Very high88Confident0.8 Ų0.810.3 Ų10.31%0.0056%0.057CC..Hα-helixtrans-57.9-51.8174.9171.10000110.2L1460 T1475 V1476 H1481 C1482 L1483 F1492L1460-V1479 HydrophobicContact CB-CG2 3.49Å; L1460-V1479 VanDerWaalsContact CB-CG2 3.47Å; L1460-V1479 HydrophobicContact CD1-CG2 4.16Å; L1460-V1479 HydrophobicContact CG-CG2 4.43Å; T1475-V1479 HydrophobicContact CG2-CG2 4.35Å; T1475-V1479 WeakPolarHBondContact O-CG2 3.34Å; T1475-V1479 PolarHBondContact O-N 3.26Å; V1476-V1479 PolarHBondContact O-N 3.32Å; V1476-V1479 VanDerWaalsContact O-N 3.1Å; V1479-H1481 VanDerWaalsContact C-N 3.29Å; V1479-H1481 PolarHBondContact O-N 3.12Å; V1479-C1482 CarbonylContact O-C 3.55Å; V1479-C1482 WeakPolarHBondContact O-CA 3.4Å; V1479-C1482 VanDerWaalsContact O-CB 3.3Å; V1479-C1482 WeakPolarHBondContact O-CB 3.38Å; V1479-C1482 PolarHBondContact O-N 2.92Å; V1479-C1482 VanDerWaalsContact O-N 3.11Å; V1479-L1483 HydrophobicContact CG1-CG 4.49Å; V1479-L1483 WeakPolarHBondContact O-CG 3.33Å; V1479-L1483 PolarHBondContact O-N 3.06Å; V1479-L1483 VanDerWaalsContact O-N 3.15Å; V1479-F1492 HydrophobicContact CG1-CD2 4.08Å; V1479-F1492 HydrophobicContact CG1-CE2 3.75Å; V1479-F1492 HydrophobicContact CG1-CZ 4.18Å
1480L90.5Very high88.1Confident0 Ų09.7 Ų9.70%05%0.049CC..Hα-helixtrans-63.1-35.1-178-61.6-171.2000112.3V1476 L1478 C1482 L1483 S1484 L1522 I1526 I1610 V1614V1476-L1480 HydrophobicContact CG1-CD1 4.25Å; V1476-L1480 HydrophobicContact CG1-CG 4.33Å; V1476-L1480 WeakPolarHBondContact O-CG 3.35Å; V1476-L1480 PolarHBondContact O-N 3.17Å; L1478-L1480 PolarHBondContact O-N 2.77Å; L1480-C1482 VanDerWaalsContact C-N 3.34Å; L1480-C1482 PolarHBondContact O-N 3.02Å; L1480-L1483 HydrophobicContact CD2-CD1 3.97Å; L1480-L1483 WeakPolarHBondContact O-CB 3.22Å; L1480-L1483 PolarHBondContact O-N 2.99Å; L1480-L1483 VanDerWaalsContact O-N 3.16Å; L1480-S1484 PolarHBondContact O-N 3.05Å; L1480-L1522 HydrophobicContact CD1-CD1 4.17Å; L1480-L1522 HydrophobicContact CD1-CD2 3.88Å; L1480-I1526 HydrophobicContact CD1-CG2 3.69Å; L1480-I1526 WeakPolarHBondContact CD1-O 3.34Å; L1480-I1610 HydrophobicContact CB-CD1 4.27Å; L1480-I1610 HydrophobicContact CB-CG2 4.38Å; L1480-I1610 HydrophobicContact CD1-CG2 4.22Å; L1480-I1610 HydrophobicContact CD2-CG2 4.16Å; L1480-I1610 HydrophobicContact CG-CG2 4.46Å; L1480-I1610 VanDerWaalsContact O-CD1 3.25Å; L1480-I1610 WeakPolarHBondContact O-CD1 3.45Å; L1480-V1614 HydrophobicContact CD2-CG2 4.3Å
1481H87.3Confident88.2Confident6.8 Ų6.86.1 Ų6.13%0.0314%0.037CC..Hα-helixtrans-63.8-41.3171.3-178.468.1000111.9C1339 H1340 D1343 P1477 L1478 V1479 L1483 S1484 F1485C1339-H1481 PolarHBondContact O-CE1 3.35Å; C1339-H1481 PolarHBondContact O-ND1 3.32Å; C1339-H1481 PolarHBondContact O-NE2 3.35Å; C1339-H1481 VanDerWaalsContact O-NE2 3.12Å; H1340-H1481 AromaticContact CD2-CG 3.86Å; H1340-H1481 AromaticContact ND1-CG 3.67Å; H1340-H1481 AromaticContact ND1-ND1 3.76Å; D1343-H1481 IonicContact OD1-CE1 3.06Å; P1477-H1481 VanDerWaalsContact O-CB 3.27Å; P1477-H1481 WeakPolarHBondContact O-CB 3.43Å; P1477-H1481 PolarHBondContact O-N 3.3Å; L1478-H1481 PolarHBondContact O-N 2.98Å; V1479-H1481 VanDerWaalsContact C-N 3.29Å; V1479-H1481 PolarHBondContact O-N 3.12Å; H1481-L1483 VanDerWaalsContact C-N 3.31Å; H1481-L1483 PolarHBondContact O-N 3.03Å; H1481-S1484 VanDerWaalsContact O-CB 3.24Å; H1481-S1484 WeakPolarHBondContact O-CB 3.34Å; H1481-S1484 PolarHBondContact O-N 3Å; H1481-S1484 VanDerWaalsContact O-N 3.07Å; H1481-S1484 PolarHBondContact O-OG 3.19Å; H1481-F1485 AromaticContact CD2-CE2 3.78Å; H1481-F1485 AromaticContact CE1-CE2 3.89Å; H1481-F1485 AromaticContact ND1-CE2 3.86Å; H1481-F1485 AromaticContact NE2-CE2 3.63Å; H1481-F1485 AromaticContact NE2-CZ 3.81Å; H1481-F1485 WeakPolarHBondContact O-CD2 3.35Å; H1481-F1485 WeakPolarHBondContact O-CE2 3.09Å
1482C88.5Confident88.4Confident1.2 Ų1.26.1 Ų6.11%0.0084%0.038CC..Hα-helixtrans-61.7-28.9175.2-64.50000113.1I1452 L1456 I1457 L1478 V1479 L1480 S1484 F1485I1452-C1482 HydrophobicContact CG2-CB 4.36Å; L1456-C1482 VanDerWaalsContact CD2-SG 3.51Å; L1456-C1482 WeakPolarHBondContact CD2-SG 3.18Å; I1457-C1482 HydrophobicContact CD1-CB 4.07Å; I1457-C1482 HydrophobicContact CG1-CB 3.7Å; L1478-C1482 PolarHBondContact O-N 3.02Å; L1478-C1482 PolarHBondContact O-SG 3.15Å; V1479-C1482 CarbonylContact O-C 3.55Å; V1479-C1482 WeakPolarHBondContact O-CA 3.4Å; V1479-C1482 VanDerWaalsContact O-CB 3.3Å; V1479-C1482 WeakPolarHBondContact O-CB 3.38Å; V1479-C1482 PolarHBondContact O-N 2.92Å; V1479-C1482 VanDerWaalsContact O-N 3.11Å; L1480-C1482 VanDerWaalsContact C-N 3.34Å; L1480-C1482 PolarHBondContact O-N 3.02Å; C1482-S1484 PolarHBondContact O-N 3.16Å; C1482-F1485 PolarHBondContact O-N 3.03Å
1483L88.3Confident88.5Confident0 Ų06.2 Ų6.20%04%0.037CC..THydrogen-bonded Turntrans-70.3-10.7174.7-51.5-174.6000113.9I1457 V1479 L1480 H1481 F1485 F1492 I1610 A1613I1457-L1483 HydrophobicContact CD1-CD2 4.42Å; V1479-L1483 HydrophobicContact CG1-CG 4.49Å; V1479-L1483 WeakPolarHBondContact O-CG 3.33Å; V1479-L1483 PolarHBondContact O-N 3.06Å; V1479-L1483 VanDerWaalsContact O-N 3.15Å; L1480-L1483 HydrophobicContact CD2-CD1 3.97Å; L1480-L1483 WeakPolarHBondContact O-CB 3.22Å; L1480-L1483 PolarHBondContact O-N 2.99Å; L1480-L1483 VanDerWaalsContact O-N 3.16Å; H1481-L1483 VanDerWaalsContact C-N 3.31Å; H1481-L1483 PolarHBondContact O-N 3.03Å; L1483-F1485 VanDerWaalsContact C-N 3.27Å; L1483-F1485 PolarHBondContact O-N 3.35Å; L1483-F1492 HydrophobicContact CD1-CD1 3.83Å; L1483-F1492 HydrophobicContact CD1-CE1 4.06Å; L1483-F1492 HydrophobicContact CD1-CG 4.37Å; L1483-F1492 HydrophobicContact CD2-CB 3.36Å; L1483-F1492 VanDerWaalsContact CD2-CB 3.41Å; L1483-F1492 HydrophobicContact CD2-CD1 3.82Å; L1483-F1492 VanDerWaalsContact CD2-CD1 3.5Å; L1483-F1492 HydrophobicContact CD2-CD2 4.35Å; L1483-F1492 HydrophobicContact CD2-CE1 4.27Å; L1483-F1492 HydrophobicContact CD2-CG 3.61Å; L1483-F1492 VanDerWaalsContact CD2-CG 3.44Å; L1483-F1492 HydrophobicContact CG-CD1 4.43Å; L1483-I1610 HydrophobicContact CB-CG1 4.14Å; L1483-I1610 HydrophobicContact CD1-CG1 4.48Å; L1483-A1613 HydrophobicContact CD1-CB 3.63Å
1484S83.9Confident88.5Confident13.4 Ų13.412.5 Ų12.59%0.0946%0.064CC..THydrogen-bonded Turntrans-86.7-2.6177.162.70000113.9R1346 L1480 H1481 C1482R1346-S1484 PolarHBondContact NH1-O 3.07Å; R1346-S1484 PolarHBondContact NH2-O 2.82Å; R1346-S1484 VanDerWaalsContact NH2-O 3.11Å; L1480-S1484 PolarHBondContact O-N 3.05Å; H1481-S1484 VanDerWaalsContact O-CB 3.24Å; H1481-S1484 WeakPolarHBondContact O-CB 3.34Å; H1481-S1484 PolarHBondContact O-N 3Å; H1481-S1484 VanDerWaalsContact O-N 3.07Å; H1481-S1484 PolarHBondContact O-OG 3.19Å; C1482-S1484 PolarHBondContact O-N 3.16Å
1485F85.2Confident88.6Confident1.2 Ų1.214.1 Ų14.11%0.0057%0.072CC..SBendtrans-95.5148.9175.9-68.4-93.3000111.4L1345 R1346 L1349 I1452 H1481 C1482 L1483 G1487 G1488L1345-F1485 HydrophobicContact CB-CD1 4.42Å; L1345-F1485 HydrophobicContact CB-CE1 3.71Å; L1345-F1485 HydrophobicContact CB-CZ 3.74Å; L1345-F1485 HydrophobicContact CD1-CE2 4.44Å; L1345-F1485 HydrophobicContact CD1-CZ 4.34Å; R1346-F1485 HydrophobicContact CB-CE1 4.03Å; R1346-F1485 HydrophobicContact CB-CZ 4.19Å; R1346-F1485 HydrophobicContact CG-CE1 4.16Å; R1346-F1485 HydrophobicContact CG-CZ 4.48Å; L1349-F1485 HydrophobicContact CD1-CD1 3.67Å; L1349-F1485 HydrophobicContact CD1-CE1 4Å; L1349-F1485 HydrophobicContact CD2-CD1 4.3Å; I1452-F1485 HydrophobicContact CD1-CB 3.73Å; I1452-F1485 HydrophobicContact CD1-CD1 3.77Å; I1452-F1485 HydrophobicContact CD1-CD2 4.05Å; I1452-F1485 HydrophobicContact CD1-CE1 4.2Å; I1452-F1485 HydrophobicContact CD1-CE2 4.41Å; I1452-F1485 HydrophobicContact CD1-CG 3.57Å; I1452-F1485 VanDerWaalsContact CD1-CG 3.42Å; H1481-F1485 AromaticContact CD2-CE2 3.78Å; H1481-F1485 AromaticContact CE1-CE2 3.89Å; H1481-F1485 AromaticContact ND1-CE2 3.86Å; H1481-F1485 AromaticContact NE2-CE2 3.63Å; H1481-F1485 AromaticContact NE2-CZ 3.81Å; H1481-F1485 WeakPolarHBondContact O-CD2 3.35Å; H1481-F1485 WeakPolarHBondContact O-CE2 3.09Å; C1482-F1485 PolarHBondContact O-N 3.03Å; L1483-F1485 VanDerWaalsContact C-N 3.27Å; L1483-F1485 PolarHBondContact O-N 3.35Å; F1485-G1487 PolarHBondContact O-N 3.13Å; F1485-G1488 PolarHBondContact O-N 3.04Å; F1485-G1488 VanDerWaalsContact O-N 3.13Å
1486P81.5Confident88.6Confident25.8 Ų25.814.1 Ų14.117%0.1687%0.072CC..THydrogen-bonded Turntrans-51.6132.2176-18.723.2000112.4V1210 P1214 Y1449 H1453 G1488V1210-P1486 CarbonylContact O-C 3.57Å; V1210-P1486 VanDerWaalsContact O-CA 3.26Å; V1210-P1486 WeakPolarHBondContact O-CA 3.39Å; P1214-P1486 HydrophobicContact CG-CB 4.11Å; Y1449-P1486 HydrophobicContact CE1-CB 3.9Å; Y1449-P1486 HydrophobicContact CE1-CG 3.99Å; Y1449-P1486 WeakPolarHBondContact CE1-O 3.47Å; Y1449-P1486 WeakPolarHBondContact OH-CG 3.44Å; H1453-P1486 PolarHBondContact CE1-O 3.17Å; H1453-P1486 PolarHBondContact NE2-O 2.92Å; P1486-G1488 PolarHBondContact O-N 3.2Å; P1486-G1488 VanDerWaalsContact O-N 3.09Å
1487G81.9Confident88.5Confident5 Ų515 Ų155%0.0528%0.076CC..THydrogen-bonded Turntrans76.8-23.2-178.500000116V1210 D1212 H1453 F1485 F1489 N1490 V1491V1210-G1487 PolarHBondContact O-N 3.2Å; D1212-G1487 PolarHBondContact O-N 2.88Å; H1453-G1487 VanDerWaalsContact NE2-C 3.3Å; H1453-G1487 WeakPolarHBondContact NE2-CA 3.14Å; F1485-G1487 PolarHBondContact O-N 3.13Å; G1487-F1489 VanDerWaalsContact C-N 3.31Å; G1487-F1489 PolarHBondContact O-N 3.23Å; G1487-N1490 WeakPolarHBondContact O-CB 3.39Å; G1487-N1490 PolarHBondContact O-N 3.2Å; G1487-V1491 PolarHBondContact O-N 3.3Å
1488G86.7Confident88.5Confident0.2 Ų0.220 Ų200%0.00210%0.099CC..Hα-helixtrans-58.5-39.3-176.100000113.7H1453 I1457 F1485 P1486 N1490 V1491 F1492H1453-G1488 PolarHBondContact NE2-N 3.14Å; I1457-G1488 WeakPolarHBondContact CD1-O 3.28Å; F1485-G1488 PolarHBondContact O-N 3.04Å; F1485-G1488 VanDerWaalsContact O-N 3.13Å; P1486-G1488 PolarHBondContact O-N 3.2Å; P1486-G1488 VanDerWaalsContact O-N 3.09Å; G1488-N1490 VanDerWaalsContact C-N 3.29Å; G1488-N1490 PolarHBondContact O-N 3.18Å; G1488-V1491 PolarHBondContact O-N 3.07Å; G1488-F1492 PolarHBondContact O-N 3.31Å; G1488-F1492 VanDerWaalsContact O-N 3.17Å
1489F88.2Confident88.5Confident2 Ų220.6 Ų20.61%0.00910%0.102CC..Hα-helixtrans-54.2-43171.4172.6-100.9000112.9V1211 G1487 V1491 F1492 W1493 L1609 A1613 K1747V1211-F1489 HydrophobicContact CG1-CD1 4.38Å; V1211-F1489 HydrophobicContact CG2-CD1 4.04Å; V1211-F1489 HydrophobicContact CG2-CE1 4.38Å; G1487-F1489 VanDerWaalsContact C-N 3.31Å; G1487-F1489 PolarHBondContact O-N 3.23Å; F1489-V1491 VanDerWaalsContact C-N 3.35Å; F1489-V1491 PolarHBondContact O-N 2.99Å; F1489-F1492 PolarHBondContact O-N 2.85Å; F1489-W1493 AromaticContact CE1-CE3 3.93Å; F1489-W1493 HydrophobicContact CE1-CE3 4.01Å; F1489-W1493 HydrophobicContact CE1-CZ3 4.44Å; F1489-W1493 AromaticContact CE2-CE3 3.81Å; F1489-W1493 HydrophobicContact CE2-CE3 3.9Å; F1489-W1493 AromaticContact CE2-CZ3 3.95Å; F1489-W1493 HydrophobicContact CE2-CZ3 4.23Å; F1489-W1493 HydrophobicContact CZ-CD2 4.4Å; F1489-W1493 AromaticContact CZ-CE3 3.39Å; F1489-W1493 HydrophobicContact CZ-CE3 3.39Å; F1489-W1493 VanDerWaalsContact CZ-CE3 3.45Å; F1489-W1493 AromaticContact CZ-CZ3 3.6Å; F1489-W1493 HydrophobicContact CZ-CZ3 3.6Å; F1489-W1493 VanDerWaalsContact CZ-CZ3 3.47Å; F1489-W1493 VanDerWaalsContact O-CB 3.28Å; F1489-W1493 WeakPolarHBondContact O-CB 3.31Å; F1489-W1493 PolarHBondContact O-N 3.2Å; F1489-L1609 HydrophobicContact CB-CB 4.4Å; F1489-L1609 HydrophobicContact CB-CD1 4.23Å; F1489-L1609 HydrophobicContact CD2-CB 3.82Å; F1489-L1609 HydrophobicContact CD2-CD2 4.4Å; F1489-L1609 VanDerWaalsContact CD2-O 3.25Å; F1489-L1609 WeakPolarHBondContact CD2-O 3.39Å; F1489-L1609 HydrophobicContact CE2-CB 4.33Å; F1489-L1609 HydrophobicContact CE2-CD2 4.41Å; F1489-L1609 WeakPolarHBondContact CE2-O 3.33Å; F1489-L1609 HydrophobicContact CG-CB 4.19Å; F1489-L1609 HydrophobicContact CG-CD1 4.4Å; F1489-L1609 HydrophobicContact CG-CD2 4.44Å; F1489-L1609 HydrophobicContact CZ-CD2 4.46Å; F1489-A1613 HydrophobicContact CD2-CB 4.02Å; F1489-A1613 HydrophobicContact CE2-CB 3.98Å; F1489-K1747 HydrophobicContact CE1-CB 4.22Å; F1489-K1747 HydrophobicContact CE1-CD 4.03Å; F1489-K1747 HydrophobicContact CE1-CG 4.12Å; F1489-K1747 HydrophobicContact CZ-CB 4.36Å
1490N87.4Confident88.5Confident35.4 Ų35.420.6 Ų20.619%0.18910%0.103CC..Hα-helixtrans-70.1-34.8-178.4-74.6-27.6000112.8V1211 F1213 G1487 G1488 W1493 K1494 K1747V1211-N1490 PolarHBondContact O-ND2 3.2Å; F1213-N1490 HydrophobicContact CD2-CB 4.13Å; F1213-N1490 HydrophobicContact CE2-CB 3.31Å; F1213-N1490 HydrophobicContact CZ-CB 3.65Å; G1487-N1490 WeakPolarHBondContact O-CB 3.39Å; G1487-N1490 PolarHBondContact O-N 3.2Å; G1488-N1490 VanDerWaalsContact C-N 3.29Å; G1488-N1490 PolarHBondContact O-N 3.18Å; N1490-W1493 PolarHBondContact O-N 2.92Å; N1490-K1494 WeakPolarHBondContact O-CB 3.41Å; N1490-K1494 VanDerWaalsContact O-CG 3.3Å; N1490-K1494 WeakPolarHBondContact O-CG 3.27Å; N1490-K1494 PolarHBondContact O-N 3.3Å; N1490-K1747 VanDerWaalsContact OD1-CE 3.31Å; N1490-K1747 WeakPolarHBondContact OD1-CE 3.32Å; N1490-K1747 PolarHBondContact OD1-NZ 3.31Å; N1490-K1747 VanDerWaalsContact OD1-NZ 3.14Å
1491V89.1Confident88.4Confident19 Ų1922.4 Ų22.412%0.11512%0.115CC..Hα-helixtrans-65.6-50.3177.1177.30000110F1213 H1453 I1457 G1487 G1488 F1489 W1493 K1494 L1495F1213-V1491 HydrophobicContact CE1-CG2 3.75Å; F1213-V1491 HydrophobicContact CE2-CG2 4.09Å; F1213-V1491 HydrophobicContact CZ-CG2 3.73Å; H1453-V1491 HydrophobicContact CB-CG2 3.88Å; H1453-V1491 VanDerWaalsContact CD2-CG2 3.47Å; H1453-V1491 WeakPolarHBondContact CD2-CG2 3.29Å; H1453-V1491 WeakPolarHBondContact O-CG1 3.35Å; I1457-V1491 HydrophobicContact CB-CG1 4.25Å; I1457-V1491 HydrophobicContact CD1-CB 4.31Å; I1457-V1491 HydrophobicContact CD1-CG1 4.43Å; I1457-V1491 HydrophobicContact CG2-CG1 4.07Å; G1487-V1491 PolarHBondContact O-N 3.3Å; G1488-V1491 PolarHBondContact O-N 3.07Å; F1489-V1491 VanDerWaalsContact C-N 3.35Å; F1489-V1491 PolarHBondContact O-N 2.99Å; V1491-W1493 VanDerWaalsContact C-N 3.32Å; V1491-W1493 PolarHBondContact O-N 3.13Å; V1491-K1494 PolarHBondContact O-N 3.21Å; V1491-L1495 HydrophobicContact CG1-CD1 4.15Å; V1491-L1495 WeakPolarHBondContact O-CB 3.34Å; V1491-L1495 WeakPolarHBondContact O-CG 3.38Å; V1491-L1495 PolarHBondContact O-N 3.15Å
1492F92.3Very high88.5Confident1.8 Ų1.824.3 Ų24.31%0.00812%0.124CC..Hα-helixtrans-62.7-39.9178.1-175.4-111.4000112.6I1457 W1461 V1479 L1483 G1488 F1489 K1494 L1495 I1496 L1518 A1613I1457-F1492 HydrophobicContact CG2-CB 4.14Å; I1457-F1492 HydrophobicContact CG2-CD2 4.28Å; W1461-F1492 HydrophobicContact CE3-CD2 4.48Å; W1461-F1492 AromaticContact CE3-CE2 3.72Å; W1461-F1492 HydrophobicContact CE3-CE2 3.72Å; W1461-F1492 HydrophobicContact CE3-CZ 4.44Å; W1461-F1492 AromaticContact CZ3-CE2 3.86Å; W1461-F1492 HydrophobicContact CZ3-CE2 3.86Å; W1461-F1492 HydrophobicContact CZ3-CZ 4.22Å; V1479-F1492 HydrophobicContact CG1-CD2 4.08Å; V1479-F1492 HydrophobicContact CG1-CE2 3.75Å; V1479-F1492 HydrophobicContact CG1-CZ 4.18Å; L1483-F1492 HydrophobicContact CD1-CD1 3.83Å; L1483-F1492 HydrophobicContact CD1-CE1 4.06Å; L1483-F1492 HydrophobicContact CD1-CG 4.37Å; L1483-F1492 HydrophobicContact CD2-CB 3.36Å; L1483-F1492 VanDerWaalsContact CD2-CB 3.41Å; L1483-F1492 HydrophobicContact CD2-CD1 3.82Å; L1483-F1492 VanDerWaalsContact CD2-CD1 3.5Å; L1483-F1492 HydrophobicContact CD2-CD2 4.35Å; L1483-F1492 HydrophobicContact CD2-CE1 4.27Å; L1483-F1492 HydrophobicContact CD2-CG 3.61Å; L1483-F1492 VanDerWaalsContact CD2-CG 3.44Å; L1483-F1492 HydrophobicContact CG-CD1 4.43Å; G1488-F1492 PolarHBondContact O-N 3.31Å; G1488-F1492 VanDerWaalsContact O-N 3.17Å; F1489-F1492 PolarHBondContact O-N 2.85Å; F1492-K1494 VanDerWaalsContact C-N 3.35Å; F1492-K1494 PolarHBondContact O-N 3.38Å; F1492-L1495 HydrophobicContact CD2-CD2 4.23Å; F1492-L1495 PolarHBondContact O-N 3.18Å; F1492-I1496 HydrophobicContact CD1-CD1 3.77Å; F1492-I1496 HydrophobicContact CD2-CD1 4.41Å; F1492-I1496 HydrophobicContact CE1-CD1 3.36Å; F1492-I1496 VanDerWaalsContact CE1-CD1 3.42Å; F1492-I1496 HydrophobicContact CE1-CG1 4.44Å; F1492-I1496 HydrophobicContact CE2-CD1 4.22Å; F1492-I1496 HydrophobicContact CG-CD1 4.36Å; F1492-I1496 HydrophobicContact CZ-CD1 3.62Å; F1492-I1496 HydrophobicContact CZ-CG1 4.36Å; F1492-I1496 WeakPolarHBondContact O-CG1 3.3Å; F1492-I1496 PolarHBondContact O-N 3.08Å; F1492-I1496 VanDerWaalsContact O-N 3.08Å; F1492-L1518 HydrophobicContact CE2-CD1 4.43Å; F1492-L1518 HydrophobicContact CZ-CD1 3.85Å; F1492-A1613 HydrophobicContact CD1-CB 3.98Å; F1492-A1613 HydrophobicContact CE1-CB 4.08Å
1493W90.8Very high88.5Confident5.2 Ų5.229.6 Ų29.62%0.0216%0.16CC..Hα-helixtrans-59.5-48.4173.5-170.3-66.2000111.8F1489 N1490 V1491 L1495 I1496 E1497 H1616 K1747 I1749 H1752F1489-W1493 AromaticContact CE1-CE3 3.93Å; F1489-W1493 HydrophobicContact CE1-CE3 4.01Å; F1489-W1493 HydrophobicContact CE1-CZ3 4.44Å; F1489-W1493 AromaticContact CE2-CE3 3.81Å; F1489-W1493 HydrophobicContact CE2-CE3 3.9Å; F1489-W1493 AromaticContact CE2-CZ3 3.95Å; F1489-W1493 HydrophobicContact CE2-CZ3 4.23Å; F1489-W1493 HydrophobicContact CZ-CD2 4.4Å; F1489-W1493 AromaticContact CZ-CE3 3.39Å; F1489-W1493 HydrophobicContact CZ-CE3 3.39Å; F1489-W1493 VanDerWaalsContact CZ-CE3 3.45Å; F1489-W1493 AromaticContact CZ-CZ3 3.6Å; F1489-W1493 HydrophobicContact CZ-CZ3 3.6Å; F1489-W1493 VanDerWaalsContact CZ-CZ3 3.47Å; F1489-W1493 VanDerWaalsContact O-CB 3.28Å; F1489-W1493 WeakPolarHBondContact O-CB 3.31Å; F1489-W1493 PolarHBondContact O-N 3.2Å; N1490-W1493 PolarHBondContact O-N 2.92Å; V1491-W1493 VanDerWaalsContact C-N 3.32Å; V1491-W1493 PolarHBondContact O-N 3.13Å; W1493-L1495 VanDerWaalsContact C-N 3.33Å; W1493-L1495 PolarHBondContact O-N 3.04Å; W1493-I1496 PolarHBondContact O-N 3.18Å; W1493-E1497 PolarHBondContact NE1-OE1 2.89Å; W1493-E1497 VanDerWaalsContact O-CB 3.22Å; W1493-E1497 WeakPolarHBondContact O-CB 3.39Å; W1493-E1497 WeakPolarHBondContact O-CG 3.34Å; W1493-E1497 PolarHBondContact O-N 3.21Å; W1493-H1616 AromaticContact CD1-CE1 3.91Å; W1493-H1616 HydrophobicContact CD2-CB 4.37Å; W1493-H1616 AromaticContact CD2-CD2 3.95Å; W1493-H1616 AromaticContact CD2-CG 3.93Å; W1493-H1616 AromaticContact CD2-ND1 3.93Å; W1493-H1616 AromaticContact CE2-CD2 3.47Å; W1493-H1616 VanDerWaalsContact CE2-CD2 3.45Å; W1493-H1616 AromaticContact CE2-CE1 3.91Å; W1493-H1616 AromaticContact CE2-CG 3.84Å; W1493-H1616 AromaticContact CE2-ND1 3.87Å; W1493-H1616 AromaticContact CE2-NE2 3.49Å; W1493-H1616 HydrophobicContact CE3-CB 3.97Å; W1493-H1616 AromaticContact CE3-CG 3.88Å; W1493-H1616 HydrophobicContact CH2-CB 4.02Å; W1493-H1616 AromaticContact CH2-CD2 3.63Å; W1493-H1616 VanDerWaalsContact CH2-CD2 3.48Å; W1493-H1616 WeakPolarHBondContact CH2-CD2 3.4Å; W1493-H1616 AromaticContact CH2-CG 3.96Å; W1493-H1616 HydrophobicContact CZ2-CB 4.06Å; W1493-H1616 AromaticContact CZ2-CD2 3.29Å; W1493-H1616 WeakPolarHBondContact CZ2-CD2 3.3Å; W1493-H1616 AromaticContact CZ2-CG 3.67Å; W1493-H1616 AromaticContact CZ2-NE2 3.71Å; W1493-H1616 HydrophobicContact CZ3-CB 3.71Å; W1493-H1616 AromaticContact CZ3-CD2 3.88Å; W1493-H1616 AromaticContact CZ3-CG 3.89Å; W1493-H1616 AromaticContact NE1-CD2 3.72Å; W1493-H1616 AromaticContact NE1-CE1 3.78Å; W1493-H1616 AromaticContact NE1-ND1 3.98Å; W1493-H1616 AromaticContact NE1-NE2 3.48Å; W1493-H1616 PolarHBondContact NE1-NE2 3.3Å; W1493-K1747 HydrophobicContact CD2-CB 4.46Å; W1493-K1747 HydrophobicContact CD2-CD 4.01Å; W1493-K1747 HydrophobicContact CE3-CB 4.22Å; W1493-K1747 HydrophobicContact CE3-CD 4.32Å; W1493-K1747 HydrophobicContact CG-CD 4.26Å; W1493-K1747 HydrophobicContact CH2-CB 3.68Å; W1493-K1747 HydrophobicContact CH2-CG 4.47Å; W1493-K1747 VanDerWaalsContact CH2-O 3.3Å; W1493-K1747 WeakPolarHBondContact CH2-O 3.37Å; W1493-K1747 HydrophobicContact CZ2-CB 3.88Å; W1493-K1747 HydrophobicContact CZ2-CD 4.13Å; W1493-K1747 HydrophobicContact CZ2-CG 3.93Å; W1493-K1747 HydrophobicContact CZ3-CB 3.92Å; W1493-I1749 HydrophobicContact CH2-CB 4.48Å; W1493-I1749 HydrophobicContact CH2-CG1 3.78Å; W1493-I1749 HydrophobicContact CZ2-CG1 4.17Å; W1493-H1752 HydrophobicContact CZ2-CB 4.12Å; W1493-H1752 PolarHBondContact NE1-O 3.21Å
1494K89.9Confident88.7Confident140 Ų14032.2 Ų32.261%0.60917%0.174SC*.Hα-helixtrans-60.6-40177.2-78.4-179.3175.7-172.40112.3N1490 V1491 F1492 E1497 H1498N1490-K1494 WeakPolarHBondContact O-CB 3.41Å; N1490-K1494 VanDerWaalsContact O-CG 3.3Å; N1490-K1494 WeakPolarHBondContact O-CG 3.27Å; N1490-K1494 PolarHBondContact O-N 3.3Å; V1491-K1494 PolarHBondContact O-N 3.21Å; F1492-K1494 VanDerWaalsContact C-N 3.35Å; F1492-K1494 PolarHBondContact O-N 3.38Å; K1494-E1497 PolarHBondContact O-N 2.97Å; K1494-H1498 VanDerWaalsContact O-CB 3.26Å; K1494-H1498 WeakPolarHBondContact O-CB 3.36Å; K1494-H1498 PolarHBondContact O-N 3.05Å
1495L91.8Very high89.1Confident35.6 Ų35.636.3 Ų36.319%0.18619%0.187CC..Hα-helixtrans-66.6-42.3178.8-85.1167.9000112.3I1457 P1458 W1461 V1491 F1492 W1493 E1497 D1499I1457-L1495 HydrophobicContact CG2-CD1 3.83Å; P1458-L1495 HydrophobicContact CG-CD1 4.36Å; W1461-L1495 HydrophobicContact CB-CD1 4.23Å; W1461-L1495 HydrophobicContact CB-CD2 4.23Å; W1461-L1495 HydrophobicContact CD2-CD2 3.48Å; W1461-L1495 VanDerWaalsContact CD2-CD2 3.48Å; W1461-L1495 HydrophobicContact CD2-CG 4.45Å; W1461-L1495 VanDerWaalsContact CE2-CD2 3.43Å; W1461-L1495 HydrophobicContact CE3-CD2 4.13Å; W1461-L1495 HydrophobicContact CG-CD1 4.22Å; W1461-L1495 HydrophobicContact CG-CD2 3.54Å; W1461-L1495 HydrophobicContact CG-CG 4.08Å; W1461-L1495 HydrophobicContact CZ2-CD2 4.03Å; V1491-L1495 HydrophobicContact CG1-CD1 4.15Å; V1491-L1495 WeakPolarHBondContact O-CB 3.34Å; V1491-L1495 WeakPolarHBondContact O-CG 3.38Å; V1491-L1495 PolarHBondContact O-N 3.15Å; F1492-L1495 HydrophobicContact CD2-CD2 4.23Å; F1492-L1495 PolarHBondContact O-N 3.18Å; W1493-L1495 VanDerWaalsContact C-N 3.33Å; W1493-L1495 PolarHBondContact O-N 3.04Å; L1495-E1497 VanDerWaalsContact C-N 3.34Å; L1495-E1497 PolarHBondContact O-N 3.33Å; L1495-D1499 WeakPolarHBondContact O-CB 3.43Å; L1495-D1499 PolarHBondContact O-N 3.28Å; L1495-D1499 VanDerWaalsContact O-N 3.09Å
1496I92.6Very high89.5Confident0.4 Ų0.443.6 Ų43.60%0.00222%0.215CC..Hα-helixtrans-63.5-47172.8-68.9164.5000110.3W1461 F1492 W1493 H1498 D1499 F1500 A1617 C1620W1461-I1496 HydrophobicContact CH2-CG1 3.89Å; W1461-I1496 HydrophobicContact CZ2-CG1 4.22Å; W1461-I1496 HydrophobicContact CZ3-CG1 4.35Å; F1492-I1496 HydrophobicContact CD1-CD1 3.77Å; F1492-I1496 HydrophobicContact CD2-CD1 4.41Å; F1492-I1496 HydrophobicContact CE1-CD1 3.36Å; F1492-I1496 VanDerWaalsContact CE1-CD1 3.42Å; F1492-I1496 HydrophobicContact CE1-CG1 4.44Å; F1492-I1496 HydrophobicContact CE2-CD1 4.22Å; F1492-I1496 HydrophobicContact CG-CD1 4.36Å; F1492-I1496 HydrophobicContact CZ-CD1 3.62Å; F1492-I1496 HydrophobicContact CZ-CG1 4.36Å; F1492-I1496 WeakPolarHBondContact O-CG1 3.3Å; F1492-I1496 PolarHBondContact O-N 3.08Å; F1492-I1496 VanDerWaalsContact O-N 3.08Å; W1493-I1496 PolarHBondContact O-N 3.18Å; I1496-H1498 VanDerWaalsContact C-N 3.32Å; I1496-H1498 PolarHBondContact O-N 3.03Å; I1496-D1499 PolarHBondContact O-N 3.2Å; I1496-F1500 HydrophobicContact CG2-CD2 3.84Å; I1496-F1500 HydrophobicContact CG2-CE2 4.19Å; I1496-F1500 WeakPolarHBondContact O-CB 3.33Å; I1496-F1500 VanDerWaalsContact O-CD2 3.29Å; I1496-F1500 WeakPolarHBondContact O-CD2 3.31Å; I1496-F1500 PolarHBondContact O-N 3.19Å; I1496-A1617 HydrophobicContact CD1-CB 3.83Å; I1496-C1620 HydrophobicContact CG2-CB 4.31Å
1497E89.5Confident90Very high19.2 Ų19.245 Ų459%0.0922%0.22CC..Hα-helixtrans-61-43.9-178.6-137.2115.2-178.200111.6W1493 K1494 L1495 D1499 F1500 S1501 H1616 K1747 H1752 S1753 H1754 A1755W1493-E1497 PolarHBondContact NE1-OE1 2.89Å; W1493-E1497 VanDerWaalsContact O-CB 3.22Å; W1493-E1497 WeakPolarHBondContact O-CB 3.39Å; W1493-E1497 WeakPolarHBondContact O-CG 3.34Å; W1493-E1497 PolarHBondContact O-N 3.21Å; K1494-E1497 PolarHBondContact O-N 2.97Å; L1495-E1497 VanDerWaalsContact C-N 3.34Å; L1495-E1497 PolarHBondContact O-N 3.33Å; E1497-D1499 PolarHBondContact O-N 2.98Å; E1497-F1500 PolarHBondContact O-N 3.32Å; E1497-S1501 VanDerWaalsContact O-CB 3.23Å; E1497-S1501 WeakPolarHBondContact O-CB 3.24Å; E1497-S1501 PolarHBondContact O-N 3.21Å; E1497-S1501 PolarHBondContact O-OG 3.09Å; E1497-H1616 IonicContact OE2-CE1 3.66Å; E1497-H1616 IonicContact OE2-NE2 3.25Å; E1497-K1747 IonicContact OE1-NZ 2.81Å; E1497-K1747 PolarHBondContact OE1-NZ 2.89Å; E1497-K1747 IonicContact OE2-NZ 2.94Å; E1497-K1747 PolarHBondContact OE2-NZ 3.46Å; E1497-H1752 IonicContact OE1-CD2 2.7Å; E1497-H1752 PolarHBondContact OE1-CD2 2.88Å; E1497-H1752 IonicContact OE1-CE1 2.81Å; E1497-H1752 IonicContact OE1-CG 2.63Å; E1497-H1752 IonicContact OE1-ND1 2.79Å; E1497-H1752 PolarHBondContact OE1-ND1 3.24Å; E1497-H1752 IonicContact OE1-NE2 3.69Å; E1497-H1752 PolarHBondContact OE1-NE2 3.3Å; E1497-S1753 WeakPolarHBondContact OE1-CA 3.45Å; E1497-S1753 PolarHBondContact OE1-OG 2.92Å; E1497-S1753 VanDerWaalsContact OE2-CA 3.27Å; E1497-S1753 WeakPolarHBondContact OE2-CA 3.45Å; E1497-S1753 WeakPolarHBondContact OE2-CB 3.39Å; E1497-S1753 PolarHBondContact OE2-OG 3.13Å; E1497-H1754 VanDerWaalsContact OE1-CA 3.29Å; E1497-H1754 WeakPolarHBondContact OE1-CA 3.42Å; E1497-H1754 WeakPolarHBondContact OE1-CB 3.32Å; E1497-H1754 IonicContact OE1-CD2 3.07Å; E1497-H1754 PolarHBondContact OE1-CD2 3.35Å; E1497-H1754 VanDerWaalsContact OE1-CD2 3.28Å; E1497-H1754 IonicContact OE1-CG 3.69Å; E1497-H1754 PolarHBondContact OE1-N 3.02Å; E1497-A1755 PolarHBondContact OE1-N 3.08Å
1498H90.1Very high90.5Very high104.6 Ų104.645.7 Ų45.748%0.48422%0.221SC..Hα-helixtrans-58.1-58.1173.1174.9-91.3000111.6K1494 I1496 F1500 S1501 H1502K1494-H1498 VanDerWaalsContact O-CB 3.26Å; K1494-H1498 WeakPolarHBondContact O-CB 3.36Å; K1494-H1498 PolarHBondContact O-N 3.05Å; I1496-H1498 VanDerWaalsContact C-N 3.32Å; I1496-H1498 PolarHBondContact O-N 3.03Å; H1498-F1500 VanDerWaalsContact C-N 3.27Å; H1498-F1500 PolarHBondContact O-N 3.03Å; H1498-S1501 PolarHBondContact O-N 2.88Å; H1498-S1501 VanDerWaalsContact O-N 3.13Å; H1498-S1501 PolarHBondContact O-OG 2.93Å; H1498-H1502 AromaticContact CE1-CD2 4Å; H1498-H1502 WeakPolarHBondContact O-CB 3.43Å; H1498-H1502 PolarHBondContact O-N 2.95Å; H1498-H1502 VanDerWaalsContact O-N 3.11Å
1499D91.5Very high90.9Very high14 Ų1448.4 Ų48.48%0.07523%0.233CC..Hα-helixtrans-65.4-30.1-173.2-74.612.7000112.5W1461 L1495 I1496 E1497 I1507 R1508 A1511 K1514W1461-D1499 PolarHBondContact NE1-OD2 3.36Å; L1495-D1499 WeakPolarHBondContact O-CB 3.43Å; L1495-D1499 PolarHBondContact O-N 3.28Å; L1495-D1499 VanDerWaalsContact O-N 3.09Å; I1496-D1499 PolarHBondContact O-N 3.2Å; E1497-D1499 PolarHBondContact O-N 2.98Å; D1499-I1507 HydrophobicContact CB-CG2 4.41Å; D1499-R1508 WeakPolarHBondContact O-CA 3.35Å; D1499-A1511 HydrophobicContact CB-CB 3.68Å; D1499-A1511 WeakPolarHBondContact O-CB 3.2Å; D1499-K1514 IonicContact OD2-NZ 3.19Å; D1499-K1514 PolarHBondContact OD2-NZ 3.36Å
1500F91.8Very high91.1Very high1.8 Ų1.850.3 Ų50.31%0.00824%0.243CC..Hα-helixtrans-87.2-25.9175.9-82.1-101.4000114.4I1496 E1497 H1498 H1502 R1508 A1511 I1512 V1515 C1620 S1624 A1755 Y1756 R1759I1496-F1500 HydrophobicContact CG2-CD2 3.84Å; I1496-F1500 HydrophobicContact CG2-CE2 4.19Å; I1496-F1500 WeakPolarHBondContact O-CB 3.33Å; I1496-F1500 VanDerWaalsContact O-CD2 3.29Å; I1496-F1500 WeakPolarHBondContact O-CD2 3.31Å; I1496-F1500 PolarHBondContact O-N 3.19Å; E1497-F1500 PolarHBondContact O-N 3.32Å; H1498-F1500 VanDerWaalsContact C-N 3.27Å; H1498-F1500 PolarHBondContact O-N 3.03Å; F1500-H1502 VanDerWaalsContact C-N 3.33Å; F1500-H1502 PolarHBondContact O-N 2.99Å; F1500-R1508 VanDerWaalsContact O-CD 3.23Å; F1500-R1508 WeakPolarHBondContact O-CD 3.36Å; F1500-R1508 VanDerWaalsContact O-CG 3.28Å; F1500-R1508 WeakPolarHBondContact O-CG 3.37Å; F1500-A1511 HydrophobicContact CD2-CB 3.56Å; F1500-A1511 HydrophobicContact CE1-CB 4.5Å; F1500-A1511 HydrophobicContact CE2-CB 3.45Å; F1500-A1511 VanDerWaalsContact CE2-CB 3.43Å; F1500-A1511 HydrophobicContact CG-CB 4.21Å; F1500-A1511 HydrophobicContact CZ-CB 4.01Å; F1500-A1511 WeakPolarHBondContact CZ-O 3.19Å; F1500-I1512 HydrophobicContact CE1-CG1 3.85Å; F1500-I1512 HydrophobicContact CZ-CG1 4.19Å; F1500-V1515 HydrophobicContact CE2-CG2 3.6Å; F1500-V1515 HydrophobicContact CZ-CB 4.28Å; F1500-V1515 HydrophobicContact CZ-CG2 3.73Å; F1500-C1620 HydrophobicContact CB-CB 4.4Å; F1500-C1620 HydrophobicContact CD1-CB 3.73Å; F1500-C1620 HydrophobicContact CD2-CB 4.27Å; F1500-C1620 HydrophobicContact CE1-CB 3.92Å; F1500-C1620 WeakPolarHBondContact CE1-O 3.35Å; F1500-C1620 HydrophobicContact CE2-CB 4.41Å; F1500-C1620 HydrophobicContact CG-CB 3.92Å; F1500-C1620 HydrophobicContact CZ-CB 4.28Å; F1500-S1624 WeakPolarHBondContact CE1-OG 3.17Å; F1500-A1755 HydrophobicContact CB-CB 4.05Å; F1500-Y1756 WeakPolarHBondContact O-CE2 3.34Å; F1500-R1759 PolarHBondContact O-NH2 3.21Å
1501S88.5Confident91.5Very high37.6 Ų37.648.6 Ų48.626%0.26323%0.234SC..Hα-helixtrans-91.3-4.3177.156.80000113.7E1497 H1498 A1755 R1759E1497-S1501 VanDerWaalsContact O-CB 3.23Å; E1497-S1501 WeakPolarHBondContact O-CB 3.24Å; E1497-S1501 PolarHBondContact O-N 3.21Å; E1497-S1501 PolarHBondContact O-OG 3.09Å; H1498-S1501 PolarHBondContact O-N 2.88Å; H1498-S1501 VanDerWaalsContact O-N 3.13Å; H1498-S1501 PolarHBondContact O-OG 2.93Å; S1501-A1755 WeakPolarHBondContact OG-CA 3.39Å; S1501-A1755 WeakPolarHBondContact OG-CB 3.45Å; S1501-A1755 PolarHBondContact OG-N 3.24Å; S1501-A1755 VanDerWaalsContact OG-N 3.12Å; S1501-R1759 PolarHBondContact O-NH1 2.96Å; S1501-R1759 PolarHBondContact OG-NH1 3.13Å; S1501-R1759 VanDerWaalsContact OG-NH1 3.12Å
1502H89.7Confident91.7Very high47.8 Ų47.847.7 Ų47.722%0.22123%0.229CC..  trans-59.3143.6-177.4-163.1-88.5000113.2H1498 F1500 D1504 I1507 R1508H1498-H1502 AromaticContact CE1-CD2 4Å; H1498-H1502 WeakPolarHBondContact O-CB 3.43Å; H1498-H1502 PolarHBondContact O-N 2.95Å; H1498-H1502 VanDerWaalsContact O-N 3.11Å; F1500-H1502 VanDerWaalsContact C-N 3.33Å; F1500-H1502 PolarHBondContact O-N 2.99Å; H1502-D1504 VanDerWaalsContact ND1-CB 3.32Å; H1502-D1504 WeakPolarHBondContact ND1-CB 3.27Å; H1502-D1504 PolarHBondContact ND1-N 2.92Å; H1502-D1504 VanDerWaalsContact ND1-N 3.18Å; H1502-I1507 HydrophobicContact CB-CB 4.17Å; H1502-I1507 HydrophobicContact CB-CG2 3.83Å; H1502-I1507 WeakPolarHBondContact CE1-CD1 3.29Å; H1502-I1507 WeakPolarHBondContact ND1-CD1 3.43Å; H1502-I1507 WeakPolarHBondContact NE2-CD1 3.37Å; H1502-R1508 HydrophobicContact CB-CG 4.44Å; H1502-R1508 WeakPolarHBondContact O-CD 3.27Å; H1502-R1508 WeakPolarHBondContact O-CG 3.37Å; H1502-R1508 PolarHBondContact O-NH1 3.21Å
1503C88.6Confident91.8Very high112.6 Ų112.648.8 Ų48.876%0.76123%0.234SC*.SBendtrans-68-45.3-177.756.40000112.8W1505 R1508C1503-W1505 PolarHBondContact O-N 3.17Å; C1503-R1508 PolarHBondContact O-NH1 3.04Å
1504D91Very high92Very high53.2 Ų53.249.4 Ų49.428%0.28424%0.237SC..SBendtrans-65.8122.8172.3-175.13.2000111H1502 R1506 I1507 R1508H1502-D1504 VanDerWaalsContact ND1-CB 3.32Å; H1502-D1504 WeakPolarHBondContact ND1-CB 3.27Å; H1502-D1504 PolarHBondContact ND1-N 2.92Å; H1502-D1504 VanDerWaalsContact ND1-N 3.18Å; D1504-R1506 VanDerWaalsContact C-N 3.28Å; D1504-R1506 PolarHBondContact O-N 3Å; D1504-R1506 WeakPolarHBondContact OD1-CB 3.45Å; D1504-R1506 WeakPolarHBondContact OD1-CG 3.35Å; D1504-R1506 PolarHBondContact OD1-N 3.19Å; D1504-R1506 IonicContact OD1-NH1 3.47Å; D1504-R1506 PolarHBondContact OD1-NH1 3.17Å; D1504-R1506 WeakPolarHBondContact OD2-CB 3.31Å; D1504-R1506 IonicContact OD2-CZ 2.72Å; D1504-R1506 IonicContact OD2-NH1 3.45Å; D1504-R1506 PolarHBondContact OD2-NH1 3.26Å; D1504-I1507 HydrophobicContact CB-CD1 4.32Å; D1504-I1507 HydrophobicContact CB-CG1 4.5Å; D1504-I1507 PolarHBondContact O-N 3.05Å; D1504-R1508 PolarHBondContact O-N 3.39Å
1505W92Very high92.3Very high99.6 Ų99.642.8 Ų42.838%0.37721%0.208SC..Hα-helixtrans-62.5-26.9176.871.1-91.5000112.8C1503 I1507 R1508 F1509 D1629 V1632C1503-W1505 PolarHBondContact O-N 3.17Å; W1505-I1507 VanDerWaalsContact C-N 3.33Å; W1505-I1507 PolarHBondContact O-N 3.02Å; W1505-R1508 PolarHBondContact O-N 3.34Å; W1505-F1509 HydrophobicContact CE3-CB 4.26Å; W1505-F1509 HydrophobicContact CZ3-CB 4.38Å; W1505-F1509 HydrophobicContact CZ3-CD2 4.26Å; W1505-F1509 HydrophobicContact CZ3-CG 4.39Å; W1505-F1509 VanDerWaalsContact O-CB 3.32Å; W1505-F1509 WeakPolarHBondContact O-CB 3.4Å; W1505-F1509 PolarHBondContact O-N 3.3Å; W1505-D1629 HydrophobicContact CB-CB 4.31Å; W1505-V1632 HydrophobicContact CB-CG2 4.09Å; W1505-V1632 HydrophobicContact CE3-CG2 4.06Å
1506R94.2Very high92.4Very high154.8 Ų154.841.1 Ų41.158%0.58420%0.199SC*.Hα-helixtrans-65.9-37.9179.3-61.6174177.9158.1-1.4112D1504 F1509 N1510D1504-R1506 VanDerWaalsContact C-N 3.28Å; D1504-R1506 PolarHBondContact O-N 3Å; D1504-R1506 WeakPolarHBondContact OD1-CB 3.45Å; D1504-R1506 WeakPolarHBondContact OD1-CG 3.35Å; D1504-R1506 PolarHBondContact OD1-N 3.19Å; D1504-R1506 IonicContact OD1-NH1 3.47Å; D1504-R1506 PolarHBondContact OD1-NH1 3.17Å; D1504-R1506 WeakPolarHBondContact OD2-CB 3.31Å; D1504-R1506 IonicContact OD2-CZ 2.72Å; D1504-R1506 IonicContact OD2-NH1 3.45Å; D1504-R1506 PolarHBondContact OD2-NH1 3.26Å; R1506-F1509 WeakPolarHBondContact O-CB 3.25Å; R1506-F1509 PolarHBondContact O-N 3.09Å; R1506-N1510 WeakPolarHBondContact O-CB 3.29Å; R1506-N1510 PolarHBondContact O-N 3.05Å
1507I92.3Very high92.4Very high54.6 Ų54.641.3 Ų41.328%0.2820%0.2SC..Hα-helixtrans-68.8-42.7175.5-67.1-179.1000109.8D1499 H1502 D1504 W1505 F1509 N1510 A1511D1499-I1507 HydrophobicContact CB-CG2 4.41Å; H1502-I1507 HydrophobicContact CB-CB 4.17Å; H1502-I1507 HydrophobicContact CB-CG2 3.83Å; H1502-I1507 WeakPolarHBondContact CE1-CD1 3.29Å; H1502-I1507 WeakPolarHBondContact ND1-CD1 3.43Å; H1502-I1507 WeakPolarHBondContact NE2-CD1 3.37Å; D1504-I1507 HydrophobicContact CB-CD1 4.32Å; D1504-I1507 HydrophobicContact CB-CG1 4.5Å; D1504-I1507 PolarHBondContact O-N 3.05Å; W1505-I1507 VanDerWaalsContact C-N 3.33Å; W1505-I1507 PolarHBondContact O-N 3.02Å; I1507-F1509 VanDerWaalsContact C-N 3.33Å; I1507-F1509 PolarHBondContact O-N 3.27Å; I1507-N1510 WeakPolarHBondContact O-CB 3.44Å; I1507-N1510 PolarHBondContact O-N 3.43Å; I1507-A1511 WeakPolarHBondContact O-CB 3.36Å; I1507-A1511 PolarHBondContact O-N 2.98Å
1508R92.9Very high92.7Very high21 Ų2140.5 Ų40.58%0.07920%0.196CC..Hα-helixtrans-60.7-41.9173.4-57.6-160.8-60.7-85.43.8112.3D1499 F1500 H1502 C1503 D1504 W1505 A1511 I1512 D1627 Y1756D1499-R1508 WeakPolarHBondContact O-CA 3.35Å; F1500-R1508 VanDerWaalsContact O-CD 3.23Å; F1500-R1508 WeakPolarHBondContact O-CD 3.36Å; F1500-R1508 VanDerWaalsContact O-CG 3.28Å; F1500-R1508 WeakPolarHBondContact O-CG 3.37Å; H1502-R1508 HydrophobicContact CB-CG 4.44Å; H1502-R1508 WeakPolarHBondContact O-CD 3.27Å; H1502-R1508 WeakPolarHBondContact O-CG 3.37Å; H1502-R1508 PolarHBondContact O-NH1 3.21Å; C1503-R1508 PolarHBondContact O-NH1 3.04Å; D1504-R1508 PolarHBondContact O-N 3.39Å; W1505-R1508 PolarHBondContact O-N 3.34Å; R1508-A1511 VanDerWaalsContact O-CB 3.27Å; R1508-A1511 WeakPolarHBondContact O-CB 3.34Å; R1508-A1511 PolarHBondContact O-N 3.1Å; R1508-A1511 VanDerWaalsContact O-N 3.15Å; R1508-I1512 VanDerWaalsContact O-CD1 3.31Å; R1508-I1512 WeakPolarHBondContact O-CD1 3.33Å; R1508-I1512 WeakPolarHBondContact O-CG1 3.37Å; R1508-I1512 PolarHBondContact O-N 3.16Å; R1508-D1627 IonicContact CZ-OD1 3.07Å; R1508-D1627 IonicContact CZ-OD2 3.4Å; R1508-D1627 IonicContact NE-OD1 3.34Å; R1508-D1627 PolarHBondContact NE-OD1 3.09Å; R1508-D1627 IonicContact NE-OD2 2.77Å; R1508-D1627 PolarHBondContact NE-OD2 3.18Å; R1508-D1627 IonicContact NH1-OD1 2.85Å; R1508-D1627 PolarHBondContact NH1-OD1 3.34Å; R1508-D1627 IonicContact NH1-OD2 3.86Å; R1508-D1627 PolarHBondContact NH1-OD2 3.28Å; R1508-D1627 IonicContact NH2-OD1 3.21Å; R1508-D1627 PolarHBondContact NH2-OD1 3.17Å; R1508-D1627 IonicContact NH2-OD2 3.59Å; R1508-Y1756 PolarHBondContact NH1-OH 3.32Å; R1508-Y1756 VanDerWaalsContact NH1-OH 3.09Å
1509F94.2Very high92.9Very high56.2 Ų56.235.5 Ų35.525%0.24617%0.173CC..Hα-helixtrans-59.7-46.7175.6-175-81.4000111.8W1505 R1506 I1507 A1511 I1512 E1513 T1631 V1632 Y1635W1505-F1509 HydrophobicContact CE3-CB 4.26Å; W1505-F1509 HydrophobicContact CZ3-CB 4.38Å; W1505-F1509 HydrophobicContact CZ3-CD2 4.26Å; W1505-F1509 HydrophobicContact CZ3-CG 4.39Å; W1505-F1509 VanDerWaalsContact O-CB 3.32Å; W1505-F1509 WeakPolarHBondContact O-CB 3.4Å; W1505-F1509 PolarHBondContact O-N 3.3Å; R1506-F1509 WeakPolarHBondContact O-CB 3.25Å; R1506-F1509 PolarHBondContact O-N 3.09Å; I1507-F1509 VanDerWaalsContact C-N 3.33Å; I1507-F1509 PolarHBondContact O-N 3.27Å; F1509-A1511 VanDerWaalsContact C-N 3.33Å; F1509-A1511 PolarHBondContact O-N 3.24Å; F1509-I1512 WeakPolarHBondContact O-CB 3.3Å; F1509-I1512 PolarHBondContact O-N 3.21Å; F1509-E1513 PolarHBondContact O-N 3.22Å; F1509-E1513 VanDerWaalsContact O-N 3.09Å; F1509-T1631 HydrophobicContact CE2-CG2 4.24Å; F1509-V1632 HydrophobicContact CB-CG2 4.39Å; F1509-Y1635 HydrophobicContact CD1-CD1 4.42Å; F1509-Y1635 HydrophobicContact CD1-CE1 4.21Å; F1509-Y1635 AromaticContact CD2-CD1 3.78Å; F1509-Y1635 HydrophobicContact CD2-CD1 3.85Å; F1509-Y1635 HydrophobicContact CD2-CE1 4.26Å; F1509-Y1635 HydrophobicContact CD2-CG 4.09Å; F1509-Y1635 HydrophobicContact CE1-CD1 4.26Å; F1509-Y1635 HydrophobicContact CE1-CD2 4.48Å; F1509-Y1635 AromaticContact CE1-CE1 3.84Å; F1509-Y1635 HydrophobicContact CE1-CE1 3.84Å; F1509-Y1635 HydrophobicContact CE1-CE2 4.17Å; F1509-Y1635 AromaticContact CE1-CZ 3.78Å; F1509-Y1635 AromaticContact CE2-CD1 3.55Å; F1509-Y1635 HydrophobicContact CE2-CD1 3.55Å; F1509-Y1635 AromaticContact CE2-CD2 3.73Å; F1509-Y1635 HydrophobicContact CE2-CD2 3.73Å; F1509-Y1635 AromaticContact CE2-CE1 3.91Å; F1509-Y1635 HydrophobicContact CE2-CE1 4Å; F1509-Y1635 HydrophobicContact CE2-CE2 4.16Å; F1509-Y1635 AromaticContact CE2-CG 3.4Å; F1509-Y1635 HydrophobicContact CE2-CG 3.4Å; F1509-Y1635 VanDerWaalsContact CE2-CG 3.43Å; F1509-Y1635 HydrophobicContact CG-CD1 4.26Å; F1509-Y1635 HydrophobicContact CG-CE1 4.36Å; F1509-Y1635 AromaticContact CZ-CD1 3.77Å; F1509-Y1635 HydrophobicContact CZ-CD1 3.77Å; F1509-Y1635 AromaticContact CZ-CD2 3.6Å; F1509-Y1635 HydrophobicContact CZ-CD2 3.6Å; F1509-Y1635 VanDerWaalsContact CZ-CD2 3.5Å; F1509-Y1635 AromaticContact CZ-CE1 3.73Å; F1509-Y1635 HydrophobicContact CZ-CE1 3.73Å; F1509-Y1635 AromaticContact CZ-CE2 3.55Å; F1509-Y1635 HydrophobicContact CZ-CE2 3.55Å; F1509-Y1635 VanDerWaalsContact CZ-CE2 3.47Å; F1509-Y1635 AromaticContact CZ-CG 3.7Å; F1509-Y1635 HydrophobicContact CZ-CG 3.7Å; F1509-Y1635 AromaticContact CZ-CZ 3.61Å
1510N93.3Very high93Very high41.6 Ų41.638.9 Ų38.922%0.22219%0.185CC..Hα-helixtrans-67-32.5174.4-179.8-99.2000112.3R1506 I1507 I1512 E1513 K1514R1506-N1510 WeakPolarHBondContact O-CB 3.29Å; R1506-N1510 PolarHBondContact O-N 3.05Å; I1507-N1510 WeakPolarHBondContact O-CB 3.44Å; I1507-N1510 PolarHBondContact O-N 3.43Å; N1510-I1512 VanDerWaalsContact C-N 3.34Å; N1510-I1512 PolarHBondContact O-N 3.09Å; N1510-E1513 PolarHBondContact ND2-OE2 3.18Å; N1510-E1513 WeakPolarHBondContact O-CB 3.32Å; N1510-E1513 PolarHBondContact O-N 3.13Å; N1510-K1514 WeakPolarHBondContact O-CB 3.37Å; N1510-K1514 VanDerWaalsContact O-CD 3.32Å; N1510-K1514 WeakPolarHBondContact O-CD 3.35Å; N1510-K1514 VanDerWaalsContact O-CG 3.29Å; N1510-K1514 WeakPolarHBondContact O-CG 3.33Å; N1510-K1514 PolarHBondContact O-N 3.07Å; N1510-K1514 WeakPolarHBondContact OD1-CD 3.25Å; N1510-K1514 WeakPolarHBondContact OD1-CE 3.38Å; N1510-K1514 PolarHBondContact OD1-NZ 3.01Å
1511A94.3Very high92.9Very high0 Ų041.6 Ų41.60%020%0.198CC..Hα-helixtrans-61.4-42.6172.900000112.1D1499 F1500 I1507 R1508 F1509 E1513 K1514 V1515D1499-A1511 HydrophobicContact CB-CB 3.68Å; D1499-A1511 WeakPolarHBondContact O-CB 3.2Å; F1500-A1511 HydrophobicContact CD2-CB 3.56Å; F1500-A1511 HydrophobicContact CE1-CB 4.5Å; F1500-A1511 HydrophobicContact CE2-CB 3.45Å; F1500-A1511 VanDerWaalsContact CE2-CB 3.43Å; F1500-A1511 HydrophobicContact CG-CB 4.21Å; F1500-A1511 HydrophobicContact CZ-CB 4.01Å; F1500-A1511 WeakPolarHBondContact CZ-O 3.19Å; I1507-A1511 WeakPolarHBondContact O-CB 3.36Å; I1507-A1511 PolarHBondContact O-N 2.98Å; R1508-A1511 VanDerWaalsContact O-CB 3.27Å; R1508-A1511 WeakPolarHBondContact O-CB 3.34Å; R1508-A1511 PolarHBondContact O-N 3.1Å; R1508-A1511 VanDerWaalsContact O-N 3.15Å; F1509-A1511 VanDerWaalsContact C-N 3.33Å; F1509-A1511 PolarHBondContact O-N 3.24Å; A1511-E1513 VanDerWaalsContact C-N 3.34Å; A1511-K1514 PolarHBondContact O-N 2.92Å; A1511-V1515 WeakPolarHBondContact O-CG2 3.33Å; A1511-V1515 PolarHBondContact O-N 3.11Å
1512I94.7Very high93Very high0 Ų039.9 Ų39.90%019%0.186CC..Hα-helixtrans-63.4-42.4174.7-72.5151.1000111F1500 R1508 F1509 N1510 S1516 L1621 V1632 Y1635 T1636 Q1639F1500-I1512 HydrophobicContact CE1-CG1 3.85Å; F1500-I1512 HydrophobicContact CZ-CG1 4.19Å; R1508-I1512 VanDerWaalsContact O-CD1 3.31Å; R1508-I1512 WeakPolarHBondContact O-CD1 3.33Å; R1508-I1512 WeakPolarHBondContact O-CG1 3.37Å; R1508-I1512 PolarHBondContact O-N 3.16Å; F1509-I1512 WeakPolarHBondContact O-CB 3.3Å; F1509-I1512 PolarHBondContact O-N 3.21Å; N1510-I1512 VanDerWaalsContact C-N 3.34Å; N1510-I1512 PolarHBondContact O-N 3.09Å; I1512-S1516 VanDerWaalsContact O-CB 3.26Å; I1512-S1516 WeakPolarHBondContact O-CB 3.33Å; I1512-S1516 PolarHBondContact O-N 3.2Å; I1512-S1516 PolarHBondContact O-OG 2.86Å; I1512-L1621 HydrophobicContact CB-CD1 4.18Å; I1512-L1621 HydrophobicContact CG1-CD1 4.11Å; I1512-L1621 HydrophobicContact CG2-CD1 3.71Å; I1512-V1632 HydrophobicContact CD1-CG1 3.33Å; I1512-V1632 VanDerWaalsContact CD1-CG1 3.43Å; I1512-Y1635 HydrophobicContact CB-CD1 4.38Å; I1512-Y1635 HydrophobicContact CB-CE1 4.35Å; I1512-Y1635 HydrophobicContact CG2-CD1 3.64Å; I1512-Y1635 HydrophobicContact CG2-CE1 3.83Å; I1512-T1636 VanDerWaalsContact CD1-OG1 3.31Å; I1512-T1636 WeakPolarHBondContact CD1-OG1 3.32Å; I1512-Q1639 HydrophobicContact CG2-CB 4.5Å; I1512-Q1639 HydrophobicContact CG2-CG 4.37Å
1513E94.1Very high93Very high24.4 Ų24.439.3 Ų39.311%0.11418%0.184CC..Hα-helixtrans-59.2-52.6173.6-173.8-170.7-177.300111.5S1466 F1509 N1510 A1511 V1515 S1516 V1517 Y1635S1466-E1513 WeakPolarHBondContact CA-OE1 3.19Å; S1466-E1513 VanDerWaalsContact CB-OE1 3.23Å; S1466-E1513 WeakPolarHBondContact CB-OE1 3.41Å; S1466-E1513 PolarHBondContact N-OE1 3.27Å; S1466-E1513 PolarHBondContact OG-OE1 3.02Å; F1509-E1513 PolarHBondContact O-N 3.22Å; F1509-E1513 VanDerWaalsContact O-N 3.09Å; N1510-E1513 PolarHBondContact ND2-OE2 3.18Å; N1510-E1513 WeakPolarHBondContact O-CB 3.32Å; N1510-E1513 PolarHBondContact O-N 3.13Å; A1511-E1513 VanDerWaalsContact C-N 3.34Å; E1513-V1515 PolarHBondContact O-N 2.98Å; E1513-S1516 WeakPolarHBondContact O-CB 3.24Å; E1513-S1516 PolarHBondContact O-N 3.11Å; E1513-S1516 VanDerWaalsContact O-N 3.13Å; E1513-V1517 WeakPolarHBondContact O-CG2 3.41Å; E1513-V1517 PolarHBondContact O-N 3.07Å; E1513-Y1635 HydrophobicContact CB-CE1 4.36Å
1514K94.6Very high92.9Very high18.8 Ų18.838.4 Ų38.48%0.08217%0.166CC..Hα-helixtrans-53.9-49.5177.5-73.7158.4164164.30112.4W1461 L1464 D1499 N1510 A1511 S1516 V1517 L1518W1461-K1514 HydrophobicContact CD2-CD 4.2Å; W1461-K1514 VanDerWaalsContact CE2-CD 3.4Å; W1461-K1514 HydrophobicContact CE3-CB 4.48Å; W1461-K1514 HydrophobicContact CE3-CD 4.45Å; W1461-K1514 HydrophobicContact CG-CD 4.44Å; W1461-K1514 HydrophobicContact CH2-CB 3.84Å; W1461-K1514 HydrophobicContact CH2-CD 4.33Å; W1461-K1514 HydrophobicContact CZ2-CB 4.05Å; W1461-K1514 HydrophobicContact CZ2-CD 3.73Å; W1461-K1514 HydrophobicContact CZ2-CG 4.41Å; W1461-K1514 HydrophobicContact CZ3-CB 4.07Å; W1461-K1514 VanDerWaalsContact NE1-NZ 3.14Å; L1464-K1514 HydrophobicContact CB-CB 4.16Å; L1464-K1514 HydrophobicContact CB-CG 4.14Å; L1464-K1514 VanDerWaalsContact O-CA 3.26Å; L1464-K1514 WeakPolarHBondContact O-CA 3.27Å; L1464-K1514 VanDerWaalsContact O-CG 3.23Å; L1464-K1514 WeakPolarHBondContact O-CG 3.33Å; D1499-K1514 IonicContact OD2-NZ 3.19Å; D1499-K1514 PolarHBondContact OD2-NZ 3.36Å; N1510-K1514 WeakPolarHBondContact O-CB 3.37Å; N1510-K1514 VanDerWaalsContact O-CD 3.32Å; N1510-K1514 WeakPolarHBondContact O-CD 3.35Å; N1510-K1514 VanDerWaalsContact O-CG 3.29Å; N1510-K1514 WeakPolarHBondContact O-CG 3.33Å; N1510-K1514 PolarHBondContact O-N 3.07Å; N1510-K1514 WeakPolarHBondContact OD1-CD 3.25Å; N1510-K1514 WeakPolarHBondContact OD1-CE 3.38Å; N1510-K1514 PolarHBondContact OD1-NZ 3.01Å; A1511-K1514 PolarHBondContact O-N 2.92Å; K1514-S1516 VanDerWaalsContact C-N 3.33Å; K1514-S1516 PolarHBondContact O-N 3.03Å; K1514-V1517 PolarHBondContact O-N 3.16Å; K1514-L1518 WeakPolarHBondContact O-CB 3.3Å; K1514-L1518 PolarHBondContact O-N 3.06Å
1515V95.4Very high92.5Very high0 Ų038 Ų380%017%0.166CC..Hα-helixtrans-67.3-38.3178.2176.90000111.2W1461 F1500 A1511 E1513 V1517 L1518 L1519 A1617 L1621W1461-V1515 HydrophobicContact CH2-CG2 3.79Å; W1461-V1515 HydrophobicContact CZ3-CG2 4.44Å; F1500-V1515 HydrophobicContact CE2-CG2 3.6Å; F1500-V1515 HydrophobicContact CZ-CB 4.28Å; F1500-V1515 HydrophobicContact CZ-CG2 3.73Å; A1511-V1515 WeakPolarHBondContact O-CG2 3.33Å; A1511-V1515 PolarHBondContact O-N 3.11Å; E1513-V1515 PolarHBondContact O-N 2.98Å; V1515-V1517 VanDerWaalsContact C-N 3.35Å; V1515-V1517 PolarHBondContact O-N 3.46Å; V1515-L1518 WeakPolarHBondContact O-CB 3.42Å; V1515-L1518 PolarHBondContact O-N 3.12Å; V1515-L1519 HydrophobicContact CG1-CD1 3.84Å; V1515-L1519 HydrophobicContact CG1-CG 4.03Å; V1515-L1519 WeakPolarHBondContact O-CB 3.29Å; V1515-L1519 VanDerWaalsContact O-CG 3.28Å; V1515-L1519 WeakPolarHBondContact O-CG 3.42Å; V1515-L1519 PolarHBondContact O-N 3.27Å; V1515-A1617 HydrophobicContact CG1-CB 4.08Å; V1515-A1617 HydrophobicContact CG2-CB 4.29Å; V1515-L1621 HydrophobicContact CG1-CB 4.07Å; V1515-L1621 HydrophobicContact CG1-CD2 4.17Å
1516S94.3Very high92.2Very high1.2 Ų1.233.4 Ų33.41%0.00815%0.149CC..Hα-helixtrans-64-41.9177.5-98.90000112I1512 E1513 K1514 L1518 L1519 R1520 Q1639I1512-S1516 VanDerWaalsContact O-CB 3.26Å; I1512-S1516 WeakPolarHBondContact O-CB 3.33Å; I1512-S1516 PolarHBondContact O-N 3.2Å; I1512-S1516 PolarHBondContact O-OG 2.86Å; E1513-S1516 WeakPolarHBondContact O-CB 3.24Å; E1513-S1516 PolarHBondContact O-N 3.11Å; E1513-S1516 VanDerWaalsContact O-N 3.13Å; K1514-S1516 VanDerWaalsContact C-N 3.33Å; K1514-S1516 PolarHBondContact O-N 3.03Å; S1516-L1518 PolarHBondContact O-N 3.16Å; S1516-L1519 PolarHBondContact O-N 3.26Å; S1516-R1520 WeakPolarHBondContact O-CB 3.25Å; S1516-R1520 VanDerWaalsContact O-CG 3.28Å; S1516-R1520 WeakPolarHBondContact O-CG 3.34Å; S1516-R1520 PolarHBondContact O-N 3.03Å; S1516-Q1639 VanDerWaalsContact OG-CB 3.32Å; S1516-Q1639 WeakPolarHBondContact OG-CB 3.28Å; S1516-Q1639 PolarHBondContact OG-OE1 3.2Å
1517V94.2Very high91.7Very high4.8 Ų4.826 Ų263%0.02912%0.121CC..Hα-helixtrans-62.6-44.9173.2172.80000110.9L1464 A1472 E1513 K1514 V1515 L1519 R1520 E1521L1464-V1517 HydrophobicContact CD2-CG1 4.21Å; A1472-V1517 HydrophobicContact CB-CG1 3.48Å; A1472-V1517 VanDerWaalsContact CB-CG1 3.47Å; E1513-V1517 WeakPolarHBondContact O-CG2 3.41Å; E1513-V1517 PolarHBondContact O-N 3.07Å; K1514-V1517 PolarHBondContact O-N 3.16Å; V1515-V1517 VanDerWaalsContact C-N 3.35Å; V1515-V1517 PolarHBondContact O-N 3.46Å; V1517-L1519 VanDerWaalsContact C-N 3.34Å; V1517-L1519 PolarHBondContact O-N 3.03Å; V1517-R1520 PolarHBondContact O-N 3.19Å; V1517-E1521 PolarHBondContact O-N 3.08Å
1518L94.8Very high91Very high1 Ų124.6 Ų24.61%0.00512%0.118CC..Hα-helixtrans-58.6-46.7175.5-175.1154000112.1L1464 V1476 F1492 K1514 V1515 S1516 R1520 E1521 L1522L1464-L1518 HydrophobicContact CD1-CB 4.33Å; L1464-L1518 HydrophobicContact CD1-CD1 4.2Å; V1476-L1518 HydrophobicContact CG1-CG 4.19Å; V1476-L1518 HydrophobicContact CG2-CB 4.36Å; V1476-L1518 HydrophobicContact CG2-CG 4.29Å; F1492-L1518 HydrophobicContact CE2-CD1 4.43Å; F1492-L1518 HydrophobicContact CZ-CD1 3.85Å; K1514-L1518 WeakPolarHBondContact O-CB 3.3Å; K1514-L1518 PolarHBondContact O-N 3.06Å; V1515-L1518 WeakPolarHBondContact O-CB 3.42Å; V1515-L1518 PolarHBondContact O-N 3.12Å; S1516-L1518 PolarHBondContact O-N 3.16Å; L1518-R1520 PolarHBondContact O-N 3Å; L1518-E1521 PolarHBondContact O-N 2.92Å; L1518-L1522 HydrophobicContact CD2-CD1 4.3Å; L1518-L1522 HydrophobicContact CD2-CD2 4.4Å; L1518-L1522 HydrophobicContact CD2-CG 4.35Å; L1518-L1522 WeakPolarHBondContact O-CG 3.35Å; L1518-L1522 PolarHBondContact O-N 2.92Å
1519L94.4Very high90Very high0.4 Ų0.424.2 Ų24.20%0.00212%0.118CC..Hα-helixtrans-70-33.3-179-68.9178.8000112.5V1515 S1516 V1517 E1521 L1522 V1614 F1618 L1621 L1643 S1647 A1651V1515-L1519 HydrophobicContact CG1-CD1 3.84Å; V1515-L1519 HydrophobicContact CG1-CG 4.03Å; V1515-L1519 WeakPolarHBondContact O-CB 3.29Å; V1515-L1519 VanDerWaalsContact O-CG 3.28Å; V1515-L1519 WeakPolarHBondContact O-CG 3.42Å; V1515-L1519 PolarHBondContact O-N 3.27Å; S1516-L1519 PolarHBondContact O-N 3.26Å; V1517-L1519 VanDerWaalsContact C-N 3.34Å; V1517-L1519 PolarHBondContact O-N 3.03Å; L1519-E1521 VanDerWaalsContact C-N 3.28Å; L1519-E1521 PolarHBondContact O-N 3.3Å; L1519-L1522 HydrophobicContact CD2-CD1 3.57Å; L1519-L1522 HydrophobicContact CD2-CD2 4.1Å; L1519-L1522 WeakPolarHBondContact O-CB 3.3Å; L1519-L1522 PolarHBondContact O-N 3.22Å; L1519-V1614 HydrophobicContact CD2-CG1 4.25Å; L1519-F1618 HydrophobicContact CD1-CB 4.36Å; L1519-F1618 HydrophobicContact CD1-CD2 3.55Å; L1519-F1618 HydrophobicContact CD1-CE2 4.17Å; L1519-F1618 HydrophobicContact CD1-CG 4.23Å; L1519-F1618 HydrophobicContact CD2-CB 4.46Å; L1519-L1621 HydrophobicContact CD1-CD2 3.56Å; L1519-L1643 HydrophobicContact CB-CD1 4.49Å; L1519-L1643 HydrophobicContact CB-CD2 3.76Å; L1519-L1643 HydrophobicContact CD1-CD1 4.24Å; L1519-S1647 WeakPolarHBondContact O-CB 3.43Å; L1519-S1647 PolarHBondContact O-OG 2.77Å; L1519-A1651 HydrophobicContact CD2-CB 4.19Å
1520R92.9Very high89Confident86 Ų8622.1 Ų22.133%0.32511%0.112SC..Hα-helixtrans-61.7-36.1178.7-94.8172.9164.7176.33.4112.8S1469 S1516 V1517 L1518 L1522 S1642 L1643 N1644S1469-R1520 PolarHBondContact OG-NH2 3.44Å; S1469-R1520 VanDerWaalsContact OG-NH2 3.13Å; S1516-R1520 WeakPolarHBondContact O-CB 3.25Å; S1516-R1520 VanDerWaalsContact O-CG 3.28Å; S1516-R1520 WeakPolarHBondContact O-CG 3.34Å; S1516-R1520 PolarHBondContact O-N 3.03Å; V1517-R1520 PolarHBondContact O-N 3.19Å; L1518-R1520 PolarHBondContact O-N 3Å; R1520-L1522 VanDerWaalsContact C-N 3.33Å; R1520-L1522 PolarHBondContact O-N 3.19Å; R1520-S1642 PolarHBondContact NE-OG 3.12Å; R1520-S1642 PolarHBondContact NH2-OG 2.85Å; R1520-L1643 HydrophobicContact CG-CD2 4Å; R1520-N1644 PolarHBondContact O-ND2 3.26Å
1521E90.8Very high88.1Confident59 Ų5920.9 Ų20.928%0.27611%0.105SC..THydrogen-bonded Turntrans-82.9-5.4177.8-63.5-61.2111.200113.7A1472 S1473 V1476 V1517 L1518 L1519 D1523 I1526A1472-E1521 HydrophobicContact CB-CG 3.66Å; S1473-E1521 VanDerWaalsContact CA-OE2 3.26Å; S1473-E1521 WeakPolarHBondContact CA-OE2 3.34Å; S1473-E1521 VanDerWaalsContact CB-OE2 3.26Å; S1473-E1521 WeakPolarHBondContact CB-OE2 3.25Å; S1473-E1521 PolarHBondContact N-OE2 2.95Å; V1476-E1521 HydrophobicContact CB-CB 4.38Å; V1476-E1521 HydrophobicContact CG1-CB 4.43Å; V1476-E1521 HydrophobicContact CG2-CB 4.25Å; V1476-E1521 HydrophobicContact CG2-CG 4.46Å; V1517-E1521 PolarHBondContact O-N 3.08Å; L1518-E1521 PolarHBondContact O-N 2.92Å; L1519-E1521 VanDerWaalsContact C-N 3.28Å; L1519-E1521 PolarHBondContact O-N 3.3Å; E1521-D1523 PolarHBondContact O-N 3.18Å; E1521-I1526 WeakPolarHBondContact O-CD1 3.21Å
1522L90.8Very high87.2Confident1.4 Ų1.422.5 Ų22.51%0.00712%0.116CC..  trans-71.3119.4-177.8-86.2168.7000112.5V1476 L1480 L1518 L1519 R1520 I1526 L1527 V1614 S1647 C1650 A1651V1476-L1522 HydrophobicContact CG1-CD2 4.37Å; L1480-L1522 HydrophobicContact CD1-CD1 4.17Å; L1480-L1522 HydrophobicContact CD1-CD2 3.88Å; L1518-L1522 HydrophobicContact CD2-CD1 4.3Å; L1518-L1522 HydrophobicContact CD2-CD2 4.4Å; L1518-L1522 HydrophobicContact CD2-CG 4.35Å; L1518-L1522 WeakPolarHBondContact O-CG 3.35Å; L1518-L1522 PolarHBondContact O-N 2.92Å; L1519-L1522 HydrophobicContact CD2-CD1 3.57Å; L1519-L1522 HydrophobicContact CD2-CD2 4.1Å; L1519-L1522 WeakPolarHBondContact O-CB 3.3Å; L1519-L1522 PolarHBondContact O-N 3.22Å; R1520-L1522 VanDerWaalsContact C-N 3.33Å; R1520-L1522 PolarHBondContact O-N 3.19Å; L1522-I1526 HydrophobicContact CD1-CG2 4.42Å; L1522-I1526 HydrophobicContact CD2-CG2 4.03Å; L1522-L1527 HydrophobicContact CD1-CD2 3.84Å; L1522-L1527 HydrophobicContact CD1-CG 3.93Å; L1522-L1527 HydrophobicContact CD2-CD2 4.22Å; L1522-L1527 HydrophobicContact CD2-CG 4.36Å; L1522-L1527 HydrophobicContact CG-CD2 4.4Å; L1522-L1527 HydrophobicContact CG-CG 4.15Å; L1522-V1614 HydrophobicContact CD1-CG1 3.61Å; L1522-V1614 HydrophobicContact CD1-CG2 4.25Å; L1522-V1614 HydrophobicContact CD2-CG1 3.84Å; L1522-S1647 VanDerWaalsContact O-CA 3.23Å; L1522-S1647 WeakPolarHBondContact O-CA 3.47Å; L1522-S1647 WeakPolarHBondContact O-CB 3.33Å; L1522-S1647 PolarHBondContact O-N 3.41Å; L1522-C1650 HydrophobicContact CB-CB 4.35Å; L1522-C1650 HydrophobicContact CD2-CB 3.7Å; L1522-C1650 HydrophobicContact CG-CB 4.05Å; L1522-A1651 HydrophobicContact CD2-CB 4.44Å
1523D89.6Confident86.3Confident34.8 Ų34.824.4 Ų24.419%0.18614%0.135CC..  trans-125172.2165.596.91.7000111.4E1521 C1525 I1526 L1527 S1532 I1646 C1650E1521-D1523 PolarHBondContact O-N 3.18Å; D1523-C1525 VanDerWaalsContact C-N 3.26Å; D1523-C1525 PolarHBondContact O-N 3.12Å; D1523-C1525 VanDerWaalsContact O-N 3.15Å; D1523-C1525 WeakPolarHBondContact OD1-CA 3.2Å; D1523-C1525 WeakPolarHBondContact OD1-CB 3.29Å; D1523-C1525 PolarHBondContact OD1-N 3.04Å; D1523-I1526 HydrophobicContact CB-CB 4.39Å; D1523-I1526 HydrophobicContact CB-CD1 4.39Å; D1523-I1526 HydrophobicContact CB-CG1 4.4Å; D1523-I1526 CarbonylContact O-C 3.59Å; D1523-I1526 WeakPolarHBondContact O-CA 3.38Å; D1523-I1526 PolarHBondContact O-N 3.17Å; D1523-I1526 WeakPolarHBondContact OD1-CB 3.45Å; D1523-I1526 VanDerWaalsContact OD1-CG1 3.32Å; D1523-I1526 WeakPolarHBondContact OD1-CG1 3.21Å; D1523-I1526 PolarHBondContact OD1-N 3.17Å; D1523-L1527 PolarHBondContact O-N 3.18Å; D1523-S1532 WeakPolarHBondContact OD2-CB 3.24Å; D1523-S1532 PolarHBondContact OD2-OG 3.24Å; D1523-I1646 HydrophobicContact CB-CG2 3.95Å; D1523-C1650 VanDerWaalsContact C-SG 3.56Å
1524Y85.4Confident85.3Confident94.4 Ų94.426.9 Ų26.937%0.3716%0.156SC..Hα-helixtrans-62.2-27.6177.3-61.2-64.4000113.3A1528 I1646 A1649 C1650Y1524-A1528 PolarHBondContact O-N 3.24Å; Y1524-I1646 HydrophobicContact CD2-CG2 4.1Å; Y1524-I1646 HydrophobicContact CE2-CG2 3.97Å; Y1524-A1649 WeakPolarHBondContact OH-CB 3.34Å; Y1524-C1650 VanDerWaalsContact CD1-SG 3.52Å; Y1524-C1650 WeakPolarHBondContact CD1-SG 3.42Å; Y1524-C1650 VanDerWaalsContact CE1-SG 3.53Å; Y1524-C1650 WeakPolarHBondContact CE1-SG 3.5Å; Y1524-C1650 PolarHBondContact N-SG 3.16Å
1525C84Confident84.4Confident44.2 Ų44.226 Ų2630%0.29915%0.152SC..Hα-helixtrans-73.9-41.5175.4-79.10000111.1D1523 L1527 A1528 S1529 G1530 F1531D1523-C1525 VanDerWaalsContact C-N 3.26Å; D1523-C1525 PolarHBondContact O-N 3.12Å; D1523-C1525 VanDerWaalsContact O-N 3.15Å; D1523-C1525 WeakPolarHBondContact OD1-CA 3.2Å; D1523-C1525 WeakPolarHBondContact OD1-CB 3.29Å; D1523-C1525 PolarHBondContact OD1-N 3.04Å; C1525-L1527 PolarHBondContact O-N 3.42Å; C1525-A1528 CarbonylContact O-C 3.55Å; C1525-A1528 VanDerWaalsContact O-C 3.3Å; C1525-A1528 WeakPolarHBondContact O-CA 3.34Å; C1525-A1528 WeakPolarHBondContact O-CB 3.36Å; C1525-A1528 PolarHBondContact O-N 3.17Å; C1525-A1528 VanDerWaalsContact O-N 3.12Å; C1525-S1529 PolarHBondContact O-N 3.39Å; C1525-G1530 VanDerWaalsContact O-CA 3.31Å; C1525-G1530 WeakPolarHBondContact O-CA 3.37Å; C1525-G1530 PolarHBondContact O-N 3.19Å; C1525-F1531 PolarHBondContact SG-O 3.27Å; C1525-F1531 VanDerWaalsContact SG-O 3.32Å
1526I84.9Confident83.4Confident2.4 Ų2.426.1 Ų26.11%0.01215%0.153CC..Hα-helixtrans-71.4-34.9179.4-71.5169.3000111.2V1476 P1477 L1480 E1521 L1522 D1523 A1528 S1529 G1530V1476-I1526 HydrophobicContact CG1-CG2 4.17Å; P1477-I1526 HydrophobicContact CG-CD1 4.22Å; P1477-I1526 HydrophobicContact CG-CG1 4.17Å; P1477-I1526 HydrophobicContact CG-CG2 4.38Å; L1480-I1526 HydrophobicContact CD1-CG2 3.69Å; L1480-I1526 WeakPolarHBondContact CD1-O 3.34Å; E1521-I1526 WeakPolarHBondContact O-CD1 3.21Å; L1522-I1526 HydrophobicContact CD1-CG2 4.42Å; L1522-I1526 HydrophobicContact CD2-CG2 4.03Å; D1523-I1526 HydrophobicContact CB-CB 4.39Å; D1523-I1526 HydrophobicContact CB-CD1 4.39Å; D1523-I1526 HydrophobicContact CB-CG1 4.4Å; D1523-I1526 CarbonylContact O-C 3.59Å; D1523-I1526 WeakPolarHBondContact O-CA 3.38Å; D1523-I1526 PolarHBondContact O-N 3.17Å; D1523-I1526 WeakPolarHBondContact OD1-CB 3.45Å; D1523-I1526 VanDerWaalsContact OD1-CG1 3.32Å; D1523-I1526 WeakPolarHBondContact OD1-CG1 3.21Å; D1523-I1526 PolarHBondContact OD1-N 3.17Å; I1526-A1528 VanDerWaalsContact C-N 3.28Å; I1526-A1528 PolarHBondContact O-N 3.11Å; I1526-S1529 VanDerWaalsContact O-CA 3.25Å; I1526-S1529 WeakPolarHBondContact O-CA 3.31Å; I1526-S1529 PolarHBondContact O-N 3.23Å; I1526-G1530 WeakPolarHBondContact CA-O 3.24Å; I1526-G1530 WeakPolarHBondContact CG1-O 3.32Å
1527L83.4Confident82.5Confident0 Ų031.5 Ų31.50%018%0.181CC..Hα-helixtrans-66.4-23.7169.9-92.5170.1000113.7L1522 D1523 C1525 S1529 I1610 Q1611 V1614 C1650L1522-L1527 HydrophobicContact CD1-CD2 3.84Å; L1522-L1527 HydrophobicContact CD1-CG 3.93Å; L1522-L1527 HydrophobicContact CD2-CD2 4.22Å; L1522-L1527 HydrophobicContact CD2-CG 4.36Å; L1522-L1527 HydrophobicContact CG-CD2 4.4Å; L1522-L1527 HydrophobicContact CG-CG 4.15Å; D1523-L1527 PolarHBondContact O-N 3.18Å; C1525-L1527 PolarHBondContact O-N 3.42Å; L1527-S1529 PolarHBondContact O-N 3.2Å; L1527-I1610 HydrophobicContact CD1-CG2 3.95Å; L1527-I1610 HydrophobicContact CD2-CG2 4.18Å; L1527-Q1611 HydrophobicContact CD1-CG 4.39Å; L1527-V1614 HydrophobicContact CD1-CG2 4.42Å; L1527-V1614 HydrophobicContact CD2-CG2 4.29Å; L1527-C1650 HydrophobicContact CD1-CB 3.64Å; L1527-C1650 HydrophobicContact CD2-CB 4.24Å; L1527-C1650 HydrophobicContact CG-CB 4.46Å
1528A77.6Confident81.6Confident25.8 Ų25.834.9 Ų34.921%0.21320%0.196CC..THydrogen-bonded Turntrans-85.221.6166.600000112.3K1197 Y1524 C1525 I1526 G1530K1197-A1528 WeakPolarHBondContact CD-O 3.21Å; K1197-A1528 PolarHBondContact NZ-O 2.95Å; Y1524-A1528 PolarHBondContact O-N 3.24Å; C1525-A1528 CarbonylContact O-C 3.55Å; C1525-A1528 VanDerWaalsContact O-C 3.3Å; C1525-A1528 WeakPolarHBondContact O-CA 3.34Å; C1525-A1528 WeakPolarHBondContact O-CB 3.36Å; C1525-A1528 PolarHBondContact O-N 3.17Å; C1525-A1528 VanDerWaalsContact O-N 3.12Å; I1526-A1528 VanDerWaalsContact C-N 3.28Å; I1526-A1528 PolarHBondContact O-N 3.11Å; A1528-G1530 VanDerWaalsContact C-N 3.28Å; A1528-G1530 PolarHBondContact O-N 2.98Å
1529S72.7Confident80.6Confident12 Ų1235.5 Ų35.58%0.08420%0.199CC..THydrogen-bonded Turntrans58.420.6-175.3-34.20000114.8K1197 H1340 C1525 I1526 L1527 I1610K1197-S1529 WeakPolarHBondContact CE-O 3.33Å; K1197-S1529 PolarHBondContact NZ-O 3.18Å; H1340-S1529 PolarHBondContact CE1-O 3.44Å; H1340-S1529 PolarHBondContact NE2-O 3.04Å; C1525-S1529 PolarHBondContact O-N 3.39Å; I1526-S1529 VanDerWaalsContact O-CA 3.25Å; I1526-S1529 WeakPolarHBondContact O-CA 3.31Å; I1526-S1529 PolarHBondContact O-N 3.23Å; L1527-S1529 PolarHBondContact O-N 3.2Å; S1529-I1610 VanDerWaalsContact OG-CD1 3.27Å; S1529-I1610 WeakPolarHBondContact OG-CD1 3.35Å
1530G73Confident79.2Confident11 Ų1138.1 Ų38.111%0.11321%0.213CC..  trans-83.3177.9175.500000113.3P1477 C1525 I1526 A1528P1477-G1530 WeakPolarHBondContact CB-O 3.19Å; C1525-G1530 VanDerWaalsContact O-CA 3.31Å; C1525-G1530 WeakPolarHBondContact O-CA 3.37Å; C1525-G1530 PolarHBondContact O-N 3.19Å; I1526-G1530 WeakPolarHBondContact CA-O 3.24Å; I1526-G1530 WeakPolarHBondContact CG1-O 3.32Å; A1528-G1530 VanDerWaalsContact C-N 3.28Å; A1528-G1530 PolarHBondContact O-N 2.98Å
1531F73.9Confident77.7Confident18.2 Ų18.240.9 Ų40.98%0.0823%0.229CC..  trans-102.5145165.6-74.8-94.9000109.8A1336 H1340 W1474 P1477 L1478 C1525 A1535 L1539A1336-F1531 HydrophobicContact CB-CE1 4.22Å; A1336-F1531 HydrophobicContact CB-CE2 4.36Å; A1336-F1531 HydrophobicContact CB-CZ 3.65Å; H1340-F1531 HydrophobicContact CB-CE2 4.09Å; H1340-F1531 HydrophobicContact CB-CZ 4.44Å; H1340-F1531 AromaticContact CD2-CD2 3.58Å; H1340-F1531 VanDerWaalsContact CD2-CD2 3.5Å; H1340-F1531 WeakPolarHBondContact CD2-CD2 3.36Å; H1340-F1531 AromaticContact CD2-CE2 3.41Å; H1340-F1531 WeakPolarHBondContact CD2-CE2 3.45Å; H1340-F1531 AromaticContact CE1-CD2 3.57Å; H1340-F1531 WeakPolarHBondContact CE1-CD2 3.41Å; H1340-F1531 AromaticContact CE1-CE2 3.62Å; H1340-F1531 WeakPolarHBondContact CE1-CE2 3.33Å; H1340-F1531 AromaticContact CG-CE2 3.56Å; H1340-F1531 AromaticContact ND1-CD2 3.89Å; H1340-F1531 AromaticContact ND1-CE2 3.62Å; H1340-F1531 WeakPolarHBondContact ND1-CE2 3.5Å; H1340-F1531 AromaticContact NE2-CD2 3.56Å; H1340-F1531 AromaticContact NE2-CE2 3.59Å; H1340-F1531 WeakPolarHBondContact NE2-CE2 2.97Å; W1474-F1531 HydrophobicContact CD2-CE1 4.45Å; W1474-F1531 HydrophobicContact CE3-CD1 4.32Å; W1474-F1531 AromaticContact CE3-CE1 3.78Å; W1474-F1531 HydrophobicContact CE3-CE1 3.83Å; W1474-F1531 HydrophobicContact CE3-CZ 4.41Å; W1474-F1531 HydrophobicContact CZ3-CD1 4.47Å; W1474-F1531 HydrophobicContact CZ3-CE1 4.37Å; P1477-F1531 HydrophobicContact CB-CD1 3.64Å; P1477-F1531 HydrophobicContact CB-CD2 4.28Å; P1477-F1531 HydrophobicContact CB-CE1 3.58Å; P1477-F1531 HydrophobicContact CB-CE2 4.23Å; P1477-F1531 HydrophobicContact CB-CG 4.01Å; P1477-F1531 HydrophobicContact CB-CZ 3.89Å; P1477-F1531 HydrophobicContact CG-CD1 3.64Å; P1477-F1531 HydrophobicContact CG-CE1 3.93Å; P1477-F1531 HydrophobicContact CG-CG 4.2Å; P1477-F1531 HydrophobicContact CG-CZ 4.39Å; L1478-F1531 HydrophobicContact CD2-CZ 4.44Å; L1478-F1531 HydrophobicContact CG-CZ 4.39Å; C1525-F1531 PolarHBondContact SG-O 3.27Å; C1525-F1531 VanDerWaalsContact SG-O 3.32Å; F1531-A1535 HydrophobicContact CB-CB 4.48Å; F1531-A1535 HydrophobicContact CD1-CB 3.77Å; F1531-A1535 HydrophobicContact CE1-CB 4.42Å; F1531-A1535 HydrophobicContact CG-CB 4.49Å; F1531-L1539 HydrophobicContact CB-CD1 3.8Å; F1531-L1539 HydrophobicContact CD1-CD1 3.87Å; F1531-L1539 HydrophobicContact CD2-CD1 3.35Å; F1531-L1539 HydrophobicContact CE1-CD1 4.26Å; F1531-L1539 HydrophobicContact CE2-CD1 3.78Å; F1531-L1539 HydrophobicContact CG-CD1 3.4Å; F1531-L1539 VanDerWaalsContact CG-CD1 3.43Å; F1531-L1539 HydrophobicContact CZ-CD1 4.23Å
1532S75.4Confident76Confident33.4 Ų33.440.7 Ų40.723%0.23423%0.23CC..  trans-131.1-177.7174.7-162.60000110.3D1523 G1536D1523-S1532 WeakPolarHBondContact OD2-CB 3.24Å; D1523-S1532 PolarHBondContact OD2-OG 3.24Å; S1532-G1536 PolarHBondContact O-N 3.07Å
1533G75.1Confident74.2Confident38.8 Ų38.843.7 Ų43.740%0.425%0.246SC..Hα-helixtrans57.7-140.5176.900000113.9A1535 G1536 N1537G1533-A1535 VanDerWaalsContact C-N 3.31Å; G1533-A1535 PolarHBondContact O-N 3.22Å; G1533-G1536 PolarHBondContact O-N 3.13Å; G1533-N1537 WeakPolarHBondContact O-CB 3.39Å; G1533-N1537 VanDerWaalsContact O-CG 3.27Å; G1533-N1537 PolarHBondContact O-N 3.1Å; G1533-N1537 PolarHBondContact O-ND2 3.13Å
1534S73.5Confident72.2Confident78 Ų7846.4 Ų46.455%0.54527%0.267SS..Hα-helixtrans-60.5-46.2-178.5177.20000112.5S1473 G1536 N1537 K1538S1473-S1534 PolarHBondContact OG-OG 3.12Å; S1534-G1536 PolarHBondContact O-N 2.71Å; S1534-N1537 PolarHBondContact O-N 3.19Å; S1534-K1538 WeakPolarHBondContact O-CB 3.29Å; S1534-K1538 PolarHBondContact O-N 3.18Å; S1534-K1538 VanDerWaalsContact O-N 3.08Å
1535A75.8Confident69.9Low0 Ų044.9 Ų44.90%028%0.28CS..Hα-helixtrans-62.6-45.9177.700000112.1S1473 W1474 F1531 G1533 N1537 K1538 L1539S1473-A1535 VanDerWaalsContact O-CB 3.27Å; S1473-A1535 WeakPolarHBondContact O-CB 3.29Å; W1474-A1535 HydrophobicContact CD2-CB 3.51Å; W1474-A1535 VanDerWaalsContact CD2-CB 3.44Å; W1474-A1535 VanDerWaalsContact CE2-CB 3.45Å; W1474-A1535 HydrophobicContact CE3-CB 3.75Å; W1474-A1535 HydrophobicContact CG-CB 4.04Å; W1474-A1535 HydrophobicContact CH2-CB 3.95Å; W1474-A1535 WeakPolarHBondContact CH2-O 3.2Å; W1474-A1535 VanDerWaalsContact CZ2-CA 3.42Å; W1474-A1535 HydrophobicContact CZ2-CB 3.74Å; W1474-A1535 HydrophobicContact CZ3-CB 3.96Å; F1531-A1535 HydrophobicContact CB-CB 4.48Å; F1531-A1535 HydrophobicContact CD1-CB 3.77Å; F1531-A1535 HydrophobicContact CE1-CB 4.42Å; F1531-A1535 HydrophobicContact CG-CB 4.49Å; G1533-A1535 VanDerWaalsContact C-N 3.31Å; G1533-A1535 PolarHBondContact O-N 3.22Å; A1535-N1537 VanDerWaalsContact C-N 3.35Å; A1535-N1537 PolarHBondContact O-N 3.14Å; A1535-K1538 PolarHBondContact O-N 3.2Å; A1535-L1539 WeakPolarHBondContact O-CB 3.49Å; A1535-L1539 WeakPolarHBondContact O-CG 3.36Å; A1535-L1539 PolarHBondContact O-N 3.24Å
1536G74.5Confident67.4Low2 Ų246.1 Ų46.12%0.02130%0.3CS..Hα-helixtrans-58.7-44.5174.700000112.3S1532 G1533 S1534 K1538 L1539 N1540S1532-G1536 PolarHBondContact O-N 3.07Å; G1533-G1536 PolarHBondContact O-N 3.13Å; S1534-G1536 PolarHBondContact O-N 2.71Å; G1536-K1538 PolarHBondContact O-N 3.19Å; G1536-L1539 PolarHBondContact O-N 3.1Å; G1536-N1540 VanDerWaalsContact O-CB 3.27Å; G1536-N1540 WeakPolarHBondContact O-CB 3.31Å; G1536-N1540 PolarHBondContact O-N 3.05Å; G1536-N1540 PolarHBondContact O-ND2 3.09Å
1537N75.4Confident64.9Low113 Ų11351.3 Ų51.360%0.60434%0.336SS*.Hα-helixtrans-62.9-43.3177.3-72.8-18.5000112.4G1533 S1534 A1535 L1539 N1540 H1541G1533-N1537 WeakPolarHBondContact O-CB 3.39Å; G1533-N1537 VanDerWaalsContact O-CG 3.27Å; G1533-N1537 PolarHBondContact O-N 3.1Å; G1533-N1537 PolarHBondContact O-ND2 3.13Å; S1534-N1537 PolarHBondContact O-N 3.19Å; A1535-N1537 VanDerWaalsContact C-N 3.35Å; A1535-N1537 PolarHBondContact O-N 3.14Å; N1537-L1539 VanDerWaalsContact C-N 3.34Å; N1537-L1539 PolarHBondContact O-N 3.17Å; N1537-N1540 PolarHBondContact O-N 3.16Å; N1537-H1541 WeakPolarHBondContact O-CB 3.27Å; N1537-H1541 PolarHBondContact O-N 3.01Å
1538K75.8Confident62.5Low76.4 Ų76.460.5 Ų60.533%0.33238%0.382SS..Hα-helixtrans-63.2-44177.4-128179.3178.8-169.60111.9E1333 W1474 S1534 A1535 G1536 N1540 H1541 L1542E1333-K1538 WeakPolarHBondContact OE1-CD 3.45Å; E1333-K1538 IonicContact OE1-NZ 3.56Å; E1333-K1538 PolarHBondContact OE1-NZ 3.17Å; E1333-K1538 VanDerWaalsContact OE2-CE 3.26Å; E1333-K1538 WeakPolarHBondContact OE2-CE 3.43Å; E1333-K1538 IonicContact OE2-NZ 3.44Å; E1333-K1538 PolarHBondContact OE2-NZ 3.01Å; W1474-K1538 HydrophobicContact CH2-CB 4.13Å; W1474-K1538 HydrophobicContact CH2-CD 4.25Å; W1474-K1538 HydrophobicContact CZ2-CB 4.18Å; W1474-K1538 HydrophobicContact CZ2-CD 3.8Å; W1474-K1538 HydrophobicContact CZ2-CG 4.49Å; S1534-K1538 WeakPolarHBondContact O-CB 3.29Å; S1534-K1538 PolarHBondContact O-N 3.18Å; S1534-K1538 VanDerWaalsContact O-N 3.08Å; A1535-K1538 PolarHBondContact O-N 3.2Å; G1536-K1538 PolarHBondContact O-N 3.19Å; K1538-N1540 PolarHBondContact O-N 3.39Å; K1538-H1541 WeakPolarHBondContact O-CB 3.37Å; K1538-H1541 PolarHBondContact O-N 3.33Å; K1538-L1542 WeakPolarHBondContact O-CG 3.45Å; K1538-L1542 PolarHBondContact O-N 3.23Å
1539L73.8Confident60.1Low14.2 Ų14.263.3 Ų63.37%0.07441%0.405CS..Hα-helixtrans-68.2-41.8177.1-70.9168.4000112.4Y1337 W1474 F1531 A1535 G1536 N1537 H1541 L1542 L1543 F1557Y1337-L1539 HydrophobicContact CD1-CD2 4.12Å; Y1337-L1539 HydrophobicContact CE1-CD2 3.51Å; Y1337-L1539 VanDerWaalsContact CE1-CD2 3.46Å; W1474-L1539 HydrophobicContact CH2-CD1 4.45Å; W1474-L1539 HydrophobicContact CH2-CD2 4.45Å; W1474-L1539 HydrophobicContact CH2-CG 4.14Å; W1474-L1539 HydrophobicContact CZ3-CD1 3.93Å; W1474-L1539 HydrophobicContact CZ3-CD2 4.31Å; W1474-L1539 HydrophobicContact CZ3-CG 3.98Å; F1531-L1539 HydrophobicContact CB-CD1 3.8Å; F1531-L1539 HydrophobicContact CD1-CD1 3.87Å; F1531-L1539 HydrophobicContact CD2-CD1 3.35Å; F1531-L1539 HydrophobicContact CE1-CD1 4.26Å; F1531-L1539 HydrophobicContact CE2-CD1 3.78Å; F1531-L1539 HydrophobicContact CG-CD1 3.4Å; F1531-L1539 VanDerWaalsContact CG-CD1 3.43Å; F1531-L1539 HydrophobicContact CZ-CD1 4.23Å; A1535-L1539 WeakPolarHBondContact O-CB 3.49Å; A1535-L1539 WeakPolarHBondContact O-CG 3.36Å; A1535-L1539 PolarHBondContact O-N 3.24Å; G1536-L1539 PolarHBondContact O-N 3.1Å; N1537-L1539 VanDerWaalsContact C-N 3.34Å; N1537-L1539 PolarHBondContact O-N 3.17Å; L1539-H1541 VanDerWaalsContact C-N 3.28Å; L1539-H1541 PolarHBondContact O-N 3.17Å; L1539-L1542 WeakPolarHBondContact O-CB 3.32Å; L1539-L1542 PolarHBondContact O-N 3.07Å; L1539-L1542 VanDerWaalsContact O-N 3.16Å; L1539-L1543 WeakPolarHBondContact O-CB 3.3Å; L1539-L1543 VanDerWaalsContact O-CG 3.32Å; L1539-L1543 WeakPolarHBondContact O-CG 3.48Å; L1539-L1543 PolarHBondContact O-N 3.29Å; L1539-L1543 VanDerWaalsContact O-N 3.13Å; L1539-F1557 HydrophobicContact CB-CE1 4.5Å; L1539-F1557 HydrophobicContact CB-CZ 4.1Å
1540N65.6Low58.1Low55.6 Ų55.668 Ų6830%0.29744%0.438SS..Hα-helixtrans-62.4-31.8176.4-76.7-43.9000112.6G1536 N1537 K1538 L1542 L1543 S1544 F1557 S1558G1536-N1540 VanDerWaalsContact O-CB 3.27Å; G1536-N1540 WeakPolarHBondContact O-CB 3.31Å; G1536-N1540 PolarHBondContact O-N 3.05Å; G1536-N1540 PolarHBondContact O-ND2 3.09Å; N1537-N1540 PolarHBondContact O-N 3.16Å; K1538-N1540 PolarHBondContact O-N 3.39Å; N1540-L1542 VanDerWaalsContact C-N 3.27Å; N1540-L1542 PolarHBondContact O-N 3.08Å; N1540-L1543 PolarHBondContact O-N 2.97Å; N1540-L1543 VanDerWaalsContact O-N 3.13Å; N1540-S1544 VanDerWaalsContact O-CB 3.3Å; N1540-S1544 WeakPolarHBondContact O-CB 3.33Å; N1540-S1544 PolarHBondContact O-N 3.2Å; N1540-F1557 WeakPolarHBondContact ND2-CE2 3.47Å; N1540-F1557 WeakPolarHBondContact OD1-CB 3.36Å; N1540-F1557 WeakPolarHBondContact OD1-CE2 3.41Å; N1540-S1558 VanDerWaalsContact ND2-CB 3.29Å; N1540-S1558 WeakPolarHBondContact ND2-CB 3.1Å; N1540-S1558 PolarHBondContact ND2-OG 3.13Å; N1540-S1558 WeakPolarHBondContact OD1-CB 3.23Å; N1540-S1558 PolarHBondContact OD1-OG 3.34Å
1541H61.3Low55.9Low143.8 Ų143.874 Ų7467%0.66648%0.478SS*.Hα-helixtrans-66.2-30.4177.3-162.3-70.7000112.7N1537 K1538 L1539 L1543 S1544 G1545N1537-H1541 WeakPolarHBondContact O-CB 3.27Å; N1537-H1541 PolarHBondContact O-N 3.01Å; K1538-H1541 WeakPolarHBondContact O-CB 3.37Å; K1538-H1541 PolarHBondContact O-N 3.33Å; L1539-H1541 VanDerWaalsContact C-N 3.28Å; L1539-H1541 PolarHBondContact O-N 3.17Å; H1541-L1543 VanDerWaalsContact C-N 3.3Å; H1541-L1543 PolarHBondContact O-N 3.26Å; H1541-S1544 PolarHBondContact O-N 3.46Å; H1541-G1545 PolarHBondContact O-N 3.44Å
1542L55.5Low53.8Low54.6 Ų54.676.1 Ų76.129%0.28651%0.505SS..Hα-helixtrans-67.2-40.4172.1-67.1171.8000111.7Q1187 Y1337 K1538 L1539 N1540 S1544 G1545Q1187-L1542 HydrophobicContact CG-CD1 4Å; Q1187-L1542 HydrophobicContact CG-CD2 3.74Å; Q1187-L1542 HydrophobicContact CG-CG 4.26Å; Q1187-L1542 VanDerWaalsContact NE2-CD2 3.32Å; Y1337-L1542 HydrophobicContact CD1-CD1 4.14Å; Y1337-L1542 HydrophobicContact CE1-CD1 3.69Å; Y1337-L1542 VanDerWaalsContact CE1-CD1 3.5Å; K1538-L1542 WeakPolarHBondContact O-CG 3.45Å; K1538-L1542 PolarHBondContact O-N 3.23Å; L1539-L1542 WeakPolarHBondContact O-CB 3.32Å; L1539-L1542 PolarHBondContact O-N 3.07Å; L1539-L1542 VanDerWaalsContact O-N 3.16Å; N1540-L1542 VanDerWaalsContact C-N 3.27Å; N1540-L1542 PolarHBondContact O-N 3.08Å; L1542-S1544 VanDerWaalsContact C-N 3.31Å; L1542-S1544 PolarHBondContact O-N 3.21Å; L1542-G1545 PolarHBondContact O-N 3.5Å
1543L52.3Low51.5Low65 Ų6578.9 Ų78.934%0.3453%0.53SS..Hα-helixtrans-73.4-21.1-179.3-60.7174.9000113.2I1192 L1539 N1540 H1541 F1557I1192-L1543 WeakPolarHBondContact O-CD2 3.36Å; L1539-L1543 WeakPolarHBondContact O-CB 3.3Å; L1539-L1543 VanDerWaalsContact O-CG 3.32Å; L1539-L1543 WeakPolarHBondContact O-CG 3.48Å; L1539-L1543 PolarHBondContact O-N 3.29Å; L1539-L1543 VanDerWaalsContact O-N 3.13Å; N1540-L1543 PolarHBondContact O-N 2.97Å; N1540-L1543 VanDerWaalsContact O-N 3.13Å; H1541-L1543 VanDerWaalsContact C-N 3.3Å; H1541-L1543 PolarHBondContact O-N 3.26Å; L1543-F1557 HydrophobicContact CB-CE2 3.9Å; L1543-F1557 HydrophobicContact CB-CZ 4.4Å; L1543-F1557 HydrophobicContact CD1-CB 4.05Å; L1543-F1557 HydrophobicContact CD1-CD2 3.95Å; L1543-F1557 HydrophobicContact CD1-CE1 4.34Å; L1543-F1557 HydrophobicContact CD1-CE2 4.07Å; L1543-F1557 HydrophobicContact CD1-CG 4.16Å; L1543-F1557 HydrophobicContact CD1-CZ 3.97Å; L1543-F1557 HydrophobicContact CD2-CE2 4.27Å; L1543-F1557 HydrophobicContact CD2-CZ 4.02Å; L1543-F1557 HydrophobicContact CG-CE2 4.27Å; L1543-F1557 HydrophobicContact CG-CZ 4.26Å
1544S46.6Very low49.4Very low92.2 Ų92.283.9 Ų83.965%0.64555%0.546SS*.THydrogen-bonded Turntrans-97-7.5-174.8-167.70000114.6N1540 H1541 L1542 G1546N1540-S1544 VanDerWaalsContact O-CB 3.3Å; N1540-S1544 WeakPolarHBondContact O-CB 3.33Å; N1540-S1544 PolarHBondContact O-N 3.2Å; H1541-S1544 PolarHBondContact O-N 3.46Å; L1542-S1544 VanDerWaalsContact C-N 3.31Å; L1542-S1544 PolarHBondContact O-N 3.21Å; S1544-G1546 VanDerWaalsContact C-N 3.33Å; S1544-G1546 PolarHBondContact O-N 2.99Å
1545G37.3Very low47.4Very low61.4 Ų61.485.6 Ų85.663%0.63355%0.549SS*.  trans-107.271.3-179.200000113.8H1541 L1542 S1547H1541-G1545 PolarHBondContact O-N 3.44Å; L1542-G1545 PolarHBondContact O-N 3.5Å; G1545-S1547 PolarHBondContact O-N 3.1Å
1546G32.5Very low45.4Very low70 Ų7091.9 Ų91.972%0.72258%0.582SS**SBendtrans-137.175.1178.800000115.7S1544 M1548S1544-G1546 VanDerWaalsContact C-N 3.33Å; S1544-G1546 PolarHBondContact O-N 2.99Å; G1546-M1548 PolarHBondContact O-N 3.03Å
1547S31.9Very low43.4Very low111 Ų11196.1 Ų96.178%0.77660%0.6SS**  trans-123.2123176.4-161.90000113.8G1545 A1549G1545-S1547 PolarHBondContact O-N 3.1Å; S1547-A1549 PolarHBondContact O-N 3.29Å; S1547-A1549 PolarHBondContact OG-N 3.1Å; S1547-A1549 PolarHBondContact OG-O 3.02Å; S1547-A1549 VanDerWaalsContact OG-O 3.04Å
1548M32.2Very low41.4Very low193.8 Ų193.893.5 Ų93.596%0.95559%0.591SS**  trans-87.362.8171.4-69.2-164.27000113.6G1546 S1550G1546-M1548 PolarHBondContact O-N 3.03Å; M1548-S1550 PolarHBondContact O-N 3.31Å
1549A28.4Very low39.2Very low84.4 Ų84.499.5 Ų99.570%0.69861%0.611SS**  trans-141.1124.2166.800000112.9S1547 S1551S1547-A1549 PolarHBondContact O-N 3.29Å; S1547-A1549 PolarHBondContact OG-N 3.1Å; S1547-A1549 PolarHBondContact OG-O 3.02Å; S1547-A1549 VanDerWaalsContact OG-O 3.04Å; A1549-S1551 PolarHBondContact O-N 3.32Å
1550S29.8Very low37.1Very low110.8 Ų110.8104.1 Ų104.178%0.77564%0.635SS**  trans54.897172.3179.10000116.7M1548 G1552M1548-S1550 PolarHBondContact O-N 3.31Å; S1550-G1552 VanDerWaalsContact C-N 3.28Å; S1550-G1552 PolarHBondContact O-N 3.26Å
1551S28Very low35.4Very low137.4 Ų137.4106.8 Ų106.896%0.96165%0.654SS**SBendtrans-51.466.9164.5-69.40000113.1A1549A1549-S1551 PolarHBondContact O-N 3.32Å
1552G29.1Very low33.8Very low62 Ų62103.4 Ų103.464%0.63966%0.657SS**  trans-155.89.3-175.200000116.1S1550 I1554S1550-G1552 VanDerWaalsContact C-N 3.28Å; S1550-G1552 PolarHBondContact O-N 3.26Å; G1552-I1554 PolarHBondContact O-N 3.03Å
1553A28.1Very low32.5Very low92.2 Ų92.2107.5 Ų107.576%0.76268%0.678SS**  trans-97.4104.9-18000000112N1555A1553-N1555 PolarHBondContact O-N 3.46Å
1554I30.9Very low31.3Very low144 Ų144108.9 Ų108.974%0.73870%0.699SS**  trans-87113.1177.4-50.8170.9000108.9G1552 L1556G1552-I1554 PolarHBondContact O-N 3.03Å; I1554-L1556 PolarHBondContact O-N 2.98Å
1555N31.3Very low30.3Very low114.2 Ų114.2112.5 Ų112.561%0.61171%0.705SS**  trans-26.188.5171.8-71.3-10.2000112.5A1553 F1557 S1558A1553-N1555 PolarHBondContact O-N 3.46Å; N1555-F1557 VanDerWaalsContact C-N 3.32Å; N1555-F1557 PolarHBondContact O-N 2.88Å; N1555-S1558 WeakPolarHBondContact O-CB 3.41Å; N1555-S1558 PolarHBondContact O-N 3.37Å; N1555-S1558 VanDerWaalsContact O-N 3.1Å
1556L32.5Very low29.8Very low131.8 Ų131.8117.9 Ų117.969%0.6972%0.716SS**  trans-74.5-15.1177.8-97.3163.2000113.9I1554 S1558 R1559 L1560I1554-L1556 PolarHBondContact O-N 2.98Å; L1556-S1558 VanDerWaalsContact C-N 3.32Å; L1556-S1558 PolarHBondContact O-N 3.21Å; L1556-S1558 VanDerWaalsContact O-N 3.13Å; L1556-R1559 PolarHBondContact O-N 3.29Å; L1556-L1560 HydrophobicContact CD2-CD1 4.41Å
1557F33.4Very low29.5Very low90.2 Ų90.2117.4 Ų117.440%0.39671%0.711SS.*SBendtrans-102.580.2173.3-75-85.9000112.1P1194 L1539 N1540 L1543 N1555 R1559P1194-F1557 HydrophobicContact CB-CZ 4.35Å; P1194-F1557 HydrophobicContact CG-CE1 3.98Å; P1194-F1557 HydrophobicContact CG-CE2 3.84Å; P1194-F1557 HydrophobicContact CG-CZ 4.09Å; L1539-F1557 HydrophobicContact CB-CE1 4.5Å; L1539-F1557 HydrophobicContact CB-CZ 4.1Å; N1540-F1557 WeakPolarHBondContact ND2-CE2 3.47Å; N1540-F1557 WeakPolarHBondContact OD1-CB 3.36Å; N1540-F1557 WeakPolarHBondContact OD1-CE2 3.41Å; L1543-F1557 HydrophobicContact CB-CE2 3.9Å; L1543-F1557 HydrophobicContact CB-CZ 4.4Å; L1543-F1557 HydrophobicContact CD1-CB 4.05Å; L1543-F1557 HydrophobicContact CD1-CD2 3.95Å; L1543-F1557 HydrophobicContact CD1-CE1 4.34Å; L1543-F1557 HydrophobicContact CD1-CE2 4.07Å; L1543-F1557 HydrophobicContact CD1-CG 4.16Å; L1543-F1557 HydrophobicContact CD1-CZ 3.97Å; L1543-F1557 HydrophobicContact CD2-CE2 4.27Å; L1543-F1557 HydrophobicContact CD2-CZ 4.02Å; L1543-F1557 HydrophobicContact CG-CE2 4.27Å; L1543-F1557 HydrophobicContact CG-CZ 4.26Å; N1555-F1557 VanDerWaalsContact C-N 3.32Å; N1555-F1557 PolarHBondContact O-N 2.88Å; F1557-R1559 VanDerWaalsContact C-N 3.32Å; F1557-R1559 PolarHBondContact O-N 3.08Å
1558S33.5Very low29.3Very low58 Ų58122 Ų12241%0.40671%0.712SS.*  trans-36.951.4169.3-39.10000116.2N1540 N1555 L1556 L1560 S1602N1540-S1558 VanDerWaalsContact ND2-CB 3.29Å; N1540-S1558 WeakPolarHBondContact ND2-CB 3.1Å; N1540-S1558 PolarHBondContact ND2-OG 3.13Å; N1540-S1558 WeakPolarHBondContact OD1-CB 3.23Å; N1540-S1558 PolarHBondContact OD1-OG 3.34Å; N1555-S1558 WeakPolarHBondContact O-CB 3.41Å; N1555-S1558 PolarHBondContact O-N 3.37Å; N1555-S1558 VanDerWaalsContact O-N 3.1Å; L1556-S1558 VanDerWaalsContact C-N 3.32Å; L1556-S1558 PolarHBondContact O-N 3.21Å; L1556-S1558 VanDerWaalsContact O-N 3.13Å; S1558-L1560 VanDerWaalsContact C-N 3.26Å; S1558-L1560 PolarHBondContact O-N 2.84Å; S1558-L1560 VanDerWaalsContact O-N 3.07Å; S1558-S1602 VanDerWaalsContact CB-OG 3.23Å; S1558-S1602 WeakPolarHBondContact CB-OG 3.48Å; S1558-S1602 PolarHBondContact OG-OG 3.36Å
1559R29.7Very low29.1Very low203.2 Ų203.2117.2 Ų117.277%0.76770%0.697SS**  trans-101.364163.2-85.8-168.7174.7-168.1-0.5112.1L1556 F1557 T1561L1556-R1559 PolarHBondContact O-N 3.29Å; F1557-R1559 VanDerWaalsContact C-N 3.32Å; F1557-R1559 PolarHBondContact O-N 3.08Å; R1559-T1561 VanDerWaalsContact C-N 3.33Å; R1559-T1561 PolarHBondContact O-N 3.1Å
1560L29.9Very low29.2Very low110.4 Ų110.4121.8 Ų121.858%0.57870%0.701SS**  trans-101.542.5176.8-108.9121.5000112.7L1556 S1558 G1562 I1563 T1599L1556-L1560 HydrophobicContact CD2-CD1 4.41Å; S1558-L1560 VanDerWaalsContact C-N 3.26Å; S1558-L1560 PolarHBondContact O-N 2.84Å; S1558-L1560 VanDerWaalsContact O-N 3.07Å; L1560-G1562 VanDerWaalsContact C-N 3.3Å; L1560-G1562 PolarHBondContact O-N 3.47Å; L1560-G1562 VanDerWaalsContact O-N 3.08Å; L1560-I1563 HydrophobicContact CD1-CD1 4.12Å; L1560-I1563 HydrophobicContact CD2-CB 4.22Å; L1560-I1563 HydrophobicContact CD2-CD1 3.82Å; L1560-I1563 HydrophobicContact CD2-CG1 4.09Å; L1560-I1563 HydrophobicContact CG-CD1 4.1Å; L1560-I1563 HydrophobicContact CG-CG1 4.1Å; L1560-T1599 HydrophobicContact CD2-CG2 3.55Å; L1560-T1599 HydrophobicContact CG-CG2 4.19Å
1561T30.2Very low29Very low112.4 Ų112.4125.2 Ų125.269%0.6970%0.702SS**THydrogen-bonded Turntrans-109.565.7165.645.10000110.9R1559 I1563R1559-T1561 VanDerWaalsContact C-N 3.33Å; R1559-T1561 PolarHBondContact O-N 3.1Å; T1561-I1563 PolarHBondContact O-N 3.23Å
1562G27Very low29.1Very low71.6 Ų71.6125.9 Ų125.974%0.73870%0.695SS**  trans-164.224.1-172.300000117L1560L1560-G1562 VanDerWaalsContact C-N 3.3Å; L1560-G1562 PolarHBondContact O-N 3.47Å; L1560-G1562 VanDerWaalsContact O-N 3.08Å
1563I28.6Very low29.3Very low141.6 Ų141.6128.6 Ų128.673%0.72670%0.702SS**  trans-122.480.9174.5-51.4-177.5000110.2L1560 T1561 H1565 M1566L1560-I1563 HydrophobicContact CD1-CD1 4.12Å; L1560-I1563 HydrophobicContact CD2-CB 4.22Å; L1560-I1563 HydrophobicContact CD2-CD1 3.82Å; L1560-I1563 HydrophobicContact CD2-CG1 4.09Å; L1560-I1563 HydrophobicContact CG-CD1 4.1Å; L1560-I1563 HydrophobicContact CG-CG1 4.1Å; T1561-I1563 PolarHBondContact O-N 3.23Å; I1563-H1565 PolarHBondContact O-N 2.89Å; I1563-M1566 HydrophobicContact CG2-CB 3.87Å; I1563-M1566 HydrophobicContact CG2-CG 3.88Å
1564A26.5Very low29.3Very low93.4 Ų93.4127.6 Ų127.677%0.77270%0.701SS**  trans-111.9101.4158.600000109.9M1566A1564-M1566 PolarHBondContact O-N 3.23Å
1565H25.8Very low29.3Very low167.8 Ų167.8132.1 Ų132.178%0.77771%0.708SS**  trans-25.5107.7173.3-91.2-84.9000113.1I1563 G1567 K1570I1563-H1565 PolarHBondContact O-N 2.89Å; H1565-G1567 PolarHBondContact O-N 3.41Å; H1565-K1570 PolarHBondContact CD2-NZ 2.98Å; H1565-K1570 VanDerWaalsContact CD2-NZ 3.35Å; H1565-K1570 VanDerWaalsContact NE2-CE 3.31Å; H1565-K1570 WeakPolarHBondContact NE2-CE 3.28Å; H1565-K1570 PolarHBondContact NE2-NZ 3.39Å
1566M26.7Very low29.3Very low176.2 Ų176.2136.1 Ų136.187%0.86872%0.72SS**  trans-101.9107.8142-83.7-108.7158.200110.7I1563 A1564 R1568I1563-M1566 HydrophobicContact CG2-CB 3.87Å; I1563-M1566 HydrophobicContact CG2-CG 3.88Å; A1564-M1566 PolarHBondContact O-N 3.23Å; M1566-R1568 PolarHBondContact O-N 3.33Å
1567G25.9Very low29.3Very low59.8 Ų59.8136.7 Ų136.762%0.61672%0.724SS**  trans-80.7131.6168.800000111H1565 S1569H1565-G1567 PolarHBondContact O-N 3.41Å; G1567-S1569 PolarHBondContact O-N 3.02Å
1568R28Very low29.2Very low207.8 Ų207.8139.7 Ų139.778%0.78474%0.743SS**  trans-81.5108.1178.7-127.8-177.3-176.4-172.13.4111.7M1566 K1570 T1687 D1689 N1693 H1728M1566-R1568 PolarHBondContact O-N 3.33Å; R1568-K1570 PolarHBondContact O-N 3.28Å; R1568-T1687 PolarHBondContact NH2-OG1 2.86Å; R1568-D1689 VanDerWaalsContact CD-OD2 3.29Å; R1568-D1689 WeakPolarHBondContact CD-OD2 3.45Å; R1568-D1689 IonicContact CZ-OD2 3.18Å; R1568-D1689 IonicContact NE-OD2 2.74Å; R1568-D1689 IonicContact NH1-OD1 3.98Å; R1568-D1689 IonicContact NH1-OD2 2.7Å; R1568-D1689 PolarHBondContact NH1-OD2 3.11Å; R1568-D1689 IonicContact NH2-OD2 2.7Å; R1568-D1689 PolarHBondContact NH2-OD2 3.27Å; R1568-N1693 PolarHBondContact NH1-ND2 2.73Å; R1568-H1728 PolarHBondContact NH2-NE2 3.25Å
1569S28.5Very low29.4Very low91.8 Ų91.8142.3 Ų142.364%0.64276%0.759SS**  trans-114.5129.9165.9176.80000112.9G1567G1567-S1569 PolarHBondContact O-N 3.02Å
1570K28.9Very low29.3Very low180.6 Ų180.6138.5 Ų138.579%0.78576%0.763SS**  trans-92.5124.2176.8-80.1-176.9174.7179.60110.7H1565 R1568 N1572H1565-K1570 PolarHBondContact CD2-NZ 2.98Å; H1565-K1570 VanDerWaalsContact CD2-NZ 3.35Å; H1565-K1570 VanDerWaalsContact NE2-CE 3.31Å; H1565-K1570 WeakPolarHBondContact NE2-CE 3.28Å; H1565-K1570 PolarHBondContact NE2-NZ 3.39Å; R1568-K1570 PolarHBondContact O-N 3.28Å; K1570-N1572 PolarHBondContact O-N 3.4Å
1571F27.5Very low29.3Very low181.8 Ų181.8136.9 Ų136.980%0.79777%0.774SS**  trans-64.9138.4156.4-93.5-96.3000112.8T1382T1382-F1571 HydrophobicContact CG2-CZ 4.46Å
1572N30.1Very low29.4Very low153.8 Ų153.8141.5 Ų141.582%0.82279%0.787SS**  trans-139.6112.8167.1-166.419.2000110.5K1570 G1574K1570-N1572 PolarHBondContact O-N 3.4Å; N1572-G1574 PolarHBondContact O-N 2.94Å
1573P31.3Very low29.6Very low118 Ų118141.6 Ų141.677%0.76679%0.787SS**  trans-97129.1-178.334.6-30.4000112.8
1574G28.4Very low29.7Very low72 Ų72142.8 Ų142.874%0.74279%0.792SS**  trans163.298.1167.600000117.8N1572N1572-G1574 PolarHBondContact O-N 2.94Å
1575R31.5Very low29.9Very low238.2 Ų238.2146.5 Ų146.590%0.89979%0.791SS**  trans-178.4129.9152.4-82.6179.7-179.3-163.50.1113.2
1576K31.5Very low30.1Very low198.2 Ų198.2146.3 Ų146.386%0.86279%0.79SS**  -125129.2118.2-77-175.8178.5-178.70109.5
1577N32Very low30.2Very low143 Ų143146.5 Ų146.577%0.76579%0.789SS**  trans-142.2138.1148.4-80.95.5000111.7
1578L32.5Very low30.2Very low154.6 Ų154.6147.3 Ų147.381%0.80980%0.797SS**  trans-141.2164.6145.4-137.171.5000110.2M1389M1389-L1578 HydrophobicContact CE-CD1 3.46Å; M1389-L1578 VanDerWaalsContact CE-CD1 3.46Å; M1389-L1578 HydrophobicContact CE-CD2 3.84Å; M1389-L1578 HydrophobicContact CE-CG 4.3Å; M1389-L1578 HydrophobicContact SD-CD2 4.17Å
1579P36.8Very low30.3Very low112.8 Ų112.8142.1 Ų142.173%0.73280%0.798SS**  -116.6176.3-107.739.5-28.2000115
1580S27.6Very low30.4Very low123 Ų123143.8 Ų143.886%0.8681%0.805SS**  trans65.2128.7155.2-103.30000119
1581G30.6Very low30.3Very low77 Ų77142.8 Ų142.879%0.79481%0.808SS**  trans-154.8129162.900000111.5G1583G1581-G1583 PolarHBondContact O-N 2.71Å
1582H31.2Very low30.3Very low209 Ų209140.2 Ų140.297%0.96881%0.807SS**  trans-88.9142.2-178.3-93.7-64.4000113.2
1583G31Very low30.1Very low72.2 Ų72.2140.8 Ų140.874%0.74481%0.805SS**  trans-174.3140.7166.300000110.8G1581G1581-G1583 PolarHBondContact O-N 2.71Å
1584M32.2Very low30Very low168 Ų168140.2 Ų140.283%0.82880%0.801SS**  trans-126.5144.8-161.2-97-149.6135.100112.4
1585K28.9Very low30Very low171.4 Ų171.4143.6 Ų143.675%0.74580%0.8SS**  trans65.3136154-70-179.7173.4179.70118.9
1586Q30.6Very low29.9Very low163 Ų163138.6 Ų138.676%0.76279%0.792SS**  162.3132.792.9-104.9175.9-17.300114.5
1587H28.6Very low29.7Very low181.2 Ų181.2136.4 Ų136.484%0.83978%0.782SS**  trans35.5138.4162.7-69.2-84.5000116.1A1589H1587-A1589 VanDerWaalsContact C-N 3.35Å
1588G27.4Very low29.5Very low75.8 Ų75.8133.1 Ų133.178%0.78178%0.775SS**  137.6104.9110.200000113.9T1590G1588-T1590 PolarHBondContact O-N 3.3Å
1589A30.1Very low29.4Very low98.4 Ų98.4130.4 Ų130.481%0.81377%0.765SS**  trans-129138172.600000113H1587 N1591H1587-A1589 VanDerWaalsContact C-N 3.35Å; A1589-N1591 PolarHBondContact O-N 3.09Å
1590T29.3Very low29.1Very low127.6 Ų127.6127.5 Ų127.578%0.78375%0.751SS**  trans-83.5124.7170.747.40000113.5G1588 T1592G1588-T1590 PolarHBondContact O-N 3.3Å; T1590-T1592 PolarHBondContact O-N 3.37Å
1591N26.8Very low29.2Very low160 Ų160128.4 Ų128.486%0.85674%0.741SS**  trans-99.2120.6158.7-86.9-25000109.7A1589 E1593A1589-N1591 PolarHBondContact O-N 3.09Å; N1591-E1593 VanDerWaalsContact C-N 3.28Å; N1591-E1593 PolarHBondContact O-N 3.42Å
1592T28.8Very low29.2Very low127 Ų127128.2 Ų128.278%0.77973%0.727SS**  trans-109.6111.2170.839.60000109.8T1590 P1594T1590-T1592 PolarHBondContact O-N 3.37Å; T1592-P1594 VanDerWaalsContact O-CD 3.32Å; T1592-P1594 WeakPolarHBondContact O-CD 3.48Å
1593E26Very low29.4Very low167 Ų167120.4 Ų120.478%0.7870%0.696SS**  trans-76137.1166.5-80.5-167.6128.700110.3N1591 I1595 K1597N1591-E1593 VanDerWaalsContact C-N 3.28Å; N1591-E1593 PolarHBondContact O-N 3.42Å; E1593-I1595 PolarHBondContact O-N 3.28Å; E1593-I1595 VanDerWaalsContact O-N 3.14Å; E1593-K1597 IonicContact OE1-NZ 3.16Å; E1593-K1597 PolarHBondContact OE1-NZ 3.2Å
1594P28.3Very low30Very low105.2 Ų105.2120.6 Ų120.668%0.68368%0.68SS**  trans-74.6123.7176.230-32.7000110.9T1592 N1596T1592-P1594 VanDerWaalsContact O-CD 3.32Å; T1592-P1594 WeakPolarHBondContact O-CD 3.48Å; P1594-N1596 VanDerWaalsContact C-N 3.33Å; P1594-N1596 PolarHBondContact O-N 3.09Å
1595I28Very low30.9Very low142 Ų142117.9 Ų117.973%0.72867%0.669SS**  trans-73.573.7-176-55172.8000110.6E1593 K1597 A1598E1593-I1595 PolarHBondContact O-N 3.28Å; E1593-I1595 VanDerWaalsContact O-N 3.14Å; I1595-K1597 HydrophobicContact CG2-CB 4.37Å; I1595-K1597 HydrophobicContact CG2-CD 4.23Å; I1595-K1597 HydrophobicContact CG2-CG 3.96Å; I1595-K1597 PolarHBondContact O-N 2.97Å; I1595-A1598 HydrophobicContact CG2-CB 4.3Å
1596N29Very low32.9Very low134.2 Ų134.2111.6 Ų111.672%0.71864%0.64SS**  trans-89.421.5177.3-78.5-13000113.2P1594 T1599P1594-N1596 VanDerWaalsContact C-N 3.33Å; P1594-N1596 PolarHBondContact O-N 3.09Å; N1596-T1599 PolarHBondContact O-OG1 2.98Å
1597K28.8Very low35.2Very low152.6 Ų152.6105.4 Ų105.466%0.66361%0.611SS**THydrogen-bonded Turntrans-90.2-21.5176.8-77.8179.1179.1170.70114.1E1593 I1595 T1599 A1600 H1601E1593-K1597 IonicContact OE1-NZ 3.16Å; E1593-K1597 PolarHBondContact OE1-NZ 3.2Å; I1595-K1597 HydrophobicContact CG2-CB 4.37Å; I1595-K1597 HydrophobicContact CG2-CD 4.23Å; I1595-K1597 HydrophobicContact CG2-CG 3.96Å; I1595-K1597 PolarHBondContact O-N 2.97Å; K1597-T1599 VanDerWaalsContact C-N 3.31Å; K1597-T1599 PolarHBondContact O-N 3.11Å; K1597-A1600 PolarHBondContact O-N 3.32Å; K1597-H1601 PolarHBondContact O-CD2 3.17Å
1598A27.6Very low37.9Very low73.6 Ų73.697.9 Ų97.961%0.60858%0.579SS**THydrogen-bonded Turntrans-68.2-31.2-176.700000113.7I1595 A1600 H1601I1595-A1598 HydrophobicContact CG2-CB 4.3Å; A1598-A1600 VanDerWaalsContact C-N 3.3Å; A1598-A1600 PolarHBondContact O-N 3.25Å; A1598-H1601 PolarHBondContact O-N 3.32Å
1599T30.1Very low40.7Very low96.8 Ų96.895 Ų9559%0.59455%0.545SS*.Hα-helixtrans-74.4-19-175.57.80000114.1L1560 N1596 K1597 H1601 S1602L1560-T1599 HydrophobicContact CD2-CG2 3.55Å; L1560-T1599 HydrophobicContact CG-CG2 4.19Å; N1596-T1599 PolarHBondContact O-OG1 2.98Å; K1597-T1599 VanDerWaalsContact C-N 3.31Å; K1597-T1599 PolarHBondContact O-N 3.11Å; T1599-H1601 VanDerWaalsContact C-N 3.28Å; T1599-H1601 PolarHBondContact O-N 3.3Å; T1599-S1602 PolarHBondContact O-N 3.37Å
1600A29.8Very low43.5Very low53.2 Ų53.290.4 Ų90.444%0.4451%0.507SS..Hα-helixtrans-77.4-25178.500000113.8K1597 A1598 S1602 C1603K1597-A1600 PolarHBondContact O-N 3.32Å; A1598-A1600 VanDerWaalsContact C-N 3.3Å; A1598-A1600 PolarHBondContact O-N 3.25Å; A1600-S1602 VanDerWaalsContact C-N 3.31Å; A1600-S1602 PolarHBondContact O-N 3.19Å; A1600-C1603 PolarHBondContact O-N 2.89Å; A1600-C1603 PolarHBondContact O-SG 3.16Å; A1600-C1603 VanDerWaalsContact O-SG 3.34Å
1601H30.1Very low46.4Very low141 Ų14184.9 Ų84.965%0.65347%0.472SS*.G310 helixtrans-84.5-0.3-174.4-65.8-66.3000114.5K1597 A1598 T1599K1597-H1601 PolarHBondContact O-CD2 3.17Å; A1598-H1601 PolarHBondContact O-N 3.32Å; T1599-H1601 VanDerWaalsContact C-N 3.28Å; T1599-H1601 PolarHBondContact O-N 3.3Å
1602S31.5Very low49.5Very low72.2 Ų72.277.2 Ų77.251%0.50543%0.431SS..THydrogen-bonded Turntrans-97-10.4-179.1-169.90000114S1558 T1599 A1600 N1604S1558-S1602 VanDerWaalsContact CB-OG 3.23Å; S1558-S1602 WeakPolarHBondContact CB-OG 3.48Å; S1558-S1602 PolarHBondContact OG-OG 3.36Å; T1599-S1602 PolarHBondContact O-N 3.37Å; A1600-S1602 VanDerWaalsContact C-N 3.31Å; A1600-S1602 PolarHBondContact O-N 3.19Å; S1602-N1604 PolarHBondContact O-N 2.8Å
1603C35.1Very low52.4Low45 Ų4571.3 Ų71.330%0.30440%0.395SS..  trans-100.25.8-17163.40000115.3A1600 R1606A1600-C1603 PolarHBondContact O-N 2.89Å; A1600-C1603 PolarHBondContact O-SG 3.16Å; A1600-C1603 VanDerWaalsContact O-SG 3.34Å; C1603-R1606 VanDerWaalsContact O-CG 3.29Å; C1603-R1606 WeakPolarHBondContact O-CG 3.49Å; C1603-R1606 PolarHBondContact O-NE 3.24Å
1604N42.3Very low55.7Low77.8 Ų77.863.4 Ų63.442%0.41636%0.358SS..  trans-89.8-20.1-177.5-65.2-8.3000113.4S1602 R1606 E1727S1602-N1604 PolarHBondContact O-N 2.8Å; N1604-R1606 VanDerWaalsContact C-N 3.27Å; N1604-R1606 PolarHBondContact O-N 3.11Å; N1604-E1727 PolarHBondContact ND2-OE1 3.27Å; N1604-E1727 PolarHBondContact ND2-OE2 3.13Å
1605N52.4Low58.8Low110.6 Ų110.658.4 Ų58.459%0.59133%0.326SS*.  trans-78.163.8175.2-75.2-15.7000112.1T1199T1199-N1605 HydrophobicContact CG2-CB 4.09Å; T1199-N1605 WeakPolarHBondContact CG2-ND2 3.3Å
1606R70.2Confident61.9Low38.8 Ų38.851.7 Ų51.715%0.14629%0.291CS..  trans-93.9130.9175.3-57.2-170.1-168.9-169.510.3110.1C1603 N1604 P1608 Q1611 Q1653C1603-R1606 VanDerWaalsContact O-CG 3.29Å; C1603-R1606 WeakPolarHBondContact O-CG 3.49Å; C1603-R1606 PolarHBondContact O-NE 3.24Å; N1604-R1606 VanDerWaalsContact C-N 3.27Å; N1604-R1606 PolarHBondContact O-N 3.11Å; R1606-P1608 WeakPolarHBondContact O-CD 3.41Å; R1606-Q1611 HydrophobicContact CB-CG 4.35Å; R1606-Q1611 VanDerWaalsContact CB-OE1 3.23Å; R1606-Q1653 VanDerWaalsContact CZ-OE1 3.24Å; R1606-Q1653 VanDerWaalsContact NH1-CD 3.3Å
1607H78.7Confident65Low33.2 Ų33.245.3 Ų45.315%0.15426%0.258CS..  trans-75121.5-177.5-168.5-110000110.2V1200 L1609 I1610 Q1611V1200-H1607 VanDerWaalsContact CG2-NE2 3.29Å; V1200-H1607 WeakPolarHBondContact CG2-NE2 3.32Å; H1607-L1609 VanDerWaalsContact C-N 3.29Å; H1607-L1609 PolarHBondContact O-N 3.18Å; H1607-I1610 HydrophobicContact CB-CB 4.23Å; H1607-I1610 HydrophobicContact CB-CD1 3.76Å; H1607-I1610 HydrophobicContact CB-CG1 3.93Å; H1607-I1610 WeakPolarHBondContact O-CB 3.45Å; H1607-I1610 PolarHBondContact O-N 3.04Å; H1607-Q1611 PolarHBondContact O-N 3.1Å; H1607-Q1611 VanDerWaalsContact O-N 3.1Å
1608P85.1Confident68.1Low24.2 Ų24.238.1 Ų38.116%0.15723%0.226CC..Hα-helixtrans-61.9-33.8-171.423.1-35000113.2F1202 L1207 R1606 I1610 Q1611 S1612 F1657 I1746F1202-P1608 HydrophobicContact CD2-CB 4.1Å; F1202-P1608 HydrophobicContact CD2-CG 4.25Å; F1202-P1608 HydrophobicContact CE2-CB 4.11Å; L1207-P1608 HydrophobicContact CD1-CG 4.39Å; L1207-P1608 HydrophobicContact CD2-CB 4.21Å; L1207-P1608 HydrophobicContact CD2-CG 3.44Å; L1207-P1608 HydrophobicContact CG-CG 4.47Å; R1606-P1608 WeakPolarHBondContact O-CD 3.41Å; P1608-I1610 VanDerWaalsContact C-N 3.33Å; P1608-I1610 PolarHBondContact O-N 3.33Å; P1608-Q1611 PolarHBondContact O-N 3.04Å; P1608-S1612 WeakPolarHBondContact O-CB 3.47Å; P1608-S1612 PolarHBondContact O-N 3.08Å; P1608-F1657 HydrophobicContact CB-CE1 4.08Å; P1608-F1657 HydrophobicContact CB-CE2 4.28Å; P1608-F1657 HydrophobicContact CB-CZ 3.51Å; P1608-F1657 VanDerWaalsContact CB-CZ 3.45Å; P1608-F1657 WeakPolarHBondContact O-CE1 3.34Å; P1608-I1746 HydrophobicContact CB-CD1 4.28Å
1609L86.5Confident71.3Confident15.2 Ų15.234.7 Ų34.78%0.0820%0.198CC..Hα-helixtrans-69.6-29175.6-54.5-175.1000112.8L1207 V1210 V1211 F1489 H1607 A1613 G1745L1207-L1609 HydrophobicContact CD2-CD2 3.98Å; L1207-L1609 HydrophobicContact CD2-CG 4.13Å; V1210-L1609 HydrophobicContact CB-CD1 4.04Å; V1210-L1609 HydrophobicContact CG1-CD1 3.63Å; V1211-L1609 HydrophobicContact CG2-CD1 3.67Å; V1211-L1609 HydrophobicContact CG2-CD2 3.5Å; V1211-L1609 VanDerWaalsContact CG2-CD2 3.5Å; V1211-L1609 HydrophobicContact CG2-CG 4.25Å; F1489-L1609 HydrophobicContact CB-CB 4.4Å; F1489-L1609 HydrophobicContact CB-CD1 4.23Å; F1489-L1609 HydrophobicContact CD2-CB 3.82Å; F1489-L1609 HydrophobicContact CD2-CD2 4.4Å; F1489-L1609 VanDerWaalsContact CD2-O 3.25Å; F1489-L1609 WeakPolarHBondContact CD2-O 3.39Å; F1489-L1609 HydrophobicContact CE2-CB 4.33Å; F1489-L1609 HydrophobicContact CE2-CD2 4.41Å; F1489-L1609 WeakPolarHBondContact CE2-O 3.33Å; F1489-L1609 HydrophobicContact CG-CB 4.19Å; F1489-L1609 HydrophobicContact CG-CD1 4.4Å; F1489-L1609 HydrophobicContact CG-CD2 4.44Å; F1489-L1609 HydrophobicContact CZ-CD2 4.46Å; H1607-L1609 VanDerWaalsContact C-N 3.29Å; H1607-L1609 PolarHBondContact O-N 3.18Å; L1609-A1613 VanDerWaalsContact O-CB 3.23Å; L1609-A1613 WeakPolarHBondContact O-CB 3.46Å; L1609-A1613 PolarHBondContact O-N 3.24Å; L1609-G1745 VanDerWaalsContact CD2-O 3.29Å; L1609-G1745 WeakPolarHBondContact CD2-O 3.4Å
1610I89.2Confident74.2Confident2.2 Ų2.230.6 Ų30.61%0.01117%0.173CC..Hα-helixtrans-69.8-45173.6-66.2176.7000109.4L1480 L1483 L1527 S1529 H1607 P1608 S1612 A1613 V1614L1480-I1610 HydrophobicContact CB-CD1 4.27Å; L1480-I1610 HydrophobicContact CB-CG2 4.38Å; L1480-I1610 HydrophobicContact CD1-CG2 4.22Å; L1480-I1610 HydrophobicContact CD2-CG2 4.16Å; L1480-I1610 HydrophobicContact CG-CG2 4.46Å; L1480-I1610 VanDerWaalsContact O-CD1 3.25Å; L1480-I1610 WeakPolarHBondContact O-CD1 3.45Å; L1483-I1610 HydrophobicContact CB-CG1 4.14Å; L1483-I1610 HydrophobicContact CD1-CG1 4.48Å; L1527-I1610 HydrophobicContact CD1-CG2 3.95Å; L1527-I1610 HydrophobicContact CD2-CG2 4.18Å; S1529-I1610 VanDerWaalsContact OG-CD1 3.27Å; S1529-I1610 WeakPolarHBondContact OG-CD1 3.35Å; H1607-I1610 HydrophobicContact CB-CB 4.23Å; H1607-I1610 HydrophobicContact CB-CD1 3.76Å; H1607-I1610 HydrophobicContact CB-CG1 3.93Å; H1607-I1610 WeakPolarHBondContact O-CB 3.45Å; H1607-I1610 PolarHBondContact O-N 3.04Å; P1608-I1610 VanDerWaalsContact C-N 3.33Å; P1608-I1610 PolarHBondContact O-N 3.33Å; I1610-S1612 VanDerWaalsContact C-N 3.35Å; I1610-S1612 PolarHBondContact O-N 3.1Å; I1610-A1613 PolarHBondContact O-N 3.11Å; I1610-V1614 HydrophobicContact CG2-CG2 4.46Å; I1610-V1614 WeakPolarHBondContact O-CB 3.36Å; I1610-V1614 WeakPolarHBondContact O-CG2 3.37Å; I1610-V1614 PolarHBondContact O-N 3.04Å
1611Q90.4Very high77.3Confident10.4 Ų10.428.1 Ų28.15%0.04915%0.152CC..Hα-helixtrans-61.7-44176.8-64.6-162-10800111.8L1527 R1606 H1607 P1608 A1613 V1614 A1615 C1654 F1657L1527-Q1611 HydrophobicContact CD1-CG 4.39Å; R1606-Q1611 HydrophobicContact CB-CG 4.35Å; R1606-Q1611 VanDerWaalsContact CB-OE1 3.23Å; H1607-Q1611 PolarHBondContact O-N 3.1Å; H1607-Q1611 VanDerWaalsContact O-N 3.1Å; P1608-Q1611 PolarHBondContact O-N 3.04Å; Q1611-A1613 PolarHBondContact O-N 3.1Å; Q1611-V1614 PolarHBondContact O-N 3.02Å; Q1611-A1615 VanDerWaalsContact O-CB 3.28Å; Q1611-A1615 WeakPolarHBondContact O-CB 3.41Å; Q1611-A1615 PolarHBondContact O-N 3.1Å; Q1611-C1654 HydrophobicContact CB-CB 4.47Å; Q1611-C1654 WeakPolarHBondContact O-CB 3.27Å; Q1611-F1657 HydrophobicContact CB-CB 4.45Å; Q1611-F1657 HydrophobicContact CB-CD1 3.57Å; Q1611-F1657 HydrophobicContact CB-CE1 4.04Å; Q1611-F1657 HydrophobicContact CB-CG 4.05Å
1612S90.7Very high80.3Confident0 Ų021.4 Ų21.40%012%0.121CC..Hα-helixtrans-64.9-38.9176.3-171.40000112.8P1608 I1610 A1615 H1616 Q1658 I1746P1608-S1612 WeakPolarHBondContact O-CB 3.47Å; P1608-S1612 PolarHBondContact O-N 3.08Å; I1610-S1612 VanDerWaalsContact C-N 3.35Å; I1610-S1612 PolarHBondContact O-N 3.1Å; S1612-A1615 WeakPolarHBondContact O-CB 3.31Å; S1612-A1615 PolarHBondContact O-N 3.15Å; S1612-H1616 WeakPolarHBondContact O-CB 3.33Å; S1612-H1616 PolarHBondContact O-N 3Å; S1612-Q1658 VanDerWaalsContact CB-OE1 3.26Å; S1612-Q1658 PolarHBondContact OG-OE1 3.2Å; S1612-I1746 VanDerWaalsContact OG-CG2 3.3Å; S1612-I1746 WeakPolarHBondContact OG-CG2 3.37Å
1613A91.4Very high83.1Confident2 Ų218 Ų182%0.01710%0.098CC..Hα-helixtrans-66.8-41.1176.700000112.9L1483 F1489 F1492 L1609 I1610 Q1611 A1615 H1616 A1617L1483-A1613 HydrophobicContact CD1-CB 3.63Å; F1489-A1613 HydrophobicContact CD2-CB 4.02Å; F1489-A1613 HydrophobicContact CE2-CB 3.98Å; F1492-A1613 HydrophobicContact CD1-CB 3.98Å; F1492-A1613 HydrophobicContact CE1-CB 4.08Å; L1609-A1613 VanDerWaalsContact O-CB 3.23Å; L1609-A1613 WeakPolarHBondContact O-CB 3.46Å; L1609-A1613 PolarHBondContact O-N 3.24Å; I1610-A1613 PolarHBondContact O-N 3.11Å; Q1611-A1613 PolarHBondContact O-N 3.1Å; A1613-A1615 VanDerWaalsContact C-N 3.34Å; A1613-H1616 PolarHBondContact O-N 3.03Å; A1613-A1617 WeakPolarHBondContact O-CB 3.38Å; A1613-A1617 PolarHBondContact O-N 3.24Å
1614V93.5Very high85.8Confident1.4 Ų1.415.9 Ų15.91%0.0088%0.084CC..Hα-helixtrans-67.4-38.3173.6171.60000110.8L1480 L1519 L1522 L1527 I1610 Q1611 A1617 F1618 C1654L1480-V1614 HydrophobicContact CD2-CG2 4.3Å; L1519-V1614 HydrophobicContact CD2-CG1 4.25Å; L1522-V1614 HydrophobicContact CD1-CG1 3.61Å; L1522-V1614 HydrophobicContact CD1-CG2 4.25Å; L1522-V1614 HydrophobicContact CD2-CG1 3.84Å; L1527-V1614 HydrophobicContact CD1-CG2 4.42Å; L1527-V1614 HydrophobicContact CD2-CG2 4.29Å; I1610-V1614 HydrophobicContact CG2-CG2 4.46Å; I1610-V1614 WeakPolarHBondContact O-CB 3.36Å; I1610-V1614 WeakPolarHBondContact O-CG2 3.37Å; I1610-V1614 PolarHBondContact O-N 3.04Å; Q1611-V1614 PolarHBondContact O-N 3.02Å; V1614-A1617 PolarHBondContact O-N 3.26Å; V1614-F1618 VanDerWaalsContact O-CB 3.31Å; V1614-F1618 WeakPolarHBondContact O-CB 3.36Å; V1614-F1618 PolarHBondContact O-N 3.12Å; V1614-C1654 HydrophobicContact CB-CB 4.29Å; V1614-C1654 HydrophobicContact CG1-CB 4.04Å
1615A93.6Very high88.2Confident0 Ų013.4 Ų13.40%07%0.07CC..Hα-helixtrans-61.9-43.6173.600000111.9Q1611 S1612 A1613 F1618 C1619 C1654 L1655 Q1658 I1749Q1611-A1615 VanDerWaalsContact O-CB 3.28Å; Q1611-A1615 WeakPolarHBondContact O-CB 3.41Å; Q1611-A1615 PolarHBondContact O-N 3.1Å; S1612-A1615 WeakPolarHBondContact O-CB 3.31Å; S1612-A1615 PolarHBondContact O-N 3.15Å; A1613-A1615 VanDerWaalsContact C-N 3.34Å; A1615-F1618 PolarHBondContact O-N 2.91Å; A1615-C1619 WeakPolarHBondContact O-CB 3.32Å; A1615-C1619 PolarHBondContact O-N 3.06Å; A1615-C1654 HydrophobicContact CB-CB 4.22Å; A1615-C1654 WeakPolarHBondContact CB-O 3.28Å; A1615-L1655 HydrophobicContact CB-CD2 4.2Å; A1615-Q1658 HydrophobicContact CB-CB 4.01Å; A1615-Q1658 HydrophobicContact CB-CG 4.48Å; A1615-I1749 HydrophobicContact CB-CD1 4.4Å
1616H93.3Very high90Very high1.2 Ų1.211.4 Ų11.41%0.0066%0.06CC..Hα-helixtrans-60.7-52.7174.1-177.6-106000111.4W1493 E1497 S1612 A1613 F1618 C1619 C1620 I1749W1493-H1616 AromaticContact CD1-CE1 3.91Å; W1493-H1616 HydrophobicContact CD2-CB 4.37Å; W1493-H1616 AromaticContact CD2-CD2 3.95Å; W1493-H1616 AromaticContact CD2-CG 3.93Å; W1493-H1616 AromaticContact CD2-ND1 3.93Å; W1493-H1616 AromaticContact CE2-CD2 3.47Å; W1493-H1616 VanDerWaalsContact CE2-CD2 3.45Å; W1493-H1616 AromaticContact CE2-CE1 3.91Å; W1493-H1616 AromaticContact CE2-CG 3.84Å; W1493-H1616 AromaticContact CE2-ND1 3.87Å; W1493-H1616 AromaticContact CE2-NE2 3.49Å; W1493-H1616 HydrophobicContact CE3-CB 3.97Å; W1493-H1616 AromaticContact CE3-CG 3.88Å; W1493-H1616 HydrophobicContact CH2-CB 4.02Å; W1493-H1616 AromaticContact CH2-CD2 3.63Å; W1493-H1616 VanDerWaalsContact CH2-CD2 3.48Å; W1493-H1616 WeakPolarHBondContact CH2-CD2 3.4Å; W1493-H1616 AromaticContact CH2-CG 3.96Å; W1493-H1616 HydrophobicContact CZ2-CB 4.06Å; W1493-H1616 AromaticContact CZ2-CD2 3.29Å; W1493-H1616 WeakPolarHBondContact CZ2-CD2 3.3Å; W1493-H1616 AromaticContact CZ2-CG 3.67Å; W1493-H1616 AromaticContact CZ2-NE2 3.71Å; W1493-H1616 HydrophobicContact CZ3-CB 3.71Å; W1493-H1616 AromaticContact CZ3-CD2 3.88Å; W1493-H1616 AromaticContact CZ3-CG 3.89Å; W1493-H1616 AromaticContact NE1-CD2 3.72Å; W1493-H1616 AromaticContact NE1-CE1 3.78Å; W1493-H1616 AromaticContact NE1-ND1 3.98Å; W1493-H1616 AromaticContact NE1-NE2 3.48Å; W1493-H1616 PolarHBondContact NE1-NE2 3.3Å; E1497-H1616 IonicContact OE2-CE1 3.66Å; E1497-H1616 IonicContact OE2-NE2 3.25Å; S1612-H1616 WeakPolarHBondContact O-CB 3.33Å; S1612-H1616 PolarHBondContact O-N 3Å; A1613-H1616 PolarHBondContact O-N 3.03Å; H1616-F1618 VanDerWaalsContact C-N 3.33Å; H1616-F1618 PolarHBondContact O-N 2.98Å; H1616-C1619 PolarHBondContact O-N 3.16Å; H1616-C1619 VanDerWaalsContact O-N 3.13Å; H1616-C1620 PolarHBondContact O-N 3.03Å; H1616-C1620 PolarHBondContact O-SG 3.14Å; H1616-C1620 VanDerWaalsContact O-SG 3.36Å; H1616-I1749 HydrophobicContact CB-CD1 4.43Å; H1616-I1749 HydrophobicContact CB-CG1 4.41Å
1617A93.7Very high90.9Very high0.8 Ų0.810.2 Ų10.21%0.0076%0.056CC..Hα-helixtrans-56.4-45.8178.600000112.4I1496 V1515 A1613 V1614 C1620 L1621I1496-A1617 HydrophobicContact CD1-CB 3.83Å; V1515-A1617 HydrophobicContact CG1-CB 4.08Å; V1515-A1617 HydrophobicContact CG2-CB 4.29Å; A1613-A1617 WeakPolarHBondContact O-CB 3.38Å; A1613-A1617 PolarHBondContact O-N 3.24Å; V1614-A1617 PolarHBondContact O-N 3.26Å; A1617-C1620 PolarHBondContact O-N 3.17Å; A1617-L1621 PolarHBondContact O-N 3.12Å
1618F94.8Very high91.4Very high0 Ų013.7 Ų13.70%08%0.082CC..Hα-helixtrans-72.2-34.6179.5-170.9-142.9000112.6L1519 V1614 A1615 H1616 C1620 L1621 I1622 L1643 L1648 A1651 I1652 L1655 L1676L1519-F1618 HydrophobicContact CD1-CB 4.36Å; L1519-F1618 HydrophobicContact CD1-CD2 3.55Å; L1519-F1618 HydrophobicContact CD1-CE2 4.17Å; L1519-F1618 HydrophobicContact CD1-CG 4.23Å; L1519-F1618 HydrophobicContact CD2-CB 4.46Å; V1614-F1618 VanDerWaalsContact O-CB 3.31Å; V1614-F1618 WeakPolarHBondContact O-CB 3.36Å; V1614-F1618 PolarHBondContact O-N 3.12Å; A1615-F1618 PolarHBondContact O-N 2.91Å; H1616-F1618 VanDerWaalsContact C-N 3.33Å; H1616-F1618 PolarHBondContact O-N 2.98Å; F1618-C1620 VanDerWaalsContact C-N 3.33Å; F1618-C1620 PolarHBondContact O-N 3.26Å; F1618-L1621 HydrophobicContact CD2-CB 4.49Å; F1618-L1621 HydrophobicContact CD2-CD2 4.26Å; F1618-L1621 PolarHBondContact O-N 3.27Å; F1618-I1622 HydrophobicContact CD1-CD1 4.06Å; F1618-I1622 HydrophobicContact CD2-CD1 4.13Å; F1618-I1622 HydrophobicContact CD2-CG1 4.11Å; F1618-I1622 HydrophobicContact CE1-CD1 3.88Å; F1618-I1622 HydrophobicContact CE2-CD1 3.95Å; F1618-I1622 HydrophobicContact CE2-CG1 3.93Å; F1618-I1622 HydrophobicContact CG-CD1 4.19Å; F1618-I1622 HydrophobicContact CG-CG1 4.5Å; F1618-I1622 HydrophobicContact CZ-CD1 3.83Å; F1618-I1622 HydrophobicContact CZ-CG1 4.27Å; F1618-I1622 VanDerWaalsContact O-CG1 3.29Å; F1618-I1622 WeakPolarHBondContact O-CG1 3.35Å; F1618-I1622 PolarHBondContact O-N 3.3Å; F1618-L1643 HydrophobicContact CE2-CD1 4.27Å; F1618-L1648 HydrophobicContact CZ-CD1 3.9Å; F1618-A1651 HydrophobicContact CD1-CB 3.49Å; F1618-A1651 VanDerWaalsContact CD1-CB 3.47Å; F1618-A1651 HydrophobicContact CD2-CB 4.49Å; F1618-A1651 HydrophobicContact CE1-CB 3.61Å; F1618-A1651 HydrophobicContact CG-CB 3.98Å; F1618-A1651 HydrophobicContact CZ-CB 4.19Å; F1618-I1652 HydrophobicContact CE1-CG1 4.45Å; F1618-L1655 HydrophobicContact CD1-CD1 3.54Å; F1618-L1655 HydrophobicContact CD1-CD2 4.34Å; F1618-L1655 HydrophobicContact CD1-CG 3.88Å; F1618-L1655 HydrophobicContact CE1-CD1 3.71Å; F1618-L1655 HydrophobicContact CE1-CG 4.43Å; F1618-L1676 HydrophobicContact CE1-CD2 4.01Å; F1618-L1676 HydrophobicContact CE2-CD1 4.44Å; F1618-L1676 HydrophobicContact CZ-CD1 4.08Å; F1618-L1676 HydrophobicContact CZ-CD2 3.69Å
1619C93.8Very high91.8Very high2.6 Ų2.614.5 Ų14.52%0.0189%0.085CC..Hα-helixtrans-64.8-38.5173.1-1730000111.9A1615 H1616 G1623 L1655 R1672 I1749 Y1756A1615-C1619 WeakPolarHBondContact O-CB 3.32Å; A1615-C1619 PolarHBondContact O-N 3.06Å; H1616-C1619 PolarHBondContact O-N 3.16Å; H1616-C1619 VanDerWaalsContact O-N 3.13Å; C1619-G1623 PolarHBondContact O-N 3.2Å; C1619-G1623 VanDerWaalsContact O-N 3.07Å; C1619-L1655 HydrophobicContact CB-CD2 4.35Å; C1619-R1672 VanDerWaalsContact SG-CG 3.6Å; C1619-I1749 HydrophobicContact CB-CD1 4.13Å; C1619-I1749 HydrophobicContact CB-CG2 4.31Å; C1619-Y1756 PolarHBondContact O-OH 3.15Å; C1619-Y1756 PolarHBondContact SG-OH 3.4Å
1620C92.5Very high92.1Very high11 Ų1117.4 Ų17.47%0.07411%0.106CC..Hα-helixtrans-65.7-42.8171.9-67.50000111.7I1496 F1500 H1616 A1617 F1618 I1622 G1623 S1624 Y1756I1496-C1620 HydrophobicContact CG2-CB 4.31Å; F1500-C1620 HydrophobicContact CB-CB 4.4Å; F1500-C1620 HydrophobicContact CD1-CB 3.73Å; F1500-C1620 HydrophobicContact CD2-CB 4.27Å; F1500-C1620 HydrophobicContact CE1-CB 3.92Å; F1500-C1620 WeakPolarHBondContact CE1-O 3.35Å; F1500-C1620 HydrophobicContact CE2-CB 4.41Å; F1500-C1620 HydrophobicContact CG-CB 3.92Å; F1500-C1620 HydrophobicContact CZ-CB 4.28Å; H1616-C1620 PolarHBondContact O-N 3.03Å; H1616-C1620 PolarHBondContact O-SG 3.14Å; H1616-C1620 VanDerWaalsContact O-SG 3.36Å; A1617-C1620 PolarHBondContact O-N 3.17Å; F1618-C1620 VanDerWaalsContact C-N 3.33Å; F1618-C1620 PolarHBondContact O-N 3.26Å; C1620-I1622 PolarHBondContact O-N 3.06Å; C1620-G1623 CarbonylContact O-C 3.48Å; C1620-G1623 VanDerWaalsContact O-CA 3.3Å; C1620-G1623 WeakPolarHBondContact O-CA 3.36Å; C1620-G1623 PolarHBondContact O-N 3.27Å; C1620-G1623 VanDerWaalsContact O-N 3.13Å; C1620-S1624 PolarHBondContact O-N 3.09Å; C1620-S1624 VanDerWaalsContact O-N 3.11Å; C1620-S1624 PolarHBondContact O-OG 3.1Å; C1620-Y1756 VanDerWaalsContact CA-OH 3.29Å; C1620-Y1756 WeakPolarHBondContact CA-OH 3.48Å; C1620-Y1756 PolarHBondContact N-OH 3.18Å; C1620-Y1756 VanDerWaalsContact N-OH 3.1Å; C1620-Y1756 PolarHBondContact SG-OH 3.4Å; C1620-Y1756 VanDerWaalsContact SG-OH 3.35Å
1621L93.7Very high92.3Very high0 Ų020.4 Ų20.40%013%0.125CC..Hα-helixtrans-61-50.2175.7-176.967000111.9I1512 V1515 L1519 A1617 F1618 G1623 S1624 T1636 I1640I1512-L1621 HydrophobicContact CB-CD1 4.18Å; I1512-L1621 HydrophobicContact CG1-CD1 4.11Å; I1512-L1621 HydrophobicContact CG2-CD1 3.71Å; V1515-L1621 HydrophobicContact CG1-CB 4.07Å; V1515-L1621 HydrophobicContact CG1-CD2 4.17Å; L1519-L1621 HydrophobicContact CD1-CD2 3.56Å; A1617-L1621 PolarHBondContact O-N 3.12Å; F1618-L1621 HydrophobicContact CD2-CB 4.49Å; F1618-L1621 HydrophobicContact CD2-CD2 4.26Å; F1618-L1621 PolarHBondContact O-N 3.27Å; L1621-G1623 VanDerWaalsContact C-N 3.26Å; L1621-G1623 PolarHBondContact O-N 3.2Å; L1621-S1624 WeakPolarHBondContact O-CB 3.46Å; L1621-S1624 PolarHBondContact O-N 3.09Å; L1621-S1624 VanDerWaalsContact O-N 3.09Å; L1621-T1636 HydrophobicContact CD1-CG2 4.04Å; L1621-T1636 HydrophobicContact CG-CG2 4.41Å; L1621-T1636 WeakPolarHBondContact O-CG2 3.35Å; L1621-I1640 HydrophobicContact CD2-CD1 4.46Å; L1621-I1640 HydrophobicContact CD2-CG1 3.89Å; L1621-I1640 HydrophobicContact CG-CD1 4.14Å; L1621-I1640 HydrophobicContact CG-CG1 4.04Å
1622I93.2Very high92.5Very high0 Ų019.9 Ų19.90%012%0.122CC..Hα-helixtrans-61.9-36175.7-60.3163.9000110.3F1618 C1620 S1624 L1625 I1640 L1655 R1672 Q1675 L1676F1618-I1622 HydrophobicContact CD1-CD1 4.06Å; F1618-I1622 HydrophobicContact CD2-CD1 4.13Å; F1618-I1622 HydrophobicContact CD2-CG1 4.11Å; F1618-I1622 HydrophobicContact CE1-CD1 3.88Å; F1618-I1622 HydrophobicContact CE2-CD1 3.95Å; F1618-I1622 HydrophobicContact CE2-CG1 3.93Å; F1618-I1622 HydrophobicContact CG-CD1 4.19Å; F1618-I1622 HydrophobicContact CG-CG1 4.5Å; F1618-I1622 HydrophobicContact CZ-CD1 3.83Å; F1618-I1622 HydrophobicContact CZ-CG1 4.27Å; F1618-I1622 VanDerWaalsContact O-CG1 3.29Å; F1618-I1622 WeakPolarHBondContact O-CG1 3.35Å; F1618-I1622 PolarHBondContact O-N 3.3Å; C1620-I1622 PolarHBondContact O-N 3.06Å; I1622-S1624 VanDerWaalsContact C-N 3.34Å; I1622-S1624 PolarHBondContact O-N 3.18Å; I1622-S1624 VanDerWaalsContact O-N 3.16Å; I1622-L1625 HydrophobicContact CG2-CD1 4.04Å; I1622-L1625 VanDerWaalsContact O-CB 3.3Å; I1622-L1625 WeakPolarHBondContact O-CB 3.4Å; I1622-L1625 WeakPolarHBondContact O-CD1 3.37Å; I1622-L1625 WeakPolarHBondContact O-CG 3.38Å; I1622-L1625 PolarHBondContact O-N 3.09Å; I1622-L1625 VanDerWaalsContact O-N 3.13Å; I1622-I1640 HydrophobicContact CG1-CD1 4.31Å; I1622-L1655 HydrophobicContact CD1-CD1 4.12Å; I1622-R1672 HydrophobicContact CB-CB 4.29Å; I1622-R1672 HydrophobicContact CB-CG 4.47Å; I1622-R1672 HydrophobicContact CD1-CB 4.1Å; I1622-R1672 HydrophobicContact CG2-CB 3.9Å; I1622-R1672 HydrophobicContact CG2-CG 4.31Å; I1622-Q1675 HydrophobicContact CG2-CB 4.14Å; I1622-L1676 HydrophobicContact CD1-CB 4.34Å; I1622-L1676 HydrophobicContact CD1-CD1 4.36Å; I1622-L1676 HydrophobicContact CD1-CD2 4.24Å; I1622-L1676 HydrophobicContact CD1-CG 4.5Å; I1622-L1676 HydrophobicContact CG1-CD1 4.3Å
1623G90.8Very high92.7Very high2.2 Ų2.220.8 Ų20.82%0.02313%0.13CC..THydrogen-bonded Turntrans-65.4-14.8174.400000115.4C1619 C1620 L1621 L1625 D1626 R1672 R1759C1619-G1623 PolarHBondContact O-N 3.2Å; C1619-G1623 VanDerWaalsContact O-N 3.07Å; C1620-G1623 CarbonylContact O-C 3.48Å; C1620-G1623 VanDerWaalsContact O-CA 3.3Å; C1620-G1623 WeakPolarHBondContact O-CA 3.36Å; C1620-G1623 PolarHBondContact O-N 3.27Å; C1620-G1623 VanDerWaalsContact O-N 3.13Å; L1621-G1623 VanDerWaalsContact C-N 3.26Å; L1621-G1623 PolarHBondContact O-N 3.2Å; G1623-L1625 VanDerWaalsContact C-N 3.34Å; G1623-L1625 PolarHBondContact O-N 2.96Å; G1623-L1625 VanDerWaalsContact O-N 3.14Å; G1623-D1626 PolarHBondContact O-N 3.33Å; G1623-D1626 VanDerWaalsContact O-N 3.09Å; G1623-R1672 VanDerWaalsContact CA-CZ 3.48Å; G1623-R1672 VanDerWaalsContact CA-NH2 3.29Å; G1623-R1759 WeakPolarHBondContact O-CD 3.41Å; G1623-R1759 PolarHBondContact O-NH1 3.15Å
1624S92.4Very high92.8Very high0.2 Ų0.227.4 Ų27.40%0.00116%0.16CC..THydrogen-bonded Turntrans-86.7-1172.4-61.70000113.9F1500 C1620 L1621 I1622 D1626 D1627 A1633 T1636 R1759F1500-S1624 WeakPolarHBondContact CE1-OG 3.17Å; C1620-S1624 PolarHBondContact O-N 3.09Å; C1620-S1624 VanDerWaalsContact O-N 3.11Å; C1620-S1624 PolarHBondContact O-OG 3.1Å; L1621-S1624 WeakPolarHBondContact O-CB 3.46Å; L1621-S1624 PolarHBondContact O-N 3.09Å; L1621-S1624 VanDerWaalsContact O-N 3.09Å; I1622-S1624 VanDerWaalsContact C-N 3.34Å; I1622-S1624 PolarHBondContact O-N 3.18Å; I1622-S1624 VanDerWaalsContact O-N 3.16Å; S1624-D1626 VanDerWaalsContact C-N 3.34Å; S1624-D1626 PolarHBondContact O-N 2.97Å; S1624-D1627 WeakPolarHBondContact O-CB 3.46Å; S1624-D1627 PolarHBondContact O-N 3.04Å; S1624-A1633 WeakPolarHBondContact O-CA 3.4Å; S1624-T1636 WeakPolarHBondContact CB-OG1 3.37Å; S1624-T1636 PolarHBondContact O-OG1 3.24Å; S1624-R1759 PolarHBondContact OG-NH1 3.18Å
1625L91.4Very high92.9Very high25.2 Ų25.229 Ų2913%0.13217%0.166CC..THydrogen-bonded Turntrans-69.7-27.1164.2-64.8168.3000111.8I1622 G1623 D1627 A1633 T1636 I1640I1622-L1625 HydrophobicContact CG2-CD1 4.04Å; I1622-L1625 VanDerWaalsContact O-CB 3.3Å; I1622-L1625 WeakPolarHBondContact O-CB 3.4Å; I1622-L1625 WeakPolarHBondContact O-CD1 3.37Å; I1622-L1625 WeakPolarHBondContact O-CG 3.38Å; I1622-L1625 PolarHBondContact O-N 3.09Å; I1622-L1625 VanDerWaalsContact O-N 3.13Å; G1623-L1625 VanDerWaalsContact C-N 3.34Å; G1623-L1625 PolarHBondContact O-N 2.96Å; G1623-L1625 VanDerWaalsContact O-N 3.14Å; L1625-D1627 VanDerWaalsContact C-N 3.34Å; L1625-D1627 PolarHBondContact O-N 3.48Å; L1625-A1633 WeakPolarHBondContact O-CB 3.3Å; L1625-T1636 HydrophobicContact CD2-CG2 3.73Å; L1625-T1636 HydrophobicContact CG-CG2 3.85Å; L1625-I1640 HydrophobicContact CD1-CD1 3.91Å; L1625-I1640 HydrophobicContact CD2-CD1 4.16Å; L1625-I1640 HydrophobicContact CG-CD1 4.06Å
1626D89.8Confident92.9Very high69.6 Ų69.629 Ų2937%0.37217%0.166SC..THydrogen-bonded Turntrans-99.827.6175.5-37.8-59.6000111.8G1623 S1624 R1672 Q1675 R1759G1623-D1626 PolarHBondContact O-N 3.33Å; G1623-D1626 VanDerWaalsContact O-N 3.09Å; S1624-D1626 VanDerWaalsContact C-N 3.34Å; S1624-D1626 PolarHBondContact O-N 2.97Å; D1626-R1672 IonicContact OD2-CZ 3.25Å; D1626-R1672 IonicContact OD2-NH1 3.28Å; D1626-R1672 PolarHBondContact OD2-NH1 3.2Å; D1626-R1672 IonicContact OD2-NH2 3.4Å; D1626-Q1675 PolarHBondContact OD1-NE2 3.13Å; D1626-Q1675 PolarHBondContact OD2-NE2 3.37Å; D1626-R1759 PolarHBondContact O-NH1 2.74Å
1627D91.2Very high93Very high11.8 Ų11.831 Ų316%0.06318%0.181CC..  trans-73.1139.6-179.3-159.2-80.4000111.4R1508 S1624 L1625 D1629 V1632 A1633 Y1756 R1759R1508-D1627 IonicContact CZ-OD1 3.07Å; R1508-D1627 IonicContact CZ-OD2 3.4Å; R1508-D1627 IonicContact NE-OD1 3.34Å; R1508-D1627 PolarHBondContact NE-OD1 3.09Å; R1508-D1627 IonicContact NE-OD2 2.77Å; R1508-D1627 PolarHBondContact NE-OD2 3.18Å; R1508-D1627 IonicContact NH1-OD1 2.85Å; R1508-D1627 PolarHBondContact NH1-OD1 3.34Å; R1508-D1627 IonicContact NH1-OD2 3.86Å; R1508-D1627 PolarHBondContact NH1-OD2 3.28Å; R1508-D1627 IonicContact NH2-OD1 3.21Å; R1508-D1627 PolarHBondContact NH2-OD1 3.17Å; R1508-D1627 IonicContact NH2-OD2 3.59Å; S1624-D1627 WeakPolarHBondContact O-CB 3.46Å; S1624-D1627 PolarHBondContact O-N 3.04Å; L1625-D1627 VanDerWaalsContact C-N 3.34Å; L1625-D1627 PolarHBondContact O-N 3.48Å; D1627-D1629 PolarHBondContact O-N 2.96Å; D1627-D1629 VanDerWaalsContact O-N 3.16Å; D1627-D1629 PolarHBondContact OD1-N 3.12Å; D1627-V1632 HydrophobicContact CB-CB 4.19Å; D1627-V1632 HydrophobicContact CB-CG1 3.76Å; D1627-V1632 VanDerWaalsContact CG-CG1 3.47Å; D1627-A1633 HydrophobicContact CB-CB 4.23Å; D1627-Y1756 PolarHBondContact OD2-OH 2.87Å; D1627-R1759 IonicContact OD2-CZ 2.92Å; D1627-R1759 IonicContact OD2-NH1 3.31Å; D1627-R1759 PolarHBondContact OD2-NH1 3.34Å; D1627-R1759 IonicContact OD2-NH2 3.32Å; D1627-R1759 PolarHBondContact OD2-NH2 3.32Å
1628P89.3Confident93Very high107.6 Ų107.636.6 Ų36.670%0.69921%0.208SC*.SBendtrans-62.8-20.7176.425.2-36.5000114.1F1760P1628-F1760 HydrophobicContact CG-CB 4.33Å; P1628-F1760 HydrophobicContact CG-CD1 3.7Å; P1628-F1760 HydrophobicContact CG-CE1 4.14Å; P1628-F1760 HydrophobicContact CG-CG 3.97Å
1629D92.1Very high92.9Very high40.4 Ų40.437.3 Ų37.322%0.21621%0.212CC..SBendtrans-88.5122170.1-176.456.4000111.6W1505 D1627 T1631 V1632 A1633W1505-D1629 HydrophobicContact CB-CB 4.31Å; D1627-D1629 PolarHBondContact O-N 2.96Å; D1627-D1629 VanDerWaalsContact O-N 3.16Å; D1627-D1629 PolarHBondContact OD1-N 3.12Å; D1629-T1631 VanDerWaalsContact C-N 3.29Å; D1629-T1631 PolarHBondContact O-N 3.23Å; D1629-T1631 VanDerWaalsContact OD1-CA 3.31Å; D1629-T1631 WeakPolarHBondContact OD1-CA 3.35Å; D1629-T1631 VanDerWaalsContact OD1-CB 3.28Å; D1629-T1631 WeakPolarHBondContact OD1-CB 3.47Å; D1629-T1631 PolarHBondContact OD1-N 3.14Å; D1629-T1631 PolarHBondContact OD1-OG1 2.84Å; D1629-T1631 VanDerWaalsContact OD2-CA 3.31Å; D1629-T1631 WeakPolarHBondContact OD2-CA 3.44Å; D1629-T1631 VanDerWaalsContact OD2-CB 3.26Å; D1629-T1631 WeakPolarHBondContact OD2-CB 3.38Å; D1629-T1631 PolarHBondContact OD2-N 3.01Å; D1629-T1631 PolarHBondContact OD2-OG1 2.93Å; D1629-V1632 HydrophobicContact CB-CB 4.06Å; D1629-V1632 HydrophobicContact CB-CG2 3.86Å; D1629-V1632 WeakPolarHBondContact O-CB 3.34Å; D1629-V1632 PolarHBondContact O-N 3.08Å; D1629-V1632 VanDerWaalsContact O-N 3.16Å; D1629-V1632 WeakPolarHBondContact OD1-CG2 3.3Å; D1629-V1632 PolarHBondContact OD1-N 3.02Å; D1629-V1632 WeakPolarHBondContact OD2-CG2 3.37Å; D1629-V1632 PolarHBondContact OD2-N 3.03Å; D1629-A1633 PolarHBondContact O-N 3.13Å
1630S93Very high92.8Very high76.4 Ų76.437.2 Ų37.253%0.53421%0.211SC..Hα-helixtrans-66.3-27.9-177620000113.8A1633 Q1634S1630-A1633 PolarHBondContact O-N 3.42Å; S1630-Q1634 WeakPolarHBondContact O-CB 3.34Å; S1630-Q1634 VanDerWaalsContact O-CG 3.23Å; S1630-Q1634 WeakPolarHBondContact O-CG 3.33Å; S1630-Q1634 PolarHBondContact O-N 3.07Å
1631T94.1Very high92.8Very high65.2 Ų65.239 Ų3940%0.423%0.227SC..Hα-helixtrans-72.6-41.6176.744.70000110.5F1509 D1629 A1633 Q1634 Y1635F1509-T1631 HydrophobicContact CE2-CG2 4.24Å; D1629-T1631 VanDerWaalsContact C-N 3.29Å; D1629-T1631 PolarHBondContact O-N 3.23Å; D1629-T1631 VanDerWaalsContact OD1-CA 3.31Å; D1629-T1631 WeakPolarHBondContact OD1-CA 3.35Å; D1629-T1631 VanDerWaalsContact OD1-CB 3.28Å; D1629-T1631 WeakPolarHBondContact OD1-CB 3.47Å; D1629-T1631 PolarHBondContact OD1-N 3.14Å; D1629-T1631 PolarHBondContact OD1-OG1 2.84Å; D1629-T1631 VanDerWaalsContact OD2-CA 3.31Å; D1629-T1631 WeakPolarHBondContact OD2-CA 3.44Å; D1629-T1631 VanDerWaalsContact OD2-CB 3.26Å; D1629-T1631 WeakPolarHBondContact OD2-CB 3.38Å; D1629-T1631 PolarHBondContact OD2-N 3.01Å; D1629-T1631 PolarHBondContact OD2-OG1 2.93Å; T1631-A1633 VanDerWaalsContact C-N 3.35Å; T1631-A1633 PolarHBondContact O-N 3.3Å; T1631-Q1634 PolarHBondContact O-N 3.28Å; T1631-Y1635 WeakPolarHBondContact O-CB 3.34Å; T1631-Y1635 PolarHBondContact O-N 2.98Å
1632V94.2Very high92.7Very high0 Ų041.5 Ų41.50%024%0.244CC..Hα-helixtrans-61.4-44.9173.6176.80000110.8W1505 F1509 I1512 D1627 D1629 T1636W1505-V1632 HydrophobicContact CB-CG2 4.09Å; W1505-V1632 HydrophobicContact CE3-CG2 4.06Å; F1509-V1632 HydrophobicContact CB-CG2 4.39Å; I1512-V1632 HydrophobicContact CD1-CG1 3.33Å; I1512-V1632 VanDerWaalsContact CD1-CG1 3.43Å; D1627-V1632 HydrophobicContact CB-CB 4.19Å; D1627-V1632 HydrophobicContact CB-CG1 3.76Å; D1627-V1632 VanDerWaalsContact CG-CG1 3.47Å; D1629-V1632 HydrophobicContact CB-CB 4.06Å; D1629-V1632 HydrophobicContact CB-CG2 3.86Å; D1629-V1632 WeakPolarHBondContact O-CB 3.34Å; D1629-V1632 PolarHBondContact O-N 3.08Å; D1629-V1632 VanDerWaalsContact O-N 3.16Å; D1629-V1632 WeakPolarHBondContact OD1-CG2 3.3Å; D1629-V1632 PolarHBondContact OD1-N 3.02Å; D1629-V1632 WeakPolarHBondContact OD2-CG2 3.37Å; D1629-V1632 PolarHBondContact OD2-N 3.03Å; V1632-T1636 WeakPolarHBondContact O-CB 3.37Å; V1632-T1636 PolarHBondContact O-N 3.08Å; V1632-T1636 PolarHBondContact O-OG1 3.03Å
1633A94Very high92.6Very high19.2 Ų19.241.6 Ų41.616%0.15925%0.245CC..Hα-helixtrans-65.6-48177.900000113.2S1624 L1625 D1627 D1629 S1630 T1631 Y1635 T1636 S1637S1624-A1633 WeakPolarHBondContact O-CA 3.4Å; L1625-A1633 WeakPolarHBondContact O-CB 3.3Å; D1627-A1633 HydrophobicContact CB-CB 4.23Å; D1629-A1633 PolarHBondContact O-N 3.13Å; S1630-A1633 PolarHBondContact O-N 3.42Å; T1631-A1633 VanDerWaalsContact C-N 3.35Å; T1631-A1633 PolarHBondContact O-N 3.3Å; A1633-Y1635 PolarHBondContact O-N 3.28Å; A1633-T1636 WeakPolarHBondContact O-CB 3.36Å; A1633-T1636 PolarHBondContact O-N 3.03Å; A1633-S1637 PolarHBondContact O-N 3.15Å
1634Q94.6Very high92.6Very high141 Ų14145 Ų4566%0.65926%0.262SS*.Hα-helixtrans-63.8-42.6177.7-72.8175.218.500112S1630 T1631 T1636 S1637 M1638S1630-Q1634 WeakPolarHBondContact O-CB 3.34Å; S1630-Q1634 VanDerWaalsContact O-CG 3.23Å; S1630-Q1634 WeakPolarHBondContact O-CG 3.33Å; S1630-Q1634 PolarHBondContact O-N 3.07Å; T1631-Q1634 PolarHBondContact O-N 3.28Å; Q1634-T1636 VanDerWaalsContact C-N 3.34Å; Q1634-T1636 PolarHBondContact O-N 2.98Å; Q1634-S1637 WeakPolarHBondContact O-CB 3.43Å; Q1634-S1637 PolarHBondContact O-N 2.87Å; Q1634-M1638 PolarHBondContact O-N 3.23Å; Q1634-M1638 VanDerWaalsContact O-N 3.07Å
1635Y95.1Very high92.5Very high33.6 Ų33.650.1 Ų50.113%0.13229%0.289CS..Hα-helixtrans-61.8-43175.7-176.7-109.8000111.4F1509 I1512 E1513 T1631 A1633 S1637 M1638 Q1639F1509-Y1635 HydrophobicContact CD1-CD1 4.42Å; F1509-Y1635 HydrophobicContact CD1-CE1 4.21Å; F1509-Y1635 AromaticContact CD2-CD1 3.78Å; F1509-Y1635 HydrophobicContact CD2-CD1 3.85Å; F1509-Y1635 HydrophobicContact CD2-CE1 4.26Å; F1509-Y1635 HydrophobicContact CD2-CG 4.09Å; F1509-Y1635 HydrophobicContact CE1-CD1 4.26Å; F1509-Y1635 HydrophobicContact CE1-CD2 4.48Å; F1509-Y1635 AromaticContact CE1-CE1 3.84Å; F1509-Y1635 HydrophobicContact CE1-CE1 3.84Å; F1509-Y1635 HydrophobicContact CE1-CE2 4.17Å; F1509-Y1635 AromaticContact CE1-CZ 3.78Å; F1509-Y1635 AromaticContact CE2-CD1 3.55Å; F1509-Y1635 HydrophobicContact CE2-CD1 3.55Å; F1509-Y1635 AromaticContact CE2-CD2 3.73Å; F1509-Y1635 HydrophobicContact CE2-CD2 3.73Å; F1509-Y1635 AromaticContact CE2-CE1 3.91Å; F1509-Y1635 HydrophobicContact CE2-CE1 4Å; F1509-Y1635 HydrophobicContact CE2-CE2 4.16Å; F1509-Y1635 AromaticContact CE2-CG 3.4Å; F1509-Y1635 HydrophobicContact CE2-CG 3.4Å; F1509-Y1635 VanDerWaalsContact CE2-CG 3.43Å; F1509-Y1635 HydrophobicContact CG-CD1 4.26Å; F1509-Y1635 HydrophobicContact CG-CE1 4.36Å; F1509-Y1635 AromaticContact CZ-CD1 3.77Å; F1509-Y1635 HydrophobicContact CZ-CD1 3.77Å; F1509-Y1635 AromaticContact CZ-CD2 3.6Å; F1509-Y1635 HydrophobicContact CZ-CD2 3.6Å; F1509-Y1635 VanDerWaalsContact CZ-CD2 3.5Å; F1509-Y1635 AromaticContact CZ-CE1 3.73Å; F1509-Y1635 HydrophobicContact CZ-CE1 3.73Å; F1509-Y1635 AromaticContact CZ-CE2 3.55Å; F1509-Y1635 HydrophobicContact CZ-CE2 3.55Å; F1509-Y1635 VanDerWaalsContact CZ-CE2 3.47Å; F1509-Y1635 AromaticContact CZ-CG 3.7Å; F1509-Y1635 HydrophobicContact CZ-CG 3.7Å; F1509-Y1635 AromaticContact CZ-CZ 3.61Å; I1512-Y1635 HydrophobicContact CB-CD1 4.38Å; I1512-Y1635 HydrophobicContact CB-CE1 4.35Å; I1512-Y1635 HydrophobicContact CG2-CD1 3.64Å; I1512-Y1635 HydrophobicContact CG2-CE1 3.83Å; E1513-Y1635 HydrophobicContact CB-CE1 4.36Å; T1631-Y1635 WeakPolarHBondContact O-CB 3.34Å; T1631-Y1635 PolarHBondContact O-N 2.98Å; A1633-Y1635 PolarHBondContact O-N 3.28Å; Y1635-S1637 VanDerWaalsContact C-N 3.34Å; Y1635-S1637 PolarHBondContact O-N 3.06Å; Y1635-M1638 HydrophobicContact CD2-CE 3.87Å; Y1635-M1638 HydrophobicContact CE2-CE 4.26Å; Y1635-M1638 PolarHBondContact O-N 3.07Å; Y1635-M1638 VanDerWaalsContact O-N 3.16Å; Y1635-Q1639 HydrophobicContact CD1-CG 4.12Å; Y1635-Q1639 HydrophobicContact CD2-CG 4.38Å; Y1635-Q1639 HydrophobicContact CE1-CG 3.88Å; Y1635-Q1639 HydrophobicContact CE2-CG 4.27Å; Y1635-Q1639 VanDerWaalsContact CE2-NE2 3.29Å; Y1635-Q1639 HydrophobicContact CG-CG 4.42Å; Y1635-Q1639 VanDerWaalsContact CZ-NE2 3.28Å; Y1635-Q1639 WeakPolarHBondContact O-CB 3.43Å; Y1635-Q1639 VanDerWaalsContact O-CG 3.27Å; Y1635-Q1639 WeakPolarHBondContact O-CG 3.33Å; Y1635-Q1639 PolarHBondContact O-N 3.19Å; Y1635-Q1639 PolarHBondContact OH-NE2 3.22Å; Y1635-Q1639 VanDerWaalsContact OH-NE2 3.1Å
1636T94.8Very high92.5Very high0 Ų053 Ų530%030%0.304CS..Hα-helixtrans-57.4-46.4174.5-60.10000111.8I1512 L1621 S1624 L1625 V1632 A1633 Q1634 M1638 Q1639 I1640I1512-T1636 VanDerWaalsContact CD1-OG1 3.31Å; I1512-T1636 WeakPolarHBondContact CD1-OG1 3.32Å; L1621-T1636 HydrophobicContact CD1-CG2 4.04Å; L1621-T1636 HydrophobicContact CG-CG2 4.41Å; L1621-T1636 WeakPolarHBondContact O-CG2 3.35Å; S1624-T1636 WeakPolarHBondContact CB-OG1 3.37Å; S1624-T1636 PolarHBondContact O-OG1 3.24Å; L1625-T1636 HydrophobicContact CD2-CG2 3.73Å; L1625-T1636 HydrophobicContact CG-CG2 3.85Å; V1632-T1636 WeakPolarHBondContact O-CB 3.37Å; V1632-T1636 PolarHBondContact O-N 3.08Å; V1632-T1636 PolarHBondContact O-OG1 3.03Å; A1633-T1636 WeakPolarHBondContact O-CB 3.36Å; A1633-T1636 PolarHBondContact O-N 3.03Å; Q1634-T1636 VanDerWaalsContact C-N 3.34Å; Q1634-T1636 PolarHBondContact O-N 2.98Å; T1636-M1638 VanDerWaalsContact C-N 3.31Å; T1636-M1638 PolarHBondContact O-N 2.94Å; T1636-Q1639 PolarHBondContact O-N 3.12Å; T1636-I1640 HydrophobicContact CG2-CD1 3.84Å; T1636-I1640 HydrophobicContact CG2-CG1 4.4Å; T1636-I1640 WeakPolarHBondContact O-CB 3.44Å; T1636-I1640 WeakPolarHBondContact O-CG1 3.27Å; T1636-I1640 PolarHBondContact O-N 3.16Å
1637S94.2Very high92.6Very high44 Ų4449.7 Ų49.731%0.30829%0.287SS..Hα-helixtrans-60.6-45178.1-168.90000111.8A1633 Q1634 Y1635 Q1639 I1640 A1641 N1679A1633-S1637 PolarHBondContact O-N 3.15Å; Q1634-S1637 WeakPolarHBondContact O-CB 3.43Å; Q1634-S1637 PolarHBondContact O-N 2.87Å; Y1635-S1637 VanDerWaalsContact C-N 3.34Å; Y1635-S1637 PolarHBondContact O-N 3.06Å; S1637-Q1639 PolarHBondContact O-N 2.89Å; S1637-I1640 PolarHBondContact O-N 3.19Å; S1637-A1641 WeakPolarHBondContact O-CB 3.34Å; S1637-A1641 PolarHBondContact O-N 2.99Å; S1637-N1679 PolarHBondContact OG-OD1 3.12Å
1638M93.3Very high92.7Very high118.8 Ų118.849.5 Ų49.559%0.58529%0.285SS*.Hα-helixtrans-63.4-41.6175.6-176.9174.66300112.6Q1634 Y1635 T1636 A1641 S1642Q1634-M1638 PolarHBondContact O-N 3.23Å; Q1634-M1638 VanDerWaalsContact O-N 3.07Å; Y1635-M1638 HydrophobicContact CD2-CE 3.87Å; Y1635-M1638 HydrophobicContact CE2-CE 4.26Å; Y1635-M1638 PolarHBondContact O-N 3.07Å; Y1635-M1638 VanDerWaalsContact O-N 3.16Å; T1636-M1638 VanDerWaalsContact C-N 3.31Å; T1636-M1638 PolarHBondContact O-N 2.94Å; M1638-A1641 PolarHBondContact O-N 2.95Å; M1638-S1642 PolarHBondContact O-N 3.14Å; M1638-S1642 VanDerWaalsContact O-N 3.11Å
1639Q92.7Very high92.8Very high14.8 Ų14.846.1 Ų46.17%0.06927%0.266CS..Hα-helixtrans-66.1-44.6177.8-68.8-59.5-21.500111.8I1512 S1516 Y1635 T1636 S1637 A1641 S1642 L1643I1512-Q1639 HydrophobicContact CG2-CB 4.5Å; I1512-Q1639 HydrophobicContact CG2-CG 4.37Å; S1516-Q1639 VanDerWaalsContact OG-CB 3.32Å; S1516-Q1639 WeakPolarHBondContact OG-CB 3.28Å; S1516-Q1639 PolarHBondContact OG-OE1 3.2Å; Y1635-Q1639 HydrophobicContact CD1-CG 4.12Å; Y1635-Q1639 HydrophobicContact CD2-CG 4.38Å; Y1635-Q1639 HydrophobicContact CE1-CG 3.88Å; Y1635-Q1639 HydrophobicContact CE2-CG 4.27Å; Y1635-Q1639 VanDerWaalsContact CE2-NE2 3.29Å; Y1635-Q1639 HydrophobicContact CG-CG 4.42Å; Y1635-Q1639 VanDerWaalsContact CZ-NE2 3.28Å; Y1635-Q1639 WeakPolarHBondContact O-CB 3.43Å; Y1635-Q1639 VanDerWaalsContact O-CG 3.27Å; Y1635-Q1639 WeakPolarHBondContact O-CG 3.33Å; Y1635-Q1639 PolarHBondContact O-N 3.19Å; Y1635-Q1639 PolarHBondContact OH-NE2 3.22Å; Y1635-Q1639 VanDerWaalsContact OH-NE2 3.1Å; T1636-Q1639 PolarHBondContact O-N 3.12Å; S1637-Q1639 PolarHBondContact O-N 2.89Å; Q1639-A1641 VanDerWaalsContact C-N 3.32Å; Q1639-A1641 PolarHBondContact O-N 2.96Å; Q1639-S1642 WeakPolarHBondContact O-CB 3.39Å; Q1639-S1642 PolarHBondContact O-N 2.97Å; Q1639-S1642 VanDerWaalsContact O-N 3.12Å; Q1639-S1642 PolarHBondContact O-OG 3.18Å; Q1639-L1643 PolarHBondContact O-N 3.41Å
1640I92.9Very high92.8Very high0.6 Ų0.644.1 Ų44.10%0.00326%0.256CS..Hα-helixtrans-61.5-41.9175.9-72.3176.1000111.1L1621 I1622 L1625 T1636 S1637 S1642 L1643 L1676 L1680L1621-I1640 HydrophobicContact CD2-CD1 4.46Å; L1621-I1640 HydrophobicContact CD2-CG1 3.89Å; L1621-I1640 HydrophobicContact CG-CD1 4.14Å; L1621-I1640 HydrophobicContact CG-CG1 4.04Å; I1622-I1640 HydrophobicContact CG1-CD1 4.31Å; L1625-I1640 HydrophobicContact CD1-CD1 3.91Å; L1625-I1640 HydrophobicContact CD2-CD1 4.16Å; L1625-I1640 HydrophobicContact CG-CD1 4.06Å; T1636-I1640 HydrophobicContact CG2-CD1 3.84Å; T1636-I1640 HydrophobicContact CG2-CG1 4.4Å; T1636-I1640 WeakPolarHBondContact O-CB 3.44Å; T1636-I1640 WeakPolarHBondContact O-CG1 3.27Å; T1636-I1640 PolarHBondContact O-N 3.16Å; S1637-I1640 PolarHBondContact O-N 3.19Å; I1640-S1642 VanDerWaalsContact C-N 3.27Å; I1640-S1642 PolarHBondContact O-N 3.16Å; I1640-L1643 WeakPolarHBondContact O-CB 3.12Å; I1640-L1643 WeakPolarHBondContact O-CG 3.46Å; I1640-L1643 PolarHBondContact O-N 3.07Å; I1640-L1643 VanDerWaalsContact O-N 3.15Å; I1640-L1676 HydrophobicContact CG2-CD1 3.61Å; I1640-L1680 HydrophobicContact CG2-CD1 3.86Å; I1640-L1680 HydrophobicContact CG2-CD2 4.34Å; I1640-L1680 HydrophobicContact CG2-CG 4.19Å
1641A91.9Very high92.8Very high49.4 Ų49.440.5 Ų40.541%0.40823%0.231SC..Hα-helixtrans-62.3-28.8175.200000113.5S1637 M1638 Q1639 L1643 L1680 R1683S1637-A1641 WeakPolarHBondContact O-CB 3.34Å; S1637-A1641 PolarHBondContact O-N 2.99Å; M1638-A1641 PolarHBondContact O-N 2.95Å; Q1639-A1641 VanDerWaalsContact C-N 3.32Å; Q1639-A1641 PolarHBondContact O-N 2.96Å; A1641-L1643 VanDerWaalsContact C-N 3.34Å; A1641-L1643 PolarHBondContact O-N 3Å; A1641-L1680 HydrophobicContact CB-CD2 4.2Å; A1641-R1683 PolarHBondContact O-NH2 3.23Å
1642S91.7Very high92.8Very high51.4 Ų51.438.2 Ų38.236%0.35922%0.216SC..Hα-helixtrans-79.1-9.7179.180.20000115.2R1520 M1638 Q1639 I1640R1520-S1642 PolarHBondContact NE-OG 3.12Å; R1520-S1642 PolarHBondContact NH2-OG 2.85Å; M1638-S1642 PolarHBondContact O-N 3.14Å; M1638-S1642 VanDerWaalsContact O-N 3.11Å; Q1639-S1642 WeakPolarHBondContact O-CB 3.39Å; Q1639-S1642 PolarHBondContact O-N 2.97Å; Q1639-S1642 VanDerWaalsContact O-N 3.12Å; Q1639-S1642 PolarHBondContact O-OG 3.18Å; I1640-S1642 VanDerWaalsContact C-N 3.27Å; I1640-S1642 PolarHBondContact O-N 3.16Å
1643L92Very high92.7Very high2.6 Ų2.641.5 Ų41.51%0.01423%0.231CC..  trans-65.6143.1-179.3-64.5178.1000111.4L1519 R1520 F1618 Q1639 I1640 A1641 L1648 R1683L1519-L1643 HydrophobicContact CB-CD1 4.49Å; L1519-L1643 HydrophobicContact CB-CD2 3.76Å; L1519-L1643 HydrophobicContact CD1-CD1 4.24Å; R1520-L1643 HydrophobicContact CG-CD2 4Å; F1618-L1643 HydrophobicContact CE2-CD1 4.27Å; Q1639-L1643 PolarHBondContact O-N 3.41Å; I1640-L1643 WeakPolarHBondContact O-CB 3.12Å; I1640-L1643 WeakPolarHBondContact O-CG 3.46Å; I1640-L1643 PolarHBondContact O-N 3.07Å; I1640-L1643 VanDerWaalsContact O-N 3.15Å; A1641-L1643 VanDerWaalsContact C-N 3.34Å; A1641-L1643 PolarHBondContact O-N 3Å; L1643-L1648 HydrophobicContact CD1-CD1 4.45Å; L1643-R1683 VanDerWaalsContact O-CZ 3.28Å; L1643-R1683 PolarHBondContact O-NH1 3.05Å; L1643-R1683 PolarHBondContact O-NH2 3.04Å
1644N91Very high92.6Very high74 Ų7440.5 Ų40.540%0.39622%0.223SC..  trans-75.3159.2176.670.447.1000110.8R1520 I1646 S1647 L1648R1520-N1644 PolarHBondContact O-ND2 3.26Å; N1644-I1646 VanDerWaalsContact C-N 3.28Å; N1644-I1646 PolarHBondContact O-N 3.06Å; N1644-I1646 WeakPolarHBondContact OD1-CA 3.31Å; N1644-I1646 WeakPolarHBondContact OD1-CB 3.44Å; N1644-I1646 PolarHBondContact OD1-N 3.14Å; N1644-S1647 PolarHBondContact N-OG 3.14Å; N1644-S1647 PolarHBondContact ND2-OG 3.04Å; N1644-S1647 PolarHBondContact O-N 2.98Å; N1644-S1647 PolarHBondContact O-OG 3.17Å; N1644-S1647 PolarHBondContact OD1-N 2.93Å; N1644-S1647 PolarHBondContact OD1-OG 3.02Å; N1644-L1648 VanDerWaalsContact O-CB 3.3Å; N1644-L1648 WeakPolarHBondContact O-CB 3.29Å; N1644-L1648 PolarHBondContact O-N 2.96Å; N1644-L1648 VanDerWaalsContact O-N 3.08Å
1645N90.1Very high92.6Very high106.6 Ų106.633.8 Ų33.857%0.5719%0.192SC*.Hα-helixtrans-67.4-29.5-176.1-73.3-17.1000113.6A1649 R1683N1645-A1649 WeakPolarHBondContact O-CB 3.27Å; N1645-A1649 PolarHBondContact O-N 3.19Å; N1645-A1649 VanDerWaalsContact O-N 3.16Å; N1645-R1683 PolarHBondContact OD1-NH1 2.98Å
1646I90.8Very high92.5Very high86 Ų8634 Ų3444%0.44119%0.194SC..Hα-helixtrans-72.4-47.2178.6-62172.7000109.9D1523 Y1524 N1644 L1648 A1649 C1650D1523-I1646 HydrophobicContact CB-CG2 3.95Å; Y1524-I1646 HydrophobicContact CD2-CG2 4.1Å; Y1524-I1646 HydrophobicContact CE2-CG2 3.97Å; N1644-I1646 VanDerWaalsContact C-N 3.28Å; N1644-I1646 PolarHBondContact O-N 3.06Å; N1644-I1646 WeakPolarHBondContact OD1-CA 3.31Å; N1644-I1646 WeakPolarHBondContact OD1-CB 3.44Å; N1644-I1646 PolarHBondContact OD1-N 3.14Å; I1646-L1648 VanDerWaalsContact C-N 3.33Å; I1646-L1648 PolarHBondContact O-N 2.85Å; I1646-A1649 PolarHBondContact O-N 3.15Å; I1646-C1650 WeakPolarHBondContact O-CB 3.35Å; I1646-C1650 PolarHBondContact O-N 3.21Å; I1646-C1650 PolarHBondContact O-SG 3.04Å
1647S92.3Very high92.3Very high0.8 Ų0.834.5 Ų34.51%0.00620%0.196CC..Hα-helixtrans-66.9-38.7178.360.10000112.8L1519 L1522 N1644 A1649 C1650 A1651L1519-S1647 WeakPolarHBondContact O-CB 3.43Å; L1519-S1647 PolarHBondContact O-OG 2.77Å; L1522-S1647 VanDerWaalsContact O-CA 3.23Å; L1522-S1647 WeakPolarHBondContact O-CA 3.47Å; L1522-S1647 WeakPolarHBondContact O-CB 3.33Å; L1522-S1647 PolarHBondContact O-N 3.41Å; N1644-S1647 PolarHBondContact N-OG 3.14Å; N1644-S1647 PolarHBondContact ND2-OG 3.04Å; N1644-S1647 PolarHBondContact O-N 2.98Å; N1644-S1647 PolarHBondContact O-OG 3.17Å; N1644-S1647 PolarHBondContact OD1-N 2.93Å; N1644-S1647 PolarHBondContact OD1-OG 3.02Å; S1647-A1649 PolarHBondContact O-N 3.13Å; S1647-C1650 WeakPolarHBondContact O-CB 3.39Å; S1647-C1650 PolarHBondContact O-N 3.06Å; S1647-A1651 WeakPolarHBondContact O-CB 3.37Å; S1647-A1651 PolarHBondContact O-N 3.07Å
1648L92.9Very high92.2Very high7 Ų732.4 Ų32.44%0.03718%0.181CC..Hα-helixtrans-60.8-45172.9-175.261.9000111.4F1618 L1643 N1644 I1646 A1651 I1652 L1676 L1680 I1685F1618-L1648 HydrophobicContact CZ-CD1 3.9Å; L1643-L1648 HydrophobicContact CD1-CD1 4.45Å; N1644-L1648 VanDerWaalsContact O-CB 3.3Å; N1644-L1648 WeakPolarHBondContact O-CB 3.29Å; N1644-L1648 PolarHBondContact O-N 2.96Å; N1644-L1648 VanDerWaalsContact O-N 3.08Å; I1646-L1648 VanDerWaalsContact C-N 3.33Å; I1646-L1648 PolarHBondContact O-N 2.85Å; L1648-A1651 PolarHBondContact O-N 3.06Å; L1648-I1652 HydrophobicContact CD1-CD1 4.26Å; L1648-I1652 HydrophobicContact CD1-CG1 4.47Å; L1648-I1652 HydrophobicContact CG-CD1 4Å; L1648-I1652 WeakPolarHBondContact O-CB 3.44Å; L1648-I1652 WeakPolarHBondContact O-CD1 3.49Å; L1648-I1652 VanDerWaalsContact O-CG1 3.27Å; L1648-I1652 WeakPolarHBondContact O-CG1 3.37Å; L1648-I1652 PolarHBondContact O-N 3Å; L1648-L1676 HydrophobicContact CD1-CD1 4.43Å; L1648-L1676 HydrophobicContact CD1-CD2 4.22Å; L1648-L1680 HydrophobicContact CD1-CD1 4.38Å; L1648-L1680 HydrophobicContact CD2-CD1 3.92Å; L1648-I1685 HydrophobicContact CD1-CD1 4.49Å; L1648-I1685 HydrophobicContact CD2-CD1 3.91Å; L1648-I1685 HydrophobicContact CG-CD1 4.44Å
1649A91.8Very high92.2Very high35.4 Ų35.426.8 Ų26.829%0.29315%0.153SC..Hα-helixtrans-64.7-39.217500000112.5Y1524 N1645 I1646 S1647 A1651 I1652 Q1653Y1524-A1649 WeakPolarHBondContact OH-CB 3.34Å; N1645-A1649 WeakPolarHBondContact O-CB 3.27Å; N1645-A1649 PolarHBondContact O-N 3.19Å; N1645-A1649 VanDerWaalsContact O-N 3.16Å; I1646-A1649 PolarHBondContact O-N 3.15Å; S1647-A1649 PolarHBondContact O-N 3.13Å; A1649-A1651 VanDerWaalsContact C-N 3.33Å; A1649-A1651 PolarHBondContact O-N 2.67Å; A1649-I1652 PolarHBondContact O-N 3.04Å; A1649-Q1653 VanDerWaalsContact O-CB 3.3Å; A1649-Q1653 WeakPolarHBondContact O-CB 3.31Å; A1649-Q1653 PolarHBondContact O-N 3.14Å
1650C92.3Very high92.1Very high0 Ų026.1 Ų26.10%015%0.15CC..Hα-helixtrans-61.5-43.4173.8-70.90000112.1L1522 D1523 Y1524 L1527 I1646 S1647 Q1653 C1654L1522-C1650 HydrophobicContact CB-CB 4.35Å; L1522-C1650 HydrophobicContact CD2-CB 3.7Å; L1522-C1650 HydrophobicContact CG-CB 4.05Å; D1523-C1650 VanDerWaalsContact C-SG 3.56Å; Y1524-C1650 VanDerWaalsContact CD1-SG 3.52Å; Y1524-C1650 WeakPolarHBondContact CD1-SG 3.42Å; Y1524-C1650 VanDerWaalsContact CE1-SG 3.53Å; Y1524-C1650 WeakPolarHBondContact CE1-SG 3.5Å; Y1524-C1650 PolarHBondContact N-SG 3.16Å; L1527-C1650 HydrophobicContact CD1-CB 3.64Å; L1527-C1650 HydrophobicContact CD2-CB 4.24Å; L1527-C1650 HydrophobicContact CG-CB 4.46Å; I1646-C1650 WeakPolarHBondContact O-CB 3.35Å; I1646-C1650 PolarHBondContact O-N 3.21Å; I1646-C1650 PolarHBondContact O-SG 3.04Å; S1647-C1650 WeakPolarHBondContact O-CB 3.39Å; S1647-C1650 PolarHBondContact O-N 3.06Å; C1650-Q1653 PolarHBondContact O-N 3.17Å; C1650-C1654 PolarHBondContact O-N 3.26Å; C1650-C1654 VanDerWaalsContact O-N 3.13Å; C1650-C1654 PolarHBondContact O-SG 3.16Å; C1650-C1654 VanDerWaalsContact O-SG 3.38Å
1651A93.3Very high91.9Very high0.4 Ų0.426.4 Ų26.40%0.00315%0.152CC..Hα-helixtrans-70.7-40.4179.800000112.1L1519 L1522 F1618 S1647 L1648 A1649 Q1653 C1654 L1655L1519-A1651 HydrophobicContact CD2-CB 4.19Å; L1522-A1651 HydrophobicContact CD2-CB 4.44Å; F1618-A1651 HydrophobicContact CD1-CB 3.49Å; F1618-A1651 VanDerWaalsContact CD1-CB 3.47Å; F1618-A1651 HydrophobicContact CD2-CB 4.49Å; F1618-A1651 HydrophobicContact CE1-CB 3.61Å; F1618-A1651 HydrophobicContact CG-CB 3.98Å; F1618-A1651 HydrophobicContact CZ-CB 4.19Å; S1647-A1651 WeakPolarHBondContact O-CB 3.37Å; S1647-A1651 PolarHBondContact O-N 3.07Å; L1648-A1651 PolarHBondContact O-N 3.06Å; A1649-A1651 VanDerWaalsContact C-N 3.33Å; A1649-A1651 PolarHBondContact O-N 2.67Å; A1651-Q1653 VanDerWaalsContact C-N 3.35Å; A1651-Q1653 PolarHBondContact O-N 2.74Å; A1651-C1654 WeakPolarHBondContact O-CB 3.22Å; A1651-C1654 PolarHBondContact O-N 3.21Å; A1651-C1654 VanDerWaalsContact O-N 3.14Å; A1651-L1655 PolarHBondContact O-N 3.32Å; A1651-L1655 VanDerWaalsContact O-N 3.08Å
1652I93.3Very high91.7Very high16.6 Ų16.624.6 Ų24.69%0.08514%0.137CC..Hα-helixtrans-60.4-44.2170.9-69.5165.4000110.6F1618 L1648 A1649 C1654 L1655 E1656 M1673 L1676 I1685F1618-I1652 HydrophobicContact CE1-CG1 4.45Å; L1648-I1652 HydrophobicContact CD1-CD1 4.26Å; L1648-I1652 HydrophobicContact CD1-CG1 4.47Å; L1648-I1652 HydrophobicContact CG-CD1 4Å; L1648-I1652 WeakPolarHBondContact O-CB 3.44Å; L1648-I1652 WeakPolarHBondContact O-CD1 3.49Å; L1648-I1652 VanDerWaalsContact O-CG1 3.27Å; L1648-I1652 WeakPolarHBondContact O-CG1 3.37Å; L1648-I1652 PolarHBondContact O-N 3Å; A1649-I1652 PolarHBondContact O-N 3.04Å; I1652-C1654 PolarHBondContact O-N 2.92Å; I1652-L1655 WeakPolarHBondContact O-CA 3.27Å; I1652-L1655 WeakPolarHBondContact O-CB 3.3Å; I1652-L1655 PolarHBondContact O-N 3.09Å; I1652-L1655 VanDerWaalsContact O-N 3.08Å; I1652-E1656 HydrophobicContact CG2-CG 4.4Å; I1652-E1656 WeakPolarHBondContact O-CG 3.39Å; I1652-E1656 PolarHBondContact O-N 3.16Å; I1652-M1673 HydrophobicContact CG2-CE 4.02Å; I1652-L1676 HydrophobicContact CD1-CD2 4.37Å; I1652-L1676 HydrophobicContact CG1-CD2 4.25Å; I1652-I1685 HydrophobicContact CD1-CB 4.38Å; I1652-I1685 HydrophobicContact CD1-CD1 4.06Å; I1652-I1685 HydrophobicContact CD1-CG1 4.1Å; I1652-I1685 HydrophobicContact CD1-CG2 4.13Å
1653Q91.8Very high91.4Very high68.4 Ų68.424.3 Ų24.332%0.3213%0.13SC..Hα-helixtrans-64-24.2177.3-166.1175.416.800113R1606 A1649 C1650 A1651 F1657R1606-Q1653 VanDerWaalsContact CZ-OE1 3.24Å; R1606-Q1653 VanDerWaalsContact NH1-CD 3.3Å; A1649-Q1653 VanDerWaalsContact O-CB 3.3Å; A1649-Q1653 WeakPolarHBondContact O-CB 3.31Å; A1649-Q1653 PolarHBondContact O-N 3.14Å; C1650-Q1653 PolarHBondContact O-N 3.17Å; A1651-Q1653 VanDerWaalsContact C-N 3.35Å; A1651-Q1653 PolarHBondContact O-N 2.74Å; Q1653-F1657 WeakPolarHBondContact O-CB 3.31Å; Q1653-F1657 PolarHBondContact O-N 3.27Å; Q1653-F1657 VanDerWaalsContact O-N 3.09Å
1654C92.9Very high91.1Very high0 Ų026.6 Ų26.60%015%0.147CC..Hα-helixtrans-76.1-40170.5-67.20000112.3Q1611 V1614 A1615 C1650 A1651 I1652 F1657 Q1658Q1611-C1654 HydrophobicContact CB-CB 4.47Å; Q1611-C1654 WeakPolarHBondContact O-CB 3.27Å; V1614-C1654 HydrophobicContact CB-CB 4.29Å; V1614-C1654 HydrophobicContact CG1-CB 4.04Å; A1615-C1654 HydrophobicContact CB-CB 4.22Å; A1615-C1654 WeakPolarHBondContact CB-O 3.28Å; C1650-C1654 PolarHBondContact O-N 3.26Å; C1650-C1654 VanDerWaalsContact O-N 3.13Å; C1650-C1654 PolarHBondContact O-SG 3.16Å; C1650-C1654 VanDerWaalsContact O-SG 3.38Å; A1651-C1654 WeakPolarHBondContact O-CB 3.22Å; A1651-C1654 PolarHBondContact O-N 3.21Å; A1651-C1654 VanDerWaalsContact O-N 3.14Å; I1652-C1654 PolarHBondContact O-N 2.92Å; C1654-F1657 WeakPolarHBondContact O-CB 3.42Å; C1654-F1657 PolarHBondContact O-N 3.07Å; C1654-Q1658 PolarHBondContact O-N 3.13Å; C1654-Q1658 VanDerWaalsContact O-N 3.08Å
1655L93.5Very high91Very high0 Ų023.1 Ų23.10%013%0.128CC..Hα-helixtrans-62.6-42.7171.7-65.8177.4000111.8A1615 F1618 C1619 I1622 A1651 I1652 F1657 Q1658 F1659 I1669 M1673A1615-L1655 HydrophobicContact CB-CD2 4.2Å; F1618-L1655 HydrophobicContact CD1-CD1 3.54Å; F1618-L1655 HydrophobicContact CD1-CD2 4.34Å; F1618-L1655 HydrophobicContact CD1-CG 3.88Å; F1618-L1655 HydrophobicContact CE1-CD1 3.71Å; F1618-L1655 HydrophobicContact CE1-CG 4.43Å; C1619-L1655 HydrophobicContact CB-CD2 4.35Å; I1622-L1655 HydrophobicContact CD1-CD1 4.12Å; A1651-L1655 PolarHBondContact O-N 3.32Å; A1651-L1655 VanDerWaalsContact O-N 3.08Å; I1652-L1655 WeakPolarHBondContact O-CA 3.27Å; I1652-L1655 WeakPolarHBondContact O-CB 3.3Å; I1652-L1655 PolarHBondContact O-N 3.09Å; I1652-L1655 VanDerWaalsContact O-N 3.08Å; L1655-F1657 VanDerWaalsContact C-N 3.33Å; L1655-F1657 PolarHBondContact O-N 3.22Å; L1655-Q1658 PolarHBondContact O-N 2.96Å; L1655-Q1658 VanDerWaalsContact O-N 3.16Å; L1655-F1659 PolarHBondContact O-N 3.16Å; L1655-I1669 HydrophobicContact CB-CD1 4.27Å; L1655-I1669 HydrophobicContact CB-CG2 4.05Å; L1655-I1669 HydrophobicContact CD2-CD1 3.66Å; L1655-I1669 HydrophobicContact CG-CD1 4.5Å; L1655-M1673 HydrophobicContact CD1-CG 4.15Å
1656E93.4Very high91.1Very high36.8 Ų36.818 Ų1817%0.17210%0.101CC..Hα-helixtrans-58.9-43.1173.3-75.3-170.3-143.600112.1I1652 Q1658 F1659 D1660 F1690 R1694I1652-E1656 HydrophobicContact CG2-CG 4.4Å; I1652-E1656 WeakPolarHBondContact O-CG 3.39Å; I1652-E1656 PolarHBondContact O-N 3.16Å; E1656-Q1658 VanDerWaalsContact C-N 3.3Å; E1656-Q1658 PolarHBondContact O-N 3.22Å; E1656-F1659 WeakPolarHBondContact O-CB 3.44Å; E1656-F1659 PolarHBondContact O-N 3.27Å; E1656-D1660 WeakPolarHBondContact O-CB 3.43Å; E1656-D1660 VanDerWaalsContact O-CG 3.26Å; E1656-D1660 PolarHBondContact O-N 2.96Å; E1656-F1690 HydrophobicContact CG-CD2 3.92Å; E1656-F1690 HydrophobicContact CG-CE2 4.02Å; E1656-R1694 IonicContact OE2-CZ 2.89Å; E1656-R1694 IonicContact OE2-NE 2.98Å; E1656-R1694 PolarHBondContact OE2-NE 3.19Å; E1656-R1694 VanDerWaalsContact OE2-NE 3.07Å; E1656-R1694 IonicContact OE2-NH2 3.64Å; E1656-R1694 PolarHBondContact OE2-NH2 3.17Å
1657F91Very high91Very high10.8 Ų10.816.2 Ų16.25%0.04710%0.095CC..Hα-helixtrans-61.5-40.7175.8172.8-94.4000112.2F1202 P1608 Q1611 Q1653 C1654 L1655 F1659 D1660 T1661 I1746F1202-F1657 AromaticContact CE2-CE2 3.98Å; F1202-F1657 HydrophobicContact CE2-CE2 4.05Å; F1202-F1657 AromaticContact CE2-CZ 3.96Å; F1202-F1657 HydrophobicContact CE2-CZ 3.96Å; F1202-F1657 HydrophobicContact CZ-CE2 4.41Å; P1608-F1657 HydrophobicContact CB-CE1 4.08Å; P1608-F1657 HydrophobicContact CB-CE2 4.28Å; P1608-F1657 HydrophobicContact CB-CZ 3.51Å; P1608-F1657 VanDerWaalsContact CB-CZ 3.45Å; P1608-F1657 WeakPolarHBondContact O-CE1 3.34Å; Q1611-F1657 HydrophobicContact CB-CB 4.45Å; Q1611-F1657 HydrophobicContact CB-CD1 3.57Å; Q1611-F1657 HydrophobicContact CB-CE1 4.04Å; Q1611-F1657 HydrophobicContact CB-CG 4.05Å; Q1653-F1657 WeakPolarHBondContact O-CB 3.31Å; Q1653-F1657 PolarHBondContact O-N 3.27Å; Q1653-F1657 VanDerWaalsContact O-N 3.09Å; C1654-F1657 WeakPolarHBondContact O-CB 3.42Å; C1654-F1657 PolarHBondContact O-N 3.07Å; L1655-F1657 VanDerWaalsContact C-N 3.33Å; L1655-F1657 PolarHBondContact O-N 3.22Å; F1657-F1659 VanDerWaalsContact C-N 3.3Å; F1657-F1659 PolarHBondContact O-N 3.24Å; F1657-D1660 WeakPolarHBondContact O-CB 3.49Å; F1657-D1660 PolarHBondContact O-N 2.97Å; F1657-D1660 VanDerWaalsContact O-N 3.17Å; F1657-T1661 HydrophobicContact CD2-CG2 4.2Å; F1657-T1661 HydrophobicContact CE1-CG2 4.37Å; F1657-T1661 HydrophobicContact CE2-CG2 3.73Å; F1657-T1661 HydrophobicContact CZ-CG2 3.81Å; F1657-T1661 WeakPolarHBondContact O-CB 3.32Å; F1657-T1661 WeakPolarHBondContact O-CG2 3.3Å; F1657-T1661 PolarHBondContact O-N 3.08Å; F1657-T1661 VanDerWaalsContact O-N 3.12Å; F1657-T1661 PolarHBondContact O-OG1 3.05Å; F1657-T1661 VanDerWaalsContact O-OG1 3.09Å; F1657-I1746 HydrophobicContact CE1-CD1 4.01Å; F1657-I1746 HydrophobicContact CZ-CD1 4Å
1658Q91.6Very high90.9Very high0 Ų016.8 Ų16.80%010%0.098CC..Hα-helixtrans-66.5-39.5175.7-167.878.810.400111.7S1612 A1615 C1654 L1655 E1656 D1660 T1661 V1662 D1665 I1669 K1747 I1749S1612-Q1658 VanDerWaalsContact CB-OE1 3.26Å; S1612-Q1658 PolarHBondContact OG-OE1 3.2Å; A1615-Q1658 HydrophobicContact CB-CB 4.01Å; A1615-Q1658 HydrophobicContact CB-CG 4.48Å; C1654-Q1658 PolarHBondContact O-N 3.13Å; C1654-Q1658 VanDerWaalsContact O-N 3.08Å; L1655-Q1658 PolarHBondContact O-N 2.96Å; L1655-Q1658 VanDerWaalsContact O-N 3.16Å; E1656-Q1658 VanDerWaalsContact C-N 3.3Å; E1656-Q1658 PolarHBondContact O-N 3.22Å; Q1658-D1660 VanDerWaalsContact C-N 3.34Å; Q1658-D1660 PolarHBondContact O-N 3.18Å; Q1658-T1661 PolarHBondContact O-N 3.14Å; Q1658-V1662 HydrophobicContact CG-CB 4.49Å; Q1658-V1662 WeakPolarHBondContact O-CB 3.34Å; Q1658-V1662 PolarHBondContact O-N 3.21Å; Q1658-D1665 HydrophobicContact CG-CB 4.29Å; Q1658-D1665 WeakPolarHBondContact CG-OD2 3.35Å; Q1658-D1665 PolarHBondContact NE2-OD2 3.04Å; Q1658-I1669 HydrophobicContact CB-CD1 4.1Å; Q1658-I1669 HydrophobicContact CG-CD1 4.16Å; Q1658-K1747 PolarHBondContact NE2-O 3.13Å; Q1658-K1747 VanDerWaalsContact NE2-O 3.14Å; Q1658-I1749 HydrophobicContact CG-CD1 3.91Å; Q1658-I1749 HydrophobicContact CG-CG1 4.42Å
1659F92.5Very high90.9Very high0.2 Ų0.216.5 Ų16.50%0.00110%0.097CC..Hα-helixtrans-61-43.1173.7178.3-78.3000112.2L1655 E1656 F1657 T1661 R1666 I1669 L1670 R1694 T1879L1655-F1659 PolarHBondContact O-N 3.16Å; E1656-F1659 WeakPolarHBondContact O-CB 3.44Å; E1656-F1659 PolarHBondContact O-N 3.27Å; F1657-F1659 VanDerWaalsContact C-N 3.3Å; F1657-F1659 PolarHBondContact O-N 3.24Å; F1659-T1661 VanDerWaalsContact C-N 3.32Å; F1659-T1661 PolarHBondContact O-N 3Å; F1659-R1666 HydrophobicContact CD1-CG 4.46Å; F1659-R1666 HydrophobicContact CD2-CB 3.83Å; F1659-R1666 HydrophobicContact CD2-CG 3.73Å; F1659-R1666 HydrophobicContact CE1-CG 4.42Å; F1659-R1666 HydrophobicContact CE2-CB 3.65Å; F1659-R1666 HydrophobicContact CE2-CG 3.75Å; F1659-R1666 HydrophobicContact CG-CG 4.11Å; F1659-R1666 HydrophobicContact CZ-CB 4.38Å; F1659-R1666 HydrophobicContact CZ-CG 4.15Å; F1659-R1666 WeakPolarHBondContact O-CG 3.5Å; F1659-R1666 PolarHBondContact O-NE 3.29Å; F1659-R1666 VanDerWaalsContact O-NE 3.11Å; F1659-R1666 PolarHBondContact O-NH2 2.83Å; F1659-I1669 HydrophobicContact CB-CB 4.37Å; F1659-I1669 HydrophobicContact CB-CD1 4.03Å; F1659-I1669 HydrophobicContact CB-CG1 4.47Å; F1659-I1669 HydrophobicContact CB-CG2 4.12Å; F1659-I1669 HydrophobicContact CD2-CB 4.42Å; F1659-I1669 HydrophobicContact CD2-CG2 4.47Å; F1659-L1670 HydrophobicContact CD2-CD2 4.38Å; F1659-L1670 HydrophobicContact CD2-CG 4.23Å; F1659-L1670 HydrophobicContact CE2-CD1 3.93Å; F1659-L1670 HydrophobicContact CE2-CD2 4.04Å; F1659-L1670 HydrophobicContact CE2-CG 3.8Å; F1659-R1694 HydrophobicContact CD1-CB 4.4Å; F1659-R1694 VanDerWaalsContact CD1-CD 3.46Å; F1659-R1694 HydrophobicContact CD1-CG 4.08Å; F1659-R1694 HydrophobicContact CE1-CB 3.79Å; F1659-R1694 HydrophobicContact CE1-CG 3.96Å; F1659-R1694 HydrophobicContact CZ-CB 4.3Å; F1659-R1694 HydrophobicContact CZ-CG 4.48Å; F1659-T1879 HydrophobicContact CE2-CG2 3.97Å; F1659-T1879 HydrophobicContact CZ-CG2 3.86Å
1660D91.3Very high91Very high0.8 Ų0.814.8 Ų14.80%0.0048%0.083CC..Hα-helixtrans-64-41-180-70.7-6.9000111.6E1656 F1657 Q1658 R1666 R1694 I1697 R1735E1656-D1660 WeakPolarHBondContact O-CB 3.43Å; E1656-D1660 VanDerWaalsContact O-CG 3.26Å; E1656-D1660 PolarHBondContact O-N 2.96Å; F1657-D1660 WeakPolarHBondContact O-CB 3.49Å; F1657-D1660 PolarHBondContact O-N 2.97Å; F1657-D1660 VanDerWaalsContact O-N 3.17Å; Q1658-D1660 VanDerWaalsContact C-N 3.34Å; Q1658-D1660 PolarHBondContact O-N 3.18Å; D1660-R1666 PolarHBondContact O-NH2 3.3Å; D1660-R1666 VanDerWaalsContact O-NH2 3.09Å; D1660-R1694 VanDerWaalsContact CG-NH1 3.34Å; D1660-R1694 VanDerWaalsContact OD1-CD 3.28Å; D1660-R1694 WeakPolarHBondContact OD1-CD 3.28Å; D1660-R1694 IonicContact OD1-CZ 3.4Å; D1660-R1694 VanDerWaalsContact OD1-CZ 3.24Å; D1660-R1694 IonicContact OD1-NE 3.21Å; D1660-R1694 PolarHBondContact OD1-NE 3.08Å; D1660-R1694 IonicContact OD1-NH1 3.46Å; D1660-R1694 PolarHBondContact OD1-NH1 3.3Å; D1660-R1694 IonicContact OD1-NH2 2.75Å; D1660-R1694 IonicContact OD2-CZ 3.11Å; D1660-R1694 IonicContact OD2-NH1 3.42Å; D1660-R1694 PolarHBondContact OD2-NH1 3.17Å; D1660-R1694 IonicContact OD2-NH2 3.29Å; D1660-I1697 HydrophobicContact CB-CD1 3.96Å; D1660-I1697 VanDerWaalsContact CG-CD1 3.43Å; D1660-I1697 VanDerWaalsContact OD1-CD1 3.25Å; D1660-I1697 WeakPolarHBondContact OD1-CD1 3.27Å; D1660-I1697 WeakPolarHBondContact OD2-CD1 3.39Å; D1660-R1735 HydrophobicContact CB-CB 4.21Å; D1660-R1735 HydrophobicContact CB-CG 4.45Å; D1660-R1735 WeakPolarHBondContact OD2-CD 3.38Å; D1660-R1735 IonicContact OD2-CZ 3.21Å; D1660-R1735 IonicContact OD2-NE 3.24Å; D1660-R1735 IonicContact OD2-NH1 3.32Å; D1660-R1735 PolarHBondContact OD2-NH1 3.03Å
1661T87.8Confident91Very high6.4 Ų6.417.9 Ų17.94%0.03910%0.097CC..Hα-helixtrans-98.6-22.6-168.857.50000115.3F1202 F1657 Q1658 F1659 R1735 F1738 A1739 I1746F1202-T1661 HydrophobicContact CE2-CG2 4.33Å; F1202-T1661 HydrophobicContact CZ-CG2 3.66Å; F1657-T1661 HydrophobicContact CD2-CG2 4.2Å; F1657-T1661 HydrophobicContact CE1-CG2 4.37Å; F1657-T1661 HydrophobicContact CE2-CG2 3.73Å; F1657-T1661 HydrophobicContact CZ-CG2 3.81Å; F1657-T1661 WeakPolarHBondContact O-CB 3.32Å; F1657-T1661 WeakPolarHBondContact O-CG2 3.3Å; F1657-T1661 PolarHBondContact O-N 3.08Å; F1657-T1661 VanDerWaalsContact O-N 3.12Å; F1657-T1661 PolarHBondContact O-OG1 3.05Å; F1657-T1661 VanDerWaalsContact O-OG1 3.09Å; Q1658-T1661 PolarHBondContact O-N 3.14Å; F1659-T1661 VanDerWaalsContact C-N 3.32Å; F1659-T1661 PolarHBondContact O-N 3Å; T1661-R1735 HydrophobicContact CG2-CB 4.3Å; T1661-R1735 HydrophobicContact CG2-CG 4.17Å; T1661-F1738 HydrophobicContact CG2-CD1 4.3Å; T1661-F1738 HydrophobicContact CG2-CE1 4.46Å; T1661-A1739 WeakPolarHBondContact O-CB 3.37Å; T1661-I1746 HydrophobicContact CG2-CD1 4.43Å
1662V88.1Confident90.9Very high13.4 Ų13.418.2 Ų18.28%0.08110%0.098CC..  trans-125.998.9-174.8-175.30000111.3Q1658 S1664 D1665 I1746Q1658-V1662 HydrophobicContact CG-CB 4.49Å; Q1658-V1662 WeakPolarHBondContact O-CB 3.34Å; Q1658-V1662 PolarHBondContact O-N 3.21Å; V1662-S1664 VanDerWaalsContact C-N 3.3Å; V1662-S1664 WeakPolarHBondContact CG1-OG 3.29Å; V1662-S1664 PolarHBondContact O-N 3.28Å; V1662-D1665 HydrophobicContact CB-CB 4.33Å; V1662-D1665 HydrophobicContact CG1-CB 4.12Å; V1662-D1665 WeakPolarHBondContact CG1-OD2 3.39Å; V1662-D1665 PolarHBondContact O-N 3.09Å; V1662-D1665 VanDerWaalsContact O-N 3.12Å; V1662-I1746 HydrophobicContact CG2-CB 4.18Å; V1662-I1746 HydrophobicContact CG2-CG2 3.75Å
1663I86.7Confident90.9Very high44.6 Ų44.617.4 Ų17.423%0.2299%0.094CC..G310 helixtrans-56.6-39.2-175.7-55.9-179.6000112.3D1665 R1666 A1739I1663-D1665 VanDerWaalsContact C-N 3.29Å; I1663-D1665 PolarHBondContact O-N 2.94Å; I1663-R1666 WeakPolarHBondContact O-CB 3.32Å; I1663-R1666 WeakPolarHBondContact O-CG 3.41Å; I1663-R1666 PolarHBondContact O-N 3.14Å; I1663-A1739 HydrophobicContact CD1-CB 4.36Å; I1663-A1739 WeakPolarHBondContact CD1-O 3.39Å; I1663-A1739 HydrophobicContact CG1-CB 4.09Å
1664S85Confident90.9Very high51 Ų5116.1 Ų16.136%0.3579%0.088SC..G310 helixtrans-71.5-13-17952.90000115V1662 S1748 S1750V1662-S1664 VanDerWaalsContact C-N 3.3Å; V1662-S1664 WeakPolarHBondContact CG1-OG 3.29Å; V1662-S1664 PolarHBondContact O-N 3.28Å; S1664-S1748 VanDerWaalsContact OG-CB 3.28Å; S1664-S1748 WeakPolarHBondContact OG-CB 3.34Å; S1664-S1748 PolarHBondContact OG-OG 3.24Å; S1664-S1750 PolarHBondContact O-OG 3.31Å
1665D89Confident90.8Very high0 Ų017.3 Ų17.30%09%0.094CC..G310 helixtrans-96-10.3179.8-69.4-10.1000112.6Q1658 V1662 I1663 C1667 L1668 I1669 S1748 I1749 S1750Q1658-D1665 HydrophobicContact CG-CB 4.29Å; Q1658-D1665 WeakPolarHBondContact CG-OD2 3.35Å; Q1658-D1665 PolarHBondContact NE2-OD2 3.04Å; V1662-D1665 HydrophobicContact CB-CB 4.33Å; V1662-D1665 HydrophobicContact CG1-CB 4.12Å; V1662-D1665 WeakPolarHBondContact CG1-OD2 3.39Å; V1662-D1665 PolarHBondContact O-N 3.09Å; V1662-D1665 VanDerWaalsContact O-N 3.12Å; I1663-D1665 VanDerWaalsContact C-N 3.29Å; I1663-D1665 PolarHBondContact O-N 2.94Å; D1665-C1667 PolarHBondContact O-N 3.11Å; D1665-L1668 CarbonylContact O-C 3.5Å; D1665-L1668 WeakPolarHBondContact O-CA 3.45Å; D1665-L1668 WeakPolarHBondContact O-CB 3.36Å; D1665-L1668 PolarHBondContact O-N 3.17Å; D1665-L1668 VanDerWaalsContact O-N 3.12Å; D1665-I1669 HydrophobicContact CB-CD1 3.73Å; D1665-I1669 HydrophobicContact CB-CG1 4.27Å; D1665-I1669 WeakPolarHBondContact O-CG1 3.36Å; D1665-I1669 PolarHBondContact O-N 3.25Å; D1665-S1748 WeakPolarHBondContact OD1-CA 3.37Å; D1665-S1748 WeakPolarHBondContact OD1-CB 3.34Å; D1665-S1748 PolarHBondContact OD1-OG 3.08Å; D1665-S1748 WeakPolarHBondContact OD2-CA 3.29Å; D1665-I1749 VanDerWaalsContact CG-N 3.28Å; D1665-I1749 PolarHBondContact OD1-N 3.18Å; D1665-I1749 WeakPolarHBondContact OD2-CG1 3.25Å; D1665-I1749 PolarHBondContact OD2-N 3.22Å; D1665-S1750 WeakPolarHBondContact OD1-CB 3.35Å; D1665-S1750 PolarHBondContact OD1-N 3.26Å; D1665-S1750 PolarHBondContact OD1-OG 3Å
1666R91.1Very high90.7Very high0 Ų017.3 Ų17.30%09%0.094CC..Hα-helixtrans-55.7-51-168.7-71.3179.9173.7173.6-6.3114.4F1659 D1660 I1663 L1668 I1669 L1670 L1698 Q1701 E1876 T1879F1659-R1666 HydrophobicContact CD1-CG 4.46Å; F1659-R1666 HydrophobicContact CD2-CB 3.83Å; F1659-R1666 HydrophobicContact CD2-CG 3.73Å; F1659-R1666 HydrophobicContact CE1-CG 4.42Å; F1659-R1666 HydrophobicContact CE2-CB 3.65Å; F1659-R1666 HydrophobicContact CE2-CG 3.75Å; F1659-R1666 HydrophobicContact CG-CG 4.11Å; F1659-R1666 HydrophobicContact CZ-CB 4.38Å; F1659-R1666 HydrophobicContact CZ-CG 4.15Å; F1659-R1666 WeakPolarHBondContact O-CG 3.5Å; F1659-R1666 PolarHBondContact O-NE 3.29Å; F1659-R1666 VanDerWaalsContact O-NE 3.11Å; F1659-R1666 PolarHBondContact O-NH2 2.83Å; D1660-R1666 PolarHBondContact O-NH2 3.3Å; D1660-R1666 VanDerWaalsContact O-NH2 3.09Å; I1663-R1666 WeakPolarHBondContact O-CB 3.32Å; I1663-R1666 WeakPolarHBondContact O-CG 3.41Å; I1663-R1666 PolarHBondContact O-N 3.14Å; R1666-L1668 VanDerWaalsContact C-N 3.31Å; R1666-L1668 PolarHBondContact O-N 2.82Å; R1666-I1669 PolarHBondContact O-N 3Å; R1666-I1669 VanDerWaalsContact O-N 3.17Å; R1666-L1670 WeakPolarHBondContact O-CG 3.31Å; R1666-L1670 PolarHBondContact O-N 3.02Å; R1666-L1698 VanDerWaalsContact NH1-CD2 3.29Å; R1666-Q1701 VanDerWaalsContact CZ-OE1 3.22Å; R1666-Q1701 VanDerWaalsContact NH2-CD 3.29Å; R1666-Q1701 VanDerWaalsContact NH2-NE2 3.15Å; R1666-E1876 IonicContact CZ-OE1 3.61Å; R1666-E1876 IonicContact NH1-OE1 3.08Å; R1666-E1876 PolarHBondContact NH1-OE1 3.06Å; R1666-T1879 HydrophobicContact CB-CG2 3.98Å; R1666-T1879 WeakPolarHBondContact CB-OG1 3.24Å
1667C89.7Confident90.5Very high48.6 Ų48.616.8 Ų16.833%0.3289%0.094SC..Hα-helixtrans-62-39.2178.3-61.60000112D1665 L1670 Q1671D1665-C1667 PolarHBondContact O-N 3.11Å; C1667-L1670 PolarHBondContact O-N 3.23Å; C1667-Q1671 WeakPolarHBondContact O-CB 3.35Å; C1667-Q1671 PolarHBondContact O-N 3.28Å
1668L90.3Very high90.4Very high12.8 Ų12.819.2 Ų19.27%0.06711%0.111CC..Hα-helixtrans-65.7-46.2176.5175.259.3000111.6D1665 R1666 L1670 Q1671 R1672 I1749 Y1756 F1760D1665-L1668 CarbonylContact O-C 3.5Å; D1665-L1668 WeakPolarHBondContact O-CA 3.45Å; D1665-L1668 WeakPolarHBondContact O-CB 3.36Å; D1665-L1668 PolarHBondContact O-N 3.17Å; D1665-L1668 VanDerWaalsContact O-N 3.12Å; R1666-L1668 VanDerWaalsContact C-N 3.31Å; R1666-L1668 PolarHBondContact O-N 2.82Å; L1668-L1670 VanDerWaalsContact C-N 3.34Å; L1668-L1670 PolarHBondContact O-N 3.09Å; L1668-Q1671 WeakPolarHBondContact O-CB 3.4Å; L1668-Q1671 PolarHBondContact O-N 3.13Å; L1668-Q1671 VanDerWaalsContact O-N 3.16Å; L1668-R1672 HydrophobicContact CD1-CG 4.06Å; L1668-R1672 HydrophobicContact CG-CG 4.49Å; L1668-R1672 WeakPolarHBondContact O-CG 3.36Å; L1668-R1672 PolarHBondContact O-N 2.99Å; L1668-I1749 HydrophobicContact CD2-CB 4.28Å; L1668-I1749 HydrophobicContact CD2-CG2 3.78Å; L1668-Y1756 HydrophobicContact CD1-CD1 4.2Å; L1668-Y1756 HydrophobicContact CD1-CD2 3.83Å; L1668-Y1756 HydrophobicContact CD1-CE1 3.3Å; L1668-Y1756 HydrophobicContact CD1-CE2 3.35Å; L1668-Y1756 VanDerWaalsContact CD1-CE2 3.41Å; L1668-Y1756 HydrophobicContact CD2-CD1 4.41Å; L1668-Y1756 HydrophobicContact CD2-CD2 4.22Å; L1668-Y1756 HydrophobicContact CD2-CE1 4.13Å; L1668-Y1756 HydrophobicContact CD2-CE2 4.06Å; L1668-Y1756 HydrophobicContact CD2-CG 4.29Å; L1668-Y1756 HydrophobicContact CG-CE1 4.27Å; L1668-Y1756 HydrophobicContact CG-CE2 4.22Å; L1668-F1760 HydrophobicContact CD1-CE2 4.24Å; L1668-F1760 HydrophobicContact CD1-CZ 4.27Å
1669I93.2Very high90.2Very high0.4 Ų0.422.2 Ų22.20%0.00213%0.127CC..Hα-helixtrans-60.6-46.4176.8-64.3-79.3000110.5L1655 Q1658 F1659 D1665 R1666 Q1671 R1672 M1673 I1749L1655-I1669 HydrophobicContact CB-CD1 4.27Å; L1655-I1669 HydrophobicContact CB-CG2 4.05Å; L1655-I1669 HydrophobicContact CD2-CD1 3.66Å; L1655-I1669 HydrophobicContact CG-CD1 4.5Å; Q1658-I1669 HydrophobicContact CB-CD1 4.1Å; Q1658-I1669 HydrophobicContact CG-CD1 4.16Å; F1659-I1669 HydrophobicContact CB-CB 4.37Å; F1659-I1669 HydrophobicContact CB-CD1 4.03Å; F1659-I1669 HydrophobicContact CB-CG1 4.47Å; F1659-I1669 HydrophobicContact CB-CG2 4.12Å; F1659-I1669 HydrophobicContact CD2-CB 4.42Å; F1659-I1669 HydrophobicContact CD2-CG2 4.47Å; D1665-I1669 HydrophobicContact CB-CD1 3.73Å; D1665-I1669 HydrophobicContact CB-CG1 4.27Å; D1665-I1669 WeakPolarHBondContact O-CG1 3.36Å; D1665-I1669 PolarHBondContact O-N 3.25Å; R1666-I1669 PolarHBondContact O-N 3Å; R1666-I1669 VanDerWaalsContact O-N 3.17Å; I1669-Q1671 VanDerWaalsContact C-N 3.3Å; I1669-Q1671 PolarHBondContact O-N 3Å; I1669-R1672 PolarHBondContact O-N 3.23Å; I1669-M1673 HydrophobicContact CG2-CG 4.31Å; I1669-M1673 HydrophobicContact CG2-SD 4Å; I1669-M1673 WeakPolarHBondContact O-CB 3.38Å; I1669-M1673 WeakPolarHBondContact O-CG 3.33Å; I1669-M1673 PolarHBondContact O-N 3.05Å; I1669-I1749 HydrophobicContact CD1-CD1 4.35Å
1670L92.9Very high89.9Confident0.4 Ų0.422.8 Ų22.80%0.00213%0.131CC..Hα-helixtrans-60.9-38.3175.9-70.4179.2000112.3F1659 R1666 C1667 L1668 H1674 F1690 T1879 Q1882 W1883 L1886F1659-L1670 HydrophobicContact CD2-CD2 4.38Å; F1659-L1670 HydrophobicContact CD2-CG 4.23Å; F1659-L1670 HydrophobicContact CE2-CD1 3.93Å; F1659-L1670 HydrophobicContact CE2-CD2 4.04Å; F1659-L1670 HydrophobicContact CE2-CG 3.8Å; R1666-L1670 WeakPolarHBondContact O-CG 3.31Å; R1666-L1670 PolarHBondContact O-N 3.02Å; C1667-L1670 PolarHBondContact O-N 3.23Å; L1668-L1670 VanDerWaalsContact C-N 3.34Å; L1668-L1670 PolarHBondContact O-N 3.09Å; L1670-H1674 VanDerWaalsContact O-CB 3.27Å; L1670-H1674 WeakPolarHBondContact O-CB 3.4Å; L1670-H1674 PolarHBondContact O-N 3.2Å; L1670-H1674 VanDerWaalsContact O-N 3.08Å; L1670-F1690 HydrophobicContact CD2-CE1 4.27Å; L1670-F1690 HydrophobicContact CD2-CZ 3.83Å; L1670-T1879 HydrophobicContact CD1-CG2 4.22Å; L1670-Q1882 HydrophobicContact CB-CG 3.73Å; L1670-Q1882 HydrophobicContact CD1-CB 4.07Å; L1670-Q1882 HydrophobicContact CD1-CG 3.95Å; L1670-Q1882 HydrophobicContact CG-CG 4.44Å; L1670-W1883 HydrophobicContact CD1-CB 4.48Å; L1670-L1886 HydrophobicContact CB-CD1 3.83Å; L1670-L1886 HydrophobicContact CD2-CD1 4.04Å; L1670-L1886 HydrophobicContact CG-CD1 4.4Å; L1670-L1886 WeakPolarHBondContact O-CD1 3.45Å
1671Q92.1Very high89.3Confident64.8 Ų64.827.5 Ų27.530%0.30316%0.161SC..Hα-helixtrans-66.3-45.3174.3-179.4176.5-13.600112.3C1667 L1668 I1669 H1674 Q1675 F1760C1667-Q1671 WeakPolarHBondContact O-CB 3.35Å; C1667-Q1671 PolarHBondContact O-N 3.28Å; L1668-Q1671 WeakPolarHBondContact O-CB 3.4Å; L1668-Q1671 PolarHBondContact O-N 3.13Å; L1668-Q1671 VanDerWaalsContact O-N 3.16Å; I1669-Q1671 VanDerWaalsContact C-N 3.3Å; I1669-Q1671 PolarHBondContact O-N 3Å; Q1671-H1674 WeakPolarHBondContact O-CB 3.4Å; Q1671-H1674 PolarHBondContact O-N 3.18Å; Q1671-Q1675 WeakPolarHBondContact O-CG 3.42Å; Q1671-Q1675 PolarHBondContact O-N 3.08Å; Q1671-F1760 VanDerWaalsContact CD-CZ 3.5Å; Q1671-F1760 VanDerWaalsContact OE1-CZ 3.28Å
1672R92.4Very high88.7Confident6 Ų634.7 Ų34.72%0.02320%0.199CC..Hα-helixtrans-67.2-41.2179-64.8-37.3-172.2179.91.8111.9C1619 I1622 G1623 D1626 L1668 I1669 H1674 Q1675 L1676 Y1756C1619-R1672 VanDerWaalsContact SG-CG 3.6Å; I1622-R1672 HydrophobicContact CB-CB 4.29Å; I1622-R1672 HydrophobicContact CB-CG 4.47Å; I1622-R1672 HydrophobicContact CD1-CB 4.1Å; I1622-R1672 HydrophobicContact CG2-CB 3.9Å; I1622-R1672 HydrophobicContact CG2-CG 4.31Å; G1623-R1672 VanDerWaalsContact CA-CZ 3.48Å; G1623-R1672 VanDerWaalsContact CA-NH2 3.29Å; D1626-R1672 IonicContact OD2-CZ 3.25Å; D1626-R1672 IonicContact OD2-NH1 3.28Å; D1626-R1672 PolarHBondContact OD2-NH1 3.2Å; D1626-R1672 IonicContact OD2-NH2 3.4Å; L1668-R1672 HydrophobicContact CD1-CG 4.06Å; L1668-R1672 HydrophobicContact CG-CG 4.49Å; L1668-R1672 WeakPolarHBondContact O-CG 3.36Å; L1668-R1672 PolarHBondContact O-N 2.99Å; I1669-R1672 PolarHBondContact O-N 3.23Å; R1672-H1674 VanDerWaalsContact C-N 3.28Å; R1672-H1674 PolarHBondContact O-N 3.22Å; R1672-Q1675 PolarHBondContact O-N 3.14Å; R1672-L1676 VanDerWaalsContact O-CB 3.3Å; R1672-L1676 WeakPolarHBondContact O-CB 3.48Å; R1672-L1676 PolarHBondContact O-N 3.23Å; R1672-Y1756 PolarHBondContact NE-OH 3.18Å; R1672-Y1756 VanDerWaalsContact NH2-CE1 3.26Å; R1672-Y1756 PolarHBondContact NH2-OH 3.06Å
1673M91.9Very high88.3Confident0.2 Ų0.237.3 Ų37.30%0.00121%0.208CC..Hα-helixtrans-61.5-37172.2-70-175.970.500112I1652 L1655 I1669 L1676 S1677 F1686 F1690I1652-M1673 HydrophobicContact CG2-CE 4.02Å; L1655-M1673 HydrophobicContact CD1-CG 4.15Å; I1669-M1673 HydrophobicContact CG2-CG 4.31Å; I1669-M1673 HydrophobicContact CG2-SD 4Å; I1669-M1673 WeakPolarHBondContact O-CB 3.38Å; I1669-M1673 WeakPolarHBondContact O-CG 3.33Å; I1669-M1673 PolarHBondContact O-N 3.05Å; M1673-L1676 PolarHBondContact O-N 3.31Å; M1673-S1677 WeakPolarHBondContact O-CB 3.39Å; M1673-S1677 PolarHBondContact O-N 3.06Å; M1673-F1686 HydrophobicContact CB-CE1 3.91Å; M1673-F1686 HydrophobicContact CB-CZ 3.75Å; M1673-F1686 HydrophobicContact CE-CD1 4.19Å; M1673-F1686 HydrophobicContact CE-CE1 3.97Å; M1673-F1690 HydrophobicContact CE-CD2 3.94Å; M1673-F1690 HydrophobicContact CE-CE2 3.55Å; M1673-F1690 HydrophobicContact CE-CZ 3.95Å; M1673-F1690 HydrophobicContact SD-CD2 4.48Å; M1673-F1690 HydrophobicContact SD-CE2 3.7Å; M1673-F1690 HydrophobicContact SD-CZ 3.92Å
1674H91.6Very high88Confident40.2 Ų40.243 Ų4319%0.18623%0.234CC..Hα-helixtrans-64.6-47.2173.8175.3-115.8000112.7L1670 Q1671 R1672 L1676 S1677 C1678 F1686 L1886 K1889L1670-H1674 VanDerWaalsContact O-CB 3.27Å; L1670-H1674 WeakPolarHBondContact O-CB 3.4Å; L1670-H1674 PolarHBondContact O-N 3.2Å; L1670-H1674 VanDerWaalsContact O-N 3.08Å; Q1671-H1674 WeakPolarHBondContact O-CB 3.4Å; Q1671-H1674 PolarHBondContact O-N 3.18Å; R1672-H1674 VanDerWaalsContact C-N 3.28Å; R1672-H1674 PolarHBondContact O-N 3.22Å; H1674-L1676 VanDerWaalsContact C-N 3.32Å; H1674-L1676 PolarHBondContact O-N 3.09Å; H1674-S1677 WeakPolarHBondContact O-CB 3.35Å; H1674-S1677 PolarHBondContact O-N 3.29Å; H1674-S1677 VanDerWaalsContact O-N 3.17Å; H1674-S1677 PolarHBondContact O-OG 3.13Å; H1674-C1678 PolarHBondContact NE2-SG 2.86Å; H1674-C1678 PolarHBondContact O-N 3.23Å; H1674-C1678 VanDerWaalsContact O-N 3.11Å; H1674-C1678 PolarHBondContact O-SG 3.03Å; H1674-C1678 VanDerWaalsContact O-SG 3.38Å; H1674-F1686 HydrophobicContact CB-CZ 4.48Å; H1674-L1886 HydrophobicContact CB-CD1 4.27Å; H1674-L1886 HydrophobicContact CB-CD2 3.64Å; H1674-L1886 WeakPolarHBondContact CD2-CD2 3.4Å; H1674-K1889 PolarHBondContact CD2-NZ 3.48Å; H1674-K1889 VanDerWaalsContact CD2-NZ 3.32Å; H1674-K1889 WeakPolarHBondContact NE2-CD 3.36Å; H1674-K1889 PolarHBondContact NE2-NZ 3.17Å
1675Q91Very high88Confident26.6 Ų26.641.1 Ų41.112%0.12422%0.219CC..Hα-helixtrans-61.4-41.5176.3-72.9169.9-49.700112I1622 D1626 Q1671 R1672 S1677 C1678 N1679I1622-Q1675 HydrophobicContact CG2-CB 4.14Å; D1626-Q1675 PolarHBondContact OD1-NE2 3.13Å; D1626-Q1675 PolarHBondContact OD2-NE2 3.37Å; Q1671-Q1675 WeakPolarHBondContact O-CG 3.42Å; Q1671-Q1675 PolarHBondContact O-N 3.08Å; R1672-Q1675 PolarHBondContact O-N 3.14Å; Q1675-S1677 VanDerWaalsContact C-N 3.33Å; Q1675-S1677 PolarHBondContact O-N 2.83Å; Q1675-C1678 WeakPolarHBondContact O-CB 3.18Å; Q1675-C1678 PolarHBondContact O-N 3.19Å; Q1675-C1678 VanDerWaalsContact O-N 3.13Å; Q1675-N1679 PolarHBondContact O-N 3.16Å; Q1675-N1679 VanDerWaalsContact O-N 3.08Å; Q1675-N1679 PolarHBondContact O-ND2 3.03Å
1676L91.4Very high88Confident0 Ų041.7 Ų41.70%022%0.222CC..Hα-helixtrans-59.2-43.3173.5-172.867.8000111.3F1618 I1622 I1640 L1648 I1652 R1672 M1673 H1674 C1678 N1679 L1680 I1685F1618-L1676 HydrophobicContact CE1-CD2 4.01Å; F1618-L1676 HydrophobicContact CE2-CD1 4.44Å; F1618-L1676 HydrophobicContact CZ-CD1 4.08Å; F1618-L1676 HydrophobicContact CZ-CD2 3.69Å; I1622-L1676 HydrophobicContact CD1-CB 4.34Å; I1622-L1676 HydrophobicContact CD1-CD1 4.36Å; I1622-L1676 HydrophobicContact CD1-CD2 4.24Å; I1622-L1676 HydrophobicContact CD1-CG 4.5Å; I1622-L1676 HydrophobicContact CG1-CD1 4.3Å; I1640-L1676 HydrophobicContact CG2-CD1 3.61Å; L1648-L1676 HydrophobicContact CD1-CD1 4.43Å; L1648-L1676 HydrophobicContact CD1-CD2 4.22Å; I1652-L1676 HydrophobicContact CD1-CD2 4.37Å; I1652-L1676 HydrophobicContact CG1-CD2 4.25Å; R1672-L1676 VanDerWaalsContact O-CB 3.3Å; R1672-L1676 WeakPolarHBondContact O-CB 3.48Å; R1672-L1676 PolarHBondContact O-N 3.23Å; M1673-L1676 PolarHBondContact O-N 3.31Å; H1674-L1676 VanDerWaalsContact C-N 3.32Å; H1674-L1676 PolarHBondContact O-N 3.09Å; L1676-C1678 VanDerWaalsContact C-N 3.29Å; L1676-C1678 PolarHBondContact O-N 3.09Å; L1676-N1679 PolarHBondContact O-N 3.16Å; L1676-L1680 HydrophobicContact CD1-CD1 3.9Å; L1676-L1680 HydrophobicContact CD1-CG 4.28Å; L1676-L1680 HydrophobicContact CG-CD1 4.39Å; L1676-L1680 PolarHBondContact O-N 3.23Å; L1676-I1685 HydrophobicContact CB-CD1 4.4Å; L1676-I1685 HydrophobicContact CB-CG2 4.32Å; L1676-I1685 HydrophobicContact CD2-CD1 4.14Å; L1676-I1685 HydrophobicContact CD2-CG1 4.34Å; L1676-I1685 HydrophobicContact CD2-CG2 3.98Å; L1676-I1685 HydrophobicContact CG-CD1 3.84Å; L1676-I1685 HydrophobicContact CG-CG1 4.29Å; L1676-I1685 HydrophobicContact CG-CG2 4.24Å; L1676-I1685 WeakPolarHBondContact O-CD1 3.14Å
1677S89.9Confident87.9Confident25.6 Ų25.643.9 Ų43.918%0.17924%0.235CC..Hα-helixtrans-64.9-29.8176.477.50000114M1673 H1674 Q1675 L1680M1673-S1677 WeakPolarHBondContact O-CB 3.39Å; M1673-S1677 PolarHBondContact O-N 3.06Å; H1674-S1677 WeakPolarHBondContact O-CB 3.35Å; H1674-S1677 PolarHBondContact O-N 3.29Å; H1674-S1677 VanDerWaalsContact O-N 3.17Å; H1674-S1677 PolarHBondContact O-OG 3.13Å; Q1675-S1677 VanDerWaalsContact C-N 3.33Å; Q1675-S1677 PolarHBondContact O-N 2.83Å; S1677-L1680 CarbonylContact O-C 3.56Å
1678C88.2Confident87.8Confident60.8 Ų60.841.9 Ų41.941%0.41122%0.221SC..Hα-helixtrans-77.1-31174.4-69.10000112.6H1674 Q1675 L1676 K1889H1674-C1678 PolarHBondContact NE2-SG 2.86Å; H1674-C1678 PolarHBondContact O-N 3.23Å; H1674-C1678 VanDerWaalsContact O-N 3.11Å; H1674-C1678 PolarHBondContact O-SG 3.03Å; H1674-C1678 VanDerWaalsContact O-SG 3.38Å; Q1675-C1678 WeakPolarHBondContact O-CB 3.18Å; Q1675-C1678 PolarHBondContact O-N 3.19Å; Q1675-C1678 VanDerWaalsContact O-N 3.13Å; L1676-C1678 VanDerWaalsContact C-N 3.29Å; L1676-C1678 PolarHBondContact O-N 3.09Å; C1678-K1889 PolarHBondContact SG-NZ 3Å
1679N87Confident87.7Confident62.6 Ų62.643.4 Ų43.434%0.33523%0.229SC..Hα-helixtrans-82.1-26.4178.2-80.4-98.8000112.9S1637 Q1675 L1676 P1681S1637-N1679 PolarHBondContact OG-OD1 3.12Å; Q1675-N1679 PolarHBondContact O-N 3.16Å; Q1675-N1679 VanDerWaalsContact O-N 3.08Å; Q1675-N1679 PolarHBondContact O-ND2 3.03Å; L1676-N1679 PolarHBondContact O-N 3.16Å; N1679-P1681 VanDerWaalsContact C-CD 3.43Å; N1679-P1681 VanDerWaalsContact O-CD 3.29Å; N1679-P1681 WeakPolarHBondContact O-CD 3.32Å
1680L87.9Confident87.7Confident13.4 Ų13.443.6 Ų43.67%0.0723%0.23CC..  trans-121.559.4-179.2-57.8-179.9000112.2I1640 A1641 L1648 L1676 S1677 N1682 R1683 I1685I1640-L1680 HydrophobicContact CG2-CD1 3.86Å; I1640-L1680 HydrophobicContact CG2-CD2 4.34Å; I1640-L1680 HydrophobicContact CG2-CG 4.19Å; A1641-L1680 HydrophobicContact CB-CD2 4.2Å; L1648-L1680 HydrophobicContact CD1-CD1 4.38Å; L1648-L1680 HydrophobicContact CD2-CD1 3.92Å; L1676-L1680 HydrophobicContact CD1-CD1 3.9Å; L1676-L1680 HydrophobicContact CD1-CG 4.28Å; L1676-L1680 HydrophobicContact CG-CD1 4.39Å; L1676-L1680 PolarHBondContact O-N 3.23Å; S1677-L1680 CarbonylContact O-C 3.56Å; L1680-N1682 PolarHBondContact O-N 3.12Å; L1680-N1682 VanDerWaalsContact O-N 3.1Å; L1680-R1683 HydrophobicContact CB-CB 4.41Å; L1680-R1683 PolarHBondContact O-N 3.15Å; L1680-R1683 VanDerWaalsContact O-N 3.1Å; L1680-I1685 HydrophobicContact CB-CD1 4.02Å; L1680-I1685 HydrophobicContact CB-CG1 4.42Å; L1680-I1685 HydrophobicContact CD1-CD1 4.15Å; L1680-I1685 HydrophobicContact CG-CD1 4.5Å
1681P78.9Confident87.7Confident99.8 Ų99.843.6 Ų43.665%0.64823%0.23SC*.THydrogen-bonded Turntrans-62.3-21.2-175.327.3-36.4000113.8N1679 R1683N1679-P1681 VanDerWaalsContact C-CD 3.43Å; N1679-P1681 VanDerWaalsContact O-CD 3.29Å; N1679-P1681 WeakPolarHBondContact O-CD 3.32Å; P1681-R1683 VanDerWaalsContact C-N 3.28Å; P1681-R1683 PolarHBondContact O-N 3.2Å
1682N75.1Confident87.6Confident157.2 Ų157.240.7 Ų40.784%0.84122%0.216SC*.THydrogen-bonded Turntrans-84.68.9178-61.3-17000113.5L1680L1680-N1682 PolarHBondContact O-N 3.12Å; L1680-N1682 VanDerWaalsContact O-N 3.1Å
1683R79.6Confident87.5Confident67.4 Ų67.441.5 Ų41.525%0.25422%0.221SC..SBendtrans-133.4137179.9-56-166.6-165.8-168.516.5111.4A1641 L1643 N1645 L1680 P1681 I1685A1641-R1683 PolarHBondContact O-NH2 3.23Å; L1643-R1683 VanDerWaalsContact O-CZ 3.28Å; L1643-R1683 PolarHBondContact O-NH1 3.05Å; L1643-R1683 PolarHBondContact O-NH2 3.04Å; N1645-R1683 PolarHBondContact OD1-NH1 2.98Å; L1680-R1683 HydrophobicContact CB-CB 4.41Å; L1680-R1683 PolarHBondContact O-N 3.15Å; L1680-R1683 VanDerWaalsContact O-N 3.1Å; P1681-R1683 VanDerWaalsContact C-N 3.28Å; P1681-R1683 PolarHBondContact O-N 3.2Å; R1683-I1685 VanDerWaalsContact C-N 3.34Å; R1683-I1685 HydrophobicContact CB-CD1 4.26Å; R1683-I1685 WeakPolarHBondContact O-CG1 3.46Å; R1683-I1685 PolarHBondContact O-N 3.01Å
1684E78.7Confident87.5Confident166 Ų16642.1 Ų42.178%0.77622%0.223SC*.  trans-75.382.9179.6-66.2175172.300111.5T1687E1684-T1687 HydrophobicContact CB-CG2 4.26Å
1685I85.8Confident87.4Confident9.4 Ų9.440.2 Ų40.25%0.04822%0.215CC..  trans-77.7-34.7177.2-62.3-143.6000111.8L1648 I1652 L1676 L1680 R1683L1648-I1685 HydrophobicContact CD1-CD1 4.49Å; L1648-I1685 HydrophobicContact CD2-CD1 3.91Å; L1648-I1685 HydrophobicContact CG-CD1 4.44Å; I1652-I1685 HydrophobicContact CD1-CB 4.38Å; I1652-I1685 HydrophobicContact CD1-CD1 4.06Å; I1652-I1685 HydrophobicContact CD1-CG1 4.1Å; I1652-I1685 HydrophobicContact CD1-CG2 4.13Å; L1676-I1685 HydrophobicContact CB-CD1 4.4Å; L1676-I1685 HydrophobicContact CB-CG2 4.32Å; L1676-I1685 HydrophobicContact CD2-CD1 4.14Å; L1676-I1685 HydrophobicContact CD2-CG1 4.34Å; L1676-I1685 HydrophobicContact CD2-CG2 3.98Å; L1676-I1685 HydrophobicContact CG-CD1 3.84Å; L1676-I1685 HydrophobicContact CG-CG1 4.29Å; L1676-I1685 HydrophobicContact CG-CG2 4.24Å; L1676-I1685 WeakPolarHBondContact O-CD1 3.14Å; L1680-I1685 HydrophobicContact CB-CD1 4.02Å; L1680-I1685 HydrophobicContact CB-CG1 4.42Å; L1680-I1685 HydrophobicContact CD1-CD1 4.15Å; L1680-I1685 HydrophobicContact CG-CD1 4.5Å; R1683-I1685 VanDerWaalsContact C-N 3.34Å; R1683-I1685 HydrophobicContact CB-CD1 4.26Å; R1683-I1685 WeakPolarHBondContact O-CG1 3.46Å; R1683-I1685 PolarHBondContact O-N 3.01Å
1686F89.5Confident87.3Confident14.2 Ų14.239 Ų396%0.06221%0.209CC..SBendtrans-103.1145.2169.9-67.6-68.4000109.5M1673 H1674 F1690 F1691 L1886 F1890M1673-F1686 HydrophobicContact CB-CE1 3.91Å; M1673-F1686 HydrophobicContact CB-CZ 3.75Å; M1673-F1686 HydrophobicContact CE-CD1 4.19Å; M1673-F1686 HydrophobicContact CE-CE1 3.97Å; H1674-F1686 HydrophobicContact CB-CZ 4.48Å; F1686-F1690 AromaticContact CD1-CD1 3.81Å; F1686-F1690 HydrophobicContact CD1-CD1 3.81Å; F1686-F1690 AromaticContact CD1-CE1 3.77Å; F1686-F1690 HydrophobicContact CD1-CE1 3.77Å; F1686-F1690 HydrophobicContact CD1-CG 4.47Å; F1686-F1690 HydrophobicContact CD1-CZ 4.42Å; F1686-F1690 HydrophobicContact CE1-CD1 4.33Å; F1686-F1690 AromaticContact CE1-CE1 3.81Å; F1686-F1690 HydrophobicContact CE1-CE1 3.81Å; F1686-F1690 HydrophobicContact CE1-CZ 4.19Å; F1686-F1691 HydrophobicContact CB-CE2 3.94Å; F1686-F1691 HydrophobicContact CB-CZ 4.24Å; F1686-F1691 HydrophobicContact CD1-CE2 4.31Å; F1686-F1691 AromaticContact CD1-CZ 3.93Å; F1686-F1691 HydrophobicContact CD1-CZ 3.93Å; F1686-F1691 HydrophobicContact CE1-CZ 4.47Å; F1686-F1691 HydrophobicContact CG-CE2 4.33Å; F1686-F1691 HydrophobicContact CG-CZ 4.13Å; F1686-L1886 HydrophobicContact CE1-CD1 4.45Å; F1686-L1886 HydrophobicContact CE2-CD2 4.48Å; F1686-L1886 HydrophobicContact CZ-CD1 4.09Å; F1686-L1886 HydrophobicContact CZ-CD2 4.34Å; F1686-F1890 HydrophobicContact CB-CD2 3.69Å; F1686-F1890 HydrophobicContact CB-CE2 3.91Å; F1686-F1890 HydrophobicContact CB-CG 4.28Å; F1686-F1890 WeakPolarHBondContact O-CE2 3.43Å
1687T87.9Confident87.2Confident45.6 Ų45.639 Ų3928%0.2821%0.209SC..  trans-136162.5175.962.30000109.7R1568 E1684 D1689 F1690 F1691R1568-T1687 PolarHBondContact NH2-OG1 2.86Å; E1684-T1687 HydrophobicContact CB-CG2 4.26Å; T1687-D1689 VanDerWaalsContact C-N 3.29Å; T1687-D1689 PolarHBondContact O-N 3.12Å; T1687-F1690 WeakPolarHBondContact O-CB 3.36Å; T1687-F1690 PolarHBondContact O-N 3.14Å; T1687-F1690 VanDerWaalsContact O-N 3.13Å; T1687-F1690 PolarHBondContact OG1-N 3.13Å; T1687-F1690 VanDerWaalsContact OG1-N 3.1Å; T1687-F1691 VanDerWaalsContact O-CD2 3.3Å; T1687-F1691 WeakPolarHBondContact O-CD2 3.34Å; T1687-F1691 PolarHBondContact O-N 2.92Å
1688W89.2Confident87.2Confident6.6 Ų6.637.8 Ų37.83%0.02520%0.201CC..Hα-helixtrans-60.9-38.2175.1-63.4105.1000112.7F1690 F1691 V1692 L1887 F1890 M1891 V1894 A1951 L1952 A1955 M2000W1688-F1690 VanDerWaalsContact C-N 3.3Å; W1688-F1690 PolarHBondContact O-N 3.22Å; W1688-F1691 PolarHBondContact O-N 3.03Å; W1688-V1692 WeakPolarHBondContact O-CB 3.3Å; W1688-V1692 VanDerWaalsContact O-CG2 3.29Å; W1688-V1692 WeakPolarHBondContact O-CG2 3.38Å; W1688-V1692 PolarHBondContact O-N 3.29Å; W1688-V1692 VanDerWaalsContact O-N 3.11Å; W1688-L1887 HydrophobicContact CZ3-CD1 4.18Å; W1688-F1890 AromaticContact CD2-CE1 3.75Å; W1688-F1890 HydrophobicContact CD2-CE1 3.75Å; W1688-F1890 AromaticContact CE2-CE1 3.73Å; W1688-F1890 AromaticContact CE3-CE1 4Å; W1688-F1890 HydrophobicContact CE3-CE1 4.04Å; W1688-F1890 HydrophobicContact CG-CE1 4.19Å; W1688-F1890 HydrophobicContact CH2-CD1 4.43Å; W1688-F1890 HydrophobicContact CH2-CE1 4.27Å; W1688-F1890 AromaticContact CZ2-CE1 3.93Å; W1688-F1890 HydrophobicContact CZ2-CE1 4.01Å; W1688-F1890 HydrophobicContact CZ3-CD1 4.45Å; W1688-F1890 HydrophobicContact CZ3-CE1 4.29Å; W1688-M1891 HydrophobicContact CH2-CG 3.91Å; W1688-M1891 HydrophobicContact CZ3-CG 4.33Å; W1688-V1894 HydrophobicContact CH2-CG1 4.49Å; W1688-V1894 HydrophobicContact CZ2-CB 4.45Å; W1688-V1894 HydrophobicContact CZ2-CG1 3.98Å; W1688-V1894 HydrophobicContact CZ2-CG2 4.49Å; W1688-A1951 HydrophobicContact CB-CB 3.4Å; W1688-A1951 VanDerWaalsContact CB-CB 3.41Å; W1688-A1951 HydrophobicContact CG-CB 4.25Å; W1688-L1952 HydrophobicContact CD2-CB 4.36Å; W1688-L1952 HydrophobicContact CE3-CB 4.3Å; W1688-L1952 HydrophobicContact CH2-CB 4.34Å; W1688-L1952 HydrophobicContact CH2-CD1 3.55Å; W1688-L1952 VanDerWaalsContact CH2-CD1 3.46Å; W1688-L1952 HydrophobicContact CH2-CG 4.46Å; W1688-L1952 HydrophobicContact CZ2-CB 4.42Å; W1688-L1952 HydrophobicContact CZ2-CD1 4.24Å; W1688-L1952 HydrophobicContact CZ3-CB 4.28Å; W1688-L1952 HydrophobicContact CZ3-CD1 3.72Å; W1688-A1955 HydrophobicContact CE3-CB 4.19Å; W1688-A1955 HydrophobicContact CZ3-CB 4.28Å; W1688-M2000 HydrophobicContact CH2-CE 3.89Å; W1688-M2000 HydrophobicContact CH2-SD 4.21Å; W1688-M2000 HydrophobicContact CZ2-CE 3.96Å
1689D88.1Confident87.1Confident45 Ų4535 Ų3524%0.24118%0.182CC..Hα-helixtrans-58.7-38.2175.3-72.8-28.6000112.1R1568 T1687 V1692 N1693 K1947R1568-D1689 VanDerWaalsContact CD-OD2 3.29Å; R1568-D1689 WeakPolarHBondContact CD-OD2 3.45Å; R1568-D1689 IonicContact CZ-OD2 3.18Å; R1568-D1689 IonicContact NE-OD2 2.74Å; R1568-D1689 IonicContact NH1-OD1 3.98Å; R1568-D1689 IonicContact NH1-OD2 2.7Å; R1568-D1689 PolarHBondContact NH1-OD2 3.11Å; R1568-D1689 IonicContact NH2-OD2 2.7Å; R1568-D1689 PolarHBondContact NH2-OD2 3.27Å; T1687-D1689 VanDerWaalsContact C-N 3.29Å; T1687-D1689 PolarHBondContact O-N 3.12Å; D1689-V1692 PolarHBondContact O-N 3.02Å; D1689-N1693 VanDerWaalsContact O-CB 3.25Å; D1689-N1693 WeakPolarHBondContact O-CB 3.36Å; D1689-N1693 VanDerWaalsContact O-CG 3.22Å; D1689-N1693 PolarHBondContact O-N 3.19Å; D1689-N1693 PolarHBondContact O-ND2 3.23Å; D1689-N1693 VanDerWaalsContact O-ND2 3.12Å; D1689-K1947 WeakPolarHBondContact OD1-CE 3.48Å; D1689-K1947 IonicContact OD1-NZ 3.31Å; D1689-K1947 PolarHBondContact OD1-NZ 2.86Å; D1689-K1947 WeakPolarHBondContact OD2-CE 3.25Å; D1689-K1947 IonicContact OD2-NZ 3.48Å; D1689-K1947 PolarHBondContact OD2-NZ 3.19Å
1690F91.6Very high87Confident3.6 Ų3.632 Ų322%0.01617%0.166CC..Hα-helixtrans-57.8-56.1176.6169.2-93.6000110.7E1656 L1670 M1673 F1686 T1687 W1688 V1692 N1693 R1694E1656-F1690 HydrophobicContact CG-CD2 3.92Å; E1656-F1690 HydrophobicContact CG-CE2 4.02Å; L1670-F1690 HydrophobicContact CD2-CE1 4.27Å; L1670-F1690 HydrophobicContact CD2-CZ 3.83Å; M1673-F1690 HydrophobicContact CE-CD2 3.94Å; M1673-F1690 HydrophobicContact CE-CE2 3.55Å; M1673-F1690 HydrophobicContact CE-CZ 3.95Å; M1673-F1690 HydrophobicContact SD-CD2 4.48Å; M1673-F1690 HydrophobicContact SD-CE2 3.7Å; M1673-F1690 HydrophobicContact SD-CZ 3.92Å; F1686-F1690 AromaticContact CD1-CD1 3.81Å; F1686-F1690 HydrophobicContact CD1-CD1 3.81Å; F1686-F1690 AromaticContact CD1-CE1 3.77Å; F1686-F1690 HydrophobicContact CD1-CE1 3.77Å; F1686-F1690 HydrophobicContact CD1-CG 4.47Å; F1686-F1690 HydrophobicContact CD1-CZ 4.42Å; F1686-F1690 HydrophobicContact CE1-CD1 4.33Å; F1686-F1690 AromaticContact CE1-CE1 3.81Å; F1686-F1690 HydrophobicContact CE1-CE1 3.81Å; F1686-F1690 HydrophobicContact CE1-CZ 4.19Å; T1687-F1690 WeakPolarHBondContact O-CB 3.36Å; T1687-F1690 PolarHBondContact O-N 3.14Å; T1687-F1690 VanDerWaalsContact O-N 3.13Å; T1687-F1690 PolarHBondContact OG1-N 3.13Å; T1687-F1690 VanDerWaalsContact OG1-N 3.1Å; W1688-F1690 VanDerWaalsContact C-N 3.3Å; W1688-F1690 PolarHBondContact O-N 3.22Å; F1690-V1692 VanDerWaalsContact C-N 3.34Å; F1690-V1692 PolarHBondContact O-N 3.17Å; F1690-N1693 PolarHBondContact O-N 3.06Å; F1690-R1694 HydrophobicContact CD2-CG 3.91Å; F1690-R1694 HydrophobicContact CE1-CG 4.35Å; F1690-R1694 HydrophobicContact CE2-CG 3.65Å; F1690-R1694 HydrophobicContact CG-CG 4.36Å; F1690-R1694 HydrophobicContact CZ-CG 3.89Å; F1690-R1694 WeakPolarHBondContact O-CB 3.4Å; F1690-R1694 VanDerWaalsContact O-CG 3.3Å; F1690-R1694 WeakPolarHBondContact O-CG 3.41Å; F1690-R1694 PolarHBondContact O-N 3.12Å
1691F93Very high86.9Confident0 Ų031.6 Ų31.60%016%0.164CC..Hα-helixtrans-61.1-44.9-178-67.5-74.1000111.8F1686 T1687 W1688 N1693 F1695 W1883 L1886 L1887 F1890F1686-F1691 HydrophobicContact CB-CE2 3.94Å; F1686-F1691 HydrophobicContact CB-CZ 4.24Å; F1686-F1691 HydrophobicContact CD1-CE2 4.31Å; F1686-F1691 AromaticContact CD1-CZ 3.93Å; F1686-F1691 HydrophobicContact CD1-CZ 3.93Å; F1686-F1691 HydrophobicContact CE1-CZ 4.47Å; F1686-F1691 HydrophobicContact CG-CE2 4.33Å; F1686-F1691 HydrophobicContact CG-CZ 4.13Å; T1687-F1691 VanDerWaalsContact O-CD2 3.3Å; T1687-F1691 WeakPolarHBondContact O-CD2 3.34Å; T1687-F1691 PolarHBondContact O-N 2.92Å; W1688-F1691 PolarHBondContact O-N 3.03Å; F1691-N1693 PolarHBondContact O-N 2.93Å; F1691-F1695 VanDerWaalsContact O-CB 3.32Å; F1691-F1695 WeakPolarHBondContact O-CB 3.4Å; F1691-F1695 PolarHBondContact O-N 2.94Å; F1691-F1695 VanDerWaalsContact O-N 3.09Å; F1691-W1883 HydrophobicContact CB-CZ2 3.91Å; F1691-W1883 HydrophobicContact CD1-CD2 4.47Å; F1691-W1883 AromaticContact CD1-CE2 3.93Å; F1691-W1883 HydrophobicContact CD1-CZ2 4.34Å; F1691-W1883 AromaticContact CD1-NE1 3.75Å; F1691-W1883 WeakPolarHBondContact O-CZ2 3.39Å; F1691-W1883 PolarHBondContact O-NE1 3.05Å; F1691-L1886 HydrophobicContact CE1-CB 4.06Å; F1691-L1886 HydrophobicContact CZ-CB 4.32Å; F1691-L1887 HydrophobicContact CB-CD1 4.25Å; F1691-L1887 HydrophobicContact CD1-CB 3.93Å; F1691-L1887 HydrophobicContact CD1-CD1 4.18Å; F1691-L1887 HydrophobicContact CD2-CD1 4.02Å; F1691-L1887 HydrophobicContact CE1-CB 3.92Å; F1691-L1887 HydrophobicContact CE2-CD1 4.44Å; F1691-L1887 HydrophobicContact CG-CB 4.44Å; F1691-L1887 HydrophobicContact CG-CD1 3.88Å; F1691-L1887 HydrophobicContact CZ-CB 4.47Å; F1691-F1890 AromaticContact CD2-CD1 3.96Å; F1691-F1890 HydrophobicContact CD2-CD1 4.01Å; F1691-F1890 HydrophobicContact CD2-CE1 4.19Å; F1691-F1890 HydrophobicContact CE2-CB 3.86Å; F1691-F1890 AromaticContact CE2-CD1 3.48Å; F1691-F1890 HydrophobicContact CE2-CD1 3.48Å; F1691-F1890 VanDerWaalsContact CE2-CD1 3.44Å; F1691-F1890 HydrophobicContact CE2-CD2 4.35Å; F1691-F1890 AromaticContact CE2-CE1 3.96Å; F1691-F1890 HydrophobicContact CE2-CE1 4.06Å; F1691-F1890 AromaticContact CE2-CG 3.69Å; F1691-F1890 HydrophobicContact CE2-CG 3.69Å; F1691-F1890 HydrophobicContact CZ-CB 3.98Å; F1691-F1890 HydrophobicContact CZ-CD1 4.37Å; F1691-F1890 HydrophobicContact CZ-CG 4.31Å
1692V91Very high87.1Confident4.4 Ų4.427.2 Ų27.23%0.02714%0.135CC..Hα-helixtrans-62.6-44179.8170.30000112W1688 D1689 F1690 G1696 N1720 A1951 K1954 A1955W1688-V1692 WeakPolarHBondContact O-CB 3.3Å; W1688-V1692 VanDerWaalsContact O-CG2 3.29Å; W1688-V1692 WeakPolarHBondContact O-CG2 3.38Å; W1688-V1692 PolarHBondContact O-N 3.29Å; W1688-V1692 VanDerWaalsContact O-N 3.11Å; D1689-V1692 PolarHBondContact O-N 3.02Å; F1690-V1692 VanDerWaalsContact C-N 3.34Å; F1690-V1692 PolarHBondContact O-N 3.17Å; V1692-G1696 PolarHBondContact O-N 2.96Å; V1692-N1720 WeakPolarHBondContact CG1-OD1 3.44Å; V1692-N1720 PolarHBondContact O-ND2 2.97Å; V1692-N1720 VanDerWaalsContact O-ND2 3.12Å; V1692-N1720 PolarHBondContact O-OD1 2.91Å; V1692-A1951 HydrophobicContact CG2-CB 4.44Å; V1692-A1951 WeakPolarHBondContact CG2-O 3.48Å; V1692-K1954 HydrophobicContact CG1-CB 4.28Å; V1692-K1954 HydrophobicContact CG1-CD 3.85Å; V1692-K1954 HydrophobicContact CG2-CB 3.95Å; V1692-A1955 HydrophobicContact CG2-CB 4.27Å
1693N90.1Very high87.5Confident23.6 Ų23.620.4 Ų20.413%0.12610%0.099CC..Hα-helixtrans-76.7-41.1-178.7-66.3-29.7000112.7R1568 D1689 F1690 F1691 F1695 G1696 I1697 H1728 Q1732R1568-N1693 PolarHBondContact NH1-ND2 2.73Å; D1689-N1693 VanDerWaalsContact O-CB 3.25Å; D1689-N1693 WeakPolarHBondContact O-CB 3.36Å; D1689-N1693 VanDerWaalsContact O-CG 3.22Å; D1689-N1693 PolarHBondContact O-N 3.19Å; D1689-N1693 PolarHBondContact O-ND2 3.23Å; D1689-N1693 VanDerWaalsContact O-ND2 3.12Å; F1690-N1693 PolarHBondContact O-N 3.06Å; F1691-N1693 PolarHBondContact O-N 2.93Å; N1693-F1695 VanDerWaalsContact C-N 3.32Å; N1693-F1695 PolarHBondContact O-N 3.07Å; N1693-G1696 WeakPolarHBondContact O-CA 3.38Å; N1693-G1696 PolarHBondContact O-N 3.11Å; N1693-G1696 VanDerWaalsContact O-N 3.14Å; N1693-I1697 PolarHBondContact O-N 3.09Å; N1693-I1697 VanDerWaalsContact O-N 3.09Å; N1693-H1728 PolarHBondContact ND2-NE2 3.24Å; N1693-H1728 PolarHBondContact OD1-CE1 3.09Å; N1693-H1728 VanDerWaalsContact OD1-CE1 3.27Å; N1693-Q1732 PolarHBondContact O-OE1 3.07Å; N1693-Q1732 PolarHBondContact OD1-NE2 2.88Å; N1693-Q1732 VanDerWaalsContact OD1-NE2 3.17Å
1694R91.5Very high87.6Confident11.8 Ų11.817.8 Ų17.85%0.0459%0.09CC..Hα-helixtrans-63.7-39.3175.7-62-48.7121.3-115.3-4111.3E1656 F1659 D1660 F1690 I1697 L1698E1656-R1694 IonicContact OE2-CZ 2.89Å; E1656-R1694 IonicContact OE2-NE 2.98Å; E1656-R1694 PolarHBondContact OE2-NE 3.19Å; E1656-R1694 VanDerWaalsContact OE2-NE 3.07Å; E1656-R1694 IonicContact OE2-NH2 3.64Å; E1656-R1694 PolarHBondContact OE2-NH2 3.17Å; F1659-R1694 HydrophobicContact CD1-CB 4.4Å; F1659-R1694 VanDerWaalsContact CD1-CD 3.46Å; F1659-R1694 HydrophobicContact CD1-CG 4.08Å; F1659-R1694 HydrophobicContact CE1-CB 3.79Å; F1659-R1694 HydrophobicContact CE1-CG 3.96Å; F1659-R1694 HydrophobicContact CZ-CB 4.3Å; F1659-R1694 HydrophobicContact CZ-CG 4.48Å; D1660-R1694 VanDerWaalsContact CG-NH1 3.34Å; D1660-R1694 VanDerWaalsContact OD1-CD 3.28Å; D1660-R1694 WeakPolarHBondContact OD1-CD 3.28Å; D1660-R1694 IonicContact OD1-CZ 3.4Å; D1660-R1694 VanDerWaalsContact OD1-CZ 3.24Å; D1660-R1694 IonicContact OD1-NE 3.21Å; D1660-R1694 PolarHBondContact OD1-NE 3.08Å; D1660-R1694 IonicContact OD1-NH1 3.46Å; D1660-R1694 PolarHBondContact OD1-NH1 3.3Å; D1660-R1694 IonicContact OD1-NH2 2.75Å; D1660-R1694 IonicContact OD2-CZ 3.11Å; D1660-R1694 IonicContact OD2-NH1 3.42Å; D1660-R1694 PolarHBondContact OD2-NH1 3.17Å; D1660-R1694 IonicContact OD2-NH2 3.29Å; F1690-R1694 HydrophobicContact CD2-CG 3.91Å; F1690-R1694 HydrophobicContact CE1-CG 4.35Å; F1690-R1694 HydrophobicContact CE2-CG 3.65Å; F1690-R1694 HydrophobicContact CG-CG 4.36Å; F1690-R1694 HydrophobicContact CZ-CG 3.89Å; F1690-R1694 WeakPolarHBondContact O-CB 3.4Å; F1690-R1694 VanDerWaalsContact O-CG 3.3Å; F1690-R1694 WeakPolarHBondContact O-CG 3.41Å; F1690-R1694 PolarHBondContact O-N 3.12Å; R1694-I1697 PolarHBondContact O-N 3.3Å; R1694-L1698 WeakPolarHBondContact O-CG 3.34Å; R1694-L1698 PolarHBondContact O-N 3.2Å; R1694-L1698 VanDerWaalsContact O-N 3.14Å
1695F90.4Very high87.3Confident0 Ų012.3 Ų12.30%08%0.078CC..Hα-helixtrans-66-39.4172.8-178.6-98.2000112.6F1691 N1693 I1697 L1698 A1699 L1719 W1883 H1958 F1961 L1962F1691-F1695 VanDerWaalsContact O-CB 3.32Å; F1691-F1695 WeakPolarHBondContact O-CB 3.4Å; F1691-F1695 PolarHBondContact O-N 2.94Å; F1691-F1695 VanDerWaalsContact O-N 3.09Å; N1693-F1695 VanDerWaalsContact C-N 3.32Å; N1693-F1695 PolarHBondContact O-N 3.07Å; F1695-I1697 VanDerWaalsContact C-N 3.31Å; F1695-I1697 PolarHBondContact O-N 3.37Å; F1695-L1698 PolarHBondContact O-N 3.13Å; F1695-L1698 VanDerWaalsContact O-N 3.15Å; F1695-A1699 HydrophobicContact CE1-CB 4.25Å; F1695-A1699 HydrophobicContact CZ-CB 4.19Å; F1695-A1699 WeakPolarHBondContact O-CB 3.3Å; F1695-A1699 PolarHBondContact O-N 3.23Å; F1695-L1719 HydrophobicContact CE1-CB 4.48Å; F1695-L1719 HydrophobicContact CE1-CD1 3.76Å; F1695-L1719 HydrophobicContact CZ-CD1 4.31Å; F1695-W1883 HydrophobicContact CB-CH2 4.44Å; F1695-W1883 HydrophobicContact CB-CZ2 3.76Å; F1695-W1883 HydrophobicContact CD2-CH2 4.48Å; F1695-W1883 HydrophobicContact CD2-CZ2 4.47Å; F1695-W1883 HydrophobicContact CG-CZ2 4.36Å; F1695-H1958 HydrophobicContact CD1-CB 3.65Å; F1695-H1958 AromaticContact CD1-CD2 3.64Å; F1695-H1958 WeakPolarHBondContact CD1-CD2 3.48Å; F1695-H1958 AromaticContact CD1-CE1 3.68Å; F1695-H1958 AromaticContact CD1-CG 3.31Å; F1695-H1958 AromaticContact CD1-ND1 3.4Å; F1695-H1958 VanDerWaalsContact CD1-ND1 3.29Å; F1695-H1958 WeakPolarHBondContact CD1-ND1 3.34Å; F1695-H1958 AromaticContact CD1-NE2 3.9Å; F1695-H1958 HydrophobicContact CD2-CB 4.42Å; F1695-H1958 HydrophobicContact CE1-CB 3.7Å; F1695-H1958 AromaticContact CE1-CD2 3.75Å; F1695-H1958 AromaticContact CE1-CG 3.57Å; F1695-H1958 AromaticContact CE1-ND1 3.84Å; F1695-H1958 HydrophobicContact CG-CB 4.12Å; F1695-H1958 AromaticContact CG-CG 3.99Å; F1695-H1958 AromaticContact CG-ND1 3.86Å; F1695-H1958 HydrophobicContact CZ-CB 4.27Å; F1695-F1961 HydrophobicContact CE1-CD1 4.24Å; F1695-F1961 HydrophobicContact CE1-CE1 4.37Å; F1695-F1961 HydrophobicContact CE2-CD1 4.26Å; F1695-F1961 HydrophobicContact CE2-CE1 4.22Å; F1695-F1961 AromaticContact CZ-CD1 3.74Å; F1695-F1961 HydrophobicContact CZ-CD1 3.74Å; F1695-F1961 AromaticContact CZ-CE1 3.78Å; F1695-F1961 HydrophobicContact CZ-CE1 3.78Å; F1695-L1962 HydrophobicContact CD2-CD1 4.07Å; F1695-L1962 HydrophobicContact CD2-CG 4.48Å; F1695-L1962 HydrophobicContact CE2-CD1 3.62Å; F1695-L1962 HydrophobicContact CE2-CD2 3.87Å; F1695-L1962 HydrophobicContact CE2-CG 3.67Å; F1695-L1962 HydrophobicContact CZ-CD1 4.36Å; F1695-L1962 HydrophobicContact CZ-CD2 4.27Å; F1695-L1962 HydrophobicContact CZ-CG 4.11Å
1696G89Confident86.4Confident1 Ų115.5 Ų15.51%0.0110%0.095CC..Hα-helixtrans-54.4-46.2173.900000112.6V1692 N1693 A1699 I1700 N1720V1692-G1696 PolarHBondContact O-N 2.96Å; N1693-G1696 WeakPolarHBondContact O-CA 3.38Å; N1693-G1696 PolarHBondContact O-N 3.11Å; N1693-G1696 VanDerWaalsContact O-N 3.14Å; G1696-A1699 PolarHBondContact O-N 3.27Å; G1696-I1700 WeakPolarHBondContact O-CD1 3.06Å; G1696-I1700 VanDerWaalsContact O-CG1 3.25Å; G1696-I1700 WeakPolarHBondContact O-CG1 3.32Å; G1696-I1700 PolarHBondContact O-N 3.23Å; G1696-N1720 WeakPolarHBondContact CA-ND2 3.4Å
1697I89.1Confident85.2Confident0.2 Ų0.217.7 Ų17.70%0.00111%0.112CC..Hα-helixtrans-64.1-44.9175.8-72.1-178.9000111.9D1660 N1693 R1694 F1695 A1699 I1700 Q1701 Q1732 R1735 A1736D1660-I1697 HydrophobicContact CB-CD1 3.96Å; D1660-I1697 VanDerWaalsContact CG-CD1 3.43Å; D1660-I1697 VanDerWaalsContact OD1-CD1 3.25Å; D1660-I1697 WeakPolarHBondContact OD1-CD1 3.27Å; D1660-I1697 WeakPolarHBondContact OD2-CD1 3.39Å; N1693-I1697 PolarHBondContact O-N 3.09Å; N1693-I1697 VanDerWaalsContact O-N 3.09Å; R1694-I1697 PolarHBondContact O-N 3.3Å; F1695-I1697 VanDerWaalsContact C-N 3.31Å; F1695-I1697 PolarHBondContact O-N 3.37Å; I1697-A1699 VanDerWaalsContact C-N 3.31Å; I1697-A1699 PolarHBondContact O-N 3.28Å; I1697-I1700 PolarHBondContact O-N 3.08Å; I1697-Q1701 HydrophobicContact CG2-CG 4.39Å; I1697-Q1701 WeakPolarHBondContact O-CB 3.41Å; I1697-Q1701 VanDerWaalsContact O-CG 3.28Å; I1697-Q1701 WeakPolarHBondContact O-CG 3.35Å; I1697-Q1701 PolarHBondContact O-N 3.15Å; I1697-Q1701 PolarHBondContact O-OE1 3.02Å; I1697-Q1732 HydrophobicContact CD1-CB 4.28Å; I1697-Q1732 HydrophobicContact CD1-CG 4.01Å; I1697-Q1732 HydrophobicContact CG1-CB 3.86Å; I1697-Q1732 HydrophobicContact CG1-CG 3.83Å; I1697-R1735 HydrophobicContact CD1-CB 4.39Å; I1697-A1736 HydrophobicContact CG2-CB 4.34Å
1698L88.4Confident83.6Confident0.8 Ų0.821.9 Ų21.90%0.00414%0.14CC..Hα-helixtrans-58.9-42.3175.6-67.2172.1000111.9R1666 R1694 F1695 I1700 Q1701 A1702 L1870 T1879 L1880R1666-L1698 VanDerWaalsContact NH1-CD2 3.29Å; R1694-L1698 WeakPolarHBondContact O-CG 3.34Å; R1694-L1698 PolarHBondContact O-N 3.2Å; R1694-L1698 VanDerWaalsContact O-N 3.14Å; F1695-L1698 PolarHBondContact O-N 3.13Å; F1695-L1698 VanDerWaalsContact O-N 3.15Å; L1698-I1700 PolarHBondContact O-N 3.12Å; L1698-Q1701 PolarHBondContact O-N 3.09Å; L1698-Q1701 VanDerWaalsContact O-N 3.15Å; L1698-A1702 WeakPolarHBondContact O-CB 3.49Å; L1698-A1702 PolarHBondContact O-N 3.03Å; L1698-L1870 HydrophobicContact CB-CD2 4.24Å; L1698-T1879 HydrophobicContact CD1-CG2 4.35Å; L1698-T1879 HydrophobicContact CD2-CG2 4.45Å; L1698-L1880 HydrophobicContact CD1-CD2 4.08Å
1699A86.5Confident82.2Confident1.6 Ų1.624.4 Ų24.41%0.01317%0.168CC..Hα-helixtrans-69.5-33.6177.700000113.4F1695 G1696 I1697 Q1701 Q1703 L1719 I1866F1695-A1699 HydrophobicContact CE1-CB 4.25Å; F1695-A1699 HydrophobicContact CZ-CB 4.19Å; F1695-A1699 WeakPolarHBondContact O-CB 3.3Å; F1695-A1699 PolarHBondContact O-N 3.23Å; G1696-A1699 PolarHBondContact O-N 3.27Å; I1697-A1699 VanDerWaalsContact C-N 3.31Å; I1697-A1699 PolarHBondContact O-N 3.28Å; A1699-Q1701 VanDerWaalsContact C-N 3.33Å; A1699-Q1703 WeakPolarHBondContact O-CG 3.28Å; A1699-Q1703 PolarHBondContact O-N 3.12Å; A1699-Q1703 PolarHBondContact O-NE2 3.3Å; A1699-L1719 HydrophobicContact CB-CD1 3.61Å; A1699-L1719 HydrophobicContact CB-CG 4.33Å; A1699-I1866 HydrophobicContact CB-CG2 4.43Å
1700I85.8Confident80.5Confident1 Ų130 Ų301%0.00519%0.193CC..Hα-helixtrans-66.3-40.6170.1-69.2164000109.9G1696 I1697 L1698 Q1703 L1704 V1716 F1729 Q1732 F1733 A1736G1696-I1700 WeakPolarHBondContact O-CD1 3.06Å; G1696-I1700 VanDerWaalsContact O-CG1 3.25Å; G1696-I1700 WeakPolarHBondContact O-CG1 3.32Å; G1696-I1700 PolarHBondContact O-N 3.23Å; I1697-I1700 PolarHBondContact O-N 3.08Å; L1698-I1700 PolarHBondContact O-N 3.12Å; I1700-Q1703 WeakPolarHBondContact O-CB 3.34Å; I1700-Q1703 PolarHBondContact O-N 3.06Å; I1700-L1704 HydrophobicContact CG2-CD1 3.88Å; I1700-L1704 HydrophobicContact CG2-CG 4.38Å; I1700-L1704 VanDerWaalsContact O-CG 3.32Å; I1700-L1704 WeakPolarHBondContact O-CG 3.45Å; I1700-L1704 PolarHBondContact O-N 3.18Å; I1700-V1716 HydrophobicContact CB-CG1 4.33Å; I1700-V1716 HydrophobicContact CG1-CG1 3.91Å; I1700-V1716 HydrophobicContact CG2-CG1 4Å; I1700-F1729 HydrophobicContact CD1-CD2 4.32Å; I1700-F1729 HydrophobicContact CD1-CE2 3.84Å; I1700-F1729 HydrophobicContact CG1-CE2 4.38Å; I1700-Q1732 HydrophobicContact CD1-CB 4.08Å; I1700-F1733 HydrophobicContact CG2-CD2 4.41Å; I1700-A1736 HydrophobicContact CB-CB 4.21Å; I1700-A1736 HydrophobicContact CG2-CB 3.55Å
1701Q85.1Confident79.1Confident5.4 Ų5.432.1 Ų32.13%0.02521%0.205CC..Hα-helixtrans-67.6-40.9-179.7-74.8178-47.300113R1666 I1697 L1698 A1699 Q1703 L1704 G1705 A1736 A1739 I1740R1666-Q1701 VanDerWaalsContact CZ-OE1 3.22Å; R1666-Q1701 VanDerWaalsContact NH2-CD 3.29Å; R1666-Q1701 VanDerWaalsContact NH2-NE2 3.15Å; I1697-Q1701 HydrophobicContact CG2-CG 4.39Å; I1697-Q1701 WeakPolarHBondContact O-CB 3.41Å; I1697-Q1701 VanDerWaalsContact O-CG 3.28Å; I1697-Q1701 WeakPolarHBondContact O-CG 3.35Å; I1697-Q1701 PolarHBondContact O-N 3.15Å; I1697-Q1701 PolarHBondContact O-OE1 3.02Å; L1698-Q1701 PolarHBondContact O-N 3.09Å; L1698-Q1701 VanDerWaalsContact O-N 3.15Å; A1699-Q1701 VanDerWaalsContact C-N 3.33Å; Q1701-Q1703 VanDerWaalsContact C-N 3.3Å; Q1701-Q1703 PolarHBondContact O-N 3.18Å; Q1701-L1704 PolarHBondContact O-N 3.22Å; Q1701-L1704 VanDerWaalsContact O-N 3.13Å; Q1701-G1705 PolarHBondContact O-N 3.11Å; Q1701-A1736 HydrophobicContact CG-CB 3.59Å; Q1701-A1736 PolarHBondContact NE2-O 3.13Å; Q1701-A1736 VanDerWaalsContact NE2-O 3.11Å; Q1701-A1739 VanDerWaalsContact NE2-CB 3.3Å; Q1701-I1740 VanDerWaalsContact CA-CD1 3.5Å; Q1701-I1740 HydrophobicContact CB-CD1 3.77Å; Q1701-I1740 HydrophobicContact CB-CG1 4.37Å; Q1701-I1740 HydrophobicContact CG-CD1 3.8Å; Q1701-I1740 HydrophobicContact CG-CG1 4.22Å; Q1701-I1740 VanDerWaalsContact O-CD1 3.24Å; Q1701-I1740 WeakPolarHBondContact O-CD1 3.35Å
1702A83.1Confident77.7Confident5.6 Ų5.636.5 Ų36.55%0.04623%0.229CC..Hα-helixtrans-58.9-36.6171.700000112.7L1698 G1705 N1706 I1866 A1869 L1870L1698-A1702 WeakPolarHBondContact O-CB 3.49Å; L1698-A1702 PolarHBondContact O-N 3.03Å; A1702-G1705 PolarHBondContact O-N 2.89Å; A1702-N1706 WeakPolarHBondContact O-CB 3.37Å; A1702-N1706 VanDerWaalsContact O-CG 3.27Å; A1702-N1706 PolarHBondContact O-N 3.37Å; A1702-N1706 VanDerWaalsContact O-N 3.16Å; A1702-N1706 PolarHBondContact O-ND2 3.16Å; A1702-I1866 HydrophobicContact CB-CB 4.38Å; A1702-I1866 HydrophobicContact CB-CG1 4.42Å; A1702-I1866 HydrophobicContact CB-CG2 3.9Å; A1702-A1869 HydrophobicContact CB-CB 4.08Å; A1702-L1870 HydrophobicContact CB-CD2 4.12Å; A1702-L1870 HydrophobicContact CB-CG 4Å
1703Q83.8Confident76.8Confident16 Ų1638.6 Ų38.68%0.07524%0.24CC..Hα-helixtrans-68.8-43.9174.8-70.1169.97900112.1A1699 I1700 Q1701 N1706 S1707 T1717 F1862 I1866A1699-Q1703 WeakPolarHBondContact O-CG 3.28Å; A1699-Q1703 PolarHBondContact O-N 3.12Å; A1699-Q1703 PolarHBondContact O-NE2 3.3Å; I1700-Q1703 WeakPolarHBondContact O-CB 3.34Å; I1700-Q1703 PolarHBondContact O-N 3.06Å; Q1701-Q1703 VanDerWaalsContact C-N 3.3Å; Q1701-Q1703 PolarHBondContact O-N 3.18Å; Q1703-N1706 PolarHBondContact O-N 3.43Å; Q1703-S1707 PolarHBondContact O-OG 2.91Å; Q1703-T1717 PolarHBondContact NE2-O 3.14Å; Q1703-T1717 PolarHBondContact OE1-O 3.27Å; Q1703-F1862 HydrophobicContact CG-CE2 4.01Å; Q1703-F1862 HydrophobicContact CG-CZ 4.17Å; Q1703-I1866 HydrophobicContact CG-CD1 3.63Å; Q1703-I1866 HydrophobicContact CG-CG1 3.9Å
1704L80.8Confident75.7Confident12.4 Ų12.442.6 Ų42.67%0.06526%0.261CS..Hα-helixtrans-66.8-42.3178.2-71.2171.1000112.3I1700 Q1701 N1706 S1707 V1711 V1716 F1733 A1736 A1737 I1740I1700-L1704 HydrophobicContact CG2-CD1 3.88Å; I1700-L1704 HydrophobicContact CG2-CG 4.38Å; I1700-L1704 VanDerWaalsContact O-CG 3.32Å; I1700-L1704 WeakPolarHBondContact O-CG 3.45Å; I1700-L1704 PolarHBondContact O-N 3.18Å; Q1701-L1704 PolarHBondContact O-N 3.22Å; Q1701-L1704 VanDerWaalsContact O-N 3.13Å; L1704-N1706 VanDerWaalsContact C-N 3.29Å; L1704-N1706 PolarHBondContact O-N 3.03Å; L1704-S1707 CarbonylContact O-C 3.52Å; L1704-S1707 PolarHBondContact O-N 3.38Å; L1704-S1707 VanDerWaalsContact O-N 3.08Å; L1704-V1711 HydrophobicContact CD2-CB 3.64Å; L1704-V1711 HydrophobicContact CD2-CG1 4.02Å; L1704-V1711 HydrophobicContact CD2-CG2 3.97Å; L1704-V1716 HydrophobicContact CD2-CG2 4.2Å; L1704-V1716 HydrophobicContact CG-CG2 4.21Å; L1704-F1733 HydrophobicContact CD1-CE2 4.35Å; L1704-F1733 HydrophobicContact CD2-CE2 4.08Å; L1704-F1733 HydrophobicContact CD2-CZ 4.45Å; L1704-A1736 HydrophobicContact CD1-CB 4.08Å; L1704-A1737 HydrophobicContact CD1-CB 4.18Å; L1704-I1740 HydrophobicContact CB-CD1 3.54Å; L1704-I1740 HydrophobicContact CD1-CD1 4.15Å; L1704-I1740 HydrophobicContact CG-CD1 4.47Å
1705G73.9Confident74.5Confident49.8 Ų49.845.3 Ų45.351%0.51328%0.282SS..Hα-helixtrans-64.5-32.9179.900000113.6Q1701 A1702 S1707Q1701-G1705 PolarHBondContact O-N 3.11Å; A1702-G1705 PolarHBondContact O-N 2.89Å; G1705-S1707 VanDerWaalsContact C-N 3.33Å; G1705-S1707 PolarHBondContact O-N 2.84Å
1706N66.9Low73.7Confident77.8 Ų77.845.4 Ų45.442%0.41628%0.282SS..THydrogen-bonded Turntrans-73.8-10.3175.7-74.3-17.8000113.8A1702 Q1703 L1704 P1708 S1865 A1869A1702-N1706 WeakPolarHBondContact O-CB 3.37Å; A1702-N1706 VanDerWaalsContact O-CG 3.27Å; A1702-N1706 PolarHBondContact O-N 3.37Å; A1702-N1706 VanDerWaalsContact O-N 3.16Å; A1702-N1706 PolarHBondContact O-ND2 3.16Å; Q1703-N1706 PolarHBondContact O-N 3.43Å; L1704-N1706 VanDerWaalsContact C-N 3.29Å; L1704-N1706 PolarHBondContact O-N 3.03Å; N1706-P1708 WeakPolarHBondContact O-CD 3.37Å; N1706-S1865 PolarHBondContact ND2-O 3.01Å; N1706-S1865 PolarHBondContact ND2-OG 3.18Å; N1706-S1865 VanDerWaalsContact ND2-OG 3.1Å; N1706-A1869 WeakPolarHBondContact OD1-CB 3.25Å
1707S62.9Low72.9Confident59.6 Ų59.648.5 Ų48.542%0.41730%0.301SS..  trans-123.976.4-173.2-59.20000111.9Q1703 L1704 G1705 G1709 Q1710 V1711Q1703-S1707 PolarHBondContact O-OG 2.91Å; L1704-S1707 CarbonylContact O-C 3.52Å; L1704-S1707 PolarHBondContact O-N 3.38Å; L1704-S1707 VanDerWaalsContact O-N 3.08Å; G1705-S1707 VanDerWaalsContact C-N 3.33Å; G1705-S1707 PolarHBondContact O-N 2.84Å; S1707-G1709 VanDerWaalsContact C-N 3.3Å; S1707-G1709 PolarHBondContact O-N 3.19Å; S1707-Q1710 PolarHBondContact O-N 2.81Å; S1707-V1711 VanDerWaalsContact O-CG2 3.26Å; S1707-V1711 WeakPolarHBondContact O-CG2 3.39Å
1708P56.2Low72.2Confident132.8 Ų132.849.5 Ų49.586%0.86231%0.306SS*.  trans-72.865.4-173.331.1-37.2000113.5N1706N1706-P1708 WeakPolarHBondContact O-CD 3.37Å
1709G57.9Low71.6Confident59.4 Ų59.451.6 Ų51.661%0.61232%0.318SS*.SBendtrans-167.2-146.817700000113.7S1707 V1711S1707-G1709 VanDerWaalsContact C-N 3.3Å; S1707-G1709 PolarHBondContact O-N 3.19Å; G1709-V1711 VanDerWaalsContact C-N 3.32Å; G1709-V1711 PolarHBondContact O-N 3.03Å
1710Q53.9Low71Confident163.6 Ų163.651.8 Ų51.876%0.76432%0.318SS*.  trans-101.786.1174.3-172.8174.1-8.200109.7S1707 D1712S1707-Q1710 PolarHBondContact O-N 2.81Å; Q1710-D1712 VanDerWaalsContact C-N 3.25Å; Q1710-D1712 HydrophobicContact CG-CB 4.08Å; Q1710-D1712 PolarHBondContact O-N 3.22Å
1711V60.9Low70.3Confident46.4 Ų46.455 Ų5528%0.28135%0.352SS..  trans-71.5100.5178.5-173.10000109.5L1704 S1707 G1709 S1715 V1716 F1733 A1737L1704-V1711 HydrophobicContact CD2-CB 3.64Å; L1704-V1711 HydrophobicContact CD2-CG1 4.02Å; L1704-V1711 HydrophobicContact CD2-CG2 3.97Å; S1707-V1711 VanDerWaalsContact O-CG2 3.26Å; S1707-V1711 WeakPolarHBondContact O-CG2 3.39Å; G1709-V1711 VanDerWaalsContact C-N 3.32Å; G1709-V1711 PolarHBondContact O-N 3.03Å; V1711-S1715 WeakPolarHBondContact CG1-OG 3.33Å; V1711-V1716 HydrophobicContact CG1-CG2 4.05Å; V1711-F1733 HydrophobicContact CG1-CE1 4.18Å; V1711-F1733 HydrophobicContact CG1-CZ 3.94Å; V1711-A1737 HydrophobicContact CG1-CB 3.94Å
1712D64Low69.6Low92.8 Ų92.856.4 Ų56.450%0.49636%0.362SS..  trans-90.3139.3177.4-160.3-16.2000110.4Q1710 D1714 S1715Q1710-D1712 VanDerWaalsContact C-N 3.25Å; Q1710-D1712 HydrophobicContact CG-CB 4.08Å; Q1710-D1712 PolarHBondContact O-N 3.22Å; D1712-D1714 PolarHBondContact O-N 3.15Å; D1712-D1714 VanDerWaalsContact O-N 3.11Å; D1712-D1714 PolarHBondContact OD1-N 3.27Å; D1712-D1714 VanDerWaalsContact OD1-N 3.09Å; D1712-S1715 WeakPolarHBondContact O-CB 3.46Å; D1712-S1715 PolarHBondContact O-N 2.84Å; D1712-S1715 PolarHBondContact O-OG 3.02Å
1713I72.3Confident68.7Low49 Ų4962.7 Ų62.725%0.25139%0.39SS..G310 helixtrans-57.8-33.4-177.4-80.1161.8000110.9S1715 V1716 R1724 F1729 F1733I1713-S1715 VanDerWaalsContact C-N 3.26Å; I1713-S1715 PolarHBondContact O-N 3.27Å; I1713-V1716 PolarHBondContact O-N 3.18Å; I1713-R1724 PolarHBondContact O-NH2 2.99Å; I1713-F1729 HydrophobicContact CD1-CD1 4.16Å; I1713-F1729 HydrophobicContact CD1-CE1 3.92Å; I1713-F1729 HydrophobicContact CG1-CD1 4.46Å; I1713-F1729 HydrophobicContact CG1-CE1 3.73Å; I1713-F1729 HydrophobicContact CG2-CE1 4.01Å; I1713-F1733 HydrophobicContact CB-CD1 4.26Å; I1713-F1733 HydrophobicContact CB-CD2 4.47Å; I1713-F1733 HydrophobicContact CB-CE1 3.92Å; I1713-F1733 HydrophobicContact CB-CE2 4.3Å; I1713-F1733 HydrophobicContact CB-CZ 4.1Å; I1713-F1733 HydrophobicContact CD1-CD1 4.12Å; I1713-F1733 HydrophobicContact CD1-CE1 4.31Å; I1713-F1733 HydrophobicContact CD1-CG 4.21Å; I1713-F1733 HydrophobicContact CG1-CD1 3.92Å; I1713-F1733 HydrophobicContact CG1-CD2 4.26Å; I1713-F1733 HydrophobicContact CG1-CE1 3.67Å; I1713-F1733 VanDerWaalsContact CG1-CE1 3.45Å; I1713-F1733 HydrophobicContact CG1-CE2 4.15Å; I1713-F1733 HydrophobicContact CG1-CG 4.27Å; I1713-F1733 HydrophobicContact CG1-CZ 3.79Å
1714D66.6Low67.8Low108.6 Ų108.666.2 Ų66.258%0.58140%0.402SS*.G310 helixtrans-70.8-13.3179.3-88.3-41.2000114.6D1712 V1716 R1724D1712-D1714 PolarHBondContact O-N 3.15Å; D1712-D1714 VanDerWaalsContact O-N 3.11Å; D1712-D1714 PolarHBondContact OD1-N 3.27Å; D1712-D1714 VanDerWaalsContact OD1-N 3.09Å; D1714-V1716 VanDerWaalsContact C-N 3.35Å; D1714-R1724 VanDerWaalsContact C-NH2 3.29Å; D1714-R1724 VanDerWaalsContact CA-NH1 3.33Å; D1714-R1724 VanDerWaalsContact O-CZ 3.25Å; D1714-R1724 PolarHBondContact O-NH1 3.07Å; D1714-R1724 PolarHBondContact O-NH2 3.05Å; D1714-R1724 IonicContact OD1-CZ 3.48Å; D1714-R1724 IonicContact OD1-NH1 3.74Å; D1714-R1724 PolarHBondContact OD1-NH1 3.28Å; D1714-R1724 VanDerWaalsContact OD1-NH1 3.08Å; D1714-R1724 IonicContact OD1-NH2 2.62Å
1715S67.1Low67Low68.4 Ų68.472.5 Ų72.548%0.47844%0.436SS..G310 helixtrans-83.4-20.2174.3690000113.9V1711 D1712 I1713V1711-S1715 WeakPolarHBondContact CG1-OG 3.33Å; D1712-S1715 WeakPolarHBondContact O-CB 3.46Å; D1712-S1715 PolarHBondContact O-N 2.84Å; D1712-S1715 PolarHBondContact O-OG 3.02Å; I1713-S1715 VanDerWaalsContact C-N 3.26Å; I1713-S1715 PolarHBondContact O-N 3.27Å
1716V72.6Confident67.1Low1.2 Ų1.271.2 Ų71.21%0.00742%0.423CS..  trans-89.5135.9-175.3176.20000111.4I1700 L1704 V1711 I1713 D1714 R1724 F1729 F1733I1700-V1716 HydrophobicContact CB-CG1 4.33Å; I1700-V1716 HydrophobicContact CG1-CG1 3.91Å; I1700-V1716 HydrophobicContact CG2-CG1 4Å; L1704-V1716 HydrophobicContact CD2-CG2 4.2Å; L1704-V1716 HydrophobicContact CG-CG2 4.21Å; V1711-V1716 HydrophobicContact CG1-CG2 4.05Å; I1713-V1716 PolarHBondContact O-N 3.18Å; D1714-V1716 VanDerWaalsContact C-N 3.35Å; V1716-R1724 PolarHBondContact O-NE 3.23Å; V1716-R1724 PolarHBondContact O-NH2 3.21Å; V1716-F1729 HydrophobicContact CB-CZ 4.36Å; V1716-F1729 HydrophobicContact CG1-CE2 4.39Å; V1716-F1729 HydrophobicContact CG1-CZ 3.98Å; V1716-F1733 HydrophobicContact CB-CD2 4.43Å; V1716-F1733 HydrophobicContact CB-CE2 4.43Å; V1716-F1733 HydrophobicContact CG2-CD2 4.16Å; V1716-F1733 HydrophobicContact CG2-CE2 3.81Å
1717T73Confident67.5Low65.4 Ų65.472.5 Ų72.540%0.40143%0.427SS..  trans-103.2126.4176.5-58.90000110.5Q1703 L1719 F1862Q1703-T1717 PolarHBondContact NE2-O 3.14Å; Q1703-T1717 PolarHBondContact OE1-O 3.27Å; T1717-L1719 PolarHBondContact O-N 3.38Å; T1717-F1862 HydrophobicContact CG2-CE1 4.45Å; T1717-F1862 HydrophobicContact CG2-CZ 4.41Å
1718D74.6Confident68.3Low21.8 Ų21.873.7 Ų73.712%0.11743%0.426CS..  trans-85.9110.9175-174.121.3000111.9N1720 G1721 S1722 F1729D1718-N1720 PolarHBondContact O-N 3.14Å; D1718-N1720 VanDerWaalsContact OD1-CB 3.3Å; D1718-N1720 WeakPolarHBondContact OD1-CB 3.36Å; D1718-N1720 PolarHBondContact OD1-N 3.14Å; D1718-N1720 WeakPolarHBondContact OD2-CB 3.3Å; D1718-G1721 PolarHBondContact O-N 3.2Å; D1718-G1721 VanDerWaalsContact O-N 3.12Å; D1718-G1721 PolarHBondContact OD2-N 3.01Å; D1718-S1722 WeakPolarHBondContact OD2-CA 3.36Å; D1718-S1722 WeakPolarHBondContact OD2-CB 3.36Å; D1718-S1722 PolarHBondContact OD2-N 3.26Å; D1718-S1722 PolarHBondContact OD2-OG 3.17Å; D1718-F1729 HydrophobicContact CB-CD2 3.76Å; D1718-F1729 HydrophobicContact CB-CE2 3.6Å; D1718-F1729 HydrophobicContact CB-CZ 4.41Å
1719L74.8Confident69.5Low46 Ų4667.4 Ų67.424%0.24139%0.385CS..THydrogen-bonded Turntrans-65.3-20.6172.1-59-177.6000112.5F1695 A1699 T1717 G1721 F1862 L1863 F1961F1695-L1719 HydrophobicContact CE1-CB 4.48Å; F1695-L1719 HydrophobicContact CE1-CD1 3.76Å; F1695-L1719 HydrophobicContact CZ-CD1 4.31Å; A1699-L1719 HydrophobicContact CB-CD1 3.61Å; A1699-L1719 HydrophobicContact CB-CG 4.33Å; T1717-L1719 PolarHBondContact O-N 3.38Å; L1719-G1721 VanDerWaalsContact C-N 3.3Å; L1719-G1721 PolarHBondContact O-N 3.29Å; L1719-F1862 HydrophobicContact CD2-CE1 4.47Å; L1719-L1863 HydrophobicContact CD2-CD2 4.19Å; L1719-F1961 HydrophobicContact CD1-CD1 4.19Å; L1719-F1961 HydrophobicContact CD1-CE1 3.95Å
1720N74.9Confident70.7Confident4.6 Ų4.667.4 Ų67.43%0.02537%0.368CS..THydrogen-bonded Turntrans-80-8.5176.4-72.2-36000113.9V1692 G1696 D1718 S1722 K1954 H1958V1692-N1720 WeakPolarHBondContact CG1-OD1 3.44Å; V1692-N1720 PolarHBondContact O-ND2 2.97Å; V1692-N1720 VanDerWaalsContact O-ND2 3.12Å; V1692-N1720 PolarHBondContact O-OD1 2.91Å; G1696-N1720 WeakPolarHBondContact CA-ND2 3.4Å; D1718-N1720 PolarHBondContact O-N 3.14Å; D1718-N1720 VanDerWaalsContact OD1-CB 3.3Å; D1718-N1720 WeakPolarHBondContact OD1-CB 3.36Å; D1718-N1720 PolarHBondContact OD1-N 3.14Å; D1718-N1720 WeakPolarHBondContact OD2-CB 3.3Å; N1720-S1722 VanDerWaalsContact C-N 3.28Å; N1720-S1722 PolarHBondContact O-N 2.9Å; N1720-K1954 VanDerWaalsContact O-CE 3.32Å; N1720-K1954 WeakPolarHBondContact O-CE 3.22Å; N1720-K1954 PolarHBondContact O-NZ 3.14Å; N1720-H1958 PolarHBondContact OD1-CE1 3.44Å; N1720-H1958 VanDerWaalsContact OD1-CE1 3.24Å; N1720-H1958 PolarHBondContact OD1-NE2 3.14Å
1721G71.3Confident72Confident68.6 Ų68.662.3 Ų62.371%0.70735%0.347SS*.  trans64.729.5179.300000114.1D1718 L1719D1718-G1721 PolarHBondContact O-N 3.2Å; D1718-G1721 VanDerWaalsContact O-N 3.12Å; D1718-G1721 PolarHBondContact OD2-N 3.01Å; L1719-G1721 VanDerWaalsContact C-N 3.3Å; L1719-G1721 PolarHBondContact O-N 3.29Å
1722S70.5Confident73.1Confident34 Ų3460.4 Ų60.424%0.23834%0.335CS..  trans-68.4150.3168.8-43.80000109.8D1718 N1720 R1724D1718-S1722 WeakPolarHBondContact OD2-CA 3.36Å; D1718-S1722 WeakPolarHBondContact OD2-CB 3.36Å; D1718-S1722 PolarHBondContact OD2-N 3.26Å; D1718-S1722 PolarHBondContact OD2-OG 3.17Å; N1720-S1722 VanDerWaalsContact C-N 3.28Å; N1720-S1722 PolarHBondContact O-N 2.9Å; S1722-R1724 PolarHBondContact O-N 3.17Å
1723H63.1Low74.1Confident139.4 Ų139.456.9 Ų56.965%0.64532%0.315SS*.  trans-65.8129.5168.7-167-78.5000109.2N1725 G1726H1723-N1725 VanDerWaalsContact C-N 3.31Å; H1723-N1725 PolarHBondContact ND1-N 3.29Å; H1723-N1725 PolarHBondContact O-N 3.16Å; H1723-G1726 WeakPolarHBondContact O-CA 3.35Å; H1723-G1726 PolarHBondContact O-N 3.22Å
1724R65.3Low74.7Confident88.2 Ų88.258.8 Ų58.833%0.33332%0.323SS..THydrogen-bonded Turntrans-53.3-48.6-176.4-75.9-177.8151-162.2-2.9112.6I1713 D1714 V1716 S1722 G1726 F1729I1713-R1724 PolarHBondContact O-NH2 2.99Å; D1714-R1724 VanDerWaalsContact C-NH2 3.29Å; D1714-R1724 VanDerWaalsContact CA-NH1 3.33Å; D1714-R1724 VanDerWaalsContact O-CZ 3.25Å; D1714-R1724 PolarHBondContact O-NH1 3.07Å; D1714-R1724 PolarHBondContact O-NH2 3.05Å; D1714-R1724 IonicContact OD1-CZ 3.48Å; D1714-R1724 IonicContact OD1-NH1 3.74Å; D1714-R1724 PolarHBondContact OD1-NH1 3.28Å; D1714-R1724 VanDerWaalsContact OD1-NH1 3.08Å; D1714-R1724 IonicContact OD1-NH2 2.62Å; V1716-R1724 PolarHBondContact O-NE 3.23Å; V1716-R1724 PolarHBondContact O-NH2 3.21Å; S1722-R1724 PolarHBondContact O-N 3.17Å; R1724-G1726 PolarHBondContact O-N 3.16Å; R1724-G1726 VanDerWaalsContact O-N 3.07Å; R1724-F1729 HydrophobicContact CB-CD1 4.34Å; R1724-F1729 HydrophobicContact CG-CE1 4.4Å; R1724-F1729 WeakPolarHBondContact O-CD1 3.36Å
1725N64.9Low75.6Confident144.2 Ų144.256.6 Ų56.677%0.77131%0.306SS*.THydrogen-bonded Turntrans-73.411.8176.9-45.232.5000113.7H1723H1723-N1725 VanDerWaalsContact C-N 3.31Å; H1723-N1725 PolarHBondContact ND1-N 3.29Å; H1723-N1725 PolarHBondContact O-N 3.16Å
1726G74.4Confident76.5Confident23.2 Ų23.253.3 Ų53.324%0.23928%0.283CS..SBendtrans-87.4131179.800000111.3H1723 R1724 H1728 F1729 Q1730H1723-G1726 WeakPolarHBondContact O-CA 3.35Å; H1723-G1726 PolarHBondContact O-N 3.22Å; R1724-G1726 PolarHBondContact O-N 3.16Å; R1724-G1726 VanDerWaalsContact O-N 3.07Å; G1726-H1728 PolarHBondContact O-N 3.15Å; G1726-F1729 WeakPolarHBondContact O-CA 3.26Å; G1726-F1729 PolarHBondContact O-N 2.97Å; G1726-Q1730 PolarHBondContact O-N 3.04Å; G1726-Q1730 VanDerWaalsContact O-N 3.09Å
1727E76.8Confident77Confident104.6 Ų104.653.9 Ų53.949%0.48929%0.289SS..Hα-helixtrans-47.5-33.5177.7-177.7177.7-141.300113.6N1604 Q1730 N1731N1604-E1727 PolarHBondContact ND2-OE1 3.27Å; N1604-E1727 PolarHBondContact ND2-OE2 3.13Å; E1727-Q1730 PolarHBondContact O-N 3.3Å; E1727-N1731 VanDerWaalsContact CG-ND2 3.31Å; E1727-N1731 WeakPolarHBondContact CG-ND2 3.42Å; E1727-N1731 VanDerWaalsContact O-CB 3.29Å; E1727-N1731 WeakPolarHBondContact O-CB 3.38Å; E1727-N1731 PolarHBondContact O-N 3.15Å; E1727-N1731 PolarHBondContact O-ND2 3.01Å; E1727-N1731 PolarHBondContact O-OD1 3.32Å; E1727-N1731 VanDerWaalsContact O-OD1 3.12Å
1728H78.4Confident77.5Confident86 Ų8652.6 Ų52.640%0.39828%0.278SS..Hα-helixtrans-68.6-36.4176.3-173.6-102.3000114R1568 N1693 G1726 Q1732R1568-H1728 PolarHBondContact NH2-NE2 3.25Å; N1693-H1728 PolarHBondContact ND2-NE2 3.24Å; N1693-H1728 PolarHBondContact OD1-CE1 3.09Å; N1693-H1728 VanDerWaalsContact OD1-CE1 3.27Å; G1726-H1728 PolarHBondContact O-N 3.15Å; H1728-Q1732 PolarHBondContact CE1-NE2 3.11Å; H1728-Q1732 PolarHBondContact ND1-NE2 3.14Å; H1728-Q1732 VanDerWaalsContact ND1-NE2 3.18Å; H1728-Q1732 PolarHBondContact NE2-NE2 2.79Å; H1728-Q1732 VanDerWaalsContact NE2-NE2 3.15Å; H1728-Q1732 VanDerWaalsContact O-CG 3.3Å; H1728-Q1732 WeakPolarHBondContact O-CG 3.35Å; H1728-Q1732 PolarHBondContact O-N 3.13Å; H1728-Q1732 VanDerWaalsContact O-N 3.13Å; H1728-Q1732 PolarHBondContact O-NE2 3.21Å
1729F81.8Confident77.9Confident0.8 Ų0.851.9 Ų51.90%0.00428%0.275CS..Hα-helixtrans-74.7-45.1173.6179.6-108.3000110.5I1700 I1713 V1716 D1718 R1724 G1726 N1731 Q1732 F1733I1700-F1729 HydrophobicContact CD1-CD2 4.32Å; I1700-F1729 HydrophobicContact CD1-CE2 3.84Å; I1700-F1729 HydrophobicContact CG1-CE2 4.38Å; I1713-F1729 HydrophobicContact CD1-CD1 4.16Å; I1713-F1729 HydrophobicContact CD1-CE1 3.92Å; I1713-F1729 HydrophobicContact CG1-CD1 4.46Å; I1713-F1729 HydrophobicContact CG1-CE1 3.73Å; I1713-F1729 HydrophobicContact CG2-CE1 4.01Å; V1716-F1729 HydrophobicContact CB-CZ 4.36Å; V1716-F1729 HydrophobicContact CG1-CE2 4.39Å; V1716-F1729 HydrophobicContact CG1-CZ 3.98Å; D1718-F1729 HydrophobicContact CB-CD2 3.76Å; D1718-F1729 HydrophobicContact CB-CE2 3.6Å; D1718-F1729 HydrophobicContact CB-CZ 4.41Å; R1724-F1729 HydrophobicContact CB-CD1 4.34Å; R1724-F1729 HydrophobicContact CG-CE1 4.4Å; R1724-F1729 WeakPolarHBondContact O-CD1 3.36Å; G1726-F1729 WeakPolarHBondContact O-CA 3.26Å; G1726-F1729 PolarHBondContact O-N 2.97Å; F1729-N1731 VanDerWaalsContact C-N 3.34Å; F1729-N1731 PolarHBondContact O-N 3.26Å; F1729-Q1732 WeakPolarHBondContact O-CB 3.44Å; F1729-Q1732 PolarHBondContact O-N 3.01Å; F1729-Q1732 VanDerWaalsContact O-N 3.15Å; F1729-F1733 WeakPolarHBondContact O-CB 3.4Å; F1729-F1733 PolarHBondContact O-N 3.17Å
1730Q83.3Confident78.1Confident57.6 Ų57.652.2 Ų52.227%0.26928%0.276SS..Hα-helixtrans-54.6-49.5177.1-171.363.329.900111.8G1726 E1727 Q1732 F1733 E1734G1726-Q1730 PolarHBondContact O-N 3.04Å; G1726-Q1730 VanDerWaalsContact O-N 3.09Å; E1727-Q1730 PolarHBondContact O-N 3.3Å; Q1730-Q1732 VanDerWaalsContact C-N 3.31Å; Q1730-Q1732 PolarHBondContact O-N 3.25Å; Q1730-F1733 PolarHBondContact O-N 3.03Å; Q1730-F1733 VanDerWaalsContact O-N 3.13Å; Q1730-E1734 VanDerWaalsContact CG-OE1 3.31Å; Q1730-E1734 WeakPolarHBondContact CG-OE1 3.38Å; Q1730-E1734 PolarHBondContact NE2-OE1 2.96Å; Q1730-E1734 WeakPolarHBondContact O-CB 3.35Å; Q1730-E1734 WeakPolarHBondContact O-CG 3.38Å; Q1730-E1734 PolarHBondContact O-N 3.04Å
1731N82.1Confident77.9Confident57.4 Ų57.457.7 Ų57.731%0.30730%0.302SS..Hα-helixtrans-63.9-31.6177.3-79.1-51.6000113.3E1727 F1729 R1735E1727-N1731 VanDerWaalsContact CG-ND2 3.31Å; E1727-N1731 WeakPolarHBondContact CG-ND2 3.42Å; E1727-N1731 VanDerWaalsContact O-CB 3.29Å; E1727-N1731 WeakPolarHBondContact O-CB 3.38Å; E1727-N1731 PolarHBondContact O-N 3.15Å; E1727-N1731 PolarHBondContact O-ND2 3.01Å; E1727-N1731 PolarHBondContact O-OD1 3.32Å; E1727-N1731 VanDerWaalsContact O-OD1 3.12Å; F1729-N1731 VanDerWaalsContact C-N 3.34Å; F1729-N1731 PolarHBondContact O-N 3.26Å; N1731-R1735 WeakPolarHBondContact O-CB 3.37Å; N1731-R1735 WeakPolarHBondContact O-CD 3.39Å; N1731-R1735 WeakPolarHBondContact O-CG 3.34Å; N1731-R1735 PolarHBondContact O-N 3.06Å; N1731-R1735 PolarHBondContact O-NE 3.07Å
1732Q84Confident77.5Confident7.6 Ų7.662.2 Ų62.24%0.03630%0.301CS..Hα-helixtrans-72.4-43.7174.4-76.2179.289.900111.2N1693 I1697 I1700 H1728 F1729 Q1730 R1735 A1736N1693-Q1732 PolarHBondContact O-OE1 3.07Å; N1693-Q1732 PolarHBondContact OD1-NE2 2.88Å; N1693-Q1732 VanDerWaalsContact OD1-NE2 3.17Å; I1697-Q1732 HydrophobicContact CD1-CB 4.28Å; I1697-Q1732 HydrophobicContact CD1-CG 4.01Å; I1697-Q1732 HydrophobicContact CG1-CB 3.86Å; I1697-Q1732 HydrophobicContact CG1-CG 3.83Å; I1700-Q1732 HydrophobicContact CD1-CB 4.08Å; H1728-Q1732 PolarHBondContact CE1-NE2 3.11Å; H1728-Q1732 PolarHBondContact ND1-NE2 3.14Å; H1728-Q1732 VanDerWaalsContact ND1-NE2 3.18Å; H1728-Q1732 PolarHBondContact NE2-NE2 2.79Å; H1728-Q1732 VanDerWaalsContact NE2-NE2 3.15Å; H1728-Q1732 VanDerWaalsContact O-CG 3.3Å; H1728-Q1732 WeakPolarHBondContact O-CG 3.35Å; H1728-Q1732 PolarHBondContact O-N 3.13Å; H1728-Q1732 VanDerWaalsContact O-N 3.13Å; H1728-Q1732 PolarHBondContact O-NE2 3.21Å; F1729-Q1732 WeakPolarHBondContact O-CB 3.44Å; F1729-Q1732 PolarHBondContact O-N 3.01Å; F1729-Q1732 VanDerWaalsContact O-N 3.15Å; Q1730-Q1732 VanDerWaalsContact C-N 3.31Å; Q1730-Q1732 PolarHBondContact O-N 3.25Å; Q1732-R1735 PolarHBondContact O-N 3.19Å; Q1732-A1736 WeakPolarHBondContact O-CB 3.33Å; Q1732-A1736 PolarHBondContact O-N 3.14Å
1733F84.9Confident76.8Confident18.6 Ų18.662.9 Ų62.98%0.08231%0.306CS..Hα-helixtrans-61.1-47.2176.4176.7-87.9000111.8I1700 L1704 V1711 I1713 V1716 F1729 Q1730 R1735 A1736 A1737I1700-F1733 HydrophobicContact CG2-CD2 4.41Å; L1704-F1733 HydrophobicContact CD1-CE2 4.35Å; L1704-F1733 HydrophobicContact CD2-CE2 4.08Å; L1704-F1733 HydrophobicContact CD2-CZ 4.45Å; V1711-F1733 HydrophobicContact CG1-CE1 4.18Å; V1711-F1733 HydrophobicContact CG1-CZ 3.94Å; I1713-F1733 HydrophobicContact CB-CD1 4.26Å; I1713-F1733 HydrophobicContact CB-CD2 4.47Å; I1713-F1733 HydrophobicContact CB-CE1 3.92Å; I1713-F1733 HydrophobicContact CB-CE2 4.3Å; I1713-F1733 HydrophobicContact CB-CZ 4.1Å; I1713-F1733 HydrophobicContact CD1-CD1 4.12Å; I1713-F1733 HydrophobicContact CD1-CE1 4.31Å; I1713-F1733 HydrophobicContact CD1-CG 4.21Å; I1713-F1733 HydrophobicContact CG1-CD1 3.92Å; I1713-F1733 HydrophobicContact CG1-CD2 4.26Å; I1713-F1733 HydrophobicContact CG1-CE1 3.67Å; I1713-F1733 VanDerWaalsContact CG1-CE1 3.45Å; I1713-F1733 HydrophobicContact CG1-CE2 4.15Å; I1713-F1733 HydrophobicContact CG1-CG 4.27Å; I1713-F1733 HydrophobicContact CG1-CZ 3.79Å; V1716-F1733 HydrophobicContact CB-CD2 4.43Å; V1716-F1733 HydrophobicContact CB-CE2 4.43Å; V1716-F1733 HydrophobicContact CG2-CD2 4.16Å; V1716-F1733 HydrophobicContact CG2-CE2 3.81Å; F1729-F1733 WeakPolarHBondContact O-CB 3.4Å; F1729-F1733 PolarHBondContact O-N 3.17Å; Q1730-F1733 PolarHBondContact O-N 3.03Å; Q1730-F1733 VanDerWaalsContact O-N 3.13Å; F1733-R1735 VanDerWaalsContact C-N 3.35Å; F1733-R1735 PolarHBondContact O-N 3.07Å; F1733-A1736 WeakPolarHBondContact O-CB 3.24Å; F1733-A1736 PolarHBondContact O-N 3.03Å; F1733-A1737 HydrophobicContact CE1-CB 4.49Å; F1733-A1737 WeakPolarHBondContact O-CB 3.3Å; F1733-A1737 PolarHBondContact O-N 3.29Å
1734E83.6Confident76.5Confident87.6 Ų87.660.8 Ų60.841%0.40931%0.308SS..Hα-helixtrans-62.4-42.4179.3-74173.7-169.600112.3F1202 Q1730 F1738F1202-E1734 HydrophobicContact CD1-CB 4.47Å; Q1730-E1734 VanDerWaalsContact CG-OE1 3.31Å; Q1730-E1734 WeakPolarHBondContact CG-OE1 3.38Å; Q1730-E1734 PolarHBondContact NE2-OE1 2.96Å; Q1730-E1734 WeakPolarHBondContact O-CB 3.35Å; Q1730-E1734 WeakPolarHBondContact O-CG 3.38Å; Q1730-E1734 PolarHBondContact O-N 3.04Å; E1734-F1738 VanDerWaalsContact O-CB 3.28Å; E1734-F1738 WeakPolarHBondContact O-CB 3.28Å; E1734-F1738 PolarHBondContact O-N 3.2Å
1735R85.9Confident76.4Confident62.4 Ų62.457.5 Ų57.524%0.23530%0.301CS..Hα-helixtrans-65.1-43.6173.6-69.5171.8-166.2-164.50.9112.2F1202 D1660 T1661 I1697 N1731 Q1732 F1733 A1737 F1738 A1739F1202-R1735 HydrophobicContact CE1-CG 4.22Å; F1202-R1735 HydrophobicContact CZ-CG 4.45Å; D1660-R1735 HydrophobicContact CB-CB 4.21Å; D1660-R1735 HydrophobicContact CB-CG 4.45Å; D1660-R1735 WeakPolarHBondContact OD2-CD 3.38Å; D1660-R1735 IonicContact OD2-CZ 3.21Å; D1660-R1735 IonicContact OD2-NE 3.24Å; D1660-R1735 IonicContact OD2-NH1 3.32Å; D1660-R1735 PolarHBondContact OD2-NH1 3.03Å; T1661-R1735 HydrophobicContact CG2-CB 4.3Å; T1661-R1735 HydrophobicContact CG2-CG 4.17Å; I1697-R1735 HydrophobicContact CD1-CB 4.39Å; N1731-R1735 WeakPolarHBondContact O-CB 3.37Å; N1731-R1735 WeakPolarHBondContact O-CD 3.39Å; N1731-R1735 WeakPolarHBondContact O-CG 3.34Å; N1731-R1735 PolarHBondContact O-N 3.06Å; N1731-R1735 PolarHBondContact O-NE 3.07Å; Q1732-R1735 PolarHBondContact O-N 3.19Å; F1733-R1735 VanDerWaalsContact C-N 3.35Å; F1733-R1735 PolarHBondContact O-N 3.07Å; R1735-A1737 PolarHBondContact O-N 2.86Å; R1735-F1738 PolarHBondContact O-N 3.22Å; R1735-A1739 VanDerWaalsContact O-CB 3.31Å; R1735-A1739 WeakPolarHBondContact O-CB 3.43Å; R1735-A1739 PolarHBondContact O-N 3.15Å
1736A85.3Confident77Confident0 Ų051.6 Ų51.60%027%0.269CS..Hα-helixtrans-59.5-48.3178.900000111.8I1697 I1700 Q1701 L1704 Q1732 F1733 A1739 I1740I1697-A1736 HydrophobicContact CG2-CB 4.34Å; I1700-A1736 HydrophobicContact CB-CB 4.21Å; I1700-A1736 HydrophobicContact CG2-CB 3.55Å; Q1701-A1736 HydrophobicContact CG-CB 3.59Å; Q1701-A1736 PolarHBondContact NE2-O 3.13Å; Q1701-A1736 VanDerWaalsContact NE2-O 3.11Å; L1704-A1736 HydrophobicContact CD1-CB 4.08Å; Q1732-A1736 WeakPolarHBondContact O-CB 3.33Å; Q1732-A1736 PolarHBondContact O-N 3.14Å; F1733-A1736 WeakPolarHBondContact O-CB 3.24Å; F1733-A1736 PolarHBondContact O-N 3.03Å; A1736-A1739 PolarHBondContact O-N 3.09Å; A1736-I1740 PolarHBondContact O-N 3.24Å
1737A83.5Confident77.3Confident14.6 Ų14.652.7 Ų52.712%0.12127%0.267CS..Hα-helixtrans-65.8-45.1177.100000112.1L1704 V1711 F1733 R1735 A1739 I1740 H1741L1704-A1737 HydrophobicContact CD1-CB 4.18Å; V1711-A1737 HydrophobicContact CG1-CB 3.94Å; F1733-A1737 HydrophobicContact CE1-CB 4.49Å; F1733-A1737 WeakPolarHBondContact O-CB 3.3Å; F1733-A1737 PolarHBondContact O-N 3.29Å; R1735-A1737 PolarHBondContact O-N 2.86Å; A1737-A1739 VanDerWaalsContact C-N 3.32Å; A1737-A1739 PolarHBondContact O-N 3.25Å; A1737-I1740 PolarHBondContact O-N 3.18Å; A1737-I1740 VanDerWaalsContact O-N 3.14Å; A1737-H1741 WeakPolarHBondContact O-CB 3.3Å; A1737-H1741 PolarHBondContact O-CD2 2.95Å; A1737-H1741 VanDerWaalsContact O-CD2 3.24Å; A1737-H1741 PolarHBondContact O-N 3.11Å
1738F83.1Confident77.5Confident37.6 Ų37.648.2 Ų48.217%0.16525%0.247CC..Hα-helixtrans-54.5-47.2176.1178.4-87.3000112F1202 V1204 L1207 T1661 E1734 R1735 I1740 H1741 K1742 S1743 I1746F1202-F1738 HydrophobicContact CD1-CB 4.46Å; F1202-F1738 HydrophobicContact CD1-CD2 4.11Å; F1202-F1738 HydrophobicContact CD1-CG 4.44Å; F1202-F1738 HydrophobicContact CE1-CB 3.6Å; F1202-F1738 HydrophobicContact CE1-CD1 4.22Å; F1202-F1738 AromaticContact CE1-CD2 3.59Å; F1202-F1738 HydrophobicContact CE1-CD2 3.93Å; F1202-F1738 HydrophobicContact CE1-CE2 4.31Å; F1202-F1738 AromaticContact CE1-CG 3.65Å; F1202-F1738 HydrophobicContact CE1-CG 3.65Å; F1202-F1738 HydrophobicContact CE2-CD2 4.24Å; F1202-F1738 HydrophobicContact CE2-CE2 4.14Å; F1202-F1738 HydrophobicContact CE2-CG 4.47Å; F1202-F1738 HydrophobicContact CE2-CZ 4.3Å; F1202-F1738 HydrophobicContact CZ-CB 4.05Å; F1202-F1738 AromaticContact CZ-CD1 3.76Å; F1202-F1738 HydrophobicContact CZ-CD1 3.76Å; F1202-F1738 AromaticContact CZ-CD2 3.64Å; F1202-F1738 HydrophobicContact CZ-CD2 3.95Å; F1202-F1738 HydrophobicContact CZ-CE1 4.19Å; F1202-F1738 AromaticContact CZ-CE2 3.97Å; F1202-F1738 HydrophobicContact CZ-CE2 3.97Å; F1202-F1738 AromaticContact CZ-CG 3.64Å; F1202-F1738 HydrophobicContact CZ-CG 3.64Å; F1202-F1738 HydrophobicContact CZ-CZ 4.17Å; V1204-F1738 HydrophobicContact CB-CE2 4.41Å; V1204-F1738 HydrophobicContact CG2-CD2 4.14Å; V1204-F1738 HydrophobicContact CG2-CE1 4.42Å; V1204-F1738 HydrophobicContact CG2-CE2 3.86Å; V1204-F1738 HydrophobicContact CG2-CZ 3.56Å; L1207-F1738 HydrophobicContact CD1-CD2 4.29Å; L1207-F1738 HydrophobicContact CD1-CE2 3.57Å; L1207-F1738 HydrophobicContact CD1-CZ 3.66Å; T1661-F1738 HydrophobicContact CG2-CD1 4.3Å; T1661-F1738 HydrophobicContact CG2-CE1 4.46Å; E1734-F1738 VanDerWaalsContact O-CB 3.28Å; E1734-F1738 WeakPolarHBondContact O-CB 3.28Å; E1734-F1738 PolarHBondContact O-N 3.2Å; R1735-F1738 PolarHBondContact O-N 3.22Å; F1738-I1740 VanDerWaalsContact C-N 3.33Å; F1738-I1740 PolarHBondContact O-N 3.32Å; F1738-H1741 PolarHBondContact O-N 3.36Å; F1738-K1742 PolarHBondContact O-N 3.04Å; F1738-S1743 WeakPolarHBondContact CD2-OG 3.37Å; F1738-S1743 VanDerWaalsContact CE2-OG 3.28Å; F1738-S1743 WeakPolarHBondContact CE2-OG 3.4Å; F1738-S1743 PolarHBondContact O-OG 3.42Å; F1738-S1743 VanDerWaalsContact O-OG 3.07Å; F1738-I1746 HydrophobicContact CE1-CD1 3.8Å; F1738-I1746 HydrophobicContact CE1-CG1 4.18Å; F1738-I1746 HydrophobicContact CZ-CD1 4.01Å; F1738-I1746 HydrophobicContact CZ-CG1 4.07Å
1739A83.8Confident77.7Confident7.2 Ų7.244.1 Ų44.16%0.0623%0.229CC..Hα-helixtrans-65.5-35.9-179.700000113.2T1661 I1663 Q1701 R1735 A1736 A1737T1661-A1739 WeakPolarHBondContact O-CB 3.37Å; I1663-A1739 HydrophobicContact CD1-CB 4.36Å; I1663-A1739 WeakPolarHBondContact CD1-O 3.39Å; I1663-A1739 HydrophobicContact CG1-CB 4.09Å; Q1701-A1739 VanDerWaalsContact NE2-CB 3.3Å; R1735-A1739 VanDerWaalsContact O-CB 3.31Å; R1735-A1739 WeakPolarHBondContact O-CB 3.43Å; R1735-A1739 PolarHBondContact O-N 3.15Å; A1736-A1739 PolarHBondContact O-N 3.09Å; A1737-A1739 VanDerWaalsContact C-N 3.32Å; A1737-A1739 PolarHBondContact O-N 3.25Å
1740I78.5Confident77.4Confident51.6 Ų51.645.6 Ų45.627%0.26524%0.239SC..Hα-helixtrans-72.1-44.3177.6-75.7171.4000111.8Q1701 L1704 A1736 A1737 F1738 K1742Q1701-I1740 VanDerWaalsContact CA-CD1 3.5Å; Q1701-I1740 HydrophobicContact CB-CD1 3.77Å; Q1701-I1740 HydrophobicContact CB-CG1 4.37Å; Q1701-I1740 HydrophobicContact CG-CD1 3.8Å; Q1701-I1740 HydrophobicContact CG-CG1 4.22Å; Q1701-I1740 VanDerWaalsContact O-CD1 3.24Å; Q1701-I1740 WeakPolarHBondContact O-CD1 3.35Å; L1704-I1740 HydrophobicContact CB-CD1 3.54Å; L1704-I1740 HydrophobicContact CD1-CD1 4.15Å; L1704-I1740 HydrophobicContact CG-CD1 4.47Å; A1736-I1740 PolarHBondContact O-N 3.24Å; A1737-I1740 PolarHBondContact O-N 3.18Å; A1737-I1740 VanDerWaalsContact O-N 3.14Å; F1738-I1740 VanDerWaalsContact C-N 3.33Å; F1738-I1740 PolarHBondContact O-N 3.32Å; I1740-K1742 PolarHBondContact O-N 3.04Å; I1740-K1742 VanDerWaalsContact O-N 3.15Å
1741H72.1Confident76.5Confident121 Ų12148.7 Ų48.756%0.5626%0.257SS*.THydrogen-bonded Turntrans-72.7-4.5-174.8-70.9-62.3000114.1A1737 F1738 S1743A1737-H1741 WeakPolarHBondContact O-CB 3.3Å; A1737-H1741 PolarHBondContact O-CD2 2.95Å; A1737-H1741 VanDerWaalsContact O-CD2 3.24Å; A1737-H1741 PolarHBondContact O-N 3.11Å; F1738-H1741 PolarHBondContact O-N 3.36Å; H1741-S1743 PolarHBondContact O-N 3.17Å
1742K62.4Low75.5Confident161.8 Ų161.849.9 Ų49.970%0.70326%0.261SS*.THydrogen-bonded Turntrans57.342.6177.7-67.3-178.8179.7178.10113.4V1204 D1205 F1738 I1740 S1744V1204-K1742 HydrophobicContact CB-CB 3.89Å; V1204-K1742 HydrophobicContact CB-CD 3.6Å; V1204-K1742 HydrophobicContact CB-CG 4.4Å; V1204-K1742 HydrophobicContact CG1-CB 4.05Å; V1204-K1742 HydrophobicContact CG1-CD 4.01Å; V1204-K1742 HydrophobicContact CG2-CB 3.46Å; V1204-K1742 VanDerWaalsContact CG2-CB 3.46Å; V1204-K1742 HydrophobicContact CG2-CD 4.03Å; V1204-K1742 HydrophobicContact CG2-CG 4.38Å; D1205-K1742 IonicContact OD1-NZ 2.66Å; D1205-K1742 PolarHBondContact OD1-NZ 3.25Å; D1205-K1742 IonicContact OD2-NZ 3.2Å; D1205-K1742 PolarHBondContact OD2-NZ 2.87Å; F1738-K1742 PolarHBondContact O-N 3.04Å; I1740-K1742 PolarHBondContact O-N 3.04Å; I1740-K1742 VanDerWaalsContact O-N 3.15Å; K1742-S1744 PolarHBondContact O-N 2.89Å; K1742-S1744 VanDerWaalsContact O-N 3.1Å
1743S55.7Low74.4Confident49.2 Ų49.250.1 Ų50.134%0.34426%0.263SS..  trans-68.1105.8-178.637.60000112.1V1204 F1738 H1741 G1745V1204-S1743 VanDerWaalsContact CG1-CB 3.44Å; V1204-S1743 WeakPolarHBondContact CG2-OG 3.37Å; F1738-S1743 WeakPolarHBondContact CD2-OG 3.37Å; F1738-S1743 VanDerWaalsContact CE2-OG 3.28Å; F1738-S1743 WeakPolarHBondContact CE2-OG 3.4Å; F1738-S1743 PolarHBondContact O-OG 3.42Å; F1738-S1743 VanDerWaalsContact O-OG 3.07Å; H1741-S1743 PolarHBondContact O-N 3.17Å; S1743-G1745 PolarHBondContact O-N 3.23Å
1744S56.1Low72.9Confident96.6 Ų96.655.6 Ų55.668%0.67629%0.288SS*.THydrogen-bonded Turntrans-86.527.5-168.365.90000115.2K1742K1742-S1744 PolarHBondContact O-N 2.89Å; K1742-S1744 VanDerWaalsContact O-N 3.1Å
1745G64.4Low71.4Confident18.2 Ų18.252.1 Ų52.119%0.18827%0.274CS..THydrogen-bonded Turntrans-87.7-19.6-176.800000115.1V1211 L1609 S1743V1211-G1745 WeakPolarHBondContact CG2-O 3.45Å; L1609-G1745 VanDerWaalsContact CD2-O 3.29Å; L1609-G1745 WeakPolarHBondContact CD2-O 3.4Å; S1743-G1745 PolarHBondContact O-N 3.23Å
1746I76.9Confident69.7Low20.6 Ų20.650.9 Ų50.911%0.10627%0.27CS..SBendtrans-124.6136.1-179.4-59.3179.8000108.8F1202 L1207 P1608 S1612 F1657 T1661 V1662 F1738F1202-I1746 HydrophobicContact CE2-CD1 4.37Å; L1207-I1746 HydrophobicContact CD1-CD1 4.39Å; L1207-I1746 HydrophobicContact CD1-CG1 4.32Å; P1608-I1746 HydrophobicContact CB-CD1 4.28Å; S1612-I1746 VanDerWaalsContact OG-CG2 3.3Å; S1612-I1746 WeakPolarHBondContact OG-CG2 3.37Å; F1657-I1746 HydrophobicContact CE1-CD1 4.01Å; F1657-I1746 HydrophobicContact CZ-CD1 4Å; T1661-I1746 HydrophobicContact CG2-CD1 4.43Å; V1662-I1746 HydrophobicContact CG2-CB 4.18Å; V1662-I1746 HydrophobicContact CG2-CG2 3.75Å; F1738-I1746 HydrophobicContact CE1-CD1 3.8Å; F1738-I1746 HydrophobicContact CE1-CG1 4.18Å; F1738-I1746 HydrophobicContact CZ-CD1 4.01Å; F1738-I1746 HydrophobicContact CZ-CG1 4.07Å
1747K80.1Confident67.8Low44.8 Ų44.854.3 Ų54.320%0.19529%0.294CS..  trans-77.4137.6176.1-94.7179.6172.5178.50111F1489 N1490 W1493 E1497 Q1658 H1752F1489-K1747 HydrophobicContact CE1-CB 4.22Å; F1489-K1747 HydrophobicContact CE1-CD 4.03Å; F1489-K1747 HydrophobicContact CE1-CG 4.12Å; F1489-K1747 HydrophobicContact CZ-CB 4.36Å; N1490-K1747 VanDerWaalsContact OD1-CE 3.31Å; N1490-K1747 WeakPolarHBondContact OD1-CE 3.32Å; N1490-K1747 PolarHBondContact OD1-NZ 3.31Å; N1490-K1747 VanDerWaalsContact OD1-NZ 3.14Å; W1493-K1747 HydrophobicContact CD2-CB 4.46Å; W1493-K1747 HydrophobicContact CD2-CD 4.01Å; W1493-K1747 HydrophobicContact CE3-CB 4.22Å; W1493-K1747 HydrophobicContact CE3-CD 4.32Å; W1493-K1747 HydrophobicContact CG-CD 4.26Å; W1493-K1747 HydrophobicContact CH2-CB 3.68Å; W1493-K1747 HydrophobicContact CH2-CG 4.47Å; W1493-K1747 VanDerWaalsContact CH2-O 3.3Å; W1493-K1747 WeakPolarHBondContact CH2-O 3.37Å; W1493-K1747 HydrophobicContact CZ2-CB 3.88Å; W1493-K1747 HydrophobicContact CZ2-CD 4.13Å; W1493-K1747 HydrophobicContact CZ2-CG 3.93Å; W1493-K1747 HydrophobicContact CZ3-CB 3.92Å; E1497-K1747 IonicContact OE1-NZ 2.81Å; E1497-K1747 PolarHBondContact OE1-NZ 2.89Å; E1497-K1747 IonicContact OE2-NZ 2.94Å; E1497-K1747 PolarHBondContact OE2-NZ 3.46Å; Q1658-K1747 PolarHBondContact NE2-O 3.13Å; Q1658-K1747 VanDerWaalsContact NE2-O 3.14Å; K1747-H1752 WeakPolarHBondContact CE-CE1 3.32Å; K1747-H1752 PolarHBondContact NZ-CE1 3.42Å; K1747-H1752 VanDerWaalsContact NZ-CE1 3.32Å; K1747-H1752 PolarHBondContact NZ-NE2 3.4Å
1748S81.2Confident65.7Low10 Ų1059.4 Ų59.47%0.0732%0.319CS..  trans-79.6127.5169.1165.80000110.6S1664 D1665 S1750 L1751 H1752S1664-S1748 VanDerWaalsContact OG-CB 3.28Å; S1664-S1748 WeakPolarHBondContact OG-CB 3.34Å; S1664-S1748 PolarHBondContact OG-OG 3.24Å; D1665-S1748 WeakPolarHBondContact OD1-CA 3.37Å; D1665-S1748 WeakPolarHBondContact OD1-CB 3.34Å; D1665-S1748 PolarHBondContact OD1-OG 3.08Å; D1665-S1748 WeakPolarHBondContact OD2-CA 3.29Å; S1748-S1750 VanDerWaalsContact C-N 3.34Å; S1748-S1750 PolarHBondContact OG-N 3.29Å; S1748-S1750 PolarHBondContact OG-OG 3.22Å; S1748-S1750 VanDerWaalsContact OG-OG 3.08Å; S1748-L1751 PolarHBondContact O-N 3.18Å; S1748-L1751 WeakPolarHBondContact OG-CD1 3.34Å; S1748-L1751 WeakPolarHBondContact OG-CG 3.33Å; S1748-L1751 PolarHBondContact OG-N 3.06Å; S1748-H1752 WeakPolarHBondContact O-CB 3.28Å; S1748-H1752 PolarHBondContact O-N 3.01Å; S1748-H1752 VanDerWaalsContact O-N 3.1Å; S1748-H1752 PolarHBondContact O-ND1 2.86Å
1749I83.3Confident63.9Low1.4 Ų1.460.3 Ų60.31%0.00732%0.321CS..Hα-helixtrans-64.3-43176.6-58.4174.6000110.1W1493 A1615 H1616 C1619 Q1658 D1665 L1668 I1669 L1751 H1752 S1753 Y1756W1493-I1749 HydrophobicContact CH2-CB 4.48Å; W1493-I1749 HydrophobicContact CH2-CG1 3.78Å; W1493-I1749 HydrophobicContact CZ2-CG1 4.17Å; A1615-I1749 HydrophobicContact CB-CD1 4.4Å; H1616-I1749 HydrophobicContact CB-CD1 4.43Å; H1616-I1749 HydrophobicContact CB-CG1 4.41Å; C1619-I1749 HydrophobicContact CB-CD1 4.13Å; C1619-I1749 HydrophobicContact CB-CG2 4.31Å; Q1658-I1749 HydrophobicContact CG-CD1 3.91Å; Q1658-I1749 HydrophobicContact CG-CG1 4.42Å; D1665-I1749 VanDerWaalsContact CG-N 3.28Å; D1665-I1749 PolarHBondContact OD1-N 3.18Å; D1665-I1749 WeakPolarHBondContact OD2-CG1 3.25Å; D1665-I1749 PolarHBondContact OD2-N 3.22Å; L1668-I1749 HydrophobicContact CD2-CB 4.28Å; L1668-I1749 HydrophobicContact CD2-CG2 3.78Å; I1669-I1749 HydrophobicContact CD1-CD1 4.35Å; I1749-L1751 VanDerWaalsContact C-N 3.3Å; I1749-L1751 PolarHBondContact O-N 3.27Å; I1749-H1752 PolarHBondContact O-N 3.2Å; I1749-S1753 VanDerWaalsContact O-CB 3.26Å; I1749-S1753 WeakPolarHBondContact O-CB 3.3Å; I1749-S1753 PolarHBondContact O-N 3.03Å; I1749-S1753 VanDerWaalsContact O-N 3.12Å; I1749-Y1756 HydrophobicContact CG2-CD2 4.35Å; I1749-Y1756 HydrophobicContact CG2-CE2 3.53Å
1750S74.4Confident62Low31.8 Ų31.863.7 Ų63.722%0.22233%0.334CS..Hα-helixtrans-66.8-33.8-175.863.10000113.5S1664 D1665 S1748 H1752 S1753 H1754S1664-S1750 PolarHBondContact O-OG 3.31Å; D1665-S1750 WeakPolarHBondContact OD1-CB 3.35Å; D1665-S1750 PolarHBondContact OD1-N 3.26Å; D1665-S1750 PolarHBondContact OD1-OG 3Å; S1748-S1750 VanDerWaalsContact C-N 3.34Å; S1748-S1750 PolarHBondContact OG-N 3.29Å; S1748-S1750 PolarHBondContact OG-OG 3.22Å; S1748-S1750 VanDerWaalsContact OG-OG 3.08Å; S1750-H1752 PolarHBondContact O-N 2.95Å; S1750-H1752 VanDerWaalsContact O-N 3.1Å; S1750-S1753 PolarHBondContact O-N 3.38Å; S1750-H1754 PolarHBondContact O-CD2 2.65Å; S1750-H1754 PolarHBondContact O-N 3.49Å
1751L66Low59.8Low123.6 Ų123.665.1 Ų65.165%0.64735%0.349SS*.Hα-helixtrans-78.8-21.4-179.2-81.7137.5000114.6S1748 I1749S1748-L1751 PolarHBondContact O-N 3.18Å; S1748-L1751 WeakPolarHBondContact OG-CD1 3.34Å; S1748-L1751 WeakPolarHBondContact OG-CG 3.33Å; S1748-L1751 PolarHBondContact OG-N 3.06Å; I1749-L1751 VanDerWaalsContact C-N 3.3Å; I1749-L1751 PolarHBondContact O-N 3.27Å
1752H60.3Low58Low82.4 Ų82.463.8 Ų63.838%0.38135%0.35SS..Hα-helixtrans-117-5.4-171.4-59.785.8000113.7W1493 E1497 K1747 S1748 I1749 S1750 H1754 A1755 Y1756W1493-H1752 HydrophobicContact CZ2-CB 4.12Å; W1493-H1752 PolarHBondContact NE1-O 3.21Å; E1497-H1752 IonicContact OE1-CD2 2.7Å; E1497-H1752 PolarHBondContact OE1-CD2 2.88Å; E1497-H1752 IonicContact OE1-CE1 2.81Å; E1497-H1752 IonicContact OE1-CG 2.63Å; E1497-H1752 IonicContact OE1-ND1 2.79Å; E1497-H1752 PolarHBondContact OE1-ND1 3.24Å; E1497-H1752 IonicContact OE1-NE2 3.69Å; E1497-H1752 PolarHBondContact OE1-NE2 3.3Å; K1747-H1752 WeakPolarHBondContact CE-CE1 3.32Å; K1747-H1752 PolarHBondContact NZ-CE1 3.42Å; K1747-H1752 VanDerWaalsContact NZ-CE1 3.32Å; K1747-H1752 PolarHBondContact NZ-NE2 3.4Å; S1748-H1752 WeakPolarHBondContact O-CB 3.28Å; S1748-H1752 PolarHBondContact O-N 3.01Å; S1748-H1752 VanDerWaalsContact O-N 3.1Å; S1748-H1752 PolarHBondContact O-ND1 2.86Å; I1749-H1752 PolarHBondContact O-N 3.2Å; S1750-H1752 PolarHBondContact O-N 2.95Å; S1750-H1752 VanDerWaalsContact O-N 3.1Å; H1752-H1754 PolarHBondContact O-N 3.27Å; H1752-A1755 WeakPolarHBondContact O-CB 3.28Å; H1752-A1755 PolarHBondContact O-N 2.98Å; H1752-A1755 VanDerWaalsContact O-N 3.09Å; H1752-Y1756 PolarHBondContact O-N 2.85Å
1753S61Low56.6Low11.4 Ų11.463.5 Ų63.58%0.0835%0.351CS..  trans-9999.9179.4-174.70000112.1E1497 I1749 S1750 A1755 Y1756 S1757E1497-S1753 WeakPolarHBondContact OE1-CA 3.45Å; E1497-S1753 PolarHBondContact OE1-OG 2.92Å; E1497-S1753 VanDerWaalsContact OE2-CA 3.27Å; E1497-S1753 WeakPolarHBondContact OE2-CA 3.45Å; E1497-S1753 WeakPolarHBondContact OE2-CB 3.39Å; E1497-S1753 PolarHBondContact OE2-OG 3.13Å; I1749-S1753 VanDerWaalsContact O-CB 3.26Å; I1749-S1753 WeakPolarHBondContact O-CB 3.3Å; I1749-S1753 PolarHBondContact O-N 3.03Å; I1749-S1753 VanDerWaalsContact O-N 3.12Å; S1750-S1753 PolarHBondContact O-N 3.38Å; S1753-A1755 PolarHBondContact O-N 3.31Å; S1753-Y1756 WeakPolarHBondContact O-CB 3.28Å; S1753-Y1756 PolarHBondContact O-N 3.34Å; S1753-Y1756 PolarHBondContact OG-N 3.36Å; S1753-Y1756 VanDerWaalsContact OG-N 3.13Å; S1753-S1757 WeakPolarHBondContact O-CB 3.08Å; S1753-S1757 PolarHBondContact O-N 3.24Å
1754H53.9Low55.4Low134.2 Ų134.267.2 Ų67.262%0.62137%0.371SS*.Hα-helixtrans-67.2-33.1172.7-71.4-82.1000112E1497 S1750 H1752 Y1756 S1757 L1758E1497-H1754 VanDerWaalsContact OE1-CA 3.29Å; E1497-H1754 WeakPolarHBondContact OE1-CA 3.42Å; E1497-H1754 WeakPolarHBondContact OE1-CB 3.32Å; E1497-H1754 IonicContact OE1-CD2 3.07Å; E1497-H1754 PolarHBondContact OE1-CD2 3.35Å; E1497-H1754 VanDerWaalsContact OE1-CD2 3.28Å; E1497-H1754 IonicContact OE1-CG 3.69Å; E1497-H1754 PolarHBondContact OE1-N 3.02Å; S1750-H1754 PolarHBondContact O-CD2 2.65Å; S1750-H1754 PolarHBondContact O-N 3.49Å; H1752-H1754 PolarHBondContact O-N 3.27Å; H1754-Y1756 VanDerWaalsContact C-N 3.29Å; H1754-Y1756 PolarHBondContact O-N 3.15Å; H1754-S1757 PolarHBondContact O-N 3.16Å; H1754-L1758 VanDerWaalsContact O-CB 3.31Å; H1754-L1758 WeakPolarHBondContact O-CB 3.32Å; H1754-L1758 VanDerWaalsContact O-CG 3.23Å; H1754-L1758 WeakPolarHBondContact O-CG 3.37Å; H1754-L1758 PolarHBondContact O-N 3.13Å; H1754-L1758 VanDerWaalsContact O-N 3.11Å
1755A51.1Low54.2Low14.2 Ų14.268.3 Ų68.312%0.11737%0.374CS..Hα-helixtrans-58.2-34.9173.200000112.6E1497 F1500 S1501 H1752 S1753 L1758 R1759E1497-A1755 PolarHBondContact OE1-N 3.08Å; F1500-A1755 HydrophobicContact CB-CB 4.05Å; S1501-A1755 WeakPolarHBondContact OG-CA 3.39Å; S1501-A1755 WeakPolarHBondContact OG-CB 3.45Å; S1501-A1755 PolarHBondContact OG-N 3.24Å; S1501-A1755 VanDerWaalsContact OG-N 3.12Å; H1752-A1755 WeakPolarHBondContact O-CB 3.28Å; H1752-A1755 PolarHBondContact O-N 2.98Å; H1752-A1755 VanDerWaalsContact O-N 3.09Å; S1753-A1755 PolarHBondContact O-N 3.31Å; A1755-L1758 PolarHBondContact O-N 3.39Å; A1755-R1759 WeakPolarHBondContact O-CB 3.45Å; A1755-R1759 VanDerWaalsContact O-CD 3.26Å; A1755-R1759 WeakPolarHBondContact O-CD 3.4Å; A1755-R1759 VanDerWaalsContact O-CG 3.28Å; A1755-R1759 WeakPolarHBondContact O-CG 3.44Å; A1755-R1759 PolarHBondContact O-N 3.12Å; A1755-R1759 PolarHBondContact O-NE 2.91Å; A1755-R1759 VanDerWaalsContact O-NE 3.11Å
1756Y51.4Low52.4Low36.2 Ų36.270.7 Ų70.714%0.14240%0.398CS..Hα-helixtrans-70.9-45.2173.4-136.9-93.5000112.4F1500 R1508 C1619 C1620 D1627 L1668 R1672 I1749 H1752 S1753 H1754 L1758 R1759 F1760F1500-Y1756 WeakPolarHBondContact O-CE2 3.34Å; R1508-Y1756 PolarHBondContact NH1-OH 3.32Å; R1508-Y1756 VanDerWaalsContact NH1-OH 3.09Å; C1619-Y1756 PolarHBondContact O-OH 3.15Å; C1619-Y1756 PolarHBondContact SG-OH 3.4Å; C1620-Y1756 VanDerWaalsContact CA-OH 3.29Å; C1620-Y1756 WeakPolarHBondContact CA-OH 3.48Å; C1620-Y1756 PolarHBondContact N-OH 3.18Å; C1620-Y1756 VanDerWaalsContact N-OH 3.1Å; C1620-Y1756 PolarHBondContact SG-OH 3.4Å; C1620-Y1756 VanDerWaalsContact SG-OH 3.35Å; D1627-Y1756 PolarHBondContact OD2-OH 2.87Å; L1668-Y1756 HydrophobicContact CD1-CD1 4.2Å; L1668-Y1756 HydrophobicContact CD1-CD2 3.83Å; L1668-Y1756 HydrophobicContact CD1-CE1 3.3Å; L1668-Y1756 HydrophobicContact CD1-CE2 3.35Å; L1668-Y1756 VanDerWaalsContact CD1-CE2 3.41Å; L1668-Y1756 HydrophobicContact CD2-CD1 4.41Å; L1668-Y1756 HydrophobicContact CD2-CD2 4.22Å; L1668-Y1756 HydrophobicContact CD2-CE1 4.13Å; L1668-Y1756 HydrophobicContact CD2-CE2 4.06Å; L1668-Y1756 HydrophobicContact CD2-CG 4.29Å; L1668-Y1756 HydrophobicContact CG-CE1 4.27Å; L1668-Y1756 HydrophobicContact CG-CE2 4.22Å; R1672-Y1756 PolarHBondContact NE-OH 3.18Å; R1672-Y1756 VanDerWaalsContact NH2-CE1 3.26Å; R1672-Y1756 PolarHBondContact NH2-OH 3.06Å; I1749-Y1756 HydrophobicContact CG2-CD2 4.35Å; I1749-Y1756 HydrophobicContact CG2-CE2 3.53Å; H1752-Y1756 PolarHBondContact O-N 2.85Å; S1753-Y1756 WeakPolarHBondContact O-CB 3.28Å; S1753-Y1756 PolarHBondContact O-N 3.34Å; S1753-Y1756 PolarHBondContact OG-N 3.36Å; S1753-Y1756 VanDerWaalsContact OG-N 3.13Å; H1754-Y1756 VanDerWaalsContact C-N 3.29Å; H1754-Y1756 PolarHBondContact O-N 3.15Å; Y1756-L1758 VanDerWaalsContact C-N 3.31Å; Y1756-L1758 PolarHBondContact O-N 3.04Å; Y1756-L1758 VanDerWaalsContact O-N 3.13Å; Y1756-R1759 PolarHBondContact O-N 3.24Å; Y1756-R1759 VanDerWaalsContact O-N 3.14Å; Y1756-F1760 AromaticContact CD1-CD2 3.73Å; Y1756-F1760 HydrophobicContact CD1-CD2 3.94Å; Y1756-F1760 AromaticContact CD1-CE2 3.75Å; Y1756-F1760 HydrophobicContact CD1-CE2 3.85Å; Y1756-F1760 HydrophobicContact CD1-CZ 4.49Å; Y1756-F1760 HydrophobicContact CD2-CD2 4.1Å; Y1756-F1760 HydrophobicContact CD2-CE2 4.07Å; Y1756-F1760 AromaticContact CE1-CD2 3.63Å; Y1756-F1760 HydrophobicContact CE1-CD2 3.63Å; Y1756-F1760 AromaticContact CE1-CE2 3.8Å; Y1756-F1760 HydrophobicContact CE1-CE2 3.8Å; Y1756-F1760 AromaticContact CE2-CD2 3.5Å; Y1756-F1760 HydrophobicContact CE2-CD2 3.83Å; Y1756-F1760 VanDerWaalsContact CE2-CD2 3.49Å; Y1756-F1760 HydrophobicContact CE2-CE1 4.34Å; Y1756-F1760 AromaticContact CE2-CE2 3.49Å; Y1756-F1760 HydrophobicContact CE2-CE2 3.49Å; Y1756-F1760 VanDerWaalsContact CE2-CE2 3.47Å; Y1756-F1760 HydrophobicContact CE2-CG 4.14Å; Y1756-F1760 AromaticContact CE2-CZ 3.71Å; Y1756-F1760 HydrophobicContact CE2-CZ 3.71Å; Y1756-F1760 HydrophobicContact CG-CD2 4.21Å; Y1756-F1760 HydrophobicContact CG-CE2 4.25Å; Y1756-F1760 AromaticContact CZ-CD2 3.91Å; Y1756-F1760 AromaticContact CZ-CE2 3.53Å; Y1756-F1760 VanDerWaalsContact O-CD2 3.23Å; Y1756-F1760 WeakPolarHBondContact O-CD2 3.39Å; Y1756-F1760 PolarHBondContact O-N 3.1Å
1757S45.5Very low49.9Very low72.6 Ų72.674.9 Ų74.951%0.50843%0.429SS..Hα-helixtrans-61.3-29.1-177.6-169.90000113.6S1753 H1754 S1761S1753-S1757 WeakPolarHBondContact O-CB 3.08Å; S1753-S1757 PolarHBondContact O-N 3.24Å; H1754-S1757 PolarHBondContact O-N 3.16Å; S1757-S1761 WeakPolarHBondContact O-CB 3.35Å; S1757-S1761 PolarHBondContact O-N 3.08Å; S1757-S1761 PolarHBondContact O-OG 2.94Å
1758L37.9Very low47.5Very low121 Ų12180.3 Ų80.363%0.63446%0.459SS*.Hα-helixtrans-81.2-38.2177.3-68.4172000112.6H1754 A1755 Y1756 F1760 S1761H1754-L1758 VanDerWaalsContact O-CB 3.31Å; H1754-L1758 WeakPolarHBondContact O-CB 3.32Å; H1754-L1758 VanDerWaalsContact O-CG 3.23Å; H1754-L1758 WeakPolarHBondContact O-CG 3.37Å; H1754-L1758 PolarHBondContact O-N 3.13Å; H1754-L1758 VanDerWaalsContact O-N 3.11Å; A1755-L1758 PolarHBondContact O-N 3.39Å; Y1756-L1758 VanDerWaalsContact C-N 3.31Å; Y1756-L1758 PolarHBondContact O-N 3.04Å; Y1756-L1758 VanDerWaalsContact O-N 3.13Å; L1758-F1760 VanDerWaalsContact C-N 3.3Å; L1758-F1760 PolarHBondContact O-N 3.27Å; L1758-S1761 WeakPolarHBondContact O-CB 3.49Å; L1758-S1761 PolarHBondContact O-N 2.83Å
1759R46.7Very low45Very low56.6 Ų56.685.8 Ų85.821%0.21449%0.493CS..Hα-helixtrans-76-16.5-173.8-66.8177.6-167.5-158.8-0114.4F1500 S1501 G1623 S1624 D1626 D1627 A1755 Y1756 T1762F1500-R1759 PolarHBondContact O-NH2 3.21Å; S1501-R1759 PolarHBondContact O-NH1 2.96Å; S1501-R1759 PolarHBondContact OG-NH1 3.13Å; S1501-R1759 VanDerWaalsContact OG-NH1 3.12Å; G1623-R1759 WeakPolarHBondContact O-CD 3.41Å; G1623-R1759 PolarHBondContact O-NH1 3.15Å; S1624-R1759 PolarHBondContact OG-NH1 3.18Å; D1626-R1759 PolarHBondContact O-NH1 2.74Å; D1627-R1759 IonicContact OD2-CZ 2.92Å; D1627-R1759 IonicContact OD2-NH1 3.31Å; D1627-R1759 PolarHBondContact OD2-NH1 3.34Å; D1627-R1759 IonicContact OD2-NH2 3.32Å; D1627-R1759 PolarHBondContact OD2-NH2 3.32Å; A1755-R1759 WeakPolarHBondContact O-CB 3.45Å; A1755-R1759 VanDerWaalsContact O-CD 3.26Å; A1755-R1759 WeakPolarHBondContact O-CD 3.4Å; A1755-R1759 VanDerWaalsContact O-CG 3.28Å; A1755-R1759 WeakPolarHBondContact O-CG 3.44Å; A1755-R1759 PolarHBondContact O-N 3.12Å; A1755-R1759 PolarHBondContact O-NE 2.91Å; A1755-R1759 VanDerWaalsContact O-NE 3.11Å; Y1756-R1759 PolarHBondContact O-N 3.24Å; Y1756-R1759 VanDerWaalsContact O-N 3.14Å; R1759-T1762 PolarHBondContact O-OG1 3.14Å; R1759-T1762 VanDerWaalsContact O-OG1 3.12Å
1760F42.8Very low42.5Very low78.6 Ų78.694.8 Ų94.835%0.34554%0.535SS..THydrogen-bonded Turntrans-97.9-9.3176.3-79.6-88.4000114.1P1628 L1668 Q1671 Y1756 L1758 T1762 H1763P1628-F1760 HydrophobicContact CG-CB 4.33Å; P1628-F1760 HydrophobicContact CG-CD1 3.7Å; P1628-F1760 HydrophobicContact CG-CE1 4.14Å; P1628-F1760 HydrophobicContact CG-CG 3.97Å; L1668-F1760 HydrophobicContact CD1-CE2 4.24Å; L1668-F1760 HydrophobicContact CD1-CZ 4.27Å; Q1671-F1760 VanDerWaalsContact CD-CZ 3.5Å; Q1671-F1760 VanDerWaalsContact OE1-CZ 3.28Å; Y1756-F1760 AromaticContact CD1-CD2 3.73Å; Y1756-F1760 HydrophobicContact CD1-CD2 3.94Å; Y1756-F1760 AromaticContact CD1-CE2 3.75Å; Y1756-F1760 HydrophobicContact CD1-CE2 3.85Å; Y1756-F1760 HydrophobicContact CD1-CZ 4.49Å; Y1756-F1760 HydrophobicContact CD2-CD2 4.1Å; Y1756-F1760 HydrophobicContact CD2-CE2 4.07Å; Y1756-F1760 AromaticContact CE1-CD2 3.63Å; Y1756-F1760 HydrophobicContact CE1-CD2 3.63Å; Y1756-F1760 AromaticContact CE1-CE2 3.8Å; Y1756-F1760 HydrophobicContact CE1-CE2 3.8Å; Y1756-F1760 AromaticContact CE2-CD2 3.5Å; Y1756-F1760 HydrophobicContact CE2-CD2 3.83Å; Y1756-F1760 VanDerWaalsContact CE2-CD2 3.49Å; Y1756-F1760 HydrophobicContact CE2-CE1 4.34Å; Y1756-F1760 AromaticContact CE2-CE2 3.49Å; Y1756-F1760 HydrophobicContact CE2-CE2 3.49Å; Y1756-F1760 VanDerWaalsContact CE2-CE2 3.47Å; Y1756-F1760 HydrophobicContact CE2-CG 4.14Å; Y1756-F1760 AromaticContact CE2-CZ 3.71Å; Y1756-F1760 HydrophobicContact CE2-CZ 3.71Å; Y1756-F1760 HydrophobicContact CG-CD2 4.21Å; Y1756-F1760 HydrophobicContact CG-CE2 4.25Å; Y1756-F1760 AromaticContact CZ-CD2 3.91Å; Y1756-F1760 AromaticContact CZ-CE2 3.53Å; Y1756-F1760 VanDerWaalsContact O-CD2 3.23Å; Y1756-F1760 WeakPolarHBondContact O-CD2 3.39Å; Y1756-F1760 PolarHBondContact O-N 3.1Å; L1758-F1760 VanDerWaalsContact C-N 3.3Å; L1758-F1760 PolarHBondContact O-N 3.27Å; F1760-T1762 VanDerWaalsContact C-N 3.32Å; F1760-T1762 PolarHBondContact O-N 3.37Å; F1760-H1763 PolarHBondContact O-N 3.06Å
1761S33.7Very low40.3Very low81.2 Ų81.299 Ų9957%0.56856%0.559SS**SBendtrans-76.6-9.3-179.4-1500000114.2S1757 L1758 H1763 V1765S1757-S1761 WeakPolarHBondContact O-CB 3.35Å; S1757-S1761 PolarHBondContact O-N 3.08Å; S1757-S1761 PolarHBondContact O-OG 2.94Å; L1758-S1761 WeakPolarHBondContact O-CB 3.49Å; L1758-S1761 PolarHBondContact O-N 2.83Å; S1761-H1763 VanDerWaalsContact C-N 3.28Å; S1761-H1763 PolarHBondContact O-N 3.41Å; S1761-V1765 WeakPolarHBondContact O-CG2 3.31Å
1762T32.5Very low38.6Very low94.2 Ų94.2100.9 Ų100.958%0.57857%0.565SS**THydrogen-bonded Turntrans-99.7-13-176.248.40000114.4R1759 F1760R1759-T1762 PolarHBondContact O-OG1 3.14Å; R1759-T1762 VanDerWaalsContact O-OG1 3.12Å; F1760-T1762 VanDerWaalsContact C-N 3.32Å; F1760-T1762 PolarHBondContact O-N 3.37Å
1763H33.6Very low37.1Very low155.4 Ų155.4105.9 Ų105.972%0.71959%0.589SS**SBendtrans-118.114.1-173.1-65.8-71.3000116.2F1760 S1761 V1765F1760-H1763 PolarHBondContact O-N 3.06Å; S1761-H1763 VanDerWaalsContact C-N 3.28Å; S1761-H1763 PolarHBondContact O-N 3.41Å; H1763-V1765 VanDerWaalsContact C-N 3.3Å; H1763-V1765 HydrophobicContact CB-CG2 4.08Å; H1763-V1765 PolarHBondContact O-N 2.92Å
1764T31.2Very low35.6Very low126 Ų126110.1 Ų110.177%0.77362%0.617SS**SBendtrans-11525.1170.514.70000113G1766T1764-G1766 PolarHBondContact O-N 2.93Å
1765V30.3Very low34.5Very low120.6 Ų120.6111.3 Ų111.373%0.73162%0.624SS**  trans-104.167.9179.7-168.30000110.7S1761 H1763S1761-V1765 WeakPolarHBondContact O-CG2 3.31Å; H1763-V1765 VanDerWaalsContact C-N 3.3Å; H1763-V1765 HydrophobicContact CB-CG2 4.08Å; H1763-V1765 PolarHBondContact O-N 2.92Å
1766G26.6Very low33.4Very low67.8 Ų67.8117.2 Ų117.270%0.69965%0.652SS**SBendtrans-139.577.4171.800000114.9T1764T1764-G1766 PolarHBondContact O-N 2.93Å
1767S25.4Very low32.4Very low108.8 Ų108.8123.5 Ų123.576%0.76168%0.683SS**  trans175.880.5173-1590000113.4T1769S1767-T1769 PolarHBondContact O-N 3.24Å
1768L27.7Very low31.7Very low158.8 Ų158.8126.2 Ų126.283%0.83169%0.69SS**  trans-129103.6158.4-12698.8000111.1
1769T30.2Very low31.3Very low125.8 Ų125.8126.7 Ų126.777%0.77269%0.694SS**  trans-88.5133.1167.151.20000112.1S1767 T1771S1767-T1769 PolarHBondContact O-N 3.24Å; T1769-T1771 PolarHBondContact O-N 3.18Å
1770Q29.9Very low30.6Very low188.8 Ų188.8132.8 Ų132.888%0.88272%0.724SS**  trans-78.1106.7176.6-132.3175.81000112.6
1771T28.5Very low29.8Very low121 Ų121136.8 Ų136.874%0.74274%0.744SS**SBendtrans-160.453.2169.6-8.90000115.4T1769T1769-T1771 PolarHBondContact O-N 3.18Å
1772Q31.4Very low29.4Very low163.4 Ų163.4138.1 Ų138.176%0.76475%0.753SS**  trans-150.457.1149.5-109.2-176.163.800114.3S1774 R1833Q1772-S1774 PolarHBondContact O-N 3.35Å; Q1772-S1774 VanDerWaalsContact O-N 3.11Å; Q1772-R1833 VanDerWaalsContact NE2-NE 3.1Å
1773Q28.4Very low29.2Very low188.2 Ų188.2141 Ų14188%0.87977%0.765SS**  trans-90.577.4172.2-73.1179.3-27.600111.2Q1775Q1773-Q1775 VanDerWaalsContact C-N 3.33Å; Q1773-Q1775 PolarHBondContact O-N 2.85Å
1774S28.6Very low28.8Very low98 Ų98140.9 Ų140.969%0.68577%0.767SS**  trans-150.8103.2161.8490000113.2Q1772Q1772-S1774 PolarHBondContact O-N 3.35Å; Q1772-S1774 VanDerWaalsContact O-N 3.11Å
1775Q31.1Very low28.5Very low161 Ų161143.5 Ų143.575%0.75277%0.767SS**SBendtrans81.380.2173.6-69.6-176.732.900116.4Q1773 R1833Q1773-Q1775 VanDerWaalsContact C-N 3.33Å; Q1773-Q1775 PolarHBondContact O-N 2.85Å; Q1775-R1833 PolarHBondContact O-NH1 2.8Å; Q1775-R1833 PolarHBondContact O-NH2 3.29Å
1776L29Very low28.4Very low138 Ų138144.6 Ų144.672%0.72377%0.769SS**  trans-157.368.4140.6-86.4155.5000113.6R1833 R1834L1776-R1833 VanDerWaalsContact C-NH2 3.3Å; L1776-R1833 HydrophobicContact CD1-CB 4.42Å; L1776-R1833 HydrophobicContact CD2-CB 4.48Å; L1776-R1833 PolarHBondContact O-NH2 3.28Å; L1776-R1834 HydrophobicContact CD2-CB 3.6Å; L1776-R1834 VanDerWaalsContact CD2-CD 3.44Å; L1776-R1834 HydrophobicContact CD2-CG 3.42Å; L1776-R1834 VanDerWaalsContact CD2-CG 3.42Å
1777Q29.2Very low28.5Very low167.8 Ų167.8146.5 Ų146.578%0.78477%0.772SS**  trans-116.2160.6163.5-104178-15.400110.6
1778I31.1Very low28.6Very low129.2 Ų129.2145 Ų14566%0.66377%0.774SS**  trans78.995.1-170.9-53.2170.5000111.2R1834I1778-R1834 PolarHBondContact O-NH2 2.97Å
1779N29Very low28.6Very low130.8 Ų130.8142.4 Ų142.470%0.69977%0.768SS**SBendtrans-144.898.2164.3-91.7-13.5000111.3G1832N1779-G1832 PolarHBondContact ND2-O 2.88Å
1780Q31.5Very low28.5Very low184.4 Ų184.4142.2 Ų142.286%0.86277%0.768SS**SBendcis-146.7119.125.2-101.3178.642.700110
1781Q26.6Very low28.4Very low163 Ų163138.6 Ų138.676%0.76276%0.759SS**  trans-132.9111.9172-118.5176.43.400111.1L1783Q1781-L1783 PolarHBondContact O-N 3.22Å
1782S26.6Very low28.4Very low108.6 Ų108.6141 Ų14176%0.75976%0.761SS**  trans-173.3131.6161.1-148.20000111.5
1783L27.1Very low28.4Very low156 Ų156140.3 Ų140.382%0.81776%0.761SS**  trans161.2129.3161.1-87.6172.2000112.1Q1781Q1781-L1783 PolarHBondContact O-N 3.22Å
1784M25.8Very low28.3Very low153.8 Ų153.8140.5 Ų140.576%0.75875%0.754SS**  trans-149.8125-162.7-85.8-154.7166.700110.9R1291R1291-M1784 PolarHBondContact NH2-O 3.36Å
1785F25.6Very low28.4Very low179.6 Ų179.6142.6 Ų142.679%0.78875%0.753SS**  trans-114.5142140.8-86.5-73.2000111.1
1786N27.7Very low28.2Very low142.8 Ų142.8142.3 Ų142.376%0.76475%0.751SS**  trans161.9145.2153.7-127.69.5000112.8
1787S27.5Very low28Very low109.4 Ų109.4140.1 Ų140.177%0.76575%0.747SS**  trans-47.6128.5147.8-62.60000114.9S1789S1787-S1789 PolarHBondContact O-N 2.98Å
1788G27.2Very low28.1Very low77 Ų77140.8 Ų140.879%0.79475%0.747SS**  trans-152.586168.700000114.5
1789S28.5Very low27.9Very low103 Ų103141.1 Ų141.172%0.7275%0.75SS**  trans-170141.2-171.664.70000113.5S1787S1787-S1789 PolarHBondContact O-N 2.98Å
1790T27.7Very low28.1Very low123.4 Ų123.4143.4 Ų143.476%0.75776%0.757SS**  trans100126.4147-380000115.2
1791T28.4Very low28.1Very low113.2 Ų113.2142 Ų14269%0.69476%0.755SS**  trans115.6124.2135.736.90000119
1792Q28.7Very low28.5Very low170 Ų170141.1 Ų141.179%0.79476%0.756SS**  trans86.6153.2133.8-74.2-175.724.900118.5
1793I30.8Very low28.9Very low149.8 Ų149.8139.1 Ų139.177%0.76875%0.752SS**  trans88.4131.7144.3-59.9172000114.5
1794R27Very low29.1Very low192 Ų192140.7 Ų140.773%0.72575%0.752SS**  cis138.4129-8.7-172.7179.7170.3-151.7-16.8111.9E1796R1794-E1796 IonicContact CZ-OE1 2.61Å; R1794-E1796 IonicContact NE-OE1 2.69Å; R1794-E1796 PolarHBondContact NE-OE1 3.36Å; R1794-E1796 IonicContact NH2-OE1 3.14Å; R1794-E1796 PolarHBondContact NH2-OE1 3.41Å
1795E29.6Very low29.4Very low141.4 Ų141.4145.2 Ų145.266%0.66176%0.761SS**  trans102153.6152.4-90.5158.3-16000113.5
1796E26.6Very low29.7Very low154.8 Ų154.8146.2 Ų146.272%0.72377%0.765SS**  cis167.5159.910.6-114.7-169.3166.800113.6R1794 K1798R1794-E1796 IonicContact CZ-OE1 2.61Å; R1794-E1796 IonicContact NE-OE1 2.69Å; R1794-E1796 PolarHBondContact NE-OE1 3.36Å; R1794-E1796 IonicContact NH2-OE1 3.14Å; R1794-E1796 PolarHBondContact NH2-OE1 3.41Å; E1796-K1798 IonicContact OE1-NZ 2.67Å; E1796-K1798 PolarHBondContact OE1-NZ 3.44Å
1797C26.5Very low30Very low92.8 Ų92.8145.5 Ų145.563%0.62777%0.768SS**  trans161.6156.9155-910000116.5
1798K29.7Very low30.1Very low182.4 Ų182.4145.2 Ų145.279%0.79377%0.766SS**  168.9159.1101.8-102.1170.6-174.4163.50113.7E1796E1796-K1798 IonicContact OE1-NZ 2.67Å; E1796-K1798 PolarHBondContact OE1-NZ 3.44Å
1799N27.7Very low30.3Very low134.2 Ų134.2148.9 Ų148.972%0.71877%0.766SS**  trans-178.7167.2-172.9-60.9-3.2000113.2
1800E33.6Very low30.5Very low179.6 Ų179.6152 Ų15284%0.83977%0.769SS**  171.7143.3113.1-94.4164.6-167.700108.9
1801D32.2Very low30.7Very low155 Ų155153.2 Ų153.283%0.82977%0.769SS**  cis158.1165.8-1-158.613.1000112.4
1802D34.4Very low30.9Very low145 Ų145151.2 Ų151.278%0.77577%0.77SS**  trans52.9160.4174.1-137.1-14.1000119.3
1803G34.7Very low31.1Very low66.2 Ų66.2148.6 Ų148.668%0.68277%0.772SS**  trans158.259.5167.500000119.8
1804K31.2Very low31.1Very low188.6 Ų188.6148.8 Ų148.882%0.8277%0.774SS**  trans-19.6140.4167.9-75.3164.6-175.7152.90116.9
1805R32.6Very low31.4Very low249.2 Ų249.2145.4 Ų145.494%0.9478%0.78SS**  171.9140.2129.6-91.2163.5-156.5-139.55.5116
1806K30.6Very low31.4Very low201 Ų201142.2 Ų142.287%0.87479%0.785SS**  trans-109.3167.8160.3-81.2-174.2174.4-178.50109.2
1807P35.4Very low31.6Very low127.2 Ų127.2143.4 Ų143.483%0.82679%0.793SS**  -136.5175.5104.439.9-26.8000116.3
1808S29Very low31.9Very low103.8 Ų103.8145.3 Ų145.373%0.72680%0.801SS**  trans-153.5148.2168.657.20000115.7
1809I32.5Very low31.8Very low154.2 Ų154.2143.9 Ų143.979%0.79180%0.802SS**  trans145134.6151.9-70.1163.7000112.9I1811I1809-I1811 HydrophobicContact CG2-CD1 4.43Å
1810H30.9Very low31.9Very low167.8 Ų167.8140.5 Ų140.578%0.77780%0.799SS**  cis177.614247.5-133.4-73.8000110.6
1811I31.7Very low31.9Very low148.8 Ų148.8138.5 Ų138.576%0.76380%0.799SS**  trans92.1136.4138.3-49.6170.7000114.1I1809I1809-I1811 HydrophobicContact CG2-CD1 4.43Å
1812G33.5Very low31.8Very low70.6 Ų70.6140 Ų14073%0.72880%0.8SS**  trans151.2134.4159.100000114.1
1813S33.8Very low31.5Very low117 Ų117143.2 Ų143.282%0.81880%0.802SS**  trans-125154.4-176.4-61.90000113.1
1814D29.8Very low31.2Very low153 Ų153145.2 Ų145.282%0.81880%0.803SS**  trans151.2149.1134.7-104.4-40.5000118.8
1815S33.3Very low31Very low120.6 Ų120.6144.3 Ų144.384%0.84380%0.801SS**  trans74.1129.1148.6-101.30000119.7
1816G30.5Very low30.8Very low75 Ų75141.6 Ų141.677%0.77380%0.796SS**  trans154.838.9159.600000119
1817M29.1Very low30.6Very low180.2 Ų180.2142.3 Ų142.389%0.88879%0.794SS**  trans-33.1144.9173.6-145.617273.100115.6
1818V33.7Very low30.3Very low132 Ų132145 Ų14580%0.879%0.793SS**  trans-174.6150.6158.7-119.50000114.1
1819D27.5Very low30.2Very low153 Ų153144.7 Ų144.782%0.81879%0.791SS**  trans-78152.4-173.7-119.8-36.3000114.2
1820G30.3Very low30.3Very low62.6 Ų62.6146 Ų14665%0.64579%0.793SS**  trans177.774.3-168.200000114.8Q1822G1820-Q1822 PolarHBondContact O-N 3.23Å; G1820-Q1822 VanDerWaalsContact O-N 3.14Å
1821V33Very low30.2Very low137.6 Ų137.6141.3 Ų141.383%0.83479%0.789SS**  trans-79.2106.6-179.2-177.10000111.8R1823V1821-R1823 PolarHBondContact O-N 2.89Å; V1821-R1823 VanDerWaalsContact O-N 3.12Å
1822Q29.8Very low30.1Very low185.6 Ų185.6137.5 Ų137.587%0.86779%0.787SS**PPolyproline II helixtrans-76130.3174.4-65.1179.4-5.400111.4G1820G1820-Q1822 PolarHBondContact O-N 3.23Å; G1820-Q1822 VanDerWaalsContact O-N 3.14Å
1823R27.6Very low30Very low212.8 Ų212.8143 Ų14380%0.80379%0.786SS**PPolyproline II helixtrans-97.8141164.4-138179.9-140176.4-0.6109.7V1821 H1825V1821-R1823 PolarHBondContact O-N 2.89Å; V1821-R1823 VanDerWaalsContact O-N 3.12Å; R1823-H1825 PolarHBondContact O-CD2 3.5Å; R1823-H1825 VanDerWaalsContact O-CD2 3.25Å; R1823-H1825 PolarHBondContact O-N 3.09Å
1824P28.4Very low29.9Very low109 Ų109148.3 Ų148.371%0.70879%0.788SS**PPolyproline II helixtrans-72127.9-16817.8-22.4000113.2F1826P1824-F1826 HydrophobicContact CG-CD2 4.45Å; P1824-F1826 HydrophobicContact CG-CE2 4.09Å; P1824-F1826 PolarHBondContact O-N 2.94Å; P1824-F1826 VanDerWaalsContact O-N 3.16Å
1825H28.4Very low29.9Very low169.8 Ų169.8146.5 Ų146.579%0.78679%0.788SS**  trans-75.7114.5169.7-79.5-108000110.8R1823 R1827R1823-H1825 PolarHBondContact O-CD2 3.5Å; R1823-H1825 VanDerWaalsContact O-CD2 3.25Å; R1823-H1825 PolarHBondContact O-N 3.09Å; H1825-R1827 PolarHBondContact O-N 3.15Å; H1825-R1827 VanDerWaalsContact O-N 3.11Å
1826F26.9Very low29.8Very low191.4 Ų191.4151.9 Ų151.984%0.83979%0.79SS**  trans-78.7114.3156.2-84-87.4000109.3P1824 F1828P1824-F1826 HydrophobicContact CG-CD2 4.45Å; P1824-F1826 HydrophobicContact CG-CE2 4.09Å; P1824-F1826 PolarHBondContact O-N 2.94Å; P1824-F1826 VanDerWaalsContact O-N 3.16Å; F1826-F1828 PolarHBondContact O-N 3Å
1827R27.3Very low29.7Very low217 Ų217153.9 Ų153.982%0.81979%0.789SS**  trans-87.8119.7172-67.9-176.8-159.61700.1109.3H1825 S1829H1825-R1827 PolarHBondContact O-N 3.15Å; H1825-R1827 VanDerWaalsContact O-N 3.11Å; R1827-S1829 PolarHBondContact O-N 3.23Å; R1827-S1829 VanDerWaalsContact O-N 3.1Å
1828F29.3Very low29.9Very low183.6 Ų183.6149.7 Ų149.781%0.80578%0.777SS**  trans-85117.8154.7-93.6-85.7000108.6F1826 H1830F1826-F1828 PolarHBondContact O-N 3Å; F1828-H1830 VanDerWaalsContact C-N 3.29Å; F1828-H1830 PolarHBondContact O-N 2.91Å
1829S27.5Very low29.8Very low97.2 Ų97.2150.6 Ų150.668%0.6878%0.776SS**  trans-96.7101.3-174.2-78.50000111.2R1827 G1831R1827-S1829 PolarHBondContact O-N 3.23Å; R1827-S1829 VanDerWaalsContact O-N 3.1Å; S1829-G1831 PolarHBondContact O-N 3.37Å
1830H33.3Very low30Very low181.6 Ų181.6148 Ų14884%0.84177%0.77SS**  trans-65.8112.7160.7-69-66.8000111.2F1828 G1832F1828-H1830 VanDerWaalsContact C-N 3.29Å; F1828-H1830 PolarHBondContact O-N 2.91Å; H1830-G1832 PolarHBondContact O-N 3.38Å
1831G29.6Very low30.1Very low68 Ų68150.2 Ų150.270%0.70178%0.776SS**  trans-90.9144.7179.100000112S1829 R1833S1829-G1831 PolarHBondContact O-N 3.37Å; G1831-R1833 PolarHBondContact O-N 3.47Å
1832G29Very low30Very low69.6 Ų69.6149 Ų14972%0.71877%0.769SS**  trans-10896.1-174.900000115N1779 H1830N1779-G1832 PolarHBondContact ND2-O 2.88Å; H1830-G1832 PolarHBondContact O-N 3.38Å
1833R32.6Very low30.1Very low186.6 Ų186.6145.9 Ų145.970%0.70477%0.766SS**  trans-118.8126.6153.5-77-165-154-119.31.3109.1Q1772 Q1775 L1776 G1831 S1835Q1772-R1833 VanDerWaalsContact NE2-NE 3.1Å; Q1775-R1833 PolarHBondContact O-NH1 2.8Å; Q1775-R1833 PolarHBondContact O-NH2 3.29Å; L1776-R1833 VanDerWaalsContact C-NH2 3.3Å; L1776-R1833 HydrophobicContact CD1-CB 4.42Å; L1776-R1833 HydrophobicContact CD2-CB 4.48Å; L1776-R1833 PolarHBondContact O-NH2 3.28Å; G1831-R1833 PolarHBondContact O-N 3.47Å; R1833-S1835 PolarHBondContact O-N 3.15Å
1834R30.7Very low30.4Very low227.2 Ų227.2139.2 Ų139.286%0.85776%0.762SS**  trans-40.5113.2-178.4-64.6179.4-176.2-176.2-0.2113.6L1776 I1778 R1836L1776-R1834 HydrophobicContact CD2-CB 3.6Å; L1776-R1834 VanDerWaalsContact CD2-CD 3.44Å; L1776-R1834 HydrophobicContact CD2-CG 3.42Å; L1776-R1834 VanDerWaalsContact CD2-CG 3.42Å; I1778-R1834 PolarHBondContact O-NH2 2.97Å; R1834-R1836 PolarHBondContact O-N 3.19Å
1835S30.9Very low30.6Very low116.4 Ų116.4141.6 Ų141.681%0.81477%0.768SS**  trans-71.2112160.534.90000111.3R1833R1833-S1835 PolarHBondContact O-N 3.15Å
1836R31Very low30.7Very low233 Ų233141.5 Ų141.588%0.87977%0.773SS**  trans-55.2135.9159.1-82.5-178.1164.4-177.5-5.1110R1834 S1838R1834-R1836 PolarHBondContact O-N 3.19Å; R1836-S1838 PolarHBondContact O-N 3.04Å; R1836-S1838 VanDerWaalsContact O-N 3.13Å
1837P28.8Very low30.8Very low118.2 Ų118.2138.9 Ų138.977%0.76877%0.773SS**  trans-69.7130.5170.529.7-33.1000109.4I1839P1837-I1839 PolarHBondContact O-N 3.15Å; P1837-I1839 VanDerWaalsContact O-N 3.13Å
1838S31.6Very low30.9Very low91.6 Ų91.6132.1 Ų132.164%0.64177%0.77SS**  trans-80126167.2-174.30000108.5R1836 S1840 S1841R1836-S1838 PolarHBondContact O-N 3.04Å; R1836-S1838 VanDerWaalsContact O-N 3.13Å; S1838-S1840 PolarHBondContact O-N 3.19Å; S1838-S1840 PolarHBondContact OG-N 3.42Å; S1838-S1840 PolarHBondContact OG-OG 3.23Å; S1838-S1840 VanDerWaalsContact OG-OG 3.06Å; S1838-S1841 WeakPolarHBondContact O-CB 3.44Å; S1838-S1841 PolarHBondContact O-N 3.19Å
1839I32.6Very low30.7Very low151.2 Ų151.2126.7 Ų126.778%0.77577%0.766SS**G310 helixtrans-70.127.2-174.8-1174.9000112P1837 S1841 V1842P1837-I1839 PolarHBondContact O-N 3.15Å; P1837-I1839 VanDerWaalsContact O-N 3.13Å; I1839-S1841 PolarHBondContact O-N 3.27Å; I1839-S1841 VanDerWaalsContact O-N 3.13Å; I1839-V1842 HydrophobicContact CG2-CG2 4.01Å; I1839-V1842 WeakPolarHBondContact O-CG2 3.29Å; I1839-V1842 PolarHBondContact O-N 3.09Å
1840S32.3Very low30.9Very low97.8 Ų97.8129.9 Ų129.968%0.68478%0.775SS**G310 helixtrans-84.3-9.4168.4-53.40000112.9S1838 V1842S1838-S1840 PolarHBondContact O-N 3.19Å; S1838-S1840 PolarHBondContact OG-N 3.42Å; S1838-S1840 PolarHBondContact OG-OG 3.23Å; S1838-S1840 VanDerWaalsContact OG-OG 3.06Å; S1840-V1842 VanDerWaalsContact C-N 3.28Å; S1840-V1842 PolarHBondContact O-N 3.12Å
1841S31.9Very low30.7Very low109.2 Ų109.2128.9 Ų128.976%0.76477%0.77SS**G310 helixtrans-94.717.8-175-165.10000114.3S1838 I1839S1838-S1841 WeakPolarHBondContact O-CB 3.44Å; S1838-S1841 PolarHBondContact O-N 3.19Å; I1839-S1841 PolarHBondContact O-N 3.27Å; I1839-S1841 VanDerWaalsContact O-N 3.13Å
1842V31Very low30.7Very low113.2 Ų113.2130.4 Ų130.469%0.68678%0.776SS**G310 helixtrans-12521.8173.8-88.90000112.9I1839 S1840 G1844 L1845I1839-V1842 HydrophobicContact CG2-CG2 4.01Å; I1839-V1842 WeakPolarHBondContact O-CG2 3.29Å; I1839-V1842 PolarHBondContact O-N 3.09Å; S1840-V1842 VanDerWaalsContact C-N 3.28Å; S1840-V1842 PolarHBondContact O-N 3.12Å; V1842-G1844 PolarHBondContact O-N 3.21Å; V1842-L1845 PolarHBondContact O-N 3.49Å
1843C32Very low31Very low120.4 Ų120.4131.1 Ų131.181%0.81477%0.77SS**THydrogen-bonded Turntrans-99.121.6169.2-85.60000112.5L1845C1843-L1845 PolarHBondContact O-N 2.96Å
1844G32.8Very low30.9Very low70.4 Ų70.4129.1 Ų129.173%0.72677%0.769SS**THydrogen-bonded Turntrans-107.85.4-177.600000115.4V1842V1842-G1844 PolarHBondContact O-N 3.21Å
1845L32.5Very low31.2Very low160 Ų160128.3 Ų128.384%0.83877%0.772SS**SBendtrans-136.526.1-174.4-14077.1000114.2V1842 C1843V1842-L1845 PolarHBondContact O-N 3.49Å; C1843-L1845 PolarHBondContact O-N 2.96Å
1846L30.3Very low32.1Very low167 Ų167125.8 Ų125.887%0.87475%0.752SS**  trans-135.461178.9-66.5177.5000112.2G1848L1846-G1848 PolarHBondContact O-N 3.12Å
1847T31Very low33Very low138.2 Ų138.2120.5 Ų120.585%0.84874%0.74SS**  trans-107.677.6164.5-34.10000109.6G1849T1847-G1849 PolarHBondContact O-N 3.18Å
1848G27.6Very low34.3Very low73.2 Ų73.2119.4 Ų119.476%0.75574%0.736SS**  trans-130.987.9162.600000110.7L1846L1846-G1848 PolarHBondContact O-N 3.12Å
1849G26.7Very low35.6Very low70.4 Ų70.4120 Ų12073%0.72673%0.732SS**  trans36.1125.9178.200000116.8T1847T1847-G1849 PolarHBondContact O-N 3.18Å
1850L31.1Very low37.1Very low164 Ų164113.6 Ų113.686%0.85970%0.699SS**  trans-153.7144.6138-92.9171.6000108.9A1852 A2240L1850-A1852 PolarHBondContact O-N 3.3Å; L1850-A2240 HydrophobicContact CD1-CB 3.9Å
1851H27.8Very low38.7Very low160.6 Ų160.6113.4 Ų113.474%0.74469%0.686SS**  trans-77.8110.4-169.2-73.9-116.7000112.2E1854H1851-E1854 IonicContact CE1-OE1 3.36Å; H1851-E1854 IonicContact CG-OE1 3.25Å; H1851-E1854 IonicContact ND1-OE1 2.76Å; H1851-E1854 PolarHBondContact ND1-OE1 3.1Å
1852A31.5Very low40.6Very low100.4 Ų100.4111.5 Ų111.583%0.8366%0.664SS**  trans-149.826.7176.500000113.9L1850L1850-A1852 PolarHBondContact O-N 3.3Å
1853S34.1Very low42.4Very low85 Ų85107.6 Ų107.659%0.59464%0.639SS**  trans-133.131.4-174.3-164.70000113.6K1861S1853-K1861 WeakPolarHBondContact O-CE 3.35Å; S1853-K1861 PolarHBondContact O-NZ 3.09Å
1854E30.9Very low44.2Very low144 Ų144102.8 Ų102.867%0.67361%0.607SS**  trans-101.45.1-170.6-66.8178.9-179.200113.4H1851H1851-E1854 IonicContact CE1-OE1 3.36Å; H1851-E1854 IonicContact CG-OE1 3.25Å; H1851-E1854 IonicContact ND1-OE1 2.76Å; H1851-E1854 PolarHBondContact ND1-OE1 3.1Å
1855F36.2Very low46.1Very low210.8 Ų210.8102 Ų10293%0.92559%0.59SS**SBendtrans-120.243.6-175.7-112-85.2000114.8
1856V50Low48.1Very low63.4 Ų63.494.5 Ų94.538%0.38455%0.551SS.*SBendtrans-126.4124.3164.8-162.30000108.3N1860 K1861V1856-N1860 HydrophobicContact CG1-CB 3.99Å; V1856-K1861 HydrophobicContact CB-CD 4.46Å; V1856-K1861 HydrophobicContact CB-CG 4.18Å; V1856-K1861 HydrophobicContact CG1-CG 4.03Å; V1856-K1861 WeakPolarHBondContact O-CD 3.23Å; V1856-K1861 VanDerWaalsContact O-CE 3.23Å; V1856-K1861 WeakPolarHBondContact O-CE 3.36Å; V1856-K1861 PolarHBondContact O-NZ 3.15Å; V1856-K1861 VanDerWaalsContact O-NZ 3.12Å
1857D50.4Low50.4Low120.6 Ų120.686.9 Ų86.965%0.64551%0.511SS*.  trans-60.8150.9-177-92.3-49.3000112.7N1859 N1860 K1861D1857-N1859 VanDerWaalsContact C-N 3.29Å; D1857-N1859 PolarHBondContact O-N 3.04Å; D1857-N1860 HydrophobicContact CB-CB 4.32Å; D1857-N1860 WeakPolarHBondContact O-CB 3.49Å; D1857-N1860 PolarHBondContact O-N 3.26Å; D1857-N1860 VanDerWaalsContact O-N 3.1Å; D1857-K1861 PolarHBondContact O-N 3.18Å
1858S55.7Low52.4Low95.2 Ų95.284.2 Ų84.267%0.66649%0.489SS*.Hα-helixtrans-61.9-33.4-175.1-60.60000112.9F1862S1858-F1862 PolarHBondContact O-N 3.12Å; S1858-F1862 VanDerWaalsContact O-N 3.13Å
1859N58.9Low54.5Low105.6 Ų105.681.4 Ų81.457%0.56546%0.459SS*.Hα-helixtrans-62.9-46.2174.1-66.4-10000111.1D1857 K1861 F1862 L1863D1857-N1859 VanDerWaalsContact C-N 3.29Å; D1857-N1859 PolarHBondContact O-N 3.04Å; N1859-K1861 VanDerWaalsContact C-N 3.33Å; N1859-K1861 PolarHBondContact O-N 3.16Å; N1859-F1862 WeakPolarHBondContact O-CB 3.36Å; N1859-F1862 PolarHBondContact O-N 3.09Å; N1859-F1862 VanDerWaalsContact O-N 3.15Å; N1859-L1863 WeakPolarHBondContact O-CB 3.4Å; N1859-L1863 VanDerWaalsContact O-CG 3.31Å; N1859-L1863 WeakPolarHBondContact O-CG 3.37Å; N1859-L1863 PolarHBondContact O-N 3.13Å
1860N63.8Low56.7Low15.6 Ų15.678.1 Ų78.18%0.08342%0.424CS..Hα-helixtrans-68.9-34.2-176.8-66.935.8000111.2V1856 D1857 S1864 T1966 D1971V1856-N1860 HydrophobicContact CG1-CB 3.99Å; D1857-N1860 HydrophobicContact CB-CB 4.32Å; D1857-N1860 WeakPolarHBondContact O-CB 3.49Å; D1857-N1860 PolarHBondContact O-N 3.26Å; D1857-N1860 VanDerWaalsContact O-N 3.1Å; N1860-S1864 WeakPolarHBondContact O-CB 3.37Å; N1860-S1864 PolarHBondContact O-N 2.97Å; N1860-S1864 PolarHBondContact O-OG 3.13Å; N1860-T1966 PolarHBondContact ND2-OG1 3.49Å; N1860-D1971 VanDerWaalsContact CB-OD1 3.29Å; N1860-D1971 WeakPolarHBondContact CB-OD1 3.3Å; N1860-D1971 VanDerWaalsContact CB-OD2 3.29Å; N1860-D1971 WeakPolarHBondContact CB-OD2 3.31Å; N1860-D1971 PolarHBondContact ND2-OD1 3.02Å; N1860-D1971 PolarHBondContact ND2-OD2 3.24Å
1861K67Low58.8Low94.2 Ų94.271.8 Ų71.841%0.4139%0.391SS..Hα-helixtrans-62.9-44.2168.7-72.5173.7172.7160.50112.4S1853 V1856 D1857 N1859 S1865S1853-K1861 WeakPolarHBondContact O-CE 3.35Å; S1853-K1861 PolarHBondContact O-NZ 3.09Å; V1856-K1861 HydrophobicContact CB-CD 4.46Å; V1856-K1861 HydrophobicContact CB-CG 4.18Å; V1856-K1861 HydrophobicContact CG1-CG 4.03Å; V1856-K1861 WeakPolarHBondContact O-CD 3.23Å; V1856-K1861 VanDerWaalsContact O-CE 3.23Å; V1856-K1861 WeakPolarHBondContact O-CE 3.36Å; V1856-K1861 PolarHBondContact O-NZ 3.15Å; V1856-K1861 VanDerWaalsContact O-NZ 3.12Å; D1857-K1861 PolarHBondContact O-N 3.18Å; N1859-K1861 VanDerWaalsContact C-N 3.33Å; N1859-K1861 PolarHBondContact O-N 3.16Å; K1861-S1865 WeakPolarHBondContact O-CB 3.37Å; K1861-S1865 PolarHBondContact O-N 3.19Å
1862F72Confident60.7Low68.6 Ų68.670.3 Ų70.330%0.30139%0.388SS..Hα-helixtrans-63.6-48.3175.8164.6-97.4000112.1Q1703 T1717 L1719 S1858 N1859 S1865 I1866Q1703-F1862 HydrophobicContact CG-CE2 4.01Å; Q1703-F1862 HydrophobicContact CG-CZ 4.17Å; T1717-F1862 HydrophobicContact CG2-CE1 4.45Å; T1717-F1862 HydrophobicContact CG2-CZ 4.41Å; L1719-F1862 HydrophobicContact CD2-CE1 4.47Å; S1858-F1862 PolarHBondContact O-N 3.12Å; S1858-F1862 VanDerWaalsContact O-N 3.13Å; N1859-F1862 WeakPolarHBondContact O-CB 3.36Å; N1859-F1862 PolarHBondContact O-N 3.09Å; N1859-F1862 VanDerWaalsContact O-N 3.15Å; F1862-S1865 WeakPolarHBondContact O-CB 3.3Å; F1862-S1865 PolarHBondContact O-N 3.24Å; F1862-S1865 VanDerWaalsContact O-N 3.1Å; F1862-I1866 HydrophobicContact CD1-CD1 4.4Å; F1862-I1866 HydrophobicContact CE1-CD1 3.69Å; F1862-I1866 HydrophobicContact CE2-CD1 3.94Å; F1862-I1866 HydrophobicContact CZ-CD1 3.42Å; F1862-I1866 VanDerWaalsContact CZ-CD1 3.43Å; F1862-I1866 HydrophobicContact CZ-CG1 4.45Å; F1862-I1866 PolarHBondContact O-N 3.1Å; F1862-I1866 VanDerWaalsContact O-N 3.1Å
1863L69.2Low62.4Low31.6 Ų31.670.6 Ų70.617%0.16538%0.376CS..Hα-helixtrans-60.9-49.1176.9-71.3179.8000111.2L1719 N1859 S1865 I1866 Q1867 F1961 T1966L1719-L1863 HydrophobicContact CD2-CD2 4.19Å; N1859-L1863 WeakPolarHBondContact O-CB 3.4Å; N1859-L1863 VanDerWaalsContact O-CG 3.31Å; N1859-L1863 WeakPolarHBondContact O-CG 3.37Å; N1859-L1863 PolarHBondContact O-N 3.13Å; L1863-S1865 PolarHBondContact O-N 3.07Å; L1863-I1866 PolarHBondContact O-N 3.17Å; L1863-I1866 VanDerWaalsContact O-N 3.11Å; L1863-Q1867 PolarHBondContact O-N 3.22Å; L1863-F1961 HydrophobicContact CB-CD2 3.93Å; L1863-F1961 HydrophobicContact CB-CE2 3.55Å; L1863-F1961 HydrophobicContact CB-CZ 4.28Å; L1863-F1961 HydrophobicContact CD1-CD2 4.38Å; L1863-F1961 HydrophobicContact CD2-CD1 4.39Å; L1863-F1961 HydrophobicContact CD2-CD2 3.97Å; L1863-F1961 HydrophobicContact CD2-CE1 4.27Å; L1863-F1961 HydrophobicContact CD2-CE2 3.85Å; L1863-F1961 HydrophobicContact CD2-CG 4.34Å; L1863-F1961 HydrophobicContact CD2-CZ 4Å; L1863-F1961 HydrophobicContact CG-CD2 4.31Å; L1863-F1961 HydrophobicContact CG-CE2 4.22Å; L1863-F1961 VanDerWaalsContact O-CE2 3.22Å; L1863-F1961 WeakPolarHBondContact O-CE2 3.33Å; L1863-F1961 WeakPolarHBondContact O-CZ 3.4Å; L1863-T1966 HydrophobicContact CD1-CG2 3.87Å
1864S69.2Low64.1Low20.8 Ų20.868.5 Ų68.515%0.14537%0.368CS..Hα-helixtrans-58.8-30174.9-105.10000113N1860 Q1868N1860-S1864 WeakPolarHBondContact O-CB 3.37Å; N1860-S1864 PolarHBondContact O-N 2.97Å; N1860-S1864 PolarHBondContact O-OG 3.13Å; S1864-Q1868 VanDerWaalsContact O-CB 3.27Å; S1864-Q1868 WeakPolarHBondContact O-CB 3.39Å; S1864-Q1868 VanDerWaalsContact O-CG 3.28Å; S1864-Q1868 WeakPolarHBondContact O-CG 3.34Å; S1864-Q1868 PolarHBondContact O-N 3.14Å; S1864-Q1868 VanDerWaalsContact O-N 3.08Å; S1864-Q1868 PolarHBondContact O-NE2 3.08Å; S1864-Q1868 PolarHBondContact OG-NE2 3.47Å; S1864-Q1868 VanDerWaalsContact OG-NE2 3.11Å
1865S71.5Confident66.2Low53.2 Ų53.266.5 Ų66.537%0.37236%0.362SS..Hα-helixtrans-71.5-41.2174.9-172.40000112.5N1706 K1861 F1862 L1863 Q1868 A1869N1706-S1865 PolarHBondContact ND2-O 3.01Å; N1706-S1865 PolarHBondContact ND2-OG 3.18Å; N1706-S1865 VanDerWaalsContact ND2-OG 3.1Å; K1861-S1865 WeakPolarHBondContact O-CB 3.37Å; K1861-S1865 PolarHBondContact O-N 3.19Å; F1862-S1865 WeakPolarHBondContact O-CB 3.3Å; F1862-S1865 PolarHBondContact O-N 3.24Å; F1862-S1865 VanDerWaalsContact O-N 3.1Å; L1863-S1865 PolarHBondContact O-N 3.07Å; S1865-Q1868 PolarHBondContact O-N 3.04Å; S1865-A1869 PolarHBondContact O-N 3.17Å; S1865-A1869 VanDerWaalsContact O-N 3.15Å
1866I75.2Confident68.3Low2.2 Ų2.257.2 Ų57.21%0.01132%0.321CS..Hα-helixtrans-63.2-49.9173.6-72.2175.2000110.4A1699 A1702 Q1703 F1862 L1863 Q1868 A1869 L1870 F1961A1699-I1866 HydrophobicContact CB-CG2 4.43Å; A1702-I1866 HydrophobicContact CB-CB 4.38Å; A1702-I1866 HydrophobicContact CB-CG1 4.42Å; A1702-I1866 HydrophobicContact CB-CG2 3.9Å; Q1703-I1866 HydrophobicContact CG-CD1 3.63Å; Q1703-I1866 HydrophobicContact CG-CG1 3.9Å; F1862-I1866 HydrophobicContact CD1-CD1 4.4Å; F1862-I1866 HydrophobicContact CE1-CD1 3.69Å; F1862-I1866 HydrophobicContact CE2-CD1 3.94Å; F1862-I1866 HydrophobicContact CZ-CD1 3.42Å; F1862-I1866 VanDerWaalsContact CZ-CD1 3.43Å; F1862-I1866 HydrophobicContact CZ-CG1 4.45Å; F1862-I1866 PolarHBondContact O-N 3.1Å; F1862-I1866 VanDerWaalsContact O-N 3.1Å; L1863-I1866 PolarHBondContact O-N 3.17Å; L1863-I1866 VanDerWaalsContact O-N 3.11Å; I1866-Q1868 VanDerWaalsContact C-N 3.28Å; I1866-Q1868 PolarHBondContact O-N 3.2Å; I1866-A1869 PolarHBondContact O-N 3.03Å; I1866-L1870 HydrophobicContact CG2-CD1 3.85Å; I1866-L1870 HydrophobicContact CG2-CG 4.44Å; I1866-L1870 WeakPolarHBondContact O-CB 3.46Å; I1866-L1870 VanDerWaalsContact O-CG 3.3Å; I1866-L1870 WeakPolarHBondContact O-CG 3.35Å; I1866-L1870 PolarHBondContact O-N 3.3Å; I1866-L1870 VanDerWaalsContact O-N 3.11Å; I1866-F1961 HydrophobicContact CB-CZ 3.94Å; I1866-F1961 HydrophobicContact CG2-CE1 3.96Å; I1866-F1961 HydrophobicContact CG2-CZ 3.69Å
1867Q77.8Confident70Confident7 Ų758.3 Ų58.33%0.03332%0.318CS..Hα-helixtrans-61.4-39.5179.6-174.6177.8-8.200111.4L1863 A1869 L1870 D1871 F1961 L1962 I1972L1863-Q1867 PolarHBondContact O-N 3.22Å; Q1867-A1869 PolarHBondContact O-N 2.94Å; Q1867-L1870 PolarHBondContact O-N 3.06Å; Q1867-D1871 WeakPolarHBondContact O-CB 3.44Å; Q1867-D1871 PolarHBondContact O-N 3.11Å; Q1867-F1961 HydrophobicContact CB-CE2 4.14Å; Q1867-F1961 HydrophobicContact CB-CZ 4.18Å; Q1867-F1961 PolarHBondContact OE1-O 2.96Å; Q1867-F1961 VanDerWaalsContact OE1-O 3.11Å; Q1867-L1962 PolarHBondContact NE2-O 3.06Å; Q1867-I1972 HydrophobicContact CG-CD1 4.34Å; Q1867-I1972 VanDerWaalsContact NE2-CD1 3.34Å
1868Q74.3Confident71.7Confident82.6 Ų82.657.3 Ų57.339%0.38631%0.313SS..Hα-helixtrans-67.3-37.1177.9-92.4170.691.400113.4S1864 S1865 I1866 L1870 D1871 L1872S1864-Q1868 VanDerWaalsContact O-CB 3.27Å; S1864-Q1868 WeakPolarHBondContact O-CB 3.39Å; S1864-Q1868 VanDerWaalsContact O-CG 3.28Å; S1864-Q1868 WeakPolarHBondContact O-CG 3.34Å; S1864-Q1868 PolarHBondContact O-N 3.14Å; S1864-Q1868 VanDerWaalsContact O-N 3.08Å; S1864-Q1868 PolarHBondContact O-NE2 3.08Å; S1864-Q1868 PolarHBondContact OG-NE2 3.47Å; S1864-Q1868 VanDerWaalsContact OG-NE2 3.11Å; S1865-Q1868 PolarHBondContact O-N 3.04Å; I1866-Q1868 VanDerWaalsContact C-N 3.28Å; I1866-Q1868 PolarHBondContact O-N 3.2Å; Q1868-L1870 VanDerWaalsContact C-N 3.34Å; Q1868-D1871 CarbonylContact O-C 3.31Å; Q1868-D1871 PolarHBondContact O-N 3.19Å; Q1868-L1872 HydrophobicContact CG-CD1 3.93Å; Q1868-L1872 HydrophobicContact CG-CG 4.39Å; Q1868-L1872 VanDerWaalsContact O-CB 3.29Å; Q1868-L1872 WeakPolarHBondContact O-CB 3.37Å; Q1868-L1872 VanDerWaalsContact O-CD1 3.31Å; Q1868-L1872 WeakPolarHBondContact O-CD1 3.39Å; Q1868-L1872 WeakPolarHBondContact O-CG 3.34Å; Q1868-L1872 PolarHBondContact O-N 2.92Å; Q1868-L1872 VanDerWaalsContact O-N 3.16Å
1869A70.4Confident73.4Confident14 Ų1452.8 Ų52.812%0.11628%0.281CS..Hα-helixtrans-62.2-47.2172.800000111.3A1702 N1706 S1865 I1866 Q1867 D1871 L1872 D1873A1702-A1869 HydrophobicContact CB-CB 4.08Å; N1706-A1869 WeakPolarHBondContact OD1-CB 3.25Å; S1865-A1869 PolarHBondContact O-N 3.17Å; S1865-A1869 VanDerWaalsContact O-N 3.15Å; I1866-A1869 PolarHBondContact O-N 3.03Å; Q1867-A1869 PolarHBondContact O-N 2.94Å; A1869-D1871 VanDerWaalsContact C-N 3.32Å; A1869-D1871 PolarHBondContact O-N 3.36Å; A1869-L1872 WeakPolarHBondContact O-CB 3.48Å; A1869-L1872 PolarHBondContact O-N 3.07Å; A1869-L1872 VanDerWaalsContact O-N 3.15Å; A1869-D1873 PolarHBondContact O-N 2.97Å
1870L74.6Confident74.9Confident1.2 Ų1.247.8 Ų47.81%0.00626%0.255CS..Hα-helixtrans-62.7-36.2178.5-69.1174.1000113.6L1698 A1702 I1866 Q1867 Q1868 L1872 E1876 R1877 L1880 L1962L1698-L1870 HydrophobicContact CB-CD2 4.24Å; A1702-L1870 HydrophobicContact CB-CD2 4.12Å; A1702-L1870 HydrophobicContact CB-CG 4Å; I1866-L1870 HydrophobicContact CG2-CD1 3.85Å; I1866-L1870 HydrophobicContact CG2-CG 4.44Å; I1866-L1870 WeakPolarHBondContact O-CB 3.46Å; I1866-L1870 VanDerWaalsContact O-CG 3.3Å; I1866-L1870 WeakPolarHBondContact O-CG 3.35Å; I1866-L1870 PolarHBondContact O-N 3.3Å; I1866-L1870 VanDerWaalsContact O-N 3.11Å; Q1867-L1870 PolarHBondContact O-N 3.06Å; Q1868-L1870 VanDerWaalsContact C-N 3.34Å; L1870-L1872 VanDerWaalsContact C-N 3.28Å; L1870-L1872 PolarHBondContact O-N 3.24Å; L1870-E1876 WeakPolarHBondContact CD2-OE2 3.43Å; L1870-R1877 PolarHBondContact O-N 2.83Å; L1870-L1880 HydrophobicContact CB-CD1 3.67Å; L1870-L1880 HydrophobicContact CD1-CD1 4.32Å; L1870-L1880 HydrophobicContact CD2-CD1 4.16Å; L1870-L1880 HydrophobicContact CG-CD1 4.37Å; L1870-L1880 WeakPolarHBondContact O-CD1 3.24Å; L1870-L1962 HydrophobicContact CD1-CD2 4.13Å
1871D73.6Confident76.2Confident30.2 Ų30.250.2 Ų50.216%0.16127%0.265CS..THydrogen-bonded Turntrans-84.2-2.8175.3-106-35.7000113.6Q1867 Q1868 A1869 R1877 S1980 T1981Q1867-D1871 WeakPolarHBondContact O-CB 3.44Å; Q1867-D1871 PolarHBondContact O-N 3.11Å; Q1868-D1871 CarbonylContact O-C 3.31Å; Q1868-D1871 PolarHBondContact O-N 3.19Å; A1869-D1871 VanDerWaalsContact C-N 3.32Å; A1869-D1871 PolarHBondContact O-N 3.36Å; D1871-R1877 WeakPolarHBondContact O-CD 3.48Å; D1871-R1877 PolarHBondContact O-NE 3.23Å; D1871-R1877 PolarHBondContact O-NH2 3.27Å; D1871-R1877 IonicContact OD1-CZ 3.19Å; D1871-R1877 IonicContact OD1-NE 2.7Å; D1871-R1877 PolarHBondContact OD1-NE 3.28Å; D1871-R1877 IonicContact OD1-NH1 3.99Å; D1871-R1877 IonicContact OD1-NH2 2.76Å; D1871-R1877 PolarHBondContact OD1-NH2 3.44Å; D1871-S1980 PolarHBondContact OD1-OG 3Å; D1871-S1980 WeakPolarHBondContact OD2-CA 3.46Å; D1871-S1980 VanDerWaalsContact OD2-CB 3.3Å; D1871-S1980 WeakPolarHBondContact OD2-CB 3.29Å; D1871-S1980 PolarHBondContact OD2-OG 3.21Å; D1871-T1981 PolarHBondContact OD1-N 3.23Å; D1871-T1981 PolarHBondContact OD1-OG1 3.38Å
1872L69.2Low77.4Confident130.4 Ų130.447.1 Ų47.168%0.68325%0.252SS*.THydrogen-bonded Turntrans-94.2-44.7175.9-82168.5000112.7Q1868 A1869 L1870 G1874 R1877Q1868-L1872 HydrophobicContact CG-CD1 3.93Å; Q1868-L1872 HydrophobicContact CG-CG 4.39Å; Q1868-L1872 VanDerWaalsContact O-CB 3.29Å; Q1868-L1872 WeakPolarHBondContact O-CB 3.37Å; Q1868-L1872 VanDerWaalsContact O-CD1 3.31Å; Q1868-L1872 WeakPolarHBondContact O-CD1 3.39Å; Q1868-L1872 WeakPolarHBondContact O-CG 3.34Å; Q1868-L1872 PolarHBondContact O-N 2.92Å; Q1868-L1872 VanDerWaalsContact O-N 3.16Å; A1869-L1872 WeakPolarHBondContact O-CB 3.48Å; A1869-L1872 PolarHBondContact O-N 3.07Å; A1869-L1872 VanDerWaalsContact O-N 3.15Å; L1870-L1872 VanDerWaalsContact C-N 3.28Å; L1870-L1872 PolarHBondContact O-N 3.24Å; L1872-G1874 PolarHBondContact O-N 3.08Å; L1872-R1877 VanDerWaalsContact O-CZ 3.3Å; L1872-R1877 PolarHBondContact O-NH2 2.92Å
1873D66.2Low78.4Confident106.6 Ų106.643.8 Ų43.857%0.5724%0.238SC*.SBendtrans-78.7114.6-175.7-93.6-31.7000112.4A1869 N1875 E1876 R1877A1869-D1873 PolarHBondContact O-N 2.97Å; D1873-N1875 VanDerWaalsContact C-N 3.32Å; D1873-N1875 PolarHBondContact O-N 3.11Å; D1873-N1875 VanDerWaalsContact O-N 3.1Å; D1873-E1876 HydrophobicContact CB-CB 4.16Å; D1873-E1876 HydrophobicContact CB-CG 3.98Å; D1873-E1876 WeakPolarHBondContact O-CA 3.47Å; D1873-E1876 WeakPolarHBondContact O-CB 3.32Å; D1873-E1876 PolarHBondContact O-N 3.27Å; D1873-R1877 WeakPolarHBondContact O-CB 3.38Å; D1873-R1877 WeakPolarHBondContact O-CG 3.36Å; D1873-R1877 PolarHBondContact O-N 3.21Å
1874G70.3Confident79.6Confident40.6 Ų40.642.3 Ų42.342%0.41923%0.23SC..Hα-helixtrans-54.2-40.3-172.400000115.2L1872 E1876 R1877 D1878L1872-G1874 PolarHBondContact O-N 3.08Å; G1874-E1876 VanDerWaalsContact C-N 3.3Å; G1874-E1876 PolarHBondContact O-N 3.26Å; G1874-R1877 WeakPolarHBondContact O-CB 3.21Å; G1874-R1877 PolarHBondContact O-N 3.35Å; G1874-D1878 PolarHBondContact O-N 3Å
1875N73.7Confident80.8Confident102.6 Ų102.646.3 Ų46.355%0.54924%0.242SC..Hα-helixtrans-69-31177.7-65.1-1.6000112.6D1873 T1879D1873-N1875 VanDerWaalsContact C-N 3.32Å; D1873-N1875 PolarHBondContact O-N 3.11Å; D1873-N1875 VanDerWaalsContact O-N 3.1Å; N1875-T1879 WeakPolarHBondContact O-CB 3.32Å; N1875-T1879 PolarHBondContact O-N 3.11Å; N1875-T1879 VanDerWaalsContact O-N 3.15Å; N1875-T1879 PolarHBondContact O-OG1 2.9Å
1876E81.1Confident81.8Confident15.4 Ų15.443.9 Ų43.97%0.07223%0.225CC..Hα-helixtrans-80.9-38.4179.8-57.6-123.8125.100110.2R1666 L1870 D1873 G1874 D1878 T1879 L1880R1666-E1876 IonicContact CZ-OE1 3.61Å; R1666-E1876 IonicContact NH1-OE1 3.08Å; R1666-E1876 PolarHBondContact NH1-OE1 3.06Å; L1870-E1876 WeakPolarHBondContact CD2-OE2 3.43Å; D1873-E1876 HydrophobicContact CB-CB 4.16Å; D1873-E1876 HydrophobicContact CB-CG 3.98Å; D1873-E1876 WeakPolarHBondContact O-CA 3.47Å; D1873-E1876 WeakPolarHBondContact O-CB 3.32Å; D1873-E1876 PolarHBondContact O-N 3.27Å; G1874-E1876 VanDerWaalsContact C-N 3.3Å; G1874-E1876 PolarHBondContact O-N 3.26Å; E1876-D1878 VanDerWaalsContact C-N 3.31Å; E1876-D1878 PolarHBondContact O-N 2.89Å; E1876-T1879 CarbonylContact O-C 3.51Å; E1876-T1879 WeakPolarHBondContact O-CA 3.34Å; E1876-T1879 WeakPolarHBondContact O-CB 3.36Å; E1876-T1879 PolarHBondContact O-N 3.26Å; E1876-T1879 VanDerWaalsContact O-N 3.09Å; E1876-L1880 WeakPolarHBondContact O-CB 3.29Å; E1876-L1880 VanDerWaalsContact O-CD1 3.32Å; E1876-L1880 WeakPolarHBondContact O-CD1 3.31Å; E1876-L1880 VanDerWaalsContact O-CG 3.22Å; E1876-L1880 WeakPolarHBondContact O-CG 3.31Å; E1876-L1880 PolarHBondContact O-N 3.25Å
1877R85.1Confident82.7Confident86.6 Ų86.643.8 Ų43.833%0.32722%0.224SC..Hα-helixtrans-52.5-47.2170.1-108.9-179163.7139.73.6113.1L1870 D1871 L1872 D1873 G1874 T1879 L1880 H1881 N1979 T1981L1870-R1877 PolarHBondContact O-N 2.83Å; D1871-R1877 WeakPolarHBondContact O-CD 3.48Å; D1871-R1877 PolarHBondContact O-NE 3.23Å; D1871-R1877 PolarHBondContact O-NH2 3.27Å; D1871-R1877 IonicContact OD1-CZ 3.19Å; D1871-R1877 IonicContact OD1-NE 2.7Å; D1871-R1877 PolarHBondContact OD1-NE 3.28Å; D1871-R1877 IonicContact OD1-NH1 3.99Å; D1871-R1877 IonicContact OD1-NH2 2.76Å; D1871-R1877 PolarHBondContact OD1-NH2 3.44Å; L1872-R1877 VanDerWaalsContact O-CZ 3.3Å; L1872-R1877 PolarHBondContact O-NH2 2.92Å; D1873-R1877 WeakPolarHBondContact O-CB 3.38Å; D1873-R1877 WeakPolarHBondContact O-CG 3.36Å; D1873-R1877 PolarHBondContact O-N 3.21Å; G1874-R1877 WeakPolarHBondContact O-CB 3.21Å; G1874-R1877 PolarHBondContact O-N 3.35Å; R1877-T1879 VanDerWaalsContact C-N 3.31Å; R1877-T1879 PolarHBondContact O-N 2.91Å; R1877-L1880 PolarHBondContact O-N 3.19Å; R1877-H1881 WeakPolarHBondContact O-CB 3.32Å; R1877-H1881 PolarHBondContact O-N 3.23Å; R1877-H1881 VanDerWaalsContact O-N 3.15Å; R1877-N1979 PolarHBondContact NH2-O 3.32Å; R1877-T1981 HydrophobicContact CB-CG2 4.02Å; R1877-T1981 HydrophobicContact CG-CG2 3.85Å; R1877-T1981 VanDerWaalsContact CG-CG2 3.41Å; R1877-T1981 VanDerWaalsContact CZ-CG2 3.4Å; R1877-T1981 VanDerWaalsContact NE-CG2 3.31Å; R1877-T1981 PolarHBondContact O-OG1 3.02Å; R1877-T1981 VanDerWaalsContact O-OG1 3.06Å
1878D87.3Confident83.4Confident99.2 Ų99.243.5 Ų43.553%0.5322%0.223SC..Hα-helixtrans-67.9-39.4176.1-75.9-15.1000111.8G1874 E1876 L1880 H1881 Q1882G1874-D1878 PolarHBondContact O-N 3Å; E1876-D1878 VanDerWaalsContact C-N 3.31Å; E1876-D1878 PolarHBondContact O-N 2.89Å; D1878-L1880 VanDerWaalsContact C-N 3.33Å; D1878-L1880 PolarHBondContact O-N 2.91Å; D1878-H1881 PolarHBondContact O-N 3.33Å; D1878-Q1882 WeakPolarHBondContact O-CB 3.26Å; D1878-Q1882 PolarHBondContact O-N 3.16Å; D1878-Q1882 VanDerWaalsContact O-N 3.11Å
1879T90.9Very high84.2Confident0.6 Ų0.643.1 Ų43.10%0.00422%0.22CC..Hα-helixtrans-61.5-44.4175.4-62.70000111.2F1659 R1666 L1670 L1698 N1875 E1876 R1877 Q1882 W1883F1659-T1879 HydrophobicContact CE2-CG2 3.97Å; F1659-T1879 HydrophobicContact CZ-CG2 3.86Å; R1666-T1879 HydrophobicContact CB-CG2 3.98Å; R1666-T1879 WeakPolarHBondContact CB-OG1 3.24Å; L1670-T1879 HydrophobicContact CD1-CG2 4.22Å; L1698-T1879 HydrophobicContact CD1-CG2 4.35Å; L1698-T1879 HydrophobicContact CD2-CG2 4.45Å; N1875-T1879 WeakPolarHBondContact O-CB 3.32Å; N1875-T1879 PolarHBondContact O-N 3.11Å; N1875-T1879 VanDerWaalsContact O-N 3.15Å; N1875-T1879 PolarHBondContact O-OG1 2.9Å; E1876-T1879 CarbonylContact O-C 3.51Å; E1876-T1879 WeakPolarHBondContact O-CA 3.34Å; E1876-T1879 WeakPolarHBondContact O-CB 3.36Å; E1876-T1879 PolarHBondContact O-N 3.26Å; E1876-T1879 VanDerWaalsContact O-N 3.09Å; R1877-T1879 VanDerWaalsContact C-N 3.31Å; R1877-T1879 PolarHBondContact O-N 2.91Å; T1879-Q1882 PolarHBondContact O-N 3.26Å; T1879-W1883 VanDerWaalsContact O-CB 3.29Å; T1879-W1883 WeakPolarHBondContact O-CB 3.32Å; T1879-W1883 PolarHBondContact O-N 3.29Å
1880L90.6Very high85.2Confident1.6 Ų1.643.6 Ų43.61%0.00822%0.219CC..Hα-helixtrans-66.8-45.7178.5-75.1169.8000111.7L1698 L1870 E1876 R1877 D1878 Q1882 W1883 V1884 L1962 V1982L1698-L1880 HydrophobicContact CD1-CD2 4.08Å; L1870-L1880 HydrophobicContact CB-CD1 3.67Å; L1870-L1880 HydrophobicContact CD1-CD1 4.32Å; L1870-L1880 HydrophobicContact CD2-CD1 4.16Å; L1870-L1880 HydrophobicContact CG-CD1 4.37Å; L1870-L1880 WeakPolarHBondContact O-CD1 3.24Å; E1876-L1880 WeakPolarHBondContact O-CB 3.29Å; E1876-L1880 VanDerWaalsContact O-CD1 3.32Å; E1876-L1880 WeakPolarHBondContact O-CD1 3.31Å; E1876-L1880 VanDerWaalsContact O-CG 3.22Å; E1876-L1880 WeakPolarHBondContact O-CG 3.31Å; E1876-L1880 PolarHBondContact O-N 3.25Å; R1877-L1880 PolarHBondContact O-N 3.19Å; D1878-L1880 VanDerWaalsContact C-N 3.33Å; D1878-L1880 PolarHBondContact O-N 2.91Å; L1880-Q1882 VanDerWaalsContact C-N 3.28Å; L1880-Q1882 PolarHBondContact O-N 3.1Å; L1880-W1883 PolarHBondContact O-N 3.08Å; L1880-W1883 VanDerWaalsContact O-N 3.12Å; L1880-V1884 WeakPolarHBondContact O-CG2 3.36Å; L1880-V1884 PolarHBondContact O-N 3.1Å; L1880-L1962 HydrophobicContact CD1-CD2 3.96Å; L1880-L1962 HydrophobicContact CD2-CD1 4.09Å; L1880-L1962 HydrophobicContact CD2-CD2 4.26Å; L1880-V1982 HydrophobicContact CB-CG2 4.5Å; L1880-V1982 HydrophobicContact CD1-CG2 4.11Å
1881H91.6Very high85.9Confident64 Ų6443.6 Ų43.630%0.29622%0.22SC..Hα-helixtrans-55.8-45.6175.6-179.4-82.5000111R1877 D1878 R1885 T1981 A1985R1877-H1881 WeakPolarHBondContact O-CB 3.32Å; R1877-H1881 PolarHBondContact O-N 3.23Å; R1877-H1881 VanDerWaalsContact O-N 3.15Å; D1878-H1881 PolarHBondContact O-N 3.33Å; H1881-R1885 VanDerWaalsContact O-CB 3.27Å; H1881-R1885 WeakPolarHBondContact O-CB 3.33Å; H1881-R1885 PolarHBondContact O-N 3.14Å; H1881-R1885 VanDerWaalsContact O-N 3.09Å; H1881-T1981 PolarHBondContact CD2-O 3.29Å; H1881-A1985 HydrophobicContact CB-CB 4.41Å; H1881-A1985 VanDerWaalsContact CD2-CB 3.5Å; H1881-A1985 WeakPolarHBondContact CD2-CB 3.46Å
1882Q91.9Very high86.6Confident29.6 Ų29.642.9 Ų42.914%0.13822%0.217CC..Hα-helixtrans-71.3-34.5176.7-173.8631000112.8L1670 D1878 T1879 L1880 R1885 L1886L1670-Q1882 HydrophobicContact CB-CG 3.73Å; L1670-Q1882 HydrophobicContact CD1-CB 4.07Å; L1670-Q1882 HydrophobicContact CD1-CG 3.95Å; L1670-Q1882 HydrophobicContact CG-CG 4.44Å; D1878-Q1882 WeakPolarHBondContact O-CB 3.26Å; D1878-Q1882 PolarHBondContact O-N 3.16Å; D1878-Q1882 VanDerWaalsContact O-N 3.11Å; T1879-Q1882 PolarHBondContact O-N 3.26Å; L1880-Q1882 VanDerWaalsContact C-N 3.28Å; L1880-Q1882 PolarHBondContact O-N 3.1Å; Q1882-R1885 PolarHBondContact O-N 3.13Å; Q1882-L1886 HydrophobicContact CG-CD1 4.07Å; Q1882-L1886 HydrophobicContact CG-CG 4.46Å; Q1882-L1886 WeakPolarHBondContact O-CB 3.3Å; Q1882-L1886 VanDerWaalsContact O-CG 3.23Å; Q1882-L1886 WeakPolarHBondContact O-CG 3.37Å; Q1882-L1886 PolarHBondContact O-N 3.12Å
1883W93.6Very high87.4Confident0.2 Ų0.241 Ų410%0.00121%0.211CC..Hα-helixtrans-64.3-47.3175.1-17999.6000111.7L1670 F1691 F1695 T1879 L1880 R1885 L1886 L1887 H1958 L1962L1670-W1883 HydrophobicContact CD1-CB 4.48Å; F1691-W1883 HydrophobicContact CB-CZ2 3.91Å; F1691-W1883 HydrophobicContact CD1-CD2 4.47Å; F1691-W1883 AromaticContact CD1-CE2 3.93Å; F1691-W1883 HydrophobicContact CD1-CZ2 4.34Å; F1691-W1883 AromaticContact CD1-NE1 3.75Å; F1691-W1883 WeakPolarHBondContact O-CZ2 3.39Å; F1691-W1883 PolarHBondContact O-NE1 3.05Å; F1695-W1883 HydrophobicContact CB-CH2 4.44Å; F1695-W1883 HydrophobicContact CB-CZ2 3.76Å; F1695-W1883 HydrophobicContact CD2-CH2 4.48Å; F1695-W1883 HydrophobicContact CD2-CZ2 4.47Å; F1695-W1883 HydrophobicContact CG-CZ2 4.36Å; T1879-W1883 VanDerWaalsContact O-CB 3.29Å; T1879-W1883 WeakPolarHBondContact O-CB 3.32Å; T1879-W1883 PolarHBondContact O-N 3.29Å; L1880-W1883 PolarHBondContact O-N 3.08Å; L1880-W1883 VanDerWaalsContact O-N 3.12Å; W1883-R1885 VanDerWaalsContact C-N 3.34Å; W1883-R1885 PolarHBondContact O-N 3.19Å; W1883-L1886 PolarHBondContact O-N 3.09Å; W1883-L1887 HydrophobicContact CE3-CD2 4.45Å; W1883-L1887 HydrophobicContact CH2-CD2 3.63Å; W1883-L1887 HydrophobicContact CZ2-CD2 4.38Å; W1883-L1887 HydrophobicContact CZ3-CD2 3.7Å; W1883-L1887 WeakPolarHBondContact O-CB 3.28Å; W1883-L1887 PolarHBondContact O-N 3Å; W1883-H1958 HydrophobicContact CH2-CB 4.4Å; W1883-L1962 HydrophobicContact CE3-CD1 4.37Å; W1883-L1962 HydrophobicContact CZ3-CD1 4.02Å
1884V93.7Very high88.2Confident0 Ų037 Ų370%019%0.19CC..Hα-helixtrans-62.4-44.7177.2173.80000110.6L1880 L1886 L1887 L1888 L1959 V1982 A1985 F1986L1880-V1884 WeakPolarHBondContact O-CG2 3.36Å; L1880-V1884 PolarHBondContact O-N 3.1Å; V1884-L1886 VanDerWaalsContact C-N 3.31Å; V1884-L1886 PolarHBondContact O-N 3.12Å; V1884-L1887 PolarHBondContact O-N 3.19Å; V1884-L1888 HydrophobicContact CG1-CD1 3.94Å; V1884-L1888 WeakPolarHBondContact O-CB 3.44Å; V1884-L1888 WeakPolarHBondContact O-CG 3.38Å; V1884-L1888 PolarHBondContact O-N 2.99Å; V1884-L1959 HydrophobicContact CG1-CD1 4.14Å; V1884-L1959 HydrophobicContact CG2-CD1 4.37Å; V1884-V1982 HydrophobicContact CG2-CB 4.49Å; V1884-V1982 HydrophobicContact CG2-CG1 3.9Å; V1884-V1982 HydrophobicContact CG2-CG2 4.48Å; V1884-A1985 HydrophobicContact CB-CB 3.78Å; V1884-A1985 HydrophobicContact CG1-CB 3.72Å; V1884-F1986 HydrophobicContact CG1-CB 4.25Å
1885R93.8Very high88.4Confident104.2 Ų104.244.1 Ų44.139%0.39321%0.213SC..Hα-helixtrans-56.1-43.5174.3173.7170.5-163.5-173.40.7112.5H1881 Q1882 W1883 K1889 H1989H1881-R1885 VanDerWaalsContact O-CB 3.27Å; H1881-R1885 WeakPolarHBondContact O-CB 3.33Å; H1881-R1885 PolarHBondContact O-N 3.14Å; H1881-R1885 VanDerWaalsContact O-N 3.09Å; Q1882-R1885 PolarHBondContact O-N 3.13Å; W1883-R1885 VanDerWaalsContact C-N 3.34Å; W1883-R1885 PolarHBondContact O-N 3.19Å; R1885-K1889 VanDerWaalsContact O-CB 3.3Å; R1885-K1889 WeakPolarHBondContact O-CB 3.37Å; R1885-K1889 PolarHBondContact O-N 2.99Å; R1885-H1989 WeakPolarHBondContact CG-NE2 3.38Å; R1885-H1989 PolarHBondContact NE-CE1 3.21Å; R1885-H1989 PolarHBondContact NE-NE2 2.96Å; R1885-H1989 PolarHBondContact NH1-NE2 3Å
1886L93.3Very high88.3Confident2.4 Ų2.440 Ų401%0.01319%0.19CC..Hα-helixtrans-76.1-36-179.8-68.8174.6000112.9L1670 H1674 F1686 F1691 Q1882 W1883 V1884 L1888 K1889 F1890L1670-L1886 HydrophobicContact CB-CD1 3.83Å; L1670-L1886 HydrophobicContact CD2-CD1 4.04Å; L1670-L1886 HydrophobicContact CG-CD1 4.4Å; L1670-L1886 WeakPolarHBondContact O-CD1 3.45Å; H1674-L1886 HydrophobicContact CB-CD1 4.27Å; H1674-L1886 HydrophobicContact CB-CD2 3.64Å; H1674-L1886 WeakPolarHBondContact CD2-CD2 3.4Å; F1686-L1886 HydrophobicContact CE1-CD1 4.45Å; F1686-L1886 HydrophobicContact CE2-CD2 4.48Å; F1686-L1886 HydrophobicContact CZ-CD1 4.09Å; F1686-L1886 HydrophobicContact CZ-CD2 4.34Å; F1691-L1886 HydrophobicContact CE1-CB 4.06Å; F1691-L1886 HydrophobicContact CZ-CB 4.32Å; Q1882-L1886 HydrophobicContact CG-CD1 4.07Å; Q1882-L1886 HydrophobicContact CG-CG 4.46Å; Q1882-L1886 WeakPolarHBondContact O-CB 3.3Å; Q1882-L1886 VanDerWaalsContact O-CG 3.23Å; Q1882-L1886 WeakPolarHBondContact O-CG 3.37Å; Q1882-L1886 PolarHBondContact O-N 3.12Å; W1883-L1886 PolarHBondContact O-N 3.09Å; V1884-L1886 VanDerWaalsContact C-N 3.31Å; V1884-L1886 PolarHBondContact O-N 3.12Å; L1886-L1888 VanDerWaalsContact C-N 3.34Å; L1886-L1888 PolarHBondContact O-N 2.95Å; L1886-K1889 PolarHBondContact O-N 3.05Å; L1886-F1890 VanDerWaalsContact O-CB 3.29Å; L1886-F1890 WeakPolarHBondContact O-CB 3.42Å; L1886-F1890 PolarHBondContact O-N 2.96Å
1887L93.7Very high87.2Confident0.8 Ų0.844.1 Ų44.10%0.00421%0.213CC..Hα-helixtrans-59.5-49.4172.1175.462.1000110.3W1688 F1691 W1883 V1884 K1889 F1890 M1891 A1955 L1959W1688-L1887 HydrophobicContact CZ3-CD1 4.18Å; F1691-L1887 HydrophobicContact CB-CD1 4.25Å; F1691-L1887 HydrophobicContact CD1-CB 3.93Å; F1691-L1887 HydrophobicContact CD1-CD1 4.18Å; F1691-L1887 HydrophobicContact CD2-CD1 4.02Å; F1691-L1887 HydrophobicContact CE1-CB 3.92Å; F1691-L1887 HydrophobicContact CE2-CD1 4.44Å; F1691-L1887 HydrophobicContact CG-CB 4.44Å; F1691-L1887 HydrophobicContact CG-CD1 3.88Å; F1691-L1887 HydrophobicContact CZ-CB 4.47Å; W1883-L1887 HydrophobicContact CE3-CD2 4.45Å; W1883-L1887 HydrophobicContact CH2-CD2 3.63Å; W1883-L1887 HydrophobicContact CZ2-CD2 4.38Å; W1883-L1887 HydrophobicContact CZ3-CD2 3.7Å; W1883-L1887 WeakPolarHBondContact O-CB 3.28Å; W1883-L1887 PolarHBondContact O-N 3Å; V1884-L1887 PolarHBondContact O-N 3.19Å; L1887-K1889 PolarHBondContact O-N 3.43Å; L1887-F1890 WeakPolarHBondContact O-CB 3.38Å; L1887-F1890 PolarHBondContact O-N 3.03Å; L1887-M1891 HydrophobicContact CD1-CG 4.36Å; L1887-M1891 HydrophobicContact CD1-SD 4.24Å; L1887-M1891 HydrophobicContact CG-SD 4.13Å; L1887-M1891 WeakPolarHBondContact O-CB 3.34Å; L1887-M1891 VanDerWaalsContact O-CG 3.27Å; L1887-M1891 WeakPolarHBondContact O-CG 3.42Å; L1887-M1891 PolarHBondContact O-N 3.13Å; L1887-A1955 HydrophobicContact CD1-CB 4.35Å; L1887-L1959 HydrophobicContact CD2-CB 4.46Å; L1887-L1959 HydrophobicContact CD2-CD2 4.41Å
1888L92.6Very high86.1Confident1 Ų142 Ų421%0.00521%0.208CC..Hα-helixtrans-66.7-39.9178.6-67.8170.5000111.7V1884 L1886 F1890 M1891 S1892 L1959 F1986 H1989 V1993 I2004V1884-L1888 HydrophobicContact CG1-CD1 3.94Å; V1884-L1888 WeakPolarHBondContact O-CB 3.44Å; V1884-L1888 WeakPolarHBondContact O-CG 3.38Å; V1884-L1888 PolarHBondContact O-N 2.99Å; L1886-L1888 VanDerWaalsContact C-N 3.34Å; L1886-L1888 PolarHBondContact O-N 2.95Å; L1888-F1890 VanDerWaalsContact C-N 3.33Å; L1888-F1890 PolarHBondContact O-N 3Å; L1888-M1891 HydrophobicContact CD2-SD 4.15Å; L1888-M1891 PolarHBondContact O-N 3.13Å; L1888-S1892 PolarHBondContact O-N 3.19Å; L1888-L1959 HydrophobicContact CD2-CD2 4.39Å; L1888-F1986 HydrophobicContact CD1-CB 4.46Å; L1888-F1986 HydrophobicContact CD1-CD2 3.98Å; L1888-F1986 HydrophobicContact CD2-CD2 4.46Å; L1888-H1989 HydrophobicContact CB-CB 3.93Å; L1888-H1989 HydrophobicContact CD1-CB 3.89Å; L1888-V1993 HydrophobicContact CB-CG2 3.92Å; L1888-V1993 HydrophobicContact CD2-CG2 3.88Å; L1888-V1993 HydrophobicContact CG-CG2 4.48Å; L1888-V1993 VanDerWaalsContact O-CG2 3.24Å; L1888-V1993 WeakPolarHBondContact O-CG2 3.34Å; L1888-I2004 HydrophobicContact CD2-CD1 4.3Å
1889K91.6Very high84.3Confident73.4 Ų73.446.6 Ų46.632%0.31922%0.223SC..Hα-helixtrans-60.1-43172.9-173173.3176-179.60111.7H1674 C1678 R1885 L1886 L1887 S1892 T1893H1674-K1889 PolarHBondContact CD2-NZ 3.48Å; H1674-K1889 VanDerWaalsContact CD2-NZ 3.32Å; H1674-K1889 WeakPolarHBondContact NE2-CD 3.36Å; H1674-K1889 PolarHBondContact NE2-NZ 3.17Å; C1678-K1889 PolarHBondContact SG-NZ 3Å; R1885-K1889 VanDerWaalsContact O-CB 3.3Å; R1885-K1889 WeakPolarHBondContact O-CB 3.37Å; R1885-K1889 PolarHBondContact O-N 2.99Å; L1886-K1889 PolarHBondContact O-N 3.05Å; L1887-K1889 PolarHBondContact O-N 3.43Å; K1889-S1892 WeakPolarHBondContact O-CB 3.35Å; K1889-S1892 PolarHBondContact O-N 3.06Å; K1889-S1892 VanDerWaalsContact O-N 3.12Å; K1889-S1892 PolarHBondContact O-OG 3.27Å; K1889-T1893 PolarHBondContact O-N 2.94Å; K1889-T1893 PolarHBondContact O-OG1 3.11Å
1890F90.9Very high82Confident24.4 Ų24.450.9 Ų50.911%0.10725%0.245CC..Hα-helixtrans-62.3-45.4174.8176.6-112.2000111.9F1686 W1688 F1691 L1886 L1887 L1888 S1892 T1893 V1894F1686-F1890 HydrophobicContact CB-CD2 3.69Å; F1686-F1890 HydrophobicContact CB-CE2 3.91Å; F1686-F1890 HydrophobicContact CB-CG 4.28Å; F1686-F1890 WeakPolarHBondContact O-CE2 3.43Å; W1688-F1890 AromaticContact CD2-CE1 3.75Å; W1688-F1890 HydrophobicContact CD2-CE1 3.75Å; W1688-F1890 AromaticContact CE2-CE1 3.73Å; W1688-F1890 AromaticContact CE3-CE1 4Å; W1688-F1890 HydrophobicContact CE3-CE1 4.04Å; W1688-F1890 HydrophobicContact CG-CE1 4.19Å; W1688-F1890 HydrophobicContact CH2-CD1 4.43Å; W1688-F1890 HydrophobicContact CH2-CE1 4.27Å; W1688-F1890 AromaticContact CZ2-CE1 3.93Å; W1688-F1890 HydrophobicContact CZ2-CE1 4.01Å; W1688-F1890 HydrophobicContact CZ3-CD1 4.45Å; W1688-F1890 HydrophobicContact CZ3-CE1 4.29Å; F1691-F1890 AromaticContact CD2-CD1 3.96Å; F1691-F1890 HydrophobicContact CD2-CD1 4.01Å; F1691-F1890 HydrophobicContact CD2-CE1 4.19Å; F1691-F1890 HydrophobicContact CE2-CB 3.86Å; F1691-F1890 AromaticContact CE2-CD1 3.48Å; F1691-F1890 HydrophobicContact CE2-CD1 3.48Å; F1691-F1890 VanDerWaalsContact CE2-CD1 3.44Å; F1691-F1890 HydrophobicContact CE2-CD2 4.35Å; F1691-F1890 AromaticContact CE2-CE1 3.96Å; F1691-F1890 HydrophobicContact CE2-CE1 4.06Å; F1691-F1890 AromaticContact CE2-CG 3.69Å; F1691-F1890 HydrophobicContact CE2-CG 3.69Å; F1691-F1890 HydrophobicContact CZ-CB 3.98Å; F1691-F1890 HydrophobicContact CZ-CD1 4.37Å; F1691-F1890 HydrophobicContact CZ-CG 4.31Å; L1886-F1890 VanDerWaalsContact O-CB 3.29Å; L1886-F1890 WeakPolarHBondContact O-CB 3.42Å; L1886-F1890 PolarHBondContact O-N 2.96Å; L1887-F1890 WeakPolarHBondContact O-CB 3.38Å; L1887-F1890 PolarHBondContact O-N 3.03Å; L1888-F1890 VanDerWaalsContact C-N 3.33Å; L1888-F1890 PolarHBondContact O-N 3Å; F1890-S1892 PolarHBondContact O-N 3.01Å; F1890-T1893 PolarHBondContact O-N 3.12Å; F1890-T1893 PolarHBondContact O-OG1 3.12Å; F1890-T1893 VanDerWaalsContact O-OG1 3.09Å; F1890-V1894 HydrophobicContact CD1-CG2 3.9Å; F1890-V1894 HydrophobicContact CD2-CB 4.49Å; F1890-V1894 HydrophobicContact CD2-CG2 3.54Å; F1890-V1894 HydrophobicContact CE1-CB 4.26Å; F1890-V1894 HydrophobicContact CE1-CG1 4.42Å; F1890-V1894 HydrophobicContact CE1-CG2 3.91Å; F1890-V1894 HydrophobicContact CE2-CB 4.12Å; F1890-V1894 HydrophobicContact CE2-CG2 3.64Å; F1890-V1894 HydrophobicContact CG-CG2 3.84Å; F1890-V1894 HydrophobicContact CZ-CB 3.99Å; F1890-V1894 HydrophobicContact CZ-CG2 3.52Å; F1890-V1894 WeakPolarHBondContact O-CB 3.25Å; F1890-V1894 WeakPolarHBondContact O-CG1 3.39Å; F1890-V1894 VanDerWaalsContact O-CG2 3.31Å; F1890-V1894 WeakPolarHBondContact O-CG2 3.32Å; F1890-V1894 PolarHBondContact O-N 2.85Å
1891M89.5Confident79.5Confident2.8 Ų2.855 Ų551%0.01427%0.267CS..Hα-helixtrans-58.1-32.4173.3-70.8178.279.400112.7W1688 L1887 L1888 T1893 L1952 V1993 N1997 M2000 I2004W1688-M1891 HydrophobicContact CH2-CG 3.91Å; W1688-M1891 HydrophobicContact CZ3-CG 4.33Å; L1887-M1891 HydrophobicContact CD1-CG 4.36Å; L1887-M1891 HydrophobicContact CD1-SD 4.24Å; L1887-M1891 HydrophobicContact CG-SD 4.13Å; L1887-M1891 WeakPolarHBondContact O-CB 3.34Å; L1887-M1891 VanDerWaalsContact O-CG 3.27Å; L1887-M1891 WeakPolarHBondContact O-CG 3.42Å; L1887-M1891 PolarHBondContact O-N 3.13Å; L1888-M1891 HydrophobicContact CD2-SD 4.15Å; L1888-M1891 PolarHBondContact O-N 3.13Å; M1891-T1893 VanDerWaalsContact C-N 3.3Å; M1891-T1893 PolarHBondContact O-N 3.14Å; M1891-L1952 HydrophobicContact CE-CD1 4.29Å; M1891-V1993 HydrophobicContact CB-CG1 3.83Å; M1891-V1993 HydrophobicContact CB-CG2 4.21Å; M1891-N1997 WeakPolarHBondContact O-CB 3.27Å; M1891-N1997 PolarHBondContact O-ND2 3.1Å; M1891-M2000 HydrophobicContact CB-CG 3.9Å; M1891-M2000 HydrophobicContact CE-CE 3.72Å; M1891-M2000 HydrophobicContact CE-CG 3.72Å; M1891-M2000 HydrophobicContact CE-SD 3.63Å; M1891-M2000 VanDerWaalsContact CE-SD 3.53Å; M1891-M2000 HydrophobicContact CG-CG 4.24Å; M1891-M2000 HydrophobicContact CG-SD 4.45Å; M1891-I2004 HydrophobicContact CE-CB 4.3Å; M1891-I2004 HydrophobicContact CE-CD1 4.05Å; M1891-I2004 HydrophobicContact CE-CG2 4.02Å; M1891-I2004 HydrophobicContact SD-CD1 4.38Å
1892S89Confident76.9Confident13.8 Ų13.860 Ų6010%0.09729%0.291CS..THydrogen-bonded Turntrans-72.9-11175.481.30000114.7L1888 K1889 F1890 G1992L1888-S1892 PolarHBondContact O-N 3.19Å; K1889-S1892 WeakPolarHBondContact O-CB 3.35Å; K1889-S1892 PolarHBondContact O-N 3.06Å; K1889-S1892 VanDerWaalsContact O-N 3.12Å; K1889-S1892 PolarHBondContact O-OG 3.27Å; F1890-S1892 PolarHBondContact O-N 3.01Å; S1892-G1992 WeakPolarHBondContact CB-O 3.35Å
1893T85.4Confident74Confident91 Ų9163.3 Ų63.356%0.55832%0.317SS*.THydrogen-bonded Turntrans-121.8-22.1-17653.30000115.2K1889 F1890 M1891 Q1895K1889-T1893 PolarHBondContact O-N 2.94Å; K1889-T1893 PolarHBondContact O-OG1 3.11Å; F1890-T1893 PolarHBondContact O-N 3.12Å; F1890-T1893 PolarHBondContact O-OG1 3.12Å; F1890-T1893 VanDerWaalsContact O-OG1 3.09Å; M1891-T1893 VanDerWaalsContact C-N 3.3Å; M1891-T1893 PolarHBondContact O-N 3.14Å; T1893-Q1895 PolarHBondContact O-N 3.21Å
1894V83.6Confident70.8Confident22.8 Ų22.869.2 Ų69.214%0.13836%0.357CS..  trans-71.6124.6-176.9131.20000111.9W1688 F1890 L1896 N1997 M2000W1688-V1894 HydrophobicContact CH2-CG1 4.49Å; W1688-V1894 HydrophobicContact CZ2-CB 4.45Å; W1688-V1894 HydrophobicContact CZ2-CG1 3.98Å; W1688-V1894 HydrophobicContact CZ2-CG2 4.49Å; F1890-V1894 HydrophobicContact CD1-CG2 3.9Å; F1890-V1894 HydrophobicContact CD2-CB 4.49Å; F1890-V1894 HydrophobicContact CD2-CG2 3.54Å; F1890-V1894 HydrophobicContact CE1-CB 4.26Å; F1890-V1894 HydrophobicContact CE1-CG1 4.42Å; F1890-V1894 HydrophobicContact CE1-CG2 3.91Å; F1890-V1894 HydrophobicContact CE2-CB 4.12Å; F1890-V1894 HydrophobicContact CE2-CG2 3.64Å; F1890-V1894 HydrophobicContact CG-CG2 3.84Å; F1890-V1894 HydrophobicContact CZ-CB 3.99Å; F1890-V1894 HydrophobicContact CZ-CG2 3.52Å; F1890-V1894 WeakPolarHBondContact O-CB 3.25Å; F1890-V1894 WeakPolarHBondContact O-CG1 3.39Å; F1890-V1894 VanDerWaalsContact O-CG2 3.31Å; F1890-V1894 WeakPolarHBondContact O-CG2 3.32Å; F1890-V1894 PolarHBondContact O-N 2.85Å; V1894-L1896 HydrophobicContact CG1-CB 4.43Å; V1894-N1997 PolarHBondContact O-ND2 3.29Å; V1894-M2000 HydrophobicContact CG1-CE 3.94Å; V1894-M2000 HydrophobicContact CG1-CG 4.01Å; V1894-M2000 HydrophobicContact CG1-SD 4.35Å
1895Q73.3Confident67.9Low190.4 Ų190.475.8 Ų75.889%0.8940%0.397SS*.  trans-85.3119.7168.6-66.3-177.7-6.900109.4T1893T1893-Q1895 PolarHBondContact O-N 3.21Å
1896L72.2Confident64.8Low16.4 Ų16.474.7 Ų74.79%0.08642%0.419CS..  trans-128.7115175-172.868000108.7V1894 L1898 D1948 R1949 L1952 M2000V1894-L1896 HydrophobicContact CG1-CB 4.43Å; L1896-L1898 VanDerWaalsContact C-N 3.31Å; L1896-L1898 HydrophobicContact CD2-CD1 4.45Å; L1896-L1898 HydrophobicContact CD2-CD2 3.89Å; L1896-L1898 HydrophobicContact CD2-CG 4.32Å; L1896-L1898 HydrophobicContact CG-CD2 4.21Å; L1896-L1898 HydrophobicContact CG-CG 4.34Å; L1896-L1898 PolarHBondContact O-N 3Å; L1896-D1948 HydrophobicContact CD1-CB 4.25Å; L1896-R1949 HydrophobicContact CD2-CG 4.42Å; L1896-L1952 HydrophobicContact CD2-CD2 3.79Å; L1896-M2000 HydrophobicContact CB-CE 4.46Å; L1896-M2000 HydrophobicContact CB-SD 4.25Å; L1896-M2000 HydrophobicContact CD2-CE 4.22Å; L1896-M2000 HydrophobicContact CD2-SD 4.16Å
1897D58.1Low61.7Low101.4 Ų101.478.1 Ų78.154%0.54245%0.454SS..  trans-73.682.2-178.8-85.2-40.7000111.2K1899 K1941 R1949D1897-K1899 PolarHBondContact O-N 3.22Å; D1897-K1941 IonicContact OD2-NZ 3.26Å; D1897-K1941 PolarHBondContact OD2-NZ 3.06Å; D1897-R1949 PolarHBondContact O-NH2 3.32Å
1898L61.8Low58.9Low41.8 Ų41.884.7 Ų84.722%0.21950%0.495CS..THydrogen-bonded Turntrans-73.40.2176.2-66.3173.6000113.7L1896 L1900 R1949 C2003L1896-L1898 VanDerWaalsContact C-N 3.31Å; L1896-L1898 HydrophobicContact CD2-CD1 4.45Å; L1896-L1898 HydrophobicContact CD2-CD2 3.89Å; L1896-L1898 HydrophobicContact CD2-CG 4.32Å; L1896-L1898 HydrophobicContact CG-CD2 4.21Å; L1896-L1898 HydrophobicContact CG-CG 4.34Å; L1896-L1898 PolarHBondContact O-N 3Å; L1898-L1900 VanDerWaalsContact C-N 3.3Å; L1898-L1900 PolarHBondContact O-N 2.98Å; L1898-R1949 HydrophobicContact CD2-CG 4.41Å; L1898-C2003 VanDerWaalsContact CD1-SG 3.58Å; L1898-C2003 WeakPolarHBondContact CD1-SG 3.41Å
1899K49.8Very low56.1Low195.6 Ų195.690.4 Ų90.485%0.8554%0.535SS*.THydrogen-bonded Turntrans-88.324.3-177.6-70.9-170.2173.7-173.50114.2D1897 D1901D1897-K1899 PolarHBondContact O-N 3.22Å; K1899-D1901 PolarHBondContact O-N 3.33Å
1900L42.5Very low53.4Low90.6 Ų90.690.8 Ų90.847%0.47456%0.559SS.*  trans-111.180.4177.1-91.2171.2000111.7L1898 R1949L1898-L1900 VanDerWaalsContact C-N 3.3Å; L1898-L1900 PolarHBondContact O-N 2.98Å; L1900-R1949 PolarHBondContact O-NH1 3.31Å; L1900-R1949 PolarHBondContact O-NH2 3.11Å
1901D38.5Very low50.7Low87.8 Ų87.894.5 Ų94.547%0.4759%0.594SS.*SBendtrans-152.7-5.2165.8-88.2-58.9000114.9K1899 S1903 R1949 N2066K1899-D1901 PolarHBondContact O-N 3.33Å; D1901-S1903 VanDerWaalsContact C-N 3.35Å; D1901-S1903 PolarHBondContact O-N 2.64Å; D1901-R1949 IonicContact OD2-CZ 3.3Å; D1901-R1949 IonicContact OD2-NH1 3.36Å; D1901-R1949 PolarHBondContact OD2-NH1 3.06Å; D1901-R1949 IonicContact OD2-NH2 3.02Å; D1901-R1949 PolarHBondContact OD2-NH2 3.37Å; D1901-N2066 HydrophobicContact CB-CB 4.4Å; D1901-N2066 WeakPolarHBondContact CB-O 3.35Å; D1901-N2066 PolarHBondContact OD2-ND2 2.85Å
1902E35.8Very low48.2Very low169.8 Ų169.899.8 Ų99.879%0.79363%0.632SS**SBendtrans-88.5-3.3-179.1-71-164.2122.500115.9C1904E1902-C1904 PolarHBondContact O-N 2.82Å
1903S30.4Very low45.8Very low98 Ų98104.8 Ų104.869%0.68567%0.667SS**SBendtrans-108.227.5-165.459.90000116.1D1901D1901-S1903 VanDerWaalsContact C-N 3.35Å; D1901-S1903 PolarHBondContact O-N 2.64Å
1904C27.8Very low43.4Very low124 Ų124104.6 Ų104.684%0.83868%0.683SS**SBendtrans-14320-179-101.60000117.5E1902E1902-C1904 PolarHBondContact O-N 2.82Å
1905T32.1Very low41.2Very low138.6 Ų138.6107.2 Ų107.285%0.8572%0.715SS**  trans-132.890.7174.747.20000113G1907T1905-G1907 PolarHBondContact O-N 2.88Å; T1905-G1907 VanDerWaalsContact O-N 3.07Å
1906G28.6Very low39.4Very low82 Ų82106.5 Ų106.585%0.84572%0.717SS**  trans-17953.2171.300000116.5T1908G1906-T1908 PolarHBondContact O-N 3.28Å
1907G29.6Very low37.7Very low73 Ų73109.3 Ų109.375%0.75375%0.75SS**  trans-142102.6170.900000114.8T1905T1905-G1907 PolarHBondContact O-N 2.88Å; T1905-G1907 VanDerWaalsContact O-N 3.07Å
1908T34.8Very low36.6Very low140.4 Ų140.4108.2 Ų108.286%0.86176%0.763SS**  trans-154.5136.7147.6500000112.5G1906 G1910G1906-T1908 PolarHBondContact O-N 3.28Å; T1908-G1910 PolarHBondContact O-N 3.03Å
1909S33.7Very low35.4Very low121 Ų121113.7 Ų113.785%0.84680%0.798SS**  trans-122.9146.1138.2520000113.9A1911S1909-A1911 PolarHBondContact O-N 3.46Å; S1909-A1911 VanDerWaalsContact O-N 3.17Å
1910G33.3Very low34.7Very low80.4 Ų80.4108 Ų10883%0.82979%0.794SS**  trans169.483.3165.200000114T1908 S1912T1908-G1910 PolarHBondContact O-N 3.03Å; G1910-S1912 PolarHBondContact O-N 3.07Å
1911A35Very low34.3Very low102.2 Ų102.2110 Ų11085%0.84582%0.815SS**  trans-127.7125.1159.700000111.8S1909S1909-A1911 PolarHBondContact O-N 3.46Å; S1909-A1911 VanDerWaalsContact O-N 3.17Å
1912S36.3Very low34.1Very low115.2 Ų115.2109.2 Ų109.281%0.80683%0.828SS**  trans-143.7126.4178.259.30000112.6G1910G1910-S1912 PolarHBondContact O-N 3.07Å
1913S39.2Very low34Very low119.2 Ų119.2109.7 Ų109.783%0.83484%0.835SS**  trans144.6121.1157.354.10000113.6
1914G35.7Very low34.1Very low85.4 Ų85.4108.6 Ų108.688%0.8884%0.838SS**  trans145.8124.9160.900000114.6
1915G36.5Very low34.5Very low78.4 Ų78.4108.1 Ų108.181%0.80884%0.836SS**  trans129.1127.3174.800000112.8
1916D36.4Very low34.6Very low174.6 Ų174.6106.7 Ų106.793%0.93483%0.832SS**  trans-31.4143.1157-122.8-18.4000114.5
1917G36Very low35Very low76.4 Ų76.4108.6 Ų108.679%0.78883%0.833SS**  132.1142.6121.500000114.9
1918G34.6Very low35.1Very low78.8 Ų78.8109.1 Ų109.181%0.81284%0.838SS**  trans162.6115.4173.700000115.9
1919V36.2Very low35Very low157 Ų157106.3 Ų106.395%0.95284%0.836SS**  trans-84.6147.3175.8-70.70000114.2
1920G35.8Very low35Very low74.8 Ų74.8106.2 Ų106.277%0.77184%0.836SS**  trans167.3108.8171.100000113.2
1921S34.7Very low35.1Very low132.2 Ų132.2109.2 Ų109.292%0.92484%0.838SS**  trans-44140.6144.5-580000114.6
1922G34.4Very low35.1Very low71.8 Ų71.8107.5 Ų107.574%0.7483%0.831SS**  trans160.6117.817400000112.3
1923I32.8Very low35Very low180.8 Ų180.8107.9 Ų107.993%0.92783%0.834SS**  trans52.9117.8134.4-53.8174.7000112.3
1924G33.4Very low34.6Very low74.2 Ų74.2106 Ų10677%0.76583%0.832SS**  trans-173.6104.6171.800000113
1925S35.2Very low34.4Very low113.2 Ų113.2113.2 Ų113.279%0.79283%0.833SS**  trans-76135.1165.346.60000115.8
1926S34.8Very low34.2Very low109.4 Ų109.4118.1 Ų118.177%0.76583%0.834SS**  144.8143.512357.30000117
1927S36.2Very low34Very low123 Ų123117.1 Ų117.186%0.8683%0.829SS**  trans68.2133154.164.40000118.6
1928G32.5Very low34.2Very low82.8 Ų82.8121.2 Ų121.285%0.85483%0.83SS**  trans150.3117.9157.200000113.8
1929G32.7Very low34.5Very low80.8 Ų80.8122.6 Ų122.683%0.83382%0.824SS**  trans156.2130.9167.200000115.5
1930S33.8Very low34.5Very low120.6 Ų120.6118.6 Ų118.684%0.84380%0.803SS**  trans-83.8129.3165.1-178.20000114.2
1931V35.1Very low35Very low142.2 Ų142.2120.9 Ų120.986%0.86279%0.792SS**  trans-146.2125146.91790000111.8
1932G35Very low35.7Very low67.6 Ų67.6117.8 Ų117.870%0.69777%0.77SS**  trans-165.7122.2160.800000115.9G1934G1932-G1934 PolarHBondContact O-N 3.35Å; G1932-G1934 VanDerWaalsContact O-N 3.12Å
1933S34.2Very low37Very low123.6 Ų123.6123.3 Ų123.386%0.86477%0.768SS**  trans13.6108.3161.6-58.60000118.6R1935S1933-R1935 PolarHBondContact O-N 3.03Å
1934G30.7Very low38.8Very low77.6 Ų77.6118.4 Ų118.480%0.874%0.744SS**  trans-128.987153.500000116.4G1932 H1936G1932-G1934 PolarHBondContact O-N 3.35Å; G1932-G1934 VanDerWaalsContact O-N 3.12Å; G1934-H1936 VanDerWaalsContact C-N 3.31Å; G1934-H1936 PolarHBondContact O-N 3.09Å; G1934-H1936 VanDerWaalsContact O-N 3.07Å
1935R31.4Very low40.9Very low238 Ų238116.4 Ų116.490%0.89872%0.715SS**  trans-118.562.5174.7-90.5-174173.1-166.2-1114.3S1933S1933-R1935 PolarHBondContact O-N 3.03Å
1936H31.3Very low43.1Very low180.2 Ų180.2115.4 Ų115.483%0.83470%0.7SS**  trans-143.585.5172.7-71.8-70.4000113.1G1934G1934-H1936 VanDerWaalsContact C-N 3.31Å; G1934-H1936 PolarHBondContact O-N 3.09Å; G1934-H1936 VanDerWaalsContact O-N 3.07Å
1937N34Very low45.4Very low153.4 Ų153.4114.8 Ų114.882%0.8268%0.684SS**  trans-17461.9155.7-110.5-12.4000113.6
1938M38.7Very low47.8Very low164.2 Ų164.2111.2 Ų111.281%0.80966%0.655SS**  trans-123.6-17.6175.4-85.3-61.4172.600118.2S1940 S1942M1938-S1940 VanDerWaalsContact C-N 3.31Å; M1938-S1940 PolarHBondContact O-N 3.01Å; M1938-S1942 PolarHBondContact O-OG 3.47Å
1939P40.9Very low50.2Low108 Ų108109.4 Ų109.470%0.70162%0.623SS**THydrogen-bonded Turntrans-80.2-6.5-169.532.4-36.4000115.5S1942P1939-S1942 PolarHBondContact O-OG 3.31Å; P1939-S1942 VanDerWaalsContact O-OG 3.14Å
1940S37.4Very low52.8Low72 Ų72111.7 Ų111.750%0.50361%0.61SS.*THydrogen-bonded Turntrans-79.7-55.4-178.584.70000112.8M1938 S1942 R1943 D1944M1938-S1940 VanDerWaalsContact C-N 3.31Å; M1938-S1940 PolarHBondContact O-N 3.01Å; S1940-S1942 VanDerWaalsContact C-N 3.3Å; S1940-S1942 PolarHBondContact O-N 3.11Å; S1940-S1942 VanDerWaalsContact O-N 3.16Å; S1940-R1943 WeakPolarHBondContact O-CA 3.33Å; S1940-R1943 VanDerWaalsContact O-CB 3.27Å; S1940-R1943 WeakPolarHBondContact O-CB 3.37Å; S1940-R1943 PolarHBondContact O-N 3.18Å; S1940-D1944 PolarHBondContact O-N 3.13Å
1941K45.3Very low55.4Low122.4 Ų122.4106.3 Ų106.353%0.53257%0.572SS.*Hα-helixtrans-55.3-43.1-170.6-161.5-174.9-177.9-100.20112.7D1897 R1943 D1944 E1945D1897-K1941 IonicContact OD2-NZ 3.26Å; D1897-K1941 PolarHBondContact OD2-NZ 3.06Å; K1941-R1943 VanDerWaalsContact C-N 3.29Å; K1941-R1943 PolarHBondContact O-N 3.28Å; K1941-D1944 PolarHBondContact O-N 3.08Å; K1941-E1945 VanDerWaalsContact CD-OE1 3.3Å; K1941-E1945 WeakPolarHBondContact CD-OE1 3.44Å; K1941-E1945 VanDerWaalsContact CE-OE1 3.27Å; K1941-E1945 WeakPolarHBondContact CE-OE1 3.33Å; K1941-E1945 HydrophobicContact CG-CG 4.43Å; K1941-E1945 WeakPolarHBondContact CG-OE1 3.25Å; K1941-E1945 IonicContact NZ-OE1 3.29Å; K1941-E1945 PolarHBondContact NZ-OE1 3.2Å; K1941-E1945 VanDerWaalsContact O-CG 3.31Å; K1941-E1945 WeakPolarHBondContact O-CG 3.39Å; K1941-E1945 PolarHBondContact O-N 2.97Å
1942S50.7Low57.9Low67 Ų6799.8 Ų99.847%0.46953%0.533SS..Hα-helixtrans-65.2-25.3177.961.70000114.6M1938 P1939 S1940 E1945 L1946M1938-S1942 PolarHBondContact O-OG 3.47Å; P1939-S1942 PolarHBondContact O-OG 3.31Å; P1939-S1942 VanDerWaalsContact O-OG 3.14Å; S1940-S1942 VanDerWaalsContact C-N 3.3Å; S1940-S1942 PolarHBondContact O-N 3.11Å; S1940-S1942 VanDerWaalsContact O-N 3.16Å; S1942-E1945 WeakPolarHBondContact CA-OE2 3.17Å; S1942-L1946 VanDerWaalsContact O-CB 3.28Å; S1942-L1946 WeakPolarHBondContact O-CB 3.28Å; S1942-L1946 PolarHBondContact O-N 3.04Å; S1942-L1946 VanDerWaalsContact O-N 3.13Å
1943R61.6Low60.4Low187.6 Ų187.697.9 Ų97.971%0.70851%0.509SS*.Hα-helixtrans-74.2-39.6176.2-176.1-178.9178.6167.51111.2S1940 K1941 K1947S1940-R1943 WeakPolarHBondContact O-CA 3.33Å; S1940-R1943 VanDerWaalsContact O-CB 3.27Å; S1940-R1943 WeakPolarHBondContact O-CB 3.37Å; S1940-R1943 PolarHBondContact O-N 3.18Å; K1941-R1943 VanDerWaalsContact C-N 3.29Å; K1941-R1943 PolarHBondContact O-N 3.28Å; R1943-K1947 WeakPolarHBondContact O-CB 3.43Å; R1943-K1947 PolarHBondContact O-N 3.12Å; R1943-K1947 VanDerWaalsContact O-N 3.09Å
1944D70.6Confident63.1Low79.4 Ų79.495.3 Ų95.343%0.42548%0.482SS..Hα-helixtrans-72.5-43.9179.2-58.2-41.3000109.8S1940 K1941 L1946 K1947 D1948S1940-D1944 PolarHBondContact O-N 3.13Å; K1941-D1944 PolarHBondContact O-N 3.08Å; D1944-L1946 VanDerWaalsContact C-N 3.32Å; D1944-L1946 PolarHBondContact O-N 2.91Å; D1944-K1947 WeakPolarHBondContact O-CA 3.33Å; D1944-K1947 VanDerWaalsContact O-CB 3.31Å; D1944-K1947 WeakPolarHBondContact O-CB 3.41Å; D1944-K1947 PolarHBondContact O-N 3.17Å; D1944-D1948 PolarHBondContact O-N 3.11Å
1945E77.4Confident65.9Low32 Ų3291.7 Ų91.715%0.1544%0.444CS..Hα-helixtrans-56-41.7170.8-71.2165.2-177.800113K1941 S1942 K1947 D1948 R1949K1941-E1945 VanDerWaalsContact CD-OE1 3.3Å; K1941-E1945 WeakPolarHBondContact CD-OE1 3.44Å; K1941-E1945 VanDerWaalsContact CE-OE1 3.27Å; K1941-E1945 WeakPolarHBondContact CE-OE1 3.33Å; K1941-E1945 HydrophobicContact CG-CG 4.43Å; K1941-E1945 WeakPolarHBondContact CG-OE1 3.25Å; K1941-E1945 IonicContact NZ-OE1 3.29Å; K1941-E1945 PolarHBondContact NZ-OE1 3.2Å; K1941-E1945 VanDerWaalsContact O-CG 3.31Å; K1941-E1945 WeakPolarHBondContact O-CG 3.39Å; K1941-E1945 PolarHBondContact O-N 2.97Å; S1942-E1945 WeakPolarHBondContact CA-OE2 3.17Å; E1945-K1947 VanDerWaalsContact C-N 3.33Å; E1945-K1947 PolarHBondContact O-N 2.68Å; E1945-D1948 PolarHBondContact O-N 3.12Å; E1945-R1949 WeakPolarHBondContact O-CB 3.29Å; E1945-R1949 WeakPolarHBondContact O-CG 3.46Å; E1945-R1949 PolarHBondContact O-N 3.02Å
1946L81.6Confident68.6Low91.8 Ų91.882.3 Ų82.348%0.48141%0.411SS..Hα-helixtrans-69.1-32.1176179.160.9000112.7S1942 D1944 K1950S1942-L1946 VanDerWaalsContact O-CB 3.28Å; S1942-L1946 WeakPolarHBondContact O-CB 3.28Å; S1942-L1946 PolarHBondContact O-N 3.04Å; S1942-L1946 VanDerWaalsContact O-N 3.13Å; D1944-L1946 VanDerWaalsContact C-N 3.32Å; D1944-L1946 PolarHBondContact O-N 2.91Å; L1946-K1950 WeakPolarHBondContact O-CD 3.39Å; L1946-K1950 VanDerWaalsContact O-CG 3.31Å; L1946-K1950 WeakPolarHBondContact O-CG 3.37Å; L1946-K1950 PolarHBondContact O-N 3.08Å
1947K83.3Confident71.2Confident95.8 Ų95.879.9 Ų79.942%0.41739%0.394SS..Hα-helixtrans-67.5-45.5173.5-178.2-160.9170.3-150.40110D1689 R1943 D1944 E1945 K1950 A1951D1689-K1947 WeakPolarHBondContact OD1-CE 3.48Å; D1689-K1947 IonicContact OD1-NZ 3.31Å; D1689-K1947 PolarHBondContact OD1-NZ 2.86Å; D1689-K1947 WeakPolarHBondContact OD2-CE 3.25Å; D1689-K1947 IonicContact OD2-NZ 3.48Å; D1689-K1947 PolarHBondContact OD2-NZ 3.19Å; R1943-K1947 WeakPolarHBondContact O-CB 3.43Å; R1943-K1947 PolarHBondContact O-N 3.12Å; R1943-K1947 VanDerWaalsContact O-N 3.09Å; D1944-K1947 WeakPolarHBondContact O-CA 3.33Å; D1944-K1947 VanDerWaalsContact O-CB 3.31Å; D1944-K1947 WeakPolarHBondContact O-CB 3.41Å; D1944-K1947 PolarHBondContact O-N 3.17Å; E1945-K1947 VanDerWaalsContact C-N 3.33Å; E1945-K1947 PolarHBondContact O-N 2.68Å; K1947-K1950 WeakPolarHBondContact O-CB 3.38Å; K1947-K1950 PolarHBondContact O-N 3.28Å; K1947-K1950 VanDerWaalsContact O-N 3.16Å; K1947-A1951 WeakPolarHBondContact O-CB 3.34Å; K1947-A1951 PolarHBondContact O-N 3.27Å
1948D84.7Confident73.8Confident47.2 Ų47.272.8 Ų72.825%0.25236%0.356SS..Hα-helixtrans-68.2-40.9179.9-70.2-24.9000112.3L1896 D1944 E1945 K1950 A1951 L1952L1896-D1948 HydrophobicContact CD1-CB 4.25Å; D1944-D1948 PolarHBondContact O-N 3.11Å; E1945-D1948 PolarHBondContact O-N 3.12Å; D1948-K1950 VanDerWaalsContact C-N 3.32Å; D1948-K1950 PolarHBondContact O-N 3.08Å; D1948-A1951 PolarHBondContact O-N 3.21Å; D1948-A1951 VanDerWaalsContact O-N 3.14Å; D1948-L1952 VanDerWaalsContact O-CB 3.27Å; D1948-L1952 WeakPolarHBondContact O-CB 3.34Å; D1948-L1952 PolarHBondContact O-N 3.16Å
1949R84.1Confident76.2Confident46.8 Ų46.865.1 Ų65.118%0.17732%0.318CS..Hα-helixtrans-55.6-39170.2-75.1179.9147.7-174.84.4111.8L1896 D1897 L1898 L1900 D1901 E1945 L1952 S1953L1896-R1949 HydrophobicContact CD2-CG 4.42Å; D1897-R1949 PolarHBondContact O-NH2 3.32Å; L1898-R1949 HydrophobicContact CD2-CG 4.41Å; L1900-R1949 PolarHBondContact O-NH1 3.31Å; L1900-R1949 PolarHBondContact O-NH2 3.11Å; D1901-R1949 IonicContact OD2-CZ 3.3Å; D1901-R1949 IonicContact OD2-NH1 3.36Å; D1901-R1949 PolarHBondContact OD2-NH1 3.06Å; D1901-R1949 IonicContact OD2-NH2 3.02Å; D1901-R1949 PolarHBondContact OD2-NH2 3.37Å; E1945-R1949 WeakPolarHBondContact O-CB 3.29Å; E1945-R1949 WeakPolarHBondContact O-CG 3.46Å; E1945-R1949 PolarHBondContact O-N 3.02Å; R1949-L1952 WeakPolarHBondContact O-CB 3.34Å; R1949-S1953 PolarHBondContact O-N 3.04Å; R1949-S1953 VanDerWaalsContact O-N 3.12Å; R1949-S1953 PolarHBondContact O-OG 3.47Å
1950K87.8Confident78.4Confident128.8 Ų128.860.5 Ų60.556%0.5629%0.289SS*.Hα-helixtrans-72.6-39.4176.4-73.4173.2-179.2179.20113L1946 K1947 D1948 S1953 K1954L1946-K1950 WeakPolarHBondContact O-CD 3.39Å; L1946-K1950 VanDerWaalsContact O-CG 3.31Å; L1946-K1950 WeakPolarHBondContact O-CG 3.37Å; L1946-K1950 PolarHBondContact O-N 3.08Å; K1947-K1950 WeakPolarHBondContact O-CB 3.38Å; K1947-K1950 PolarHBondContact O-N 3.28Å; K1947-K1950 VanDerWaalsContact O-N 3.16Å; D1948-K1950 VanDerWaalsContact C-N 3.32Å; D1948-K1950 PolarHBondContact O-N 3.08Å; K1950-S1953 PolarHBondContact O-N 3.17Å; K1950-K1954 PolarHBondContact O-N 3.11Å; K1950-K1954 VanDerWaalsContact O-N 3.1Å
1951A87.4Confident80.7Confident6.6 Ų6.657.7 Ų57.76%0.05527%0.268CS..Hα-helixtrans-72.6-35.4179.600000111.8W1688 V1692 K1947 D1948 K1954 A1955W1688-A1951 HydrophobicContact CB-CB 3.4Å; W1688-A1951 VanDerWaalsContact CB-CB 3.41Å; W1688-A1951 HydrophobicContact CG-CB 4.25Å; V1692-A1951 HydrophobicContact CG2-CB 4.44Å; V1692-A1951 WeakPolarHBondContact CG2-O 3.48Å; K1947-A1951 WeakPolarHBondContact O-CB 3.34Å; K1947-A1951 PolarHBondContact O-N 3.27Å; D1948-A1951 PolarHBondContact O-N 3.21Å; D1948-A1951 VanDerWaalsContact O-N 3.14Å; A1951-K1954 WeakPolarHBondContact O-CB 3.01Å; A1951-K1954 PolarHBondContact O-N 3.09Å; A1951-A1955 WeakPolarHBondContact O-CB 3.33Å; A1951-A1955 PolarHBondContact O-N 3.19Å
1952L88.6Confident82.7Confident6.2 Ų6.251.9 Ų51.93%0.03224%0.243CC..Hα-helixtrans-54.6-52.4164.8167.561.9000111.2W1688 M1891 L1896 D1948 R1949 K1954 A1955 Q1956 M2000W1688-L1952 HydrophobicContact CD2-CB 4.36Å; W1688-L1952 HydrophobicContact CE3-CB 4.3Å; W1688-L1952 HydrophobicContact CH2-CB 4.34Å; W1688-L1952 HydrophobicContact CH2-CD1 3.55Å; W1688-L1952 VanDerWaalsContact CH2-CD1 3.46Å; W1688-L1952 HydrophobicContact CH2-CG 4.46Å; W1688-L1952 HydrophobicContact CZ2-CB 4.42Å; W1688-L1952 HydrophobicContact CZ2-CD1 4.24Å; W1688-L1952 HydrophobicContact CZ3-CB 4.28Å; W1688-L1952 HydrophobicContact CZ3-CD1 3.72Å; M1891-L1952 HydrophobicContact CE-CD1 4.29Å; L1896-L1952 HydrophobicContact CD2-CD2 3.79Å; D1948-L1952 VanDerWaalsContact O-CB 3.27Å; D1948-L1952 WeakPolarHBondContact O-CB 3.34Å; D1948-L1952 PolarHBondContact O-N 3.16Å; R1949-L1952 WeakPolarHBondContact O-CB 3.34Å; L1952-K1954 VanDerWaalsContact C-N 3.26Å; L1952-K1954 PolarHBondContact O-N 3.24Å; L1952-A1955 PolarHBondContact O-N 3.2Å; L1952-A1955 VanDerWaalsContact O-N 3.1Å; L1952-Q1956 HydrophobicContact CD1-CG 3.77Å; L1952-Q1956 HydrophobicContact CG-CG 4.43Å; L1952-Q1956 WeakPolarHBondContact O-CB 3.27Å; L1952-Q1956 WeakPolarHBondContact O-CG 3.37Å; L1952-Q1956 PolarHBondContact O-N 3.26Å; L1952-M2000 HydrophobicContact CD1-CE 3.91Å; L1952-M2000 VanDerWaalsContact CD1-CE 3.48Å; L1952-M2000 HydrophobicContact CD1-SD 3.59Å; L1952-M2000 VanDerWaalsContact CD1-SD 3.57Å; L1952-M2000 HydrophobicContact CD2-CE 3.98Å; L1952-M2000 HydrophobicContact CD2-SD 4.21Å; L1952-M2000 HydrophobicContact CG-CE 4.28Å; L1952-M2000 HydrophobicContact CG-SD 4.44Å
1953S87.7Confident84.4Confident27.6 Ų27.648.8 Ų48.819%0.19322%0.221CC..Hα-helixtrans-58.7-35.4178.6-168.50000112.8R1949 K1950 R1957 I2069R1949-S1953 PolarHBondContact O-N 3.04Å; R1949-S1953 VanDerWaalsContact O-N 3.12Å; R1949-S1953 PolarHBondContact O-OG 3.47Å; K1950-S1953 PolarHBondContact O-N 3.17Å; S1953-R1957 WeakPolarHBondContact O-CB 3.27Å; S1953-R1957 PolarHBondContact O-N 3.18Å; S1953-R1957 VanDerWaalsContact O-N 3.1Å; S1953-R1957 PolarHBondContact O-NH1 2.97Å; S1953-R1957 VanDerWaalsContact O-NH1 3.12Å; S1953-R1957 PolarHBondContact OG-NH2 3.11Å; S1953-I2069 WeakPolarHBondContact OG-CG2 3.39Å
1954K89.5Confident85.4Confident69.6 Ų69.639.9 Ų39.930%0.30319%0.188SC..Hα-helixtrans-67-50.4171.1-68.7-174.9-173.9-174.10111.8V1692 N1720 K1950 A1951 L1952 Q1956 R1957 H1958V1692-K1954 HydrophobicContact CG1-CB 4.28Å; V1692-K1954 HydrophobicContact CG1-CD 3.85Å; V1692-K1954 HydrophobicContact CG2-CB 3.95Å; N1720-K1954 VanDerWaalsContact O-CE 3.32Å; N1720-K1954 WeakPolarHBondContact O-CE 3.22Å; N1720-K1954 PolarHBondContact O-NZ 3.14Å; K1950-K1954 PolarHBondContact O-N 3.11Å; K1950-K1954 VanDerWaalsContact O-N 3.1Å; A1951-K1954 WeakPolarHBondContact O-CB 3.01Å; A1951-K1954 PolarHBondContact O-N 3.09Å; L1952-K1954 VanDerWaalsContact C-N 3.26Å; L1952-K1954 PolarHBondContact O-N 3.24Å; K1954-Q1956 VanDerWaalsContact C-N 3.3Å; K1954-Q1956 PolarHBondContact O-N 3.07Å; K1954-R1957 PolarHBondContact O-N 2.87Å; K1954-R1957 VanDerWaalsContact O-N 3.1Å; K1954-H1958 PolarHBondContact O-CD2 2.94Å; K1954-H1958 VanDerWaalsContact O-CD2 3.3Å; K1954-H1958 PolarHBondContact O-N 3.21Å; K1954-H1958 PolarHBondContact O-ND1 2.86Å
1955A89.4Confident86.1Confident2 Ų237.8 Ų37.82%0.01717%0.174CC..Hα-helixtrans-59.8-38.5179.800000112.7W1688 V1692 L1887 A1951 L1952 H1958 L1959W1688-A1955 HydrophobicContact CE3-CB 4.19Å; W1688-A1955 HydrophobicContact CZ3-CB 4.28Å; V1692-A1955 HydrophobicContact CG2-CB 4.27Å; L1887-A1955 HydrophobicContact CD1-CB 4.35Å; A1951-A1955 WeakPolarHBondContact O-CB 3.33Å; A1951-A1955 PolarHBondContact O-N 3.19Å; L1952-A1955 PolarHBondContact O-N 3.2Å; L1952-A1955 VanDerWaalsContact O-N 3.1Å; A1955-H1958 PolarHBondContact O-N 2.96Å; A1955-L1959 WeakPolarHBondContact O-CB 3.36Å; A1955-L1959 PolarHBondContact O-N 3.35Å
1956Q88.3Confident86.1Confident39.6 Ų39.636.8 Ų36.819%0.18517%0.171CC..Hα-helixtrans-64.5-44.3172.5-70.4-175.8-66.900112L1952 K1954 H1958 L1959 A1960 C2003 I2004L1952-Q1956 HydrophobicContact CD1-CG 3.77Å; L1952-Q1956 HydrophobicContact CG-CG 4.43Å; L1952-Q1956 WeakPolarHBondContact O-CB 3.27Å; L1952-Q1956 WeakPolarHBondContact O-CG 3.37Å; L1952-Q1956 PolarHBondContact O-N 3.26Å; K1954-Q1956 VanDerWaalsContact C-N 3.3Å; K1954-Q1956 PolarHBondContact O-N 3.07Å; Q1956-H1958 VanDerWaalsContact C-N 3.33Å; Q1956-H1958 PolarHBondContact O-N 3.09Å; Q1956-L1959 PolarHBondContact O-N 3.16Å; Q1956-A1960 WeakPolarHBondContact O-CB 3.38Å; Q1956-A1960 PolarHBondContact O-N 3.23Å; Q1956-C2003 PolarHBondContact NE2-O 3.33Å; Q1956-I2004 HydrophobicContact CG-CG2 4.49Å
1957R87Confident85.8Confident129.2 Ų129.238.7 Ų38.749%0.48818%0.181SC..Hα-helixtrans-62.5-39.6175.2-170.5-177.9-61.9102.17.8111.9S1953 K1954 A1960 F1961S1953-R1957 WeakPolarHBondContact O-CB 3.27Å; S1953-R1957 PolarHBondContact O-N 3.18Å; S1953-R1957 VanDerWaalsContact O-N 3.1Å; S1953-R1957 PolarHBondContact O-NH1 2.97Å; S1953-R1957 VanDerWaalsContact O-NH1 3.12Å; S1953-R1957 PolarHBondContact OG-NH2 3.11Å; K1954-R1957 PolarHBondContact O-N 2.87Å; K1954-R1957 VanDerWaalsContact O-N 3.1Å; R1957-A1960 PolarHBondContact O-N 2.88Å; R1957-F1961 VanDerWaalsContact O-CB 3.24Å; R1957-F1961 WeakPolarHBondContact O-CB 3.19Å; R1957-F1961 PolarHBondContact O-N 3.25Å
1958H88.1Confident85.5Confident4.6 Ų4.636.8 Ų36.82%0.02119%0.189CC..Hα-helixtrans-65-40.2175.8-60.8171.2000111.9F1695 N1720 W1883 K1954 A1955 Q1956 L1962F1695-H1958 HydrophobicContact CD1-CB 3.65Å; F1695-H1958 AromaticContact CD1-CD2 3.64Å; F1695-H1958 WeakPolarHBondContact CD1-CD2 3.48Å; F1695-H1958 AromaticContact CD1-CE1 3.68Å; F1695-H1958 AromaticContact CD1-CG 3.31Å; F1695-H1958 AromaticContact CD1-ND1 3.4Å; F1695-H1958 VanDerWaalsContact CD1-ND1 3.29Å; F1695-H1958 WeakPolarHBondContact CD1-ND1 3.34Å; F1695-H1958 AromaticContact CD1-NE2 3.9Å; F1695-H1958 HydrophobicContact CD2-CB 4.42Å; F1695-H1958 HydrophobicContact CE1-CB 3.7Å; F1695-H1958 AromaticContact CE1-CD2 3.75Å; F1695-H1958 AromaticContact CE1-CG 3.57Å; F1695-H1958 AromaticContact CE1-ND1 3.84Å; F1695-H1958 HydrophobicContact CG-CB 4.12Å; F1695-H1958 AromaticContact CG-CG 3.99Å; F1695-H1958 AromaticContact CG-ND1 3.86Å; F1695-H1958 HydrophobicContact CZ-CB 4.27Å; N1720-H1958 PolarHBondContact OD1-CE1 3.44Å; N1720-H1958 VanDerWaalsContact OD1-CE1 3.24Å; N1720-H1958 PolarHBondContact OD1-NE2 3.14Å; W1883-H1958 HydrophobicContact CH2-CB 4.4Å; K1954-H1958 PolarHBondContact O-CD2 2.94Å; K1954-H1958 VanDerWaalsContact O-CD2 3.3Å; K1954-H1958 PolarHBondContact O-N 3.21Å; K1954-H1958 PolarHBondContact O-ND1 2.86Å; A1955-H1958 PolarHBondContact O-N 2.96Å; Q1956-H1958 VanDerWaalsContact C-N 3.33Å; Q1956-H1958 PolarHBondContact O-N 3.09Å; H1958-L1962 VanDerWaalsContact O-CB 3.31Å; H1958-L1962 WeakPolarHBondContact O-CB 3.34Å; H1958-L1962 WeakPolarHBondContact O-CG 3.37Å; H1958-L1962 PolarHBondContact O-N 3.05Å
1959L89Confident85.3Confident3.8 Ų3.837.2 Ų37.22%0.0220%0.195CC..Hα-helixtrans-69.5-41.6176.2-178.960.8000112.2V1884 L1887 L1888 A1955 Q1956 L1962 L1963 V1982 F1986 I2004V1884-L1959 HydrophobicContact CG1-CD1 4.14Å; V1884-L1959 HydrophobicContact CG2-CD1 4.37Å; L1887-L1959 HydrophobicContact CD2-CB 4.46Å; L1887-L1959 HydrophobicContact CD2-CD2 4.41Å; L1888-L1959 HydrophobicContact CD2-CD2 4.39Å; A1955-L1959 WeakPolarHBondContact O-CB 3.36Å; A1955-L1959 PolarHBondContact O-N 3.35Å; Q1956-L1959 PolarHBondContact O-N 3.16Å; L1959-L1962 PolarHBondContact O-N 3.23Å; L1959-L1963 HydrophobicContact CD1-CD1 4.23Å; L1959-L1963 HydrophobicContact CG-CD1 4.18Å; L1959-L1963 WeakPolarHBondContact O-CD1 3.45Å; L1959-L1963 VanDerWaalsContact O-CG 3.29Å; L1959-L1963 WeakPolarHBondContact O-CG 3.38Å; L1959-L1963 PolarHBondContact O-N 3.02Å; L1959-L1963 VanDerWaalsContact O-N 3.1Å; L1959-V1982 HydrophobicContact CD1-CG1 4.38Å; L1959-F1986 HydrophobicContact CD1-CD2 4.31Å; L1959-F1986 HydrophobicContact CD2-CD2 4.12Å; L1959-F1986 HydrophobicContact CD2-CE2 4.18Å; L1959-F1986 HydrophobicContact CG-CD2 4.44Å; L1959-I2004 HydrophobicContact CD2-CD1 3.89Å
1960A87.5Confident85.2Confident10.8 Ų10.835.9 Ų35.99%0.08919%0.191CC..Hα-helixtrans-59.7-49.5173.500000111.1Q1956 R1957 L1962 L1963 G1964 Y1965 Q2007Q1956-A1960 WeakPolarHBondContact O-CB 3.38Å; Q1956-A1960 PolarHBondContact O-N 3.23Å; R1957-A1960 PolarHBondContact O-N 2.88Å; A1960-L1962 PolarHBondContact O-N 2.96Å; A1960-L1963 CarbonylContact O-C 3.53Å; A1960-L1963 WeakPolarHBondContact O-CA 3.37Å; A1960-L1963 PolarHBondContact O-N 3.05Å; A1960-L1963 VanDerWaalsContact O-N 3.09Å; A1960-G1964 PolarHBondContact O-N 3.12Å; A1960-Y1965 CarbonylContact C-O 3.49Å; A1960-Y1965 VanDerWaalsContact C-O 3.29Å; A1960-Y1965 HydrophobicContact CB-CD1 4.3Å; A1960-Y1965 PolarHBondContact O-N 3.09Å; A1960-Q2007 VanDerWaalsContact CB-OE1 3.27Å
1961F85.5Confident84.8Confident12.6 Ų12.631.4 Ų31.46%0.05517%0.173CC..Hα-helixtrans-55.9-49.3173.7163.7-126.9000112F1695 L1719 L1863 I1866 Q1867 R1957 L1963 G1964F1695-F1961 HydrophobicContact CE1-CD1 4.24Å; F1695-F1961 HydrophobicContact CE1-CE1 4.37Å; F1695-F1961 HydrophobicContact CE2-CD1 4.26Å; F1695-F1961 HydrophobicContact CE2-CE1 4.22Å; F1695-F1961 AromaticContact CZ-CD1 3.74Å; F1695-F1961 HydrophobicContact CZ-CD1 3.74Å; F1695-F1961 AromaticContact CZ-CE1 3.78Å; F1695-F1961 HydrophobicContact CZ-CE1 3.78Å; L1719-F1961 HydrophobicContact CD1-CD1 4.19Å; L1719-F1961 HydrophobicContact CD1-CE1 3.95Å; L1863-F1961 HydrophobicContact CB-CD2 3.93Å; L1863-F1961 HydrophobicContact CB-CE2 3.55Å; L1863-F1961 HydrophobicContact CB-CZ 4.28Å; L1863-F1961 HydrophobicContact CD1-CD2 4.38Å; L1863-F1961 HydrophobicContact CD2-CD1 4.39Å; L1863-F1961 HydrophobicContact CD2-CD2 3.97Å; L1863-F1961 HydrophobicContact CD2-CE1 4.27Å; L1863-F1961 HydrophobicContact CD2-CE2 3.85Å; L1863-F1961 HydrophobicContact CD2-CG 4.34Å; L1863-F1961 HydrophobicContact CD2-CZ 4Å; L1863-F1961 HydrophobicContact CG-CD2 4.31Å; L1863-F1961 HydrophobicContact CG-CE2 4.22Å; L1863-F1961 VanDerWaalsContact O-CE2 3.22Å; L1863-F1961 WeakPolarHBondContact O-CE2 3.33Å; L1863-F1961 WeakPolarHBondContact O-CZ 3.4Å; I1866-F1961 HydrophobicContact CB-CZ 3.94Å; I1866-F1961 HydrophobicContact CG2-CE1 3.96Å; I1866-F1961 HydrophobicContact CG2-CZ 3.69Å; Q1867-F1961 HydrophobicContact CB-CE2 4.14Å; Q1867-F1961 HydrophobicContact CB-CZ 4.18Å; Q1867-F1961 PolarHBondContact OE1-O 2.96Å; Q1867-F1961 VanDerWaalsContact OE1-O 3.11Å; R1957-F1961 VanDerWaalsContact O-CB 3.24Å; R1957-F1961 WeakPolarHBondContact O-CB 3.19Å; R1957-F1961 PolarHBondContact O-N 3.25Å; F1961-L1963 PolarHBondContact O-N 3.2Å; F1961-L1963 VanDerWaalsContact O-N 3.16Å; F1961-G1964 WeakPolarHBondContact O-CA 3.29Å; F1961-G1964 PolarHBondContact O-N 3.08Å
1962L86.6Confident84.4Confident1 Ų131.5 Ų31.51%0.00517%0.172CC..Hα-helixtrans-63.9-18.1177.3-82.5179.8000114.2F1695 Q1867 L1870 L1880 W1883 H1958 L1959 A1960 G1964 V1982F1695-L1962 HydrophobicContact CD2-CD1 4.07Å; F1695-L1962 HydrophobicContact CD2-CG 4.48Å; F1695-L1962 HydrophobicContact CE2-CD1 3.62Å; F1695-L1962 HydrophobicContact CE2-CD2 3.87Å; F1695-L1962 HydrophobicContact CE2-CG 3.67Å; F1695-L1962 HydrophobicContact CZ-CD1 4.36Å; F1695-L1962 HydrophobicContact CZ-CD2 4.27Å; F1695-L1962 HydrophobicContact CZ-CG 4.11Å; Q1867-L1962 PolarHBondContact NE2-O 3.06Å; L1870-L1962 HydrophobicContact CD1-CD2 4.13Å; L1880-L1962 HydrophobicContact CD1-CD2 3.96Å; L1880-L1962 HydrophobicContact CD2-CD1 4.09Å; L1880-L1962 HydrophobicContact CD2-CD2 4.26Å; W1883-L1962 HydrophobicContact CE3-CD1 4.37Å; W1883-L1962 HydrophobicContact CZ3-CD1 4.02Å; H1958-L1962 VanDerWaalsContact O-CB 3.31Å; H1958-L1962 WeakPolarHBondContact O-CB 3.34Å; H1958-L1962 WeakPolarHBondContact O-CG 3.37Å; H1958-L1962 PolarHBondContact O-N 3.05Å; L1959-L1962 PolarHBondContact O-N 3.23Å; A1960-L1962 PolarHBondContact O-N 2.96Å; L1962-G1964 VanDerWaalsContact C-N 3.34Å; L1962-V1982 HydrophobicContact CB-CB 4.42Å; L1962-V1982 HydrophobicContact CB-CG1 3.68Å; L1962-V1982 HydrophobicContact CB-CG2 4.07Å; L1962-V1982 HydrophobicContact CD1-CG1 4.48Å; L1962-V1982 HydrophobicContact CD1-CG2 4.38Å; L1962-V1982 HydrophobicContact CD2-CG2 4.19Å; L1962-V1982 HydrophobicContact CG-CG2 4.41Å; L1962-V1982 WeakPolarHBondContact O-CB 3.42Å; L1962-V1982 WeakPolarHBondContact O-CG1 3.37Å
1963L86.7Confident84.1Confident1.8 Ų1.832.5 Ų32.51%0.00918%0.18CC..THydrogen-bonded Turntrans-922.3172.1-68.3166.4000112.4L1959 A1960 F1961 Y1965 M1977 V1982 F1983 F1986 V2011L1959-L1963 HydrophobicContact CD1-CD1 4.23Å; L1959-L1963 HydrophobicContact CG-CD1 4.18Å; L1959-L1963 WeakPolarHBondContact O-CD1 3.45Å; L1959-L1963 VanDerWaalsContact O-CG 3.29Å; L1959-L1963 WeakPolarHBondContact O-CG 3.38Å; L1959-L1963 PolarHBondContact O-N 3.02Å; L1959-L1963 VanDerWaalsContact O-N 3.1Å; A1960-L1963 CarbonylContact O-C 3.53Å; A1960-L1963 WeakPolarHBondContact O-CA 3.37Å; A1960-L1963 PolarHBondContact O-N 3.05Å; A1960-L1963 VanDerWaalsContact O-N 3.09Å; F1961-L1963 PolarHBondContact O-N 3.2Å; F1961-L1963 VanDerWaalsContact O-N 3.16Å; L1963-Y1965 VanDerWaalsContact C-N 3.34Å; L1963-M1977 VanDerWaalsContact O-CE 3.3Å; L1963-M1977 WeakPolarHBondContact O-CE 3.44Å; L1963-V1982 HydrophobicContact CD2-CB 4.43Å; L1963-V1982 HydrophobicContact CD2-CG1 3.77Å; L1963-V1982 HydrophobicContact CG-CG1 4.01Å; L1963-F1983 HydrophobicContact CD2-CB 4.29Å; L1963-F1986 HydrophobicContact CD1-CD1 4.29Å; L1963-F1986 HydrophobicContact CD1-CD2 4.07Å; L1963-F1986 HydrophobicContact CD1-CE1 4.45Å; L1963-F1986 HydrophobicContact CD1-CE2 4.28Å; L1963-F1986 HydrophobicContact CD1-CG 4.08Å; L1963-F1986 HydrophobicContact CD1-CZ 4.46Å; L1963-F1986 HydrophobicContact CD2-CB 4.18Å; L1963-F1986 HydrophobicContact CD2-CD1 4.46Å; L1963-F1986 HydrophobicContact CD2-CG 4.35Å; L1963-V2011 HydrophobicContact CD1-CG2 4.17Å
1964G83.1Confident83.9Confident1.6 Ų1.631.2 Ų31.22%0.01617%0.17CC..THydrogen-bonded Turntrans74.419.5-176.700000114.3A1960 F1961 L1962 F1970 D1971A1960-G1964 PolarHBondContact O-N 3.12Å; F1961-G1964 WeakPolarHBondContact O-CA 3.29Å; F1961-G1964 PolarHBondContact O-N 3.08Å; L1962-G1964 VanDerWaalsContact C-N 3.34Å; G1964-F1970 CarbonylContact O-C 3.55Å; G1964-F1970 VanDerWaalsContact O-CA 3.29Å; G1964-F1970 WeakPolarHBondContact O-CA 3.37Å; G1964-F1970 WeakPolarHBondContact O-CD1 3.17Å; G1964-D1971 PolarHBondContact O-N 3.13Å
1965Y84.6Confident83.6Confident33.8 Ų33.832.4 Ų32.413%0.13318%0.177CC..EExtended strand (participates in β ladder)trans-102116.6-180-173.2-107.5000111.4A1960 L1963 G1968 S1969 F1970 H2006 V2010A1960-Y1965 CarbonylContact C-O 3.49Å; A1960-Y1965 VanDerWaalsContact C-O 3.29Å; A1960-Y1965 HydrophobicContact CB-CD1 4.3Å; A1960-Y1965 PolarHBondContact O-N 3.09Å; L1963-Y1965 VanDerWaalsContact C-N 3.34Å; Y1965-G1968 WeakPolarHBondContact OH-CA 3.38Å; Y1965-S1969 CarbonylContact C-O 3.59Å; Y1965-S1969 WeakPolarHBondContact CA-O 3.35Å; Y1965-S1969 WeakPolarHBondContact CD2-O 3.36Å; Y1965-F1970 AromaticContact CD2-CD1 3.93Å; Y1965-F1970 HydrophobicContact CD2-CD1 4.11Å; Y1965-F1970 AromaticContact CD2-CD2 3.97Å; Y1965-F1970 HydrophobicContact CD2-CD2 4.03Å; Y1965-F1970 AromaticContact CD2-CE1 3.88Å; Y1965-F1970 HydrophobicContact CD2-CE1 3.93Å; Y1965-F1970 AromaticContact CD2-CE2 3.84Å; Y1965-F1970 HydrophobicContact CD2-CE2 3.84Å; Y1965-F1970 HydrophobicContact CD2-CG 4.17Å; Y1965-F1970 AromaticContact CD2-CZ 3.79Å; Y1965-F1970 HydrophobicContact CD2-CZ 3.79Å; Y1965-F1970 HydrophobicContact CE2-CD2 4.5Å; Y1965-F1970 HydrophobicContact CE2-CE2 4.29Å; Y1965-F1970 HydrophobicContact CE2-CZ 4.38Å; Y1965-F1970 HydrophobicContact CG-CD1 4.44Å; Y1965-F1970 HydrophobicContact CG-CE1 4.29Å; Y1965-F1970 HydrophobicContact CG-CZ 4.44Å; Y1965-H2006 PolarHBondContact OH-NE2 3.42Å; Y1965-V2010 HydrophobicContact CD2-CG1 4.06Å; Y1965-V2010 HydrophobicContact CE2-CG1 3.54Å
1966T78.4Confident83.3Confident12.6 Ų12.636 Ų368%0.07719%0.192CC..EExtended strand (participates in β ladder)trans-143.3133.4-168.544.50000109.8N1860 L1863 G1968 S1969 D1971N1860-T1966 PolarHBondContact ND2-OG1 3.49Å; L1863-T1966 HydrophobicContact CD1-CG2 3.87Å; T1966-G1968 PolarHBondContact O-N 3.16Å; T1966-S1969 PolarHBondContact N-O 3.23Å; T1966-S1969 CarbonylContact O-C 3.57Å; T1966-S1969 PolarHBondContact O-N 3.04Å; T1966-S1969 VanDerWaalsContact O-O 3.08Å; T1966-S1969 PolarHBondContact O-OG 3.05Å; T1966-S1969 VanDerWaalsContact O-OG 3.09Å; T1966-D1971 PolarHBondContact OG1-OD1 2.83Å; T1966-D1971 PolarHBondContact OG1-OD2 3.18Å
1967D74.3Confident83.2Confident130.4 Ų130.434.2 Ų34.270%0.69718%0.184SC*.THydrogen-bonded Turntrans46.333.1175.9-60.7-22.3000116.1
1968G77Confident83.2Confident56 Ų5629.9 Ų29.958%0.57717%0.168SC*.THydrogen-bonded Turntrans91.32.8178.500000115.2Y1965 T1966Y1965-G1968 WeakPolarHBondContact OH-CA 3.38Å; T1966-G1968 PolarHBondContact O-N 3.16Å
1969S80Confident83.1Confident55.8 Ų55.835.3 Ų35.339%0.3920%0.196SC..EExtended strand (participates in β ladder)trans-129.7175.3-177.1730000111.9Y1965 T1966Y1965-S1969 CarbonylContact C-O 3.59Å; Y1965-S1969 WeakPolarHBondContact CA-O 3.35Å; Y1965-S1969 WeakPolarHBondContact CD2-O 3.36Å; T1966-S1969 PolarHBondContact N-O 3.23Å; T1966-S1969 CarbonylContact O-C 3.57Å; T1966-S1969 PolarHBondContact O-N 3.04Å; T1966-S1969 VanDerWaalsContact O-O 3.08Å; T1966-S1969 PolarHBondContact O-OG 3.05Å; T1966-S1969 VanDerWaalsContact O-OG 3.09Å
1970F83.3Confident82.9Confident19 Ų1935.3 Ų35.38%0.08320%0.197CC..EExtended strand (participates in β ladder)trans-107.4126.8169.5-74.4-83.7000110.7G1964 Y1965 I1972 M1977 V2010 V2011 F2014 A2022G1964-F1970 CarbonylContact O-C 3.55Å; G1964-F1970 VanDerWaalsContact O-CA 3.29Å; G1964-F1970 WeakPolarHBondContact O-CA 3.37Å; G1964-F1970 WeakPolarHBondContact O-CD1 3.17Å; Y1965-F1970 AromaticContact CD2-CD1 3.93Å; Y1965-F1970 HydrophobicContact CD2-CD1 4.11Å; Y1965-F1970 AromaticContact CD2-CD2 3.97Å; Y1965-F1970 HydrophobicContact CD2-CD2 4.03Å; Y1965-F1970 AromaticContact CD2-CE1 3.88Å; Y1965-F1970 HydrophobicContact CD2-CE1 3.93Å; Y1965-F1970 AromaticContact CD2-CE2 3.84Å; Y1965-F1970 HydrophobicContact CD2-CE2 3.84Å; Y1965-F1970 HydrophobicContact CD2-CG 4.17Å; Y1965-F1970 AromaticContact CD2-CZ 3.79Å; Y1965-F1970 HydrophobicContact CD2-CZ 3.79Å; Y1965-F1970 HydrophobicContact CE2-CD2 4.5Å; Y1965-F1970 HydrophobicContact CE2-CE2 4.29Å; Y1965-F1970 HydrophobicContact CE2-CZ 4.38Å; Y1965-F1970 HydrophobicContact CG-CD1 4.44Å; Y1965-F1970 HydrophobicContact CG-CE1 4.29Å; Y1965-F1970 HydrophobicContact CG-CZ 4.44Å; F1970-I1972 VanDerWaalsContact C-N 3.3Å; F1970-I1972 PolarHBondContact O-N 3.12Å; F1970-M1977 HydrophobicContact CD1-CE 3.68Å; F1970-M1977 HydrophobicContact CD1-SD 4.47Å; F1970-M1977 HydrophobicContact CE1-CE 3.24Å; F1970-M1977 HydrophobicContact CE1-SD 3.95Å; F1970-M1977 HydrophobicContact CZ-CE 3.95Å; F1970-V2010 HydrophobicContact CE2-CG1 3.51Å; F1970-V2010 VanDerWaalsContact CE2-CG1 3.49Å; F1970-V2010 HydrophobicContact CZ-CG1 3.81Å; F1970-V2011 HydrophobicContact CE1-CG2 4.36Å; F1970-V2011 HydrophobicContact CZ-CG2 4.11Å; F1970-F2014 HydrophobicContact CB-CD1 4.21Å; F1970-F2014 HydrophobicContact CB-CD2 4.46Å; F1970-F2014 HydrophobicContact CB-CE1 3.71Å; F1970-F2014 HydrophobicContact CB-CE2 3.99Å; F1970-F2014 HydrophobicContact CB-CZ 3.5Å; F1970-F2014 VanDerWaalsContact CB-CZ 3.47Å; F1970-F2014 AromaticContact CD1-CD1 3.63Å; F1970-F2014 HydrophobicContact CD1-CD1 3.75Å; F1970-F2014 AromaticContact CD1-CE1 3.65Å; F1970-F2014 HydrophobicContact CD1-CE1 3.77Å; F1970-F2014 HydrophobicContact CD1-CG 4.4Å; F1970-F2014 HydrophobicContact CD1-CZ 4.4Å; F1970-F2014 HydrophobicContact CD2-CB 3.99Å; F1970-F2014 AromaticContact CD2-CD1 3.65Å; F1970-F2014 HydrophobicContact CD2-CD1 3.65Å; F1970-F2014 VanDerWaalsContact CD2-CD1 3.48Å; F1970-F2014 AromaticContact CD2-CD2 3.58Å; F1970-F2014 HydrophobicContact CD2-CD2 3.58Å; F1970-F2014 AromaticContact CD2-CE1 3.83Å; F1970-F2014 HydrophobicContact CD2-CE1 3.92Å; F1970-F2014 AromaticContact CD2-CE2 3.84Å; F1970-F2014 HydrophobicContact CD2-CE2 3.84Å; F1970-F2014 AromaticContact CD2-CG 3.47Å; F1970-F2014 HydrophobicContact CD2-CG 3.47Å; F1970-F2014 VanDerWaalsContact CD2-CG 3.46Å; F1970-F2014 AromaticContact CD2-CZ 3.99Å; F1970-F2014 HydrophobicContact CD2-CZ 4Å; F1970-F2014 AromaticContact CE1-CD1 3.73Å; F1970-F2014 HydrophobicContact CE1-CD1 3.86Å; F1970-F2014 HydrophobicContact CE1-CE1 4.23Å; F1970-F2014 HydrophobicContact CE1-CG 4.38Å; F1970-F2014 HydrophobicContact CE2-CB 3.41Å; F1970-F2014 VanDerWaalsContact CE2-CB 3.42Å; F1970-F2014 AromaticContact CE2-CD1 3.65Å; F1970-F2014 HydrophobicContact CE2-CD1 3.75Å; F1970-F2014 AromaticContact CE2-CD2 3.83Å; F1970-F2014 HydrophobicContact CE2-CD2 3.93Å; F1970-F2014 HydrophobicContact CE2-CE1 4.38Å; F1970-F2014 HydrophobicContact CE2-CE2 4.38Å; F1970-F2014 AromaticContact CE2-CG 3.44Å; F1970-F2014 HydrophobicContact CE2-CG 3.44Å; F1970-F2014 VanDerWaalsContact CE2-CG 3.44Å; F1970-F2014 AromaticContact CG-CD1 3.53Å; F1970-F2014 HydrophobicContact CG-CD1 3.65Å; F1970-F2014 VanDerWaalsContact CG-CD1 3.49Å; F1970-F2014 HydrophobicContact CG-CD2 4.19Å; F1970-F2014 AromaticContact CG-CE1 3.53Å; F1970-F2014 HydrophobicContact CG-CE1 3.53Å; F1970-F2014 VanDerWaalsContact CG-CE1 3.43Å; F1970-F2014 AromaticContact CG-CE2 3.9Å; F1970-F2014 HydrophobicContact CG-CE2 4.08Å; F1970-F2014 AromaticContact CG-CG 3.95Å; F1970-F2014 HydrophobicContact CG-CG 3.98Å; F1970-F2014 AromaticContact CG-CZ 3.75Å; F1970-F2014 HydrophobicContact CG-CZ 3.75Å; F1970-F2014 HydrophobicContact CZ-CB 3.76Å; F1970-F2014 AromaticContact CZ-CD1 3.75Å; F1970-F2014 HydrophobicContact CZ-CD1 3.85Å; F1970-F2014 AromaticContact CZ-CG 3.92Å; F1970-F2014 HydrophobicContact CZ-CG 3.92Å; F1970-A2022 HydrophobicContact CB-CB 4.16Å; F1970-A2022 WeakPolarHBondContact O-CB 3.42Å
1971D78.6Confident83Confident35.8 Ų35.835.8 Ų35.819%0.19120%0.199CC..SBendtrans-77.5-16.4172.3-78.7-32.5000112.8N1860 G1964 T1966N1860-D1971 VanDerWaalsContact CB-OD1 3.29Å; N1860-D1971 WeakPolarHBondContact CB-OD1 3.3Å; N1860-D1971 VanDerWaalsContact CB-OD2 3.29Å; N1860-D1971 WeakPolarHBondContact CB-OD2 3.31Å; N1860-D1971 PolarHBondContact ND2-OD1 3.02Å; N1860-D1971 PolarHBondContact ND2-OD2 3.24Å; G1964-D1971 PolarHBondContact O-N 3.13Å; T1966-D1971 PolarHBondContact OG1-OD1 2.83Å; T1966-D1971 PolarHBondContact OG1-OD2 3.18Å
1972I80.2Confident83.2Confident7 Ų735.3 Ų35.34%0.03620%0.197CC..SBendtrans-119.5126.2-167.7-68.7-174.2000109.6Q1867 F1970 K1976 M1977 F2014Q1867-I1972 HydrophobicContact CG-CD1 4.34Å; Q1867-I1972 VanDerWaalsContact NE2-CD1 3.34Å; F1970-I1972 VanDerWaalsContact C-N 3.3Å; F1970-I1972 PolarHBondContact O-N 3.12Å; I1972-K1976 HydrophobicContact CG2-CB 3.63Å; I1972-K1976 HydrophobicContact CG2-CD 4.09Å; I1972-K1976 HydrophobicContact CG2-CG 3.91Å; I1972-M1977 HydrophobicContact CG2-CB 4.34Å; I1972-F2014 WeakPolarHBondContact O-CE1 3.4Å; I1972-F2014 WeakPolarHBondContact O-CZ 3.35Å
1973P82.4Confident83.5Confident28.2 Ų28.235.3 Ų35.318%0.18320%0.197CC..  trans-68152.9-178.428.6-36.1000112H1975 K1976 M1977 R2020P1973-H1975 WeakPolarHBondContact CG-CE1 3.33Å; P1973-H1975 PolarHBondContact O-N 3.04Å; P1973-K1976 HydrophobicContact CG-CB 4.26Å; P1973-K1976 HydrophobicContact CG-CD 4.38Å; P1973-K1976 HydrophobicContact CG-CG 4.26Å; P1973-K1976 PolarHBondContact O-N 3.26Å; P1973-M1977 PolarHBondContact O-N 3.22Å; P1973-R2020 WeakPolarHBondContact CB-O 3.38Å
1974P83.4Confident83.7Confident0 Ų037.5 Ų37.50%021%0.207CC..Hα-helixtrans-54.7-33.2-170.9-28.834.7000115K1976 M1977 R1978 F2014 S2017 Q2019P1974-K1976 VanDerWaalsContact C-N 3.32Å; P1974-K1976 PolarHBondContact O-N 3.27Å; P1974-M1977 PolarHBondContact O-N 3.33Å; P1974-R1978 VanDerWaalsContact O-CB 3.31Å; P1974-R1978 WeakPolarHBondContact O-CB 3.4Å; P1974-R1978 VanDerWaalsContact O-CG 3.3Å; P1974-R1978 WeakPolarHBondContact O-CG 3.26Å; P1974-R1978 PolarHBondContact O-N 3.22Å; P1974-R1978 PolarHBondContact O-NE 3.14Å; P1974-F2014 HydrophobicContact CB-CD1 4.4Å; P1974-F2014 HydrophobicContact CB-CE1 4.41Å; P1974-F2014 VanDerWaalsContact CD-CZ 3.46Å; P1974-F2014 HydrophobicContact CG-CD1 4.32Å; P1974-F2014 HydrophobicContact CG-CD2 4.14Å; P1974-F2014 HydrophobicContact CG-CE1 3.92Å; P1974-F2014 HydrophobicContact CG-CE2 3.72Å; P1974-F2014 HydrophobicContact CG-CG 4.41Å; P1974-F2014 HydrophobicContact CG-CZ 3.61Å; P1974-S2017 WeakPolarHBondContact CB-O 3.4Å; P1974-Q2019 HydrophobicContact CG-CB 4.26Å
1975H82.3Confident84.2Confident94.2 Ų94.237.4 Ų37.444%0.43621%0.206SC..Hα-helixtrans-68.8-26.9178.869.3-98.1000113.6P1973 N1979P1973-H1975 WeakPolarHBondContact CG-CE1 3.33Å; P1973-H1975 PolarHBondContact O-N 3.04Å; H1975-N1979 PolarHBondContact O-ND2 3.17Å
1976K83.3Confident84.7Confident78.2 Ų78.235.8 Ų35.834%0.3420%0.2SC..Hα-helixtrans-84.5-40176.4-163.6176.2-178.9179.80110.7I1972 P1973 P1974 R1978 N1979 S1980I1972-K1976 HydrophobicContact CG2-CB 3.63Å; I1972-K1976 HydrophobicContact CG2-CD 4.09Å; I1972-K1976 HydrophobicContact CG2-CG 3.91Å; P1973-K1976 HydrophobicContact CG-CB 4.26Å; P1973-K1976 HydrophobicContact CG-CD 4.38Å; P1973-K1976 HydrophobicContact CG-CG 4.26Å; P1973-K1976 PolarHBondContact O-N 3.26Å; P1974-K1976 VanDerWaalsContact C-N 3.32Å; P1974-K1976 PolarHBondContact O-N 3.27Å; K1976-R1978 VanDerWaalsContact C-N 3.32Å; K1976-R1978 PolarHBondContact O-N 3.11Å; K1976-N1979 PolarHBondContact O-N 3.09Å; K1976-N1979 VanDerWaalsContact O-N 3.09Å; K1976-S1980 PolarHBondContact O-N 3.12Å
1977M85.7Confident85.4Confident2.4 Ų2.435.3 Ų35.31%0.01220%0.197CC..Hα-helixtrans-59.3-43.4171.8-172.7-174.157.100111.5L1963 F1970 I1972 P1973 P1974 N1979 S1980 F1983 V2011 F2014 C2015L1963-M1977 VanDerWaalsContact O-CE 3.3Å; L1963-M1977 WeakPolarHBondContact O-CE 3.44Å; F1970-M1977 HydrophobicContact CD1-CE 3.68Å; F1970-M1977 HydrophobicContact CD1-SD 4.47Å; F1970-M1977 HydrophobicContact CE1-CE 3.24Å; F1970-M1977 HydrophobicContact CE1-SD 3.95Å; F1970-M1977 HydrophobicContact CZ-CE 3.95Å; I1972-M1977 HydrophobicContact CG2-CB 4.34Å; P1973-M1977 PolarHBondContact O-N 3.22Å; P1974-M1977 PolarHBondContact O-N 3.33Å; M1977-N1979 PolarHBondContact O-N 3.13Å; M1977-N1979 VanDerWaalsContact O-N 3.12Å; M1977-S1980 WeakPolarHBondContact O-CB 3.32Å; M1977-S1980 PolarHBondContact O-N 3.23Å; M1977-S1980 VanDerWaalsContact O-N 3.12Å; M1977-F1983 HydrophobicContact CE-CD2 4.08Å; M1977-F1983 HydrophobicContact CE-CE2 4.09Å; M1977-F1983 HydrophobicContact CG-CB 4.11Å; M1977-F1983 HydrophobicContact CG-CD2 4.09Å; M1977-F1983 HydrophobicContact CG-CG 4.14Å; M1977-F1983 VanDerWaalsContact O-CB 3.27Å; M1977-F1983 WeakPolarHBondContact O-CB 3.33Å; M1977-F1983 WeakPolarHBondContact O-CD1 3.3Å; M1977-F1983 WeakPolarHBondContact O-CG 3.43Å; M1977-F1983 HydrophobicContact SD-CD2 4.2Å; M1977-F1983 HydrophobicContact SD-CE2 4.35Å; M1977-V2011 HydrophobicContact CE-CG1 4.48Å; M1977-V2011 HydrophobicContact SD-CG1 4.44Å; M1977-F2014 HydrophobicContact CE-CB 4.47Å; M1977-F2014 HydrophobicContact CE-CD1 3.59Å; M1977-F2014 HydrophobicContact CE-CE1 4.29Å; M1977-F2014 HydrophobicContact CE-CG 4.49Å; M1977-F2014 HydrophobicContact SD-CD1 3.97Å; M1977-F2014 HydrophobicContact SD-CE1 4.46Å; M1977-C2015 VanDerWaalsContact CE-CA 3.42Å; M1977-C2015 HydrophobicContact CE-CB 3.36Å; M1977-C2015 HydrophobicContact SD-CB 3.9Å
1978R87.5Confident86.3Confident39.2 Ų39.230.9 Ų30.915%0.14818%0.178CC..THydrogen-bonded Turntrans-59.9-14175.3-80.9-171.6-75.5173.2-0.2115.1P1974 K1976 F1983 H1984 C2015 S2017 L2034 L2035P1974-R1978 VanDerWaalsContact O-CB 3.31Å; P1974-R1978 WeakPolarHBondContact O-CB 3.4Å; P1974-R1978 VanDerWaalsContact O-CG 3.3Å; P1974-R1978 WeakPolarHBondContact O-CG 3.26Å; P1974-R1978 PolarHBondContact O-N 3.22Å; P1974-R1978 PolarHBondContact O-NE 3.14Å; K1976-R1978 VanDerWaalsContact C-N 3.32Å; K1976-R1978 PolarHBondContact O-N 3.11Å; R1978-F1983 HydrophobicContact CG-CE1 4.37Å; R1978-F1983 HydrophobicContact CG-CZ 4.35Å; R1978-H1984 PolarHBondContact O-NE2 3.17Å; R1978-C2015 VanDerWaalsContact CD-O 3.28Å; R1978-C2015 WeakPolarHBondContact CD-O 3.23Å; R1978-C2015 WeakPolarHBondContact CG-O 3.24Å; R1978-C2015 PolarHBondContact NE-O 2.77Å; R1978-C2015 PolarHBondContact NH1-O 3.04Å; R1978-S2017 PolarHBondContact NH1-O 2.94Å; R1978-S2017 PolarHBondContact NH2-O 2.96Å; R1978-L2034 VanDerWaalsContact CD-O 3.28Å; R1978-L2034 WeakPolarHBondContact CD-O 3.4Å; R1978-L2034 PolarHBondContact NH1-O 3.16Å; R1978-L2035 HydrophobicContact CG-CD2 3.92Å
1979N85.4Confident87.1Confident116.8 Ų116.830.4 Ų30.463%0.62516%0.16SC*.THydrogen-bonded Turntrans-107.6-3.8177.4-67.2-24.8000113.3R1877 H1975 K1976 M1977R1877-N1979 PolarHBondContact NH2-O 3.32Å; H1975-N1979 PolarHBondContact O-ND2 3.17Å; K1976-N1979 PolarHBondContact O-N 3.09Å; K1976-N1979 VanDerWaalsContact O-N 3.09Å; M1977-N1979 PolarHBondContact O-N 3.13Å; M1977-N1979 VanDerWaalsContact O-N 3.12Å
1980S86.3Confident87.8Confident4 Ų427.7 Ų27.73%0.02814%0.142CC..  trans-81.4135.3-178.4178.10000111.3D1871 K1976 M1977 V1982 F1983 H1984D1871-S1980 PolarHBondContact OD1-OG 3Å; D1871-S1980 WeakPolarHBondContact OD2-CA 3.46Å; D1871-S1980 VanDerWaalsContact OD2-CB 3.3Å; D1871-S1980 WeakPolarHBondContact OD2-CB 3.29Å; D1871-S1980 PolarHBondContact OD2-OG 3.21Å; K1976-S1980 PolarHBondContact O-N 3.12Å; M1977-S1980 WeakPolarHBondContact O-CB 3.32Å; M1977-S1980 PolarHBondContact O-N 3.23Å; M1977-S1980 VanDerWaalsContact O-N 3.12Å; S1980-V1982 VanDerWaalsContact C-N 3.28Å; S1980-V1982 PolarHBondContact O-N 2.73Å; S1980-V1982 PolarHBondContact OG-N 2.69Å; S1980-F1983 PolarHBondContact O-N 3.01Å; S1980-F1983 VanDerWaalsContact O-N 3.11Å; S1980-H1984 PolarHBondContact O-CD2 3.06Å; S1980-H1984 PolarHBondContact O-N 3.11Å
1981T89.1Confident88.2Confident22 Ų2227.5 Ų27.514%0.13514%0.144CC..Hα-helixtrans-68-26.6-178.160.70000112.9D1871 R1877 H1881 F1983 H1984 A1985D1871-T1981 PolarHBondContact OD1-N 3.23Å; D1871-T1981 PolarHBondContact OD1-OG1 3.38Å; R1877-T1981 HydrophobicContact CB-CG2 4.02Å; R1877-T1981 HydrophobicContact CG-CG2 3.85Å; R1877-T1981 VanDerWaalsContact CG-CG2 3.41Å; R1877-T1981 VanDerWaalsContact CZ-CG2 3.4Å; R1877-T1981 VanDerWaalsContact NE-CG2 3.31Å; R1877-T1981 PolarHBondContact O-OG1 3.02Å; R1877-T1981 VanDerWaalsContact O-OG1 3.06Å; H1881-T1981 PolarHBondContact CD2-O 3.29Å; T1981-F1983 VanDerWaalsContact C-N 3.31Å; T1981-F1983 PolarHBondContact O-N 2.87Å; T1981-H1984 PolarHBondContact O-N 3.05Å; T1981-A1985 VanDerWaalsContact O-CB 3.28Å; T1981-A1985 WeakPolarHBondContact O-CB 3.37Å; T1981-A1985 PolarHBondContact O-N 3.3Å
1982V90.2Very high88.8Confident0.6 Ų0.627.2 Ų27.20%0.00415%0.148CC..Hα-helixtrans-60.2-44.5173.3-178.10000110.5L1880 V1884 L1959 L1962 L1963 S1980 A1985 F1986L1880-V1982 HydrophobicContact CB-CG2 4.5Å; L1880-V1982 HydrophobicContact CD1-CG2 4.11Å; V1884-V1982 HydrophobicContact CG2-CB 4.49Å; V1884-V1982 HydrophobicContact CG2-CG1 3.9Å; V1884-V1982 HydrophobicContact CG2-CG2 4.48Å; L1959-V1982 HydrophobicContact CD1-CG1 4.38Å; L1962-V1982 HydrophobicContact CB-CB 4.42Å; L1962-V1982 HydrophobicContact CB-CG1 3.68Å; L1962-V1982 HydrophobicContact CB-CG2 4.07Å; L1962-V1982 HydrophobicContact CD1-CG1 4.48Å; L1962-V1982 HydrophobicContact CD1-CG2 4.38Å; L1962-V1982 HydrophobicContact CD2-CG2 4.19Å; L1962-V1982 HydrophobicContact CG-CG2 4.41Å; L1962-V1982 WeakPolarHBondContact O-CB 3.42Å; L1962-V1982 WeakPolarHBondContact O-CG1 3.37Å; L1963-V1982 HydrophobicContact CD2-CB 4.43Å; L1963-V1982 HydrophobicContact CD2-CG1 3.77Å; L1963-V1982 HydrophobicContact CG-CG1 4.01Å; S1980-V1982 VanDerWaalsContact C-N 3.28Å; S1980-V1982 PolarHBondContact O-N 2.73Å; S1980-V1982 PolarHBondContact OG-N 2.69Å; V1982-A1985 PolarHBondContact O-N 3.11Å; V1982-F1986 VanDerWaalsContact O-CB 3.22Å; V1982-F1986 WeakPolarHBondContact O-CB 3.34Å; V1982-F1986 PolarHBondContact O-N 3.03Å
1983F91.6Very high89.4Confident1.6 Ų1.626.8 Ų26.81%0.00715%0.147CC..Hα-helixtrans-63.8-46.1-179.6168.7-104.6000112L1963 M1977 R1978 S1980 T1981 F1986 L1987 V2011 C2015 L2035 V2039L1963-F1983 HydrophobicContact CD2-CB 4.29Å; M1977-F1983 HydrophobicContact CE-CD2 4.08Å; M1977-F1983 HydrophobicContact CE-CE2 4.09Å; M1977-F1983 HydrophobicContact CG-CB 4.11Å; M1977-F1983 HydrophobicContact CG-CD2 4.09Å; M1977-F1983 HydrophobicContact CG-CG 4.14Å; M1977-F1983 VanDerWaalsContact O-CB 3.27Å; M1977-F1983 WeakPolarHBondContact O-CB 3.33Å; M1977-F1983 WeakPolarHBondContact O-CD1 3.3Å; M1977-F1983 WeakPolarHBondContact O-CG 3.43Å; M1977-F1983 HydrophobicContact SD-CD2 4.2Å; M1977-F1983 HydrophobicContact SD-CE2 4.35Å; R1978-F1983 HydrophobicContact CG-CE1 4.37Å; R1978-F1983 HydrophobicContact CG-CZ 4.35Å; S1980-F1983 PolarHBondContact O-N 3.01Å; S1980-F1983 VanDerWaalsContact O-N 3.11Å; T1981-F1983 VanDerWaalsContact C-N 3.31Å; T1981-F1983 PolarHBondContact O-N 2.87Å; F1983-F1986 PolarHBondContact O-N 3.1Å; F1983-L1987 HydrophobicContact CD2-CD1 4.24Å; F1983-L1987 HydrophobicContact CE1-CD1 4.02Å; F1983-L1987 HydrophobicContact CE1-CD2 4.45Å; F1983-L1987 HydrophobicContact CE2-CB 4.46Å; F1983-L1987 HydrophobicContact CE2-CD1 3.41Å; F1983-L1987 VanDerWaalsContact CE2-CD1 3.41Å; F1983-L1987 HydrophobicContact CE2-CD2 4.1Å; F1983-L1987 HydrophobicContact CE2-CG 4.36Å; F1983-L1987 HydrophobicContact CZ-CD1 3.27Å; F1983-L1987 HydrophobicContact CZ-CD2 3.84Å; F1983-L1987 WeakPolarHBondContact O-CB 3.37Å; F1983-L1987 PolarHBondContact O-N 3.01Å; F1983-V2011 HydrophobicContact CD2-CG1 4.19Å; F1983-V2011 HydrophobicContact CE2-CG1 4.14Å; F1983-C2015 HydrophobicContact CD2-CB 4.39Å; F1983-C2015 HydrophobicContact CE1-CB 4.49Å; F1983-C2015 HydrophobicContact CE2-CB 3.38Å; F1983-C2015 VanDerWaalsContact CE2-CB 3.41Å; F1983-C2015 HydrophobicContact CZ-CB 3.45Å; F1983-C2015 VanDerWaalsContact CZ-CB 3.45Å; F1983-L2035 HydrophobicContact CE1-CD2 4.28Å; F1983-L2035 HydrophobicContact CZ-CD2 4.09Å; F1983-V2039 HydrophobicContact CE1-CG1 3.96Å; F1983-V2039 HydrophobicContact CZ-CG1 4.15Å
1984H91.7Very high89.9Confident47.4 Ų47.425.5 Ų25.522%0.21914%0.138CC..Hα-helixtrans-62.6-45.8174.9-72.6-93.2000111.7R1978 S1980 T1981 F1986 A1988 E2036 H2038R1978-H1984 PolarHBondContact O-NE2 3.17Å; S1980-H1984 PolarHBondContact O-CD2 3.06Å; S1980-H1984 PolarHBondContact O-N 3.11Å; T1981-H1984 PolarHBondContact O-N 3.05Å; H1984-F1986 VanDerWaalsContact C-N 3.31Å; H1984-F1986 PolarHBondContact O-N 3.29Å; H1984-A1988 VanDerWaalsContact O-CB 3.28Å; H1984-A1988 WeakPolarHBondContact O-CB 3.37Å; H1984-A1988 PolarHBondContact O-N 3.11Å; H1984-A1988 VanDerWaalsContact O-N 3.13Å; H1984-E2036 IonicContact CE1-OE2 2.94Å; H1984-E2036 PolarHBondContact CE1-OE2 3.38Å; H1984-H2038 AromaticContact ND1-NE2 3.74Å
1985A92.9Very high90.4Very high0 Ų028.8 Ų28.80%016%0.156CC..Hα-helixtrans-60.7-40.4177.400000112.3H1881 V1884 T1981 V1982 H1989H1881-A1985 HydrophobicContact CB-CB 4.41Å; H1881-A1985 VanDerWaalsContact CD2-CB 3.5Å; H1881-A1985 WeakPolarHBondContact CD2-CB 3.46Å; V1884-A1985 HydrophobicContact CB-CB 3.78Å; V1884-A1985 HydrophobicContact CG1-CB 3.72Å; T1981-A1985 VanDerWaalsContact O-CB 3.28Å; T1981-A1985 WeakPolarHBondContact O-CB 3.37Å; T1981-A1985 PolarHBondContact O-N 3.3Å; V1982-A1985 PolarHBondContact O-N 3.11Å; A1985-H1989 PolarHBondContact O-ND1 3.1Å
1986F94.6Very high90.8Very high0.6 Ų0.632.3 Ų32.30%0.00317%0.165CC..Hα-helixtrans-64.9-57.7178.6173.8-100.6000111.3V1884 L1888 L1959 L1963 V1982 F1983 H1984 A1988 H1989 V1990 I2004 T2008 V2011V1884-F1986 HydrophobicContact CG1-CB 4.25Å; L1888-F1986 HydrophobicContact CD1-CB 4.46Å; L1888-F1986 HydrophobicContact CD1-CD2 3.98Å; L1888-F1986 HydrophobicContact CD2-CD2 4.46Å; L1959-F1986 HydrophobicContact CD1-CD2 4.31Å; L1959-F1986 HydrophobicContact CD2-CD2 4.12Å; L1959-F1986 HydrophobicContact CD2-CE2 4.18Å; L1959-F1986 HydrophobicContact CG-CD2 4.44Å; L1963-F1986 HydrophobicContact CD1-CD1 4.29Å; L1963-F1986 HydrophobicContact CD1-CD2 4.07Å; L1963-F1986 HydrophobicContact CD1-CE1 4.45Å; L1963-F1986 HydrophobicContact CD1-CE2 4.28Å; L1963-F1986 HydrophobicContact CD1-CG 4.08Å; L1963-F1986 HydrophobicContact CD1-CZ 4.46Å; L1963-F1986 HydrophobicContact CD2-CB 4.18Å; L1963-F1986 HydrophobicContact CD2-CD1 4.46Å; L1963-F1986 HydrophobicContact CD2-CG 4.35Å; V1982-F1986 VanDerWaalsContact O-CB 3.22Å; V1982-F1986 WeakPolarHBondContact O-CB 3.34Å; V1982-F1986 PolarHBondContact O-N 3.03Å; F1983-F1986 PolarHBondContact O-N 3.1Å; H1984-F1986 VanDerWaalsContact C-N 3.31Å; H1984-F1986 PolarHBondContact O-N 3.29Å; F1986-A1988 VanDerWaalsContact C-N 3.3Å; F1986-A1988 PolarHBondContact O-N 3.28Å; F1986-H1989 PolarHBondContact O-N 3.03Å; F1986-H1989 VanDerWaalsContact O-N 3.09Å; F1986-V1990 HydrophobicContact CD1-CG1 4.43Å; F1986-V1990 HydrophobicContact CD2-CB 4.39Å; F1986-V1990 HydrophobicContact CE1-CB 4.33Å; F1986-V1990 HydrophobicContact CE1-CG1 4.17Å; F1986-V1990 HydrophobicContact CE1-CG2 4.38Å; F1986-V1990 HydrophobicContact CE2-CB 4.08Å; F1986-V1990 HydrophobicContact CE2-CG2 3.88Å; F1986-V1990 HydrophobicContact CZ-CB 4.05Å; F1986-V1990 HydrophobicContact CZ-CG1 4.33Å; F1986-V1990 HydrophobicContact CZ-CG2 3.72Å; F1986-V1990 WeakPolarHBondContact O-CB 3.31Å; F1986-V1990 WeakPolarHBondContact O-CG1 3.31Å; F1986-V1990 PolarHBondContact O-N 3.23Å; F1986-I2004 HydrophobicContact CE2-CD1 4.04Å; F1986-T2008 HydrophobicContact CE1-CG2 4.41Å; F1986-T2008 HydrophobicContact CZ-CG2 4.25Å; F1986-V2011 HydrophobicContact CD1-CG1 4.19Å; F1986-V2011 HydrophobicContact CE1-CB 4.26Å; F1986-V2011 HydrophobicContact CE1-CG1 3.9Å
1987L93.6Very high91Very high2.8 Ų2.829.5 Ų29.52%0.01515%0.154CC..Hα-helixtrans-64.3-34.4-173.4-154.277.7000112.5F1983 H1989 V1990 L2012 V2039 H2042 W2043F1983-L1987 HydrophobicContact CD2-CD1 4.24Å; F1983-L1987 HydrophobicContact CE1-CD1 4.02Å; F1983-L1987 HydrophobicContact CE1-CD2 4.45Å; F1983-L1987 HydrophobicContact CE2-CB 4.46Å; F1983-L1987 HydrophobicContact CE2-CD1 3.41Å; F1983-L1987 VanDerWaalsContact CE2-CD1 3.41Å; F1983-L1987 HydrophobicContact CE2-CD2 4.1Å; F1983-L1987 HydrophobicContact CE2-CG 4.36Å; F1983-L1987 HydrophobicContact CZ-CD1 3.27Å; F1983-L1987 HydrophobicContact CZ-CD2 3.84Å; F1983-L1987 WeakPolarHBondContact O-CB 3.37Å; F1983-L1987 PolarHBondContact O-N 3.01Å; L1987-H1989 VanDerWaalsContact C-N 3.28Å; L1987-H1989 PolarHBondContact O-N 3.11Å; L1987-V1990 HydrophobicContact CD1-CG1 4.25Å; L1987-L2012 HydrophobicContact CD1-CD2 3.73Å; L1987-V2039 HydrophobicContact CD2-CG1 3.59Å; L1987-V2039 VanDerWaalsContact CD2-CG1 3.46Å; L1987-V2039 WeakPolarHBondContact CD2-O 3.38Å; L1987-H2042 HydrophobicContact CD2-CB 4.17Å; L1987-H2042 HydrophobicContact CG-CB 4.09Å; L1987-W2043 HydrophobicContact CD2-CB 4.21Å
1988A93.2Very high91.2Very high36.8 Ų36.834.5 Ų34.530%0.30418%0.176SC..Hα-helixtrans-68.3-18.217700000114.6H1984 F1986 H2042H1984-A1988 VanDerWaalsContact O-CB 3.28Å; H1984-A1988 WeakPolarHBondContact O-CB 3.37Å; H1984-A1988 PolarHBondContact O-N 3.11Å; H1984-A1988 VanDerWaalsContact O-N 3.13Å; F1986-A1988 VanDerWaalsContact C-N 3.3Å; F1986-A1988 PolarHBondContact O-N 3.28Å; A1988-H2042 VanDerWaalsContact CA-CD2 3.49Å; A1988-H2042 WeakPolarHBondContact CA-CD2 3.43Å
1989H93.8Very high91.1Very high45.6 Ų45.634.6 Ų34.621%0.21118%0.182CC..Hα-helixtrans-123.3-20-174.5-6091.1000114.6R1885 L1888 A1985 F1986 L1987 A1991 G1992 V1993R1885-H1989 WeakPolarHBondContact CG-NE2 3.38Å; R1885-H1989 PolarHBondContact NE-CE1 3.21Å; R1885-H1989 PolarHBondContact NE-NE2 2.96Å; R1885-H1989 PolarHBondContact NH1-NE2 3Å; L1888-H1989 HydrophobicContact CB-CB 3.93Å; L1888-H1989 HydrophobicContact CD1-CB 3.89Å; A1985-H1989 PolarHBondContact O-ND1 3.1Å; F1986-H1989 PolarHBondContact O-N 3.03Å; F1986-H1989 VanDerWaalsContact O-N 3.09Å; L1987-H1989 VanDerWaalsContact C-N 3.28Å; L1987-H1989 PolarHBondContact O-N 3.11Å; H1989-A1991 VanDerWaalsContact C-N 3.33Å; H1989-A1991 PolarHBondContact O-N 3.2Å; H1989-G1992 PolarHBondContact O-N 3.17Å; H1989-G1992 VanDerWaalsContact O-N 3.08Å; H1989-V1993 PolarHBondContact O-N 3.28Å
1990V94.2Very high91.2Very high0 Ų029 Ų290%015%0.152CC..Hα-helixtrans-61.3-37.3-176.665.90000113.2F1986 L1987 G1992 V1993 L1994 I2004 T2008 T2046F1986-V1990 HydrophobicContact CD1-CG1 4.43Å; F1986-V1990 HydrophobicContact CD2-CB 4.39Å; F1986-V1990 HydrophobicContact CE1-CB 4.33Å; F1986-V1990 HydrophobicContact CE1-CG1 4.17Å; F1986-V1990 HydrophobicContact CE1-CG2 4.38Å; F1986-V1990 HydrophobicContact CE2-CB 4.08Å; F1986-V1990 HydrophobicContact CE2-CG2 3.88Å; F1986-V1990 HydrophobicContact CZ-CB 4.05Å; F1986-V1990 HydrophobicContact CZ-CG1 4.33Å; F1986-V1990 HydrophobicContact CZ-CG2 3.72Å; F1986-V1990 WeakPolarHBondContact O-CB 3.31Å; F1986-V1990 WeakPolarHBondContact O-CG1 3.31Å; F1986-V1990 PolarHBondContact O-N 3.23Å; L1987-V1990 HydrophobicContact CD1-CG1 4.25Å; V1990-G1992 VanDerWaalsContact C-N 3.25Å; V1990-G1992 PolarHBondContact O-N 3.13Å; V1990-V1993 WeakPolarHBondContact O-CB 3.32Å; V1990-V1993 PolarHBondContact O-N 3.3Å; V1990-L1994 HydrophobicContact CG2-CD1 4.19Å; V1990-L1994 HydrophobicContact CG2-CG 4.45Å; V1990-L1994 WeakPolarHBondContact O-CG 3.38Å; V1990-L1994 PolarHBondContact O-N 3.05Å; V1990-L1994 VanDerWaalsContact O-N 3.11Å; V1990-I2004 HydrophobicContact CG2-CD1 3.94Å; V1990-T2008 HydrophobicContact CG1-CG2 4.27Å; V1990-T2008 HydrophobicContact CG2-CG2 3.81Å; V1990-T2008 WeakPolarHBondContact CG2-OG1 3.46Å; V1990-T2046 HydrophobicContact CG1-CG2 3.85Å
1991A92.4Very high91.3Very high15 Ų1528.8 Ų28.812%0.12415%0.151CC..Hα-helixtrans-56-38173.800000112.2H1989 V1993 L1994 D1995 Q2045H1989-A1991 VanDerWaalsContact C-N 3.33Å; H1989-A1991 PolarHBondContact O-N 3.2Å; A1991-V1993 VanDerWaalsContact C-N 3.32Å; A1991-V1993 PolarHBondContact O-N 3.08Å; A1991-L1994 PolarHBondContact O-N 3.1Å; A1991-D1995 VanDerWaalsContact O-CB 3.22Å; A1991-D1995 WeakPolarHBondContact O-CB 3.34Å; A1991-D1995 PolarHBondContact O-N 3.13Å; A1991-Q2045 HydrophobicContact CB-CG 4.34Å
1992G92Very high91.2Very high27.8 Ų27.830.4 Ų30.429%0.28716%0.162SC..Hα-helixtrans-70.3-2417700000114.2S1892 H1989 V1990 R1996S1892-G1992 WeakPolarHBondContact CB-O 3.35Å; H1989-G1992 PolarHBondContact O-N 3.17Å; H1989-G1992 VanDerWaalsContact O-N 3.08Å; V1990-G1992 VanDerWaalsContact C-N 3.25Å; V1990-G1992 PolarHBondContact O-N 3.13Å; G1992-R1996 VanDerWaalsContact O-CB 3.3Å; G1992-R1996 WeakPolarHBondContact O-CB 3.34Å; G1992-R1996 WeakPolarHBondContact O-CD 3.48Å; G1992-R1996 VanDerWaalsContact O-CG 3.27Å; G1992-R1996 WeakPolarHBondContact O-CG 3.42Å; G1992-R1996 PolarHBondContact O-N 3.09Å
1993V92.1Very high91.1Very high0.6 Ų0.632 Ų320%0.00417%0.173CC..Hα-helixtrans-74.5-51.3171.5-173.80000110L1888 M1891 H1989 V1990 A1991 D1995 R1996 N1997 M2000 I2004L1888-V1993 HydrophobicContact CB-CG2 3.92Å; L1888-V1993 HydrophobicContact CD2-CG2 3.88Å; L1888-V1993 HydrophobicContact CG-CG2 4.48Å; L1888-V1993 VanDerWaalsContact O-CG2 3.24Å; L1888-V1993 WeakPolarHBondContact O-CG2 3.34Å; M1891-V1993 HydrophobicContact CB-CG1 3.83Å; M1891-V1993 HydrophobicContact CB-CG2 4.21Å; H1989-V1993 PolarHBondContact O-N 3.28Å; V1990-V1993 WeakPolarHBondContact O-CB 3.32Å; V1990-V1993 PolarHBondContact O-N 3.3Å; A1991-V1993 VanDerWaalsContact C-N 3.32Å; A1991-V1993 PolarHBondContact O-N 3.08Å; V1993-D1995 VanDerWaalsContact C-N 3.27Å; V1993-D1995 PolarHBondContact O-N 3.17Å; V1993-R1996 PolarHBondContact O-N 3.1Å; V1993-N1997 PolarHBondContact O-N 3.36Å; V1993-M2000 HydrophobicContact CG1-CB 4.44Å; V1993-M2000 HydrophobicContact CG1-CG 4.21Å; V1993-I2004 HydrophobicContact CB-CD1 4.06Å; V1993-I2004 HydrophobicContact CG1-CD1 3.78Å
1994L92.3Very high90.9Very high0 Ų032.1 Ų32.10%017%0.174CC..Hα-helixtrans-61.3-34180-65.8167.4000112.3V1990 A1991 I2004 L2005 T2008 T2046 V2049 I2050 Y2054V1990-L1994 HydrophobicContact CG2-CD1 4.19Å; V1990-L1994 HydrophobicContact CG2-CG 4.45Å; V1990-L1994 WeakPolarHBondContact O-CG 3.38Å; V1990-L1994 PolarHBondContact O-N 3.05Å; V1990-L1994 VanDerWaalsContact O-N 3.11Å; A1991-L1994 PolarHBondContact O-N 3.1Å; L1994-I2004 HydrophobicContact CD2-CG1 4.35Å; L1994-I2004 HydrophobicContact CD2-CG2 4.4Å; L1994-L2005 HydrophobicContact CD2-CD1 4.43Å; L1994-T2008 HydrophobicContact CD1-CG2 4.23Å; L1994-T2046 HydrophobicContact CD1-CG2 3.85Å; L1994-V2049 HydrophobicContact CB-CG1 3.67Å; L1994-I2050 HydrophobicContact CD1-CD1 4.16Å; L1994-I2050 HydrophobicContact CD1-CG1 3.89Å; L1994-Y2054 WeakPolarHBondContact CA-OH 3.24Å; L1994-Y2054 HydrophobicContact CB-CE2 4.04Å; L1994-Y2054 HydrophobicContact CD2-CE1 4.37Å; L1994-Y2054 HydrophobicContact CD2-CE2 4.09Å; L1994-Y2054 WeakPolarHBondContact O-CE2 3.39Å; L1994-Y2054 PolarHBondContact O-OH 3.23Å
1995D93.9Very high90.9Very high69.6 Ų69.630.6 Ų30.637%0.37217%0.167SC..Hα-helixtrans-74.6-48178.4178.355.2000112.7A1991 V1993 V2049 K2053A1991-D1995 VanDerWaalsContact O-CB 3.22Å; A1991-D1995 WeakPolarHBondContact O-CB 3.34Å; A1991-D1995 PolarHBondContact O-N 3.13Å; V1993-D1995 VanDerWaalsContact C-N 3.27Å; V1993-D1995 PolarHBondContact O-N 3.17Å; D1995-V2049 HydrophobicContact CB-CG1 4.04Å; D1995-V2049 HydrophobicContact CB-CG2 4.37Å; D1995-K2053 PolarHBondContact O-NZ 3.18Å; D1995-K2053 IonicContact OD1-NZ 2.87Å; D1995-K2053 PolarHBondContact OD1-NZ 3.03Å
1996R91Very high90.7Very high167.6 Ų167.634.9 Ų34.963%0.63219%0.187SC*.Hα-helixtrans-88.5-33.1-169.5-63.8177.1176.8-159.2-4.6114.2G1992 V1993G1992-R1996 VanDerWaalsContact O-CB 3.3Å; G1992-R1996 WeakPolarHBondContact O-CB 3.34Å; G1992-R1996 WeakPolarHBondContact O-CD 3.48Å; G1992-R1996 VanDerWaalsContact O-CG 3.27Å; G1992-R1996 WeakPolarHBondContact O-CG 3.42Å; G1992-R1996 PolarHBondContact O-N 3.09Å; V1993-R1996 PolarHBondContact O-N 3.1Å
1997N88.6Confident90.3Very high18.8 Ų18.836.2 Ų36.210%0.10119%0.193CC..  trans-129.983-173.3-169.2-6.6000111.1M1891 V1894 V1993 S1999 M2000 G2001M1891-N1997 WeakPolarHBondContact O-CB 3.27Å; M1891-N1997 PolarHBondContact O-ND2 3.1Å; V1894-N1997 PolarHBondContact O-ND2 3.29Å; V1993-N1997 PolarHBondContact O-N 3.36Å; N1997-S1999 VanDerWaalsContact C-N 3.32Å; N1997-S1999 PolarHBondContact O-N 3.08Å; N1997-S1999 PolarHBondContact OD1-N 3.26Å; N1997-S1999 PolarHBondContact OD1-OG 3.25Å; N1997-M2000 HydrophobicContact CB-CB 4.2Å; N1997-M2000 VanDerWaalsContact CG-CB 3.47Å; N1997-M2000 VanDerWaalsContact ND2-CB 3.31Å; N1997-M2000 WeakPolarHBondContact ND2-CB 3.33Å; N1997-M2000 WeakPolarHBondContact ND2-CG 3.2Å; N1997-M2000 PolarHBondContact O-N 3.25Å; N1997-M2000 PolarHBondContact OD1-N 3.07Å; N1997-G2001 PolarHBondContact O-N 3.11Å
1998F88.9Confident90.3Very high107.6 Ų107.636.1 Ų36.147%0.47219%0.193SC..Hα-helixtrans-53.6-41.3-176.7-174.9-103000113.3G2001 C2002 K2053 Y2054F1998-G2001 CarbonylContact O-C 3.57Å; F1998-G2001 PolarHBondContact O-N 3.19Å; F1998-C2002 PolarHBondContact O-N 3.19Å; F1998-C2002 PolarHBondContact O-SG 3.23Å; F1998-C2002 VanDerWaalsContact O-SG 3.33Å; F1998-K2053 VanDerWaalsContact CE2-O 3.3Å; F1998-K2053 WeakPolarHBondContact CE2-O 3.36Å; F1998-Y2054 WeakPolarHBondContact CA-OH 3.36Å; F1998-Y2054 HydrophobicContact CD2-CD1 4.28Å; F1998-Y2054 AromaticContact CD2-CE1 3.7Å; F1998-Y2054 HydrophobicContact CD2-CE1 3.7Å; F1998-Y2054 HydrophobicContact CD2-CE2 4.21Å; F1998-Y2054 AromaticContact CD2-CZ 3.64Å; F1998-Y2054 AromaticContact CE2-CD1 3.68Å; F1998-Y2054 HydrophobicContact CE2-CD1 3.68Å; F1998-Y2054 HydrophobicContact CE2-CD2 4.41Å; F1998-Y2054 AromaticContact CE2-CE1 3.55Å; F1998-Y2054 HydrophobicContact CE2-CE1 3.55Å; F1998-Y2054 VanDerWaalsContact CE2-CE1 3.44Å; F1998-Y2054 HydrophobicContact CE2-CE2 4.34Å; F1998-Y2054 HydrophobicContact CE2-CG 4.14Å; F1998-Y2054 AromaticContact CE2-CZ 3.83Å; F1998-Y2054 HydrophobicContact CG-CE1 4.5Å; F1998-Y2054 HydrophobicContact CZ-CD1 4.31Å; F1998-Y2054 HydrophobicContact CZ-CE1 4.31Å; F1998-Y2054 PolarHBondContact O-OH 2.97Å
1999S86.3Confident90.2Very high40.8 Ų40.834.4 Ų34.429%0.28518%0.178SC..Hα-helixtrans-65.3-45.8-178.266.90000112.6N1997 G2001 C2002 C2003N1997-S1999 VanDerWaalsContact C-N 3.32Å; N1997-S1999 PolarHBondContact O-N 3.08Å; N1997-S1999 PolarHBondContact OD1-N 3.26Å; N1997-S1999 PolarHBondContact OD1-OG 3.25Å; S1999-G2001 VanDerWaalsContact C-N 3.3Å; S1999-G2001 PolarHBondContact O-N 2.93Å; S1999-C2002 WeakPolarHBondContact O-CB 3.37Å; S1999-C2002 PolarHBondContact O-N 2.73Å; S1999-C2003 PolarHBondContact O-N 2.95Å; S1999-C2003 PolarHBondContact O-SG 2.75Å; S1999-C2003 VanDerWaalsContact O-SG 3.38Å
2000M86.8Confident89.9Confident0 Ų033 Ų330%017%0.173CC..Hα-helixtrans-70.2-33174.2-133.820.123.900111.9W1688 M1891 V1894 L1896 L1952 V1993 N1997 C2003 I2004W1688-M2000 HydrophobicContact CH2-CE 3.89Å; W1688-M2000 HydrophobicContact CH2-SD 4.21Å; W1688-M2000 HydrophobicContact CZ2-CE 3.96Å; M1891-M2000 HydrophobicContact CB-CG 3.9Å; M1891-M2000 HydrophobicContact CE-CE 3.72Å; M1891-M2000 HydrophobicContact CE-CG 3.72Å; M1891-M2000 HydrophobicContact CE-SD 3.63Å; M1891-M2000 VanDerWaalsContact CE-SD 3.53Å; M1891-M2000 HydrophobicContact CG-CG 4.24Å; M1891-M2000 HydrophobicContact CG-SD 4.45Å; V1894-M2000 HydrophobicContact CG1-CE 3.94Å; V1894-M2000 HydrophobicContact CG1-CG 4.01Å; V1894-M2000 HydrophobicContact CG1-SD 4.35Å; L1896-M2000 HydrophobicContact CB-CE 4.46Å; L1896-M2000 HydrophobicContact CB-SD 4.25Å; L1896-M2000 HydrophobicContact CD2-CE 4.22Å; L1896-M2000 HydrophobicContact CD2-SD 4.16Å; L1952-M2000 HydrophobicContact CD1-CE 3.91Å; L1952-M2000 VanDerWaalsContact CD1-CE 3.48Å; L1952-M2000 HydrophobicContact CD1-SD 3.59Å; L1952-M2000 VanDerWaalsContact CD1-SD 3.57Å; L1952-M2000 HydrophobicContact CD2-CE 3.98Å; L1952-M2000 HydrophobicContact CD2-SD 4.21Å; L1952-M2000 HydrophobicContact CG-CE 4.28Å; L1952-M2000 HydrophobicContact CG-SD 4.44Å; V1993-M2000 HydrophobicContact CG1-CB 4.44Å; V1993-M2000 HydrophobicContact CG1-CG 4.21Å; N1997-M2000 HydrophobicContact CB-CB 4.2Å; N1997-M2000 VanDerWaalsContact CG-CB 3.47Å; N1997-M2000 VanDerWaalsContact ND2-CB 3.31Å; N1997-M2000 WeakPolarHBondContact ND2-CB 3.33Å; N1997-M2000 WeakPolarHBondContact ND2-CG 3.2Å; N1997-M2000 PolarHBondContact O-N 3.25Å; N1997-M2000 PolarHBondContact OD1-N 3.07Å; M2000-C2003 HydrophobicContact CE-CB 4.4Å; M2000-C2003 WeakPolarHBondContact O-CB 3.25Å; M2000-C2003 PolarHBondContact O-N 3.33Å; M2000-C2003 VanDerWaalsContact O-N 3.12Å; M2000-I2004 PolarHBondContact O-N 3.19Å
2001G88.4Confident89.8Confident0 Ų033 Ų330%017%0.173CC..Hα-helixtrans-60.4-42.6174.200000112.8N1997 F1998 S1999 C2003 I2004 L2005 Y2054N1997-G2001 PolarHBondContact O-N 3.11Å; F1998-G2001 CarbonylContact O-C 3.57Å; F1998-G2001 PolarHBondContact O-N 3.19Å; S1999-G2001 VanDerWaalsContact C-N 3.3Å; S1999-G2001 PolarHBondContact O-N 2.93Å; G2001-C2003 VanDerWaalsContact C-N 3.28Å; G2001-C2003 PolarHBondContact O-N 3.14Å; G2001-I2004 CarbonylContact O-C 3.56Å; G2001-I2004 WeakPolarHBondContact O-CG1 3.46Å; G2001-I2004 WeakPolarHBondContact O-CG2 3.41Å; G2001-I2004 PolarHBondContact O-N 3.09Å; G2001-I2004 VanDerWaalsContact O-N 3.13Å; G2001-L2005 WeakPolarHBondContact O-CA 3.39Å; G2001-L2005 WeakPolarHBondContact O-CB 3.35Å; G2001-L2005 PolarHBondContact O-N 3.08Å; G2001-Y2054 WeakPolarHBondContact CA-OH 3.41Å
2002C87.6Confident89.7Confident54.4 Ų54.432.3 Ų32.337%0.36817%0.167SC..Hα-helixtrans-57.1-40.7172.4-66.70000112F1998 S1999 I2004 L2005 T2067F1998-C2002 PolarHBondContact O-N 3.19Å; F1998-C2002 PolarHBondContact O-SG 3.23Å; F1998-C2002 VanDerWaalsContact O-SG 3.33Å; S1999-C2002 WeakPolarHBondContact O-CB 3.37Å; S1999-C2002 PolarHBondContact O-N 2.73Å; C2002-I2004 VanDerWaalsContact C-N 3.29Å; C2002-I2004 PolarHBondContact O-N 3.16Å; C2002-L2005 PolarHBondContact O-N 3.14Å; C2002-T2067 HydrophobicContact CB-CG2 4.48Å
2003C86.4Confident89.5Confident35.2 Ų35.232.7 Ų32.724%0.23816%0.162CC..Hα-helixtrans-66.3-26.8179-63.20000113.8L1898 Q1956 S1999 M2000 G2001L1898-C2003 VanDerWaalsContact CD1-SG 3.58Å; L1898-C2003 WeakPolarHBondContact CD1-SG 3.41Å; Q1956-C2003 PolarHBondContact NE2-O 3.33Å; S1999-C2003 PolarHBondContact O-N 2.95Å; S1999-C2003 PolarHBondContact O-SG 2.75Å; S1999-C2003 VanDerWaalsContact O-SG 3.38Å; M2000-C2003 HydrophobicContact CE-CB 4.4Å; M2000-C2003 WeakPolarHBondContact O-CB 3.25Å; M2000-C2003 PolarHBondContact O-N 3.33Å; M2000-C2003 VanDerWaalsContact O-N 3.12Å; G2001-C2003 VanDerWaalsContact C-N 3.28Å; G2001-C2003 PolarHBondContact O-N 3.14Å
2004I89.2Confident89.3Confident3.6 Ų3.633.5 Ų33.52%0.01817%0.165CC..Hα-helixtrans-105.9-6.7179.8157.6167000114L1888 M1891 Q1956 L1959 F1986 V1990 V1993 L1994 M2000 G2001 C2002 H2006 Q2007 T2008L1888-I2004 HydrophobicContact CD2-CD1 4.3Å; M1891-I2004 HydrophobicContact CE-CB 4.3Å; M1891-I2004 HydrophobicContact CE-CD1 4.05Å; M1891-I2004 HydrophobicContact CE-CG2 4.02Å; M1891-I2004 HydrophobicContact SD-CD1 4.38Å; Q1956-I2004 HydrophobicContact CG-CG2 4.49Å; L1959-I2004 HydrophobicContact CD2-CD1 3.89Å; F1986-I2004 HydrophobicContact CE2-CD1 4.04Å; V1990-I2004 HydrophobicContact CG2-CD1 3.94Å; V1993-I2004 HydrophobicContact CB-CD1 4.06Å; V1993-I2004 HydrophobicContact CG1-CD1 3.78Å; L1994-I2004 HydrophobicContact CD2-CG1 4.35Å; L1994-I2004 HydrophobicContact CD2-CG2 4.4Å; M2000-I2004 PolarHBondContact O-N 3.19Å; G2001-I2004 CarbonylContact O-C 3.56Å; G2001-I2004 WeakPolarHBondContact O-CG1 3.46Å; G2001-I2004 WeakPolarHBondContact O-CG2 3.41Å; G2001-I2004 PolarHBondContact O-N 3.09Å; G2001-I2004 VanDerWaalsContact O-N 3.13Å; C2002-I2004 VanDerWaalsContact C-N 3.29Å; C2002-I2004 PolarHBondContact O-N 3.16Å; I2004-H2006 VanDerWaalsContact C-N 3.33Å; I2004-H2006 PolarHBondContact O-N 3.15Å; I2004-H2006 VanDerWaalsContact O-N 3.15Å; I2004-Q2007 HydrophobicContact CG1-CB 4.21Å; I2004-Q2007 WeakPolarHBondContact O-CB 3.25Å; I2004-Q2007 PolarHBondContact O-N 3.17Å; I2004-T2008 WeakPolarHBondContact O-CB 3.44Å; I2004-T2008 PolarHBondContact O-N 3.17Å; I2004-T2008 PolarHBondContact O-OG1 3.4Å
2005L90Very high89Confident15.2 Ų15.233.5 Ų33.58%0.0817%0.165CC..Hα-helixtrans-54-49.6-173.7178.362.8000112.6L1994 G2001 C2002 Q2007 T2008 L2009 I2050 Y2054 T2192L1994-L2005 HydrophobicContact CD2-CD1 4.43Å; G2001-L2005 WeakPolarHBondContact O-CA 3.39Å; G2001-L2005 WeakPolarHBondContact O-CB 3.35Å; G2001-L2005 PolarHBondContact O-N 3.08Å; C2002-L2005 PolarHBondContact O-N 3.14Å; L2005-Q2007 PolarHBondContact O-N 3.09Å; L2005-T2008 WeakPolarHBondContact O-CB 3.42Å; L2005-T2008 PolarHBondContact O-N 3.16Å; L2005-T2008 VanDerWaalsContact O-N 3.14Å; L2005-L2009 HydrophobicContact CD1-CD1 4.17Å; L2005-L2009 HydrophobicContact CD1-CG 4.19Å; L2005-L2009 HydrophobicContact CG-CD1 4.03Å; L2005-L2009 HydrophobicContact CG-CG 4.45Å; L2005-L2009 WeakPolarHBondContact O-CG 3.33Å; L2005-L2009 PolarHBondContact O-N 2.97Å; L2005-I2050 HydrophobicContact CD1-CB 4.47Å; L2005-I2050 HydrophobicContact CD1-CD1 3.99Å; L2005-I2050 HydrophobicContact CD1-CG1 3.89Å; L2005-I2050 HydrophobicContact CD1-CG2 3.95Å; L2005-Y2054 HydrophobicContact CD1-CD1 4.46Å; L2005-Y2054 HydrophobicContact CD1-CG 4.38Å; L2005-Y2054 HydrophobicContact CD2-CD1 3.86Å; L2005-Y2054 HydrophobicContact CD2-CE1 4.46Å; L2005-Y2054 HydrophobicContact CD2-CG 4.27Å; L2005-T2192 HydrophobicContact CD2-CG2 4.26Å
2006H88.8Confident88.5Confident90.8 Ų90.830.2 Ų30.242%0.4215%0.148SC..Hα-helixtrans-58.9-46.7178.4176.467.7000112.3Y1965 I2004 T2008 L2009 V2010Y1965-H2006 PolarHBondContact OH-NE2 3.42Å; I2004-H2006 VanDerWaalsContact C-N 3.33Å; I2004-H2006 PolarHBondContact O-N 3.15Å; I2004-H2006 VanDerWaalsContact O-N 3.15Å; H2006-T2008 VanDerWaalsContact C-N 3.3Å; H2006-T2008 PolarHBondContact O-N 3.17Å; H2006-L2009 PolarHBondContact O-N 3Å; H2006-V2010 WeakPolarHBondContact O-CG2 3.37Å; H2006-V2010 PolarHBondContact O-N 3.25Å; H2006-V2010 VanDerWaalsContact O-N 3.09Å
2007Q87.9Confident88.1Confident28.4 Ų28.422.3 Ų22.313%0.13312%0.118CC..Hα-helixtrans-60-40.7176.5-173.265.875.200111.6A1960 I2004 L2005 V2011A1960-Q2007 VanDerWaalsContact CB-OE1 3.27Å; I2004-Q2007 HydrophobicContact CG1-CB 4.21Å; I2004-Q2007 WeakPolarHBondContact O-CB 3.25Å; I2004-Q2007 PolarHBondContact O-N 3.17Å; L2005-Q2007 PolarHBondContact O-N 3.09Å; Q2007-V2011 WeakPolarHBondContact O-CB 3.48Å; Q2007-V2011 VanDerWaalsContact O-CG2 3.26Å; Q2007-V2011 WeakPolarHBondContact O-CG2 3.4Å; Q2007-V2011 PolarHBondContact O-N 2.99Å; Q2007-V2011 VanDerWaalsContact O-N 3.11Å
2008T91.9Very high87.5Confident0 Ų024.4 Ų24.40%013%0.133CC..Hα-helixtrans-67.4-45.6179.4-51.30000111.4F1986 V1990 L1994 I2004 L2005 H2006 V2010 V2011 L2012 T2046 I2050F1986-T2008 HydrophobicContact CE1-CG2 4.41Å; F1986-T2008 HydrophobicContact CZ-CG2 4.25Å; V1990-T2008 HydrophobicContact CG1-CG2 4.27Å; V1990-T2008 HydrophobicContact CG2-CG2 3.81Å; V1990-T2008 WeakPolarHBondContact CG2-OG1 3.46Å; L1994-T2008 HydrophobicContact CD1-CG2 4.23Å; I2004-T2008 WeakPolarHBondContact O-CB 3.44Å; I2004-T2008 PolarHBondContact O-N 3.17Å; I2004-T2008 PolarHBondContact O-OG1 3.4Å; L2005-T2008 WeakPolarHBondContact O-CB 3.42Å; L2005-T2008 PolarHBondContact O-N 3.16Å; L2005-T2008 VanDerWaalsContact O-N 3.14Å; H2006-T2008 VanDerWaalsContact C-N 3.3Å; H2006-T2008 PolarHBondContact O-N 3.17Å; T2008-V2010 PolarHBondContact O-N 3.22Å; T2008-V2011 PolarHBondContact O-N 3.23Å; T2008-L2012 HydrophobicContact CG2-CD1 4.13Å; T2008-L2012 HydrophobicContact CG2-CG 4.36Å; T2008-L2012 WeakPolarHBondContact O-CB 3.42Å; T2008-L2012 VanDerWaalsContact O-CG 3.27Å; T2008-L2012 WeakPolarHBondContact O-CG 3.35Å; T2008-L2012 PolarHBondContact O-N 3.14Å; T2008-T2046 HydrophobicContact CG2-CG2 3.68Å; T2008-I2050 HydrophobicContact CG2-CD1 4.37Å
2009L91.3Very high86.9Confident0.8 Ų0.820.1 Ų20.10%0.00411%0.114CC..Hα-helixtrans-58.3-48.2177.3-71.9170.9000111.7L2005 H2006 V2011 L2012 Q2013 I2050 T2192 M2195 I2196 L2199L2005-L2009 HydrophobicContact CD1-CD1 4.17Å; L2005-L2009 HydrophobicContact CD1-CG 4.19Å; L2005-L2009 HydrophobicContact CG-CD1 4.03Å; L2005-L2009 HydrophobicContact CG-CG 4.45Å; L2005-L2009 WeakPolarHBondContact O-CG 3.33Å; L2005-L2009 PolarHBondContact O-N 2.97Å; H2006-L2009 PolarHBondContact O-N 3Å; L2009-V2011 VanDerWaalsContact C-N 3.33Å; L2009-V2011 PolarHBondContact O-N 3.2Å; L2009-L2012 PolarHBondContact O-N 3.32Å; L2009-Q2013 WeakPolarHBondContact O-CB 3.48Å; L2009-Q2013 WeakPolarHBondContact O-CG 3.35Å; L2009-Q2013 PolarHBondContact O-N 3.23Å; L2009-Q2013 VanDerWaalsContact O-N 3.08Å; L2009-I2050 HydrophobicContact CD2-CD1 4.03Å; L2009-I2050 HydrophobicContact CD2-CG2 4.4Å; L2009-T2192 HydrophobicContact CD1-CG2 4.05Å; L2009-M2195 HydrophobicContact CB-CB 4.32Å; L2009-M2195 HydrophobicContact CB-SD 3.98Å; L2009-M2195 HydrophobicContact CD1-CB 4.36Å; L2009-M2195 HydrophobicContact CD1-SD 4.33Å; L2009-I2196 HydrophobicContact CD1-CD1 4.3Å; L2009-I2196 HydrophobicContact CD1-CG1 4.37Å; L2009-I2196 HydrophobicContact CD2-CD1 3.8Å; L2009-I2196 HydrophobicContact CD2-CG1 4.03Å; L2009-L2199 HydrophobicContact CD2-CD1 3.54Å; L2009-L2199 VanDerWaalsContact CD2-CD1 3.49Å
2010V88.9Confident85.8Confident15.8 Ų15.827.2 Ų27.210%0.09613%0.134CC..Hα-helixtrans-63-39.3179.7172.70000111.7Y1965 F1970 H2006 T2008 Q2013 F2014 M2195Y1965-V2010 HydrophobicContact CD2-CG1 4.06Å; Y1965-V2010 HydrophobicContact CE2-CG1 3.54Å; F1970-V2010 HydrophobicContact CE2-CG1 3.51Å; F1970-V2010 VanDerWaalsContact CE2-CG1 3.49Å; F1970-V2010 HydrophobicContact CZ-CG1 3.81Å; H2006-V2010 WeakPolarHBondContact O-CG2 3.37Å; H2006-V2010 PolarHBondContact O-N 3.25Å; H2006-V2010 VanDerWaalsContact O-N 3.09Å; T2008-V2010 PolarHBondContact O-N 3.22Å; V2010-Q2013 PolarHBondContact O-N 3.21Å; V2010-F2014 WeakPolarHBondContact O-CB 3.43Å; V2010-F2014 PolarHBondContact O-N 3.06Å; V2010-F2014 VanDerWaalsContact O-N 3.12Å; V2010-M2195 HydrophobicContact CG2-CE 3.53Å; V2010-M2195 VanDerWaalsContact CG2-CE 3.47Å; V2010-M2195 HydrophobicContact CG2-SD 4.1Å
2011V90.3Very high84.7Confident0.2 Ų0.234.8 Ų34.80%0.00116%0.164CC..Hα-helixtrans-67.7-41174.3171.50000112.1L1963 F1970 M1977 F1983 F1986 Q2007 T2008 L2009 Q2013 F2014 C2015L1963-V2011 HydrophobicContact CD1-CG2 4.17Å; F1970-V2011 HydrophobicContact CE1-CG2 4.36Å; F1970-V2011 HydrophobicContact CZ-CG2 4.11Å; M1977-V2011 HydrophobicContact CE-CG1 4.48Å; M1977-V2011 HydrophobicContact SD-CG1 4.44Å; F1983-V2011 HydrophobicContact CD2-CG1 4.19Å; F1983-V2011 HydrophobicContact CE2-CG1 4.14Å; F1986-V2011 HydrophobicContact CD1-CG1 4.19Å; F1986-V2011 HydrophobicContact CE1-CB 4.26Å; F1986-V2011 HydrophobicContact CE1-CG1 3.9Å; Q2007-V2011 WeakPolarHBondContact O-CB 3.48Å; Q2007-V2011 VanDerWaalsContact O-CG2 3.26Å; Q2007-V2011 WeakPolarHBondContact O-CG2 3.4Å; Q2007-V2011 PolarHBondContact O-N 2.99Å; Q2007-V2011 VanDerWaalsContact O-N 3.11Å; T2008-V2011 PolarHBondContact O-N 3.23Å; L2009-V2011 VanDerWaalsContact C-N 3.33Å; L2009-V2011 PolarHBondContact O-N 3.2Å; V2011-Q2013 VanDerWaalsContact C-N 3.32Å; V2011-Q2013 PolarHBondContact O-N 3.29Å; V2011-F2014 PolarHBondContact O-N 3.13Å; V2011-C2015 VanDerWaalsContact O-CB 3.27Å; V2011-C2015 WeakPolarHBondContact O-CB 3.31Å; V2011-C2015 PolarHBondContact O-N 3.35Å; V2011-C2015 PolarHBondContact O-SG 3.11Å; V2011-C2015 VanDerWaalsContact O-SG 3.36Å
2012L91.3Very high83.5Confident0.4 Ų0.436 Ų360%0.00217%0.174CC..Hα-helixtrans-62.4-39.3177-72.1170.8000112L1987 T2008 L2009 C2015 W2043 T2046 I2050 L2199L1987-L2012 HydrophobicContact CD1-CD2 3.73Å; T2008-L2012 HydrophobicContact CG2-CD1 4.13Å; T2008-L2012 HydrophobicContact CG2-CG 4.36Å; T2008-L2012 WeakPolarHBondContact O-CB 3.42Å; T2008-L2012 VanDerWaalsContact O-CG 3.27Å; T2008-L2012 WeakPolarHBondContact O-CG 3.35Å; T2008-L2012 PolarHBondContact O-N 3.14Å; L2009-L2012 PolarHBondContact O-N 3.32Å; L2012-C2015 PolarHBondContact O-SG 3.12Å; L2012-C2015 VanDerWaalsContact O-SG 3.38Å; L2012-W2043 HydrophobicContact CD2-CB 4.43Å; L2012-W2043 VanDerWaalsContact CD2-CD1 3.41Å; L2012-W2043 HydrophobicContact CD2-CD2 4.15Å; L2012-W2043 HydrophobicContact CD2-CG 3.76Å; L2012-W2043 PolarHBondContact O-NE1 3.04Å; L2012-T2046 HydrophobicContact CD1-CG2 3.96Å; L2012-T2046 HydrophobicContact CD2-CG2 4.35Å; L2012-I2050 HydrophobicContact CD1-CD1 3.96Å; L2012-L2199 HydrophobicContact CB-CD1 4.25Å; L2012-L2199 HydrophobicContact CB-CD2 3.71Å; L2012-L2199 HydrophobicContact CD1-CD1 4.33Å
2013Q88.2Confident82.3Confident37.8 Ų37.839.4 Ų39.418%0.17719%0.194CC..Hα-helixtrans-65.5-48.8176.1-83.8-179.8-4000111.4L2009 V2010 V2011 M2195 Y2198 L2199L2009-Q2013 WeakPolarHBondContact O-CB 3.48Å; L2009-Q2013 WeakPolarHBondContact O-CG 3.35Å; L2009-Q2013 PolarHBondContact O-N 3.23Å; L2009-Q2013 VanDerWaalsContact O-N 3.08Å; V2010-Q2013 PolarHBondContact O-N 3.21Å; V2011-Q2013 VanDerWaalsContact C-N 3.32Å; V2011-Q2013 PolarHBondContact O-N 3.29Å; Q2013-M2195 PolarHBondContact NE2-O 3.05Å; Q2013-M2195 VanDerWaalsContact NE2-O 3.08Å; Q2013-Y2198 HydrophobicContact CB-CD1 4.22Å; Q2013-Y2198 HydrophobicContact CB-CE1 4.01Å; Q2013-Y2198 HydrophobicContact CG-CD1 3.74Å; Q2013-Y2198 HydrophobicContact CG-CE1 3.96Å; Q2013-L2199 HydrophobicContact CB-CD2 4.39Å; Q2013-L2199 HydrophobicContact CG-CD1 4.45Å; Q2013-L2199 HydrophobicContact CG-CD2 3.79Å; Q2013-L2199 HydrophobicContact CG-CG 4.01Å
2014F86.7Confident81.1Confident17.2 Ų17.240.6 Ų40.68%0.07520%0.198CC..Hα-helixtrans-73.4-38.1-172.9-171.4-107.5000113.2F1970 I1972 P1974 M1977 V2010 V2011 A2016 S2017 A2022F1970-F2014 HydrophobicContact CB-CD1 4.21Å; F1970-F2014 HydrophobicContact CB-CD2 4.46Å; F1970-F2014 HydrophobicContact CB-CE1 3.71Å; F1970-F2014 HydrophobicContact CB-CE2 3.99Å; F1970-F2014 HydrophobicContact CB-CZ 3.5Å; F1970-F2014 VanDerWaalsContact CB-CZ 3.47Å; F1970-F2014 AromaticContact CD1-CD1 3.63Å; F1970-F2014 HydrophobicContact CD1-CD1 3.75Å; F1970-F2014 AromaticContact CD1-CE1 3.65Å; F1970-F2014 HydrophobicContact CD1-CE1 3.77Å; F1970-F2014 HydrophobicContact CD1-CG 4.4Å; F1970-F2014 HydrophobicContact CD1-CZ 4.4Å; F1970-F2014 HydrophobicContact CD2-CB 3.99Å; F1970-F2014 AromaticContact CD2-CD1 3.65Å; F1970-F2014 HydrophobicContact CD2-CD1 3.65Å; F1970-F2014 VanDerWaalsContact CD2-CD1 3.48Å; F1970-F2014 AromaticContact CD2-CD2 3.58Å; F1970-F2014 HydrophobicContact CD2-CD2 3.58Å; F1970-F2014 AromaticContact CD2-CE1 3.83Å; F1970-F2014 HydrophobicContact CD2-CE1 3.92Å; F1970-F2014 AromaticContact CD2-CE2 3.84Å; F1970-F2014 HydrophobicContact CD2-CE2 3.84Å; F1970-F2014 AromaticContact CD2-CG 3.47Å; F1970-F2014 HydrophobicContact CD2-CG 3.47Å; F1970-F2014 VanDerWaalsContact CD2-CG 3.46Å; F1970-F2014 AromaticContact CD2-CZ 3.99Å; F1970-F2014 HydrophobicContact CD2-CZ 4Å; F1970-F2014 AromaticContact CE1-CD1 3.73Å; F1970-F2014 HydrophobicContact CE1-CD1 3.86Å; F1970-F2014 HydrophobicContact CE1-CE1 4.23Å; F1970-F2014 HydrophobicContact CE1-CG 4.38Å; F1970-F2014 HydrophobicContact CE2-CB 3.41Å; F1970-F2014 VanDerWaalsContact CE2-CB 3.42Å; F1970-F2014 AromaticContact CE2-CD1 3.65Å; F1970-F2014 HydrophobicContact CE2-CD1 3.75Å; F1970-F2014 AromaticContact CE2-CD2 3.83Å; F1970-F2014 HydrophobicContact CE2-CD2 3.93Å; F1970-F2014 HydrophobicContact CE2-CE1 4.38Å; F1970-F2014 HydrophobicContact CE2-CE2 4.38Å; F1970-F2014 AromaticContact CE2-CG 3.44Å; F1970-F2014 HydrophobicContact CE2-CG 3.44Å; F1970-F2014 VanDerWaalsContact CE2-CG 3.44Å; F1970-F2014 AromaticContact CG-CD1 3.53Å; F1970-F2014 HydrophobicContact CG-CD1 3.65Å; F1970-F2014 VanDerWaalsContact CG-CD1 3.49Å; F1970-F2014 HydrophobicContact CG-CD2 4.19Å; F1970-F2014 AromaticContact CG-CE1 3.53Å; F1970-F2014 HydrophobicContact CG-CE1 3.53Å; F1970-F2014 VanDerWaalsContact CG-CE1 3.43Å; F1970-F2014 AromaticContact CG-CE2 3.9Å; F1970-F2014 HydrophobicContact CG-CE2 4.08Å; F1970-F2014 AromaticContact CG-CG 3.95Å; F1970-F2014 HydrophobicContact CG-CG 3.98Å; F1970-F2014 AromaticContact CG-CZ 3.75Å; F1970-F2014 HydrophobicContact CG-CZ 3.75Å; F1970-F2014 HydrophobicContact CZ-CB 3.76Å; F1970-F2014 AromaticContact CZ-CD1 3.75Å; F1970-F2014 HydrophobicContact CZ-CD1 3.85Å; F1970-F2014 AromaticContact CZ-CG 3.92Å; F1970-F2014 HydrophobicContact CZ-CG 3.92Å; I1972-F2014 WeakPolarHBondContact O-CE1 3.4Å; I1972-F2014 WeakPolarHBondContact O-CZ 3.35Å; P1974-F2014 HydrophobicContact CB-CD1 4.4Å; P1974-F2014 HydrophobicContact CB-CE1 4.41Å; P1974-F2014 VanDerWaalsContact CD-CZ 3.46Å; P1974-F2014 HydrophobicContact CG-CD1 4.32Å; P1974-F2014 HydrophobicContact CG-CD2 4.14Å; P1974-F2014 HydrophobicContact CG-CE1 3.92Å; P1974-F2014 HydrophobicContact CG-CE2 3.72Å; P1974-F2014 HydrophobicContact CG-CG 4.41Å; P1974-F2014 HydrophobicContact CG-CZ 3.61Å; M1977-F2014 HydrophobicContact CE-CB 4.47Å; M1977-F2014 HydrophobicContact CE-CD1 3.59Å; M1977-F2014 HydrophobicContact CE-CE1 4.29Å; M1977-F2014 HydrophobicContact CE-CG 4.49Å; M1977-F2014 HydrophobicContact SD-CD1 3.97Å; M1977-F2014 HydrophobicContact SD-CE1 4.46Å; V2010-F2014 WeakPolarHBondContact O-CB 3.43Å; V2010-F2014 PolarHBondContact O-N 3.06Å; V2010-F2014 VanDerWaalsContact O-N 3.12Å; V2011-F2014 PolarHBondContact O-N 3.13Å; F2014-A2016 VanDerWaalsContact C-N 3.32Å; F2014-A2016 PolarHBondContact O-N 3.09Å; F2014-S2017 VanDerWaalsContact O-CB 3.28Å; F2014-S2017 WeakPolarHBondContact O-CB 3.41Å; F2014-S2017 PolarHBondContact O-N 3.21Å; F2014-S2017 VanDerWaalsContact O-N 3.11Å; F2014-A2022 HydrophobicContact CE2-CB 4.19Å; F2014-A2022 HydrophobicContact CZ-CB 3.92Å
2015C87.4Confident79.9Confident0 Ų046.1 Ų46.10%023%0.232CC..Hα-helixtrans-66.6-28.6-175.671.20000114.2M1977 R1978 F1983 V2011 L2012 S2017 L2035 W2043M1977-C2015 VanDerWaalsContact CE-CA 3.42Å; M1977-C2015 HydrophobicContact CE-CB 3.36Å; M1977-C2015 HydrophobicContact SD-CB 3.9Å; R1978-C2015 VanDerWaalsContact CD-O 3.28Å; R1978-C2015 WeakPolarHBondContact CD-O 3.23Å; R1978-C2015 WeakPolarHBondContact CG-O 3.24Å; R1978-C2015 PolarHBondContact NE-O 2.77Å; R1978-C2015 PolarHBondContact NH1-O 3.04Å; F1983-C2015 HydrophobicContact CD2-CB 4.39Å; F1983-C2015 HydrophobicContact CE1-CB 4.49Å; F1983-C2015 HydrophobicContact CE2-CB 3.38Å; F1983-C2015 VanDerWaalsContact CE2-CB 3.41Å; F1983-C2015 HydrophobicContact CZ-CB 3.45Å; F1983-C2015 VanDerWaalsContact CZ-CB 3.45Å; V2011-C2015 VanDerWaalsContact O-CB 3.27Å; V2011-C2015 WeakPolarHBondContact O-CB 3.31Å; V2011-C2015 PolarHBondContact O-N 3.35Å; V2011-C2015 PolarHBondContact O-SG 3.11Å; V2011-C2015 VanDerWaalsContact O-SG 3.36Å; L2012-C2015 PolarHBondContact O-SG 3.12Å; L2012-C2015 VanDerWaalsContact O-SG 3.38Å; C2015-S2017 VanDerWaalsContact C-N 3.3Å; C2015-S2017 PolarHBondContact O-N 3.31Å; C2015-L2035 HydrophobicContact CB-CD2 4.37Å; C2015-L2035 WeakPolarHBondContact O-CD2 3.49Å; C2015-W2043 PolarHBondContact SG-NE1 3.09Å; C2015-W2043 VanDerWaalsContact SG-NE1 3.43Å
2016A83.4Confident78.8Confident0 Ų049.5 Ų49.50%025%0.247CC..THydrogen-bonded Turntrans-78.8-13.5176.400000113F2014 F2030 L2032 L2035 I2202F2014-A2016 VanDerWaalsContact C-N 3.32Å; F2014-A2016 PolarHBondContact O-N 3.09Å; A2016-F2030 VanDerWaalsContact C-CE2 3.5Å; A2016-F2030 HydrophobicContact CB-CD2 4.27Å; A2016-F2030 HydrophobicContact CB-CE2 3.75Å; A2016-F2030 VanDerWaalsContact O-CD2 3.29Å; A2016-F2030 WeakPolarHBondContact O-CD2 3.37Å; A2016-F2030 WeakPolarHBondContact O-CE2 3.38Å; A2016-L2032 HydrophobicContact CB-CD2 3.93Å; A2016-L2035 HydrophobicContact CB-CD1 4.45Å; A2016-I2202 HydrophobicContact CB-CD1 4.39Å; A2016-I2202 HydrophobicContact CB-CG2 4.32Å
2017S82.2Confident77.9Confident1 Ų148.7 Ų48.71%0.00725%0.25CS..  trans-71.2141.3-170.5-176.90000114.4P1974 R1978 F2014 C2015 Q2019P1974-S2017 WeakPolarHBondContact CB-O 3.4Å; R1978-S2017 PolarHBondContact NH1-O 2.94Å; R1978-S2017 PolarHBondContact NH2-O 2.96Å; F2014-S2017 VanDerWaalsContact O-CB 3.28Å; F2014-S2017 WeakPolarHBondContact O-CB 3.41Å; F2014-S2017 PolarHBondContact O-N 3.21Å; F2014-S2017 VanDerWaalsContact O-N 3.11Å; C2015-S2017 VanDerWaalsContact C-N 3.3Å; C2015-S2017 PolarHBondContact O-N 3.31Å; S2017-Q2019 VanDerWaalsContact C-N 3.31Å; S2017-Q2019 PolarHBondContact O-N 3.38Å; S2017-Q2019 VanDerWaalsContact OG-CG 3.23Å; S2017-Q2019 WeakPolarHBondContact OG-CG 3.42Å; S2017-Q2019 PolarHBondContact OG-N 3.33Å; S2017-Q2019 PolarHBondContact OG-NE2 3.43Å; S2017-Q2019 VanDerWaalsContact OG-NE2 3.1Å; S2017-Q2019 PolarHBondContact OG-OE1 3.25Å
2018P76.2Confident77.3Confident63.2 Ų63.248.8 Ų48.841%0.4125%0.253SS..  trans-81-2.3174.534.5-37.9000114.6F2030 L2034P2018-F2030 VanDerWaalsContact CD-CD1 3.44Å; P2018-F2030 VanDerWaalsContact CD-CG 3.46Å; P2018-F2030 HydrophobicContact CG-CB 4.08Å; P2018-F2030 HydrophobicContact CG-CD1 4.11Å; P2018-F2030 HydrophobicContact CG-CG 4.23Å; P2018-L2034 VanDerWaalsContact CA-CD1 3.49Å; P2018-L2034 HydrophobicContact CB-CD1 3.74Å
2019Q75.6Confident76.6Confident17.6 Ų17.653.6 Ų53.68%0.08228%0.283CS..  trans-57.7147.1-169.4-68.9153.2-18.800114.3P1974 S2017 Y2021 D2024 Q2026P1974-Q2019 HydrophobicContact CG-CB 4.26Å; S2017-Q2019 VanDerWaalsContact C-N 3.31Å; S2017-Q2019 PolarHBondContact O-N 3.38Å; S2017-Q2019 VanDerWaalsContact OG-CG 3.23Å; S2017-Q2019 WeakPolarHBondContact OG-CG 3.42Å; S2017-Q2019 PolarHBondContact OG-N 3.33Å; S2017-Q2019 PolarHBondContact OG-NE2 3.43Å; S2017-Q2019 VanDerWaalsContact OG-NE2 3.1Å; S2017-Q2019 PolarHBondContact OG-OE1 3.25Å; Q2019-Y2021 WeakPolarHBondContact CB-O 3.3Å; Q2019-D2024 HydrophobicContact CB-CB 4.19Å; Q2019-D2024 HydrophobicContact CG-CB 3.97Å; Q2019-D2024 WeakPolarHBondContact CG-O 3.4Å; Q2019-D2024 PolarHBondContact NE2-O 3Å; Q2019-Q2026 HydrophobicContact CG-CB 4.28Å; Q2019-Q2026 HydrophobicContact CG-CG 4.01Å; Q2019-Q2026 VanDerWaalsContact NE2-N 3.17Å
2020R62.7Low76.2Confident188.8 Ų188.854.4 Ų54.471%0.71229%0.286SS*.SBendtrans-84.2-35.6173.4-71-175.9177.4-97.43112.4P1973P1973-R2020 WeakPolarHBondContact CB-O 3.38Å
2021Y64Low76.1Confident159.8 Ų159.854.6 Ų54.663%0.62729%0.288SS*.SBendtrans-116.5149.6-178.6-53.3-72.7000110Q2019 T2023 D2024Q2019-Y2021 WeakPolarHBondContact CB-O 3.3Å; Y2021-T2023 VanDerWaalsContact C-N 3.3Å; Y2021-T2023 PolarHBondContact O-N 3.07Å; Y2021-T2023 VanDerWaalsContact O-N 3.16Å; Y2021-D2024 PolarHBondContact N-OD2 2.7Å; Y2021-D2024 PolarHBondContact O-N 3.37Å
2022A62.5Low76Confident25.4 Ų25.454.7 Ų54.721%0.2129%0.288CS..THydrogen-bonded Turntrans-78.5-14.8-174.500000114.2F1970 F2014F1970-A2022 HydrophobicContact CB-CB 4.16Å; F1970-A2022 WeakPolarHBondContact O-CB 3.42Å; F2014-A2022 HydrophobicContact CE2-CB 4.19Å; F2014-A2022 HydrophobicContact CZ-CB 3.92Å
2023T62.8Low75.7Confident125.8 Ų125.860 Ų6077%0.77231%0.308SS*.THydrogen-bonded Turntrans-91.4-8.417951.30000114.1Y2021 T2025Y2021-T2023 VanDerWaalsContact C-N 3.3Å; Y2021-T2023 PolarHBondContact O-N 3.07Å; Y2021-T2023 VanDerWaalsContact O-N 3.16Å; T2023-T2025 PolarHBondContact O-N 3.12Å; T2023-T2025 VanDerWaalsContact O-N 3.08Å
2024D61.6Low75.6Confident60.2 Ų60.261.6 Ų61.632%0.32232%0.317SS..  trans-72.7123.9-179.5-142.1-2.6000110.5Q2019 Y2021 Q2026Q2019-D2024 HydrophobicContact CB-CB 4.19Å; Q2019-D2024 HydrophobicContact CG-CB 3.97Å; Q2019-D2024 WeakPolarHBondContact CG-O 3.4Å; Q2019-D2024 PolarHBondContact NE2-O 3Å; Y2021-D2024 PolarHBondContact N-OD2 2.7Å; Y2021-D2024 PolarHBondContact O-N 3.37Å; D2024-Q2026 PolarHBondContact O-N 3.22Å; D2024-Q2026 VanDerWaalsContact O-N 3.12Å; D2024-Q2026 PolarHBondContact OD1-NE2 2.98Å; D2024-Q2026 WeakPolarHBondContact OD2-CG 3.14Å; D2024-Q2026 PolarHBondContact OD2-NE2 3.15Å; D2024-Q2026 VanDerWaalsContact OD2-NE2 3.1Å
2025T63.3Low75.6Confident119.2 Ų119.261.1 Ų61.173%0.73132%0.315SS*.  trans-104.5105.3172.752.80000110.7T2023T2023-T2025 PolarHBondContact O-N 3.12Å; T2023-T2025 VanDerWaalsContact O-N 3.08Å
2026Q66.7Low75.6Confident87.2 Ų87.266.5 Ų66.541%0.40734%0.34SS..  trans-102.8143.8176.1-69.2-80.9-24.700110.5Q2019 D2024 Y2198Q2019-Q2026 HydrophobicContact CG-CB 4.28Å; Q2019-Q2026 HydrophobicContact CG-CG 4.01Å; Q2019-Q2026 VanDerWaalsContact NE2-N 3.17Å; D2024-Q2026 PolarHBondContact O-N 3.22Å; D2024-Q2026 VanDerWaalsContact O-N 3.12Å; D2024-Q2026 PolarHBondContact OD1-NE2 2.98Å; D2024-Q2026 WeakPolarHBondContact OD2-CG 3.14Å; D2024-Q2026 PolarHBondContact OD2-NE2 3.15Å; D2024-Q2026 VanDerWaalsContact OD2-NE2 3.1Å; Q2026-Y2198 PolarHBondContact O-OH 3.15Å
2027P71.1Confident75.8Confident74.6 Ų74.670.3 Ų70.348%0.48437%0.365SS..  trans-61.8157170.927.5-34.4000110.8T2029P2027-T2029 VanDerWaalsContact C-N 3.27Å; P2027-T2029 HydrophobicContact CB-CG2 4.24Å; P2027-T2029 HydrophobicContact CG-CG2 3.94Å; P2027-T2029 PolarHBondContact O-N 3.19Å; P2027-T2029 PolarHBondContact O-OG1 3.09Å
2028P75.8Confident76.2Confident29.6 Ų29.675.5 Ų75.519%0.19239%0.389CS..SBendtrans-73.777.9-179.431.1-32.5000110.2Y2198 Q2201 I2202 N2205P2028-Y2198 HydrophobicContact CB-CD1 4.13Å; P2028-Y2198 HydrophobicContact CB-CD2 3.89Å; P2028-Y2198 HydrophobicContact CB-CE1 4.07Å; P2028-Y2198 HydrophobicContact CB-CE2 3.81Å; P2028-Y2198 HydrophobicContact CB-CG 4.05Å; P2028-Y2198 VanDerWaalsContact CD-CE2 3.45Å; P2028-Y2198 HydrophobicContact CG-CD2 3.66Å; P2028-Y2198 HydrophobicContact CG-CE2 3.85Å; P2028-Y2198 HydrophobicContact CG-CG 4.1Å; P2028-Q2201 HydrophobicContact CB-CB 4.1Å; P2028-Q2201 HydrophobicContact CB-CG 4.14Å; P2028-Q2201 HydrophobicContact CG-CB 3.93Å; P2028-Q2201 HydrophobicContact CG-CG 3.87Å; P2028-Q2201 VanDerWaalsContact O-CG 3.31Å; P2028-Q2201 WeakPolarHBondContact O-CG 3.36Å; P2028-I2202 HydrophobicContact CB-CG1 4.09Å; P2028-N2205 PolarHBondContact O-ND2 3.17Å
2029T77.5Confident77Confident101.2 Ų101.272.8 Ų72.862%0.62137%0.371SS*.  trans-1100.5-18051.70000112.4P2027P2027-T2029 VanDerWaalsContact C-N 3.27Å; P2027-T2029 HydrophobicContact CB-CG2 4.24Å; P2027-T2029 HydrophobicContact CG-CG2 3.94Å; P2027-T2029 PolarHBondContact O-N 3.19Å; P2027-T2029 PolarHBondContact O-OG1 3.09Å
2030F82.9Confident77.8Confident17 Ų1773.9 Ų73.98%0.07538%0.375CS..  trans-105.6170.8-177.354.5-95.2000112A2016 P2018 Y2198 I2202 N2205A2016-F2030 VanDerWaalsContact C-CE2 3.5Å; A2016-F2030 HydrophobicContact CB-CD2 4.27Å; A2016-F2030 HydrophobicContact CB-CE2 3.75Å; A2016-F2030 VanDerWaalsContact O-CD2 3.29Å; A2016-F2030 WeakPolarHBondContact O-CD2 3.37Å; A2016-F2030 WeakPolarHBondContact O-CE2 3.38Å; P2018-F2030 VanDerWaalsContact CD-CD1 3.44Å; P2018-F2030 VanDerWaalsContact CD-CG 3.46Å; P2018-F2030 HydrophobicContact CG-CB 4.08Å; P2018-F2030 HydrophobicContact CG-CD1 4.11Å; P2018-F2030 HydrophobicContact CG-CG 4.23Å; F2030-Y2198 WeakPolarHBondContact CE1-OH 3.35Å; F2030-Y2198 AromaticContact CZ-CE1 3.96Å; F2030-Y2198 HydrophobicContact CZ-CE1 4.07Å; F2030-Y2198 WeakPolarHBondContact CZ-OH 3.32Å; F2030-I2202 HydrophobicContact CD2-CD1 4.49Å; F2030-I2202 HydrophobicContact CD2-CG1 4.31Å; F2030-I2202 HydrophobicContact CE2-CD1 3.53Å; F2030-I2202 HydrophobicContact CE2-CG1 3.78Å; F2030-I2202 HydrophobicContact CZ-CD1 3.85Å; F2030-I2202 HydrophobicContact CZ-CG1 4.22Å; F2030-N2205 PolarHBondContact N-ND2 3.23Å; F2030-N2205 WeakPolarHBondContact O-CB 3.33Å; F2030-N2205 PolarHBondContact O-ND2 3.1Å
2031T86.3Confident79.3Confident21.2 Ų21.268 Ų6813%0.1336%0.357CS..  trans-121.1165.3-174.566.80000111.1R2033 N2205 T2206 S2209 D2668 Y2670T2031-R2033 PolarHBondContact O-N 3.21Å; T2031-R2033 VanDerWaalsContact O-N 3.1Å; T2031-R2033 VanDerWaalsContact OG1-CB 3.28Å; T2031-R2033 WeakPolarHBondContact OG1-CB 3.32Å; T2031-R2033 PolarHBondContact OG1-N 3.07Å; T2031-N2205 HydrophobicContact CG2-CB 4.07Å; T2031-N2205 WeakPolarHBondContact CG2-O 3.26Å; T2031-T2206 WeakPolarHBondContact CA-OG1 3.35Å; T2031-T2206 WeakPolarHBondContact CB-OG1 3.19Å; T2031-S2209 WeakPolarHBondContact CG2-OG 3.33Å; T2031-D2668 WeakPolarHBondContact CB-OD2 3.39Å; T2031-D2668 PolarHBondContact OG1-OD2 3.39Å; T2031-Y2670 VanDerWaalsContact CB-OH 3.3Å; T2031-Y2670 WeakPolarHBondContact CB-OH 3.45Å; T2031-Y2670 PolarHBondContact OG1-OH 2.94Å
2032L87.9Confident80.7Confident1.6 Ų1.662.8 Ų62.81%0.00834%0.338CS..G310 helixtrans-68.43.5175.7-59.9177.3000114.1A2016 L2034 L2035 R2040 W2043 L2044 I2202 T2206A2016-L2032 HydrophobicContact CB-CD2 3.93Å; L2032-L2034 PolarHBondContact O-N 3.06Å; L2032-L2034 VanDerWaalsContact O-N 3.12Å; L2032-L2035 HydrophobicContact CD2-CD1 4.04Å; L2032-L2035 WeakPolarHBondContact O-CB 3.39Å; L2032-L2035 PolarHBondContact O-N 3.24Å; L2032-L2035 VanDerWaalsContact O-N 3.1Å; L2032-R2040 HydrophobicContact CB-CG 4.17Å; L2032-R2040 WeakPolarHBondContact O-CD 3.41Å; L2032-R2040 PolarHBondContact O-NE 3.3Å; L2032-W2043 HydrophobicContact CD1-CD2 4.26Å; L2032-W2043 HydrophobicContact CD1-CE3 3.72Å; L2032-W2043 HydrophobicContact CD1-CZ3 3.93Å; L2032-W2043 HydrophobicContact CD2-CD2 3.7Å; L2032-W2043 HydrophobicContact CD2-CE3 3.89Å; L2032-W2043 HydrophobicContact CD2-CG 4.28Å; L2032-W2043 HydrophobicContact CD2-CH2 4Å; L2032-W2043 HydrophobicContact CD2-CZ2 3.78Å; L2032-W2043 HydrophobicContact CD2-CZ3 4.05Å; L2032-W2043 HydrophobicContact CG-CE3 4.46Å; L2032-L2044 HydrophobicContact CD1-CD1 4.39Å; L2032-L2044 HydrophobicContact CD1-CD2 4.01Å; L2032-L2044 HydrophobicContact CD1-CG 4.07Å; L2032-I2202 HydrophobicContact CD2-CG2 3.56Å; L2032-I2202 HydrophobicContact CG-CG2 3.93Å; L2032-T2206 HydrophobicContact CB-CG2 4.04Å; L2032-T2206 HydrophobicContact CD1-CG2 4.41Å; L2032-T2206 HydrophobicContact CG-CG2 4.3Å; L2032-T2206 PolarHBondContact N-OG1 3.13Å
2033R84.9Confident82.3Confident111.8 Ų111.861.5 Ų61.542%0.42233%0.328SS..G310 helixtrans-52.8-34.6-179.6177.9172.712154.1-5113.5T2031 L2035 R2040 S2209 D2668 Y2670T2031-R2033 PolarHBondContact O-N 3.21Å; T2031-R2033 VanDerWaalsContact O-N 3.1Å; T2031-R2033 VanDerWaalsContact OG1-CB 3.28Å; T2031-R2033 WeakPolarHBondContact OG1-CB 3.32Å; T2031-R2033 PolarHBondContact OG1-N 3.07Å; R2033-L2035 VanDerWaalsContact C-N 3.29Å; R2033-L2035 PolarHBondContact O-N 3.29Å; R2033-R2040 PolarHBondContact O-NH2 3.05Å; R2033-S2209 PolarHBondContact NH2-O 2.93Å; R2033-S2209 PolarHBondContact NH2-OG 2.74Å; R2033-D2668 WeakPolarHBondContact CB-OD2 3.37Å; R2033-D2668 WeakPolarHBondContact CD-OD1 3.38Å; R2033-D2668 IonicContact CZ-OD1 2.68Å; R2033-D2668 IonicContact CZ-OD2 3.15Å; R2033-D2668 IonicContact NE-OD1 3.16Å; R2033-D2668 PolarHBondContact NE-OD1 3.04Å; R2033-D2668 IonicContact NE-OD2 3.11Å; R2033-D2668 PolarHBondContact NE-OD2 3.01Å; R2033-D2668 IonicContact NH2-OD1 2.89Å; R2033-D2668 PolarHBondContact NH2-OD1 2.94Å; R2033-D2668 IonicContact NH2-OD2 2.73Å; R2033-D2668 PolarHBondContact NH2-OD2 2.93Å; R2033-Y2670 HydrophobicContact CB-CE1 4.46Å
2034L85.3Confident83.9Confident72 Ų7257 Ų5738%0.37730%0.299SS..G310 helixtrans-73.3-9.9-178.3-70.2178.9000114.7R1978 P2018 L2032R1978-L2034 VanDerWaalsContact CD-O 3.28Å; R1978-L2034 WeakPolarHBondContact CD-O 3.4Å; R1978-L2034 PolarHBondContact NH1-O 3.16Å; P2018-L2034 VanDerWaalsContact CA-CD1 3.49Å; P2018-L2034 HydrophobicContact CB-CD1 3.74Å; L2032-L2034 PolarHBondContact O-N 3.06Å; L2032-L2034 VanDerWaalsContact O-N 3.12Å
2035L88.1Confident85.5Confident5.8 Ų5.857.7 Ų57.73%0.0330%0.301CS..SBendtrans-93.2148.4169.2-60.7170.6000109.7R1978 F1983 C2015 A2016 L2032 R2033 V2039 R2040 W2043R1978-L2035 HydrophobicContact CG-CD2 3.92Å; F1983-L2035 HydrophobicContact CE1-CD2 4.28Å; F1983-L2035 HydrophobicContact CZ-CD2 4.09Å; C2015-L2035 HydrophobicContact CB-CD2 4.37Å; C2015-L2035 WeakPolarHBondContact O-CD2 3.49Å; A2016-L2035 HydrophobicContact CB-CD1 4.45Å; L2032-L2035 HydrophobicContact CD2-CD1 4.04Å; L2032-L2035 WeakPolarHBondContact O-CB 3.39Å; L2032-L2035 PolarHBondContact O-N 3.24Å; L2032-L2035 VanDerWaalsContact O-N 3.1Å; R2033-L2035 VanDerWaalsContact C-N 3.29Å; R2033-L2035 PolarHBondContact O-N 3.29Å; L2035-V2039 HydrophobicContact CB-CB 4.29Å; L2035-V2039 HydrophobicContact CB-CG1 4.2Å; L2035-V2039 HydrophobicContact CD1-CG1 4.43Å; L2035-V2039 HydrophobicContact CD2-CG1 3.92Å; L2035-V2039 HydrophobicContact CG-CG1 4.41Å; L2035-R2040 HydrophobicContact CB-CG 3.89Å; L2035-R2040 VanDerWaalsContact O-CZ 3.26Å; L2035-R2040 PolarHBondContact O-NE 3.18Å; L2035-R2040 PolarHBondContact O-NH2 3.17Å; L2035-R2040 VanDerWaalsContact O-NH2 3.11Å; L2035-W2043 HydrophobicContact CD1-CB 4.31Å; L2035-W2043 HydrophobicContact CD1-CG 4.09Å
2036E87.5Confident87Confident112.6 Ų112.652.1 Ų52.153%0.52627%0.266SS..  trans-66.1152.4172.2-59.4-172.7142.400111.4H1984 H2038 V2039 R2040H1984-E2036 IonicContact CE1-OE2 2.94Å; H1984-E2036 PolarHBondContact CE1-OE2 3.38Å; E2036-H2038 VanDerWaalsContact C-N 3.31Å; E2036-H2038 PolarHBondContact O-N 2.96Å; E2036-H2038 VanDerWaalsContact O-N 3.12Å; E2036-H2038 IonicContact OE2-CE1 2.7Å; E2036-H2038 PolarHBondContact OE2-CE1 3.27Å; E2036-H2038 IonicContact OE2-ND1 3.69Å; E2036-H2038 PolarHBondContact OE2-ND1 3.31Å; E2036-V2039 HydrophobicContact CB-CB 4.42Å; E2036-V2039 HydrophobicContact CB-CG2 4.04Å; E2036-V2039 CarbonylContact O-C 3.56Å; E2036-V2039 WeakPolarHBondContact O-CA 3.41Å; E2036-V2039 WeakPolarHBondContact O-CB 3.35Å; E2036-V2039 PolarHBondContact O-N 3.18Å; E2036-R2040 WeakPolarHBondContact O-CG 3.44Å; E2036-R2040 PolarHBondContact O-N 3.18Å
2037P87.7Confident88.4Confident80.4 Ų80.448 Ų4852%0.52225%0.247SC..Hα-helixtrans-52.6-43.8-174.2-29.136000114.8V2039 R2040 L2041P2037-V2039 VanDerWaalsContact C-N 3.28Å; P2037-V2039 PolarHBondContact O-N 3.19Å; P2037-R2040 WeakPolarHBondContact O-CB 3.29Å; P2037-R2040 PolarHBondContact O-N 3.13Å; P2037-R2040 VanDerWaalsContact O-N 3.1Å; P2037-L2041 WeakPolarHBondContact O-CG 3.4Å; P2037-L2041 PolarHBondContact O-N 3.15Å; P2037-L2041 VanDerWaalsContact O-N 3.09Å
2038H90.3Very high89.5Confident110.2 Ų110.247.8 Ų47.851%0.5124%0.242SC..Hα-helixtrans-66.8-33.7177.385.2-85.9000112.7H1984 E2036 R2040 L2041 H2042H1984-H2038 AromaticContact ND1-NE2 3.74Å; E2036-H2038 VanDerWaalsContact C-N 3.31Å; E2036-H2038 PolarHBondContact O-N 2.96Å; E2036-H2038 VanDerWaalsContact O-N 3.12Å; E2036-H2038 IonicContact OE2-CE1 2.7Å; E2036-H2038 PolarHBondContact OE2-CE1 3.27Å; E2036-H2038 IonicContact OE2-ND1 3.69Å; E2036-H2038 PolarHBondContact OE2-ND1 3.31Å; H2038-R2040 VanDerWaalsContact C-N 3.33Å; H2038-R2040 PolarHBondContact O-N 2.96Å; H2038-L2041 WeakPolarHBondContact O-CB 3.33Å; H2038-L2041 PolarHBondContact O-N 3.17Å; H2038-H2042 AromaticContact CE1-CD2 3.77Å; H2038-H2042 AromaticContact CE1-CE1 3.86Å; H2038-H2042 AromaticContact CE1-NE2 3.07Å; H2038-H2042 PolarHBondContact CE1-NE2 3.45Å; H2038-H2042 AromaticContact ND1-CD2 3.76Å; H2038-H2042 AromaticContact ND1-NE2 3.56Å; H2038-H2042 AromaticContact NE2-NE2 3.96Å; H2038-H2042 PolarHBondContact O-CD2 3.04Å; H2038-H2042 VanDerWaalsContact O-CD2 3.23Å; H2038-H2042 PolarHBondContact O-N 3.2Å
2039V92.2Very high90.4Very high6.2 Ų6.247.6 Ų47.64%0.03824%0.24CC..Hα-helixtrans-70.7-36.2176.4-175.20000110.8F1983 L1987 L2035 E2036 P2037 L2041 H2042 W2043F1983-V2039 HydrophobicContact CE1-CG1 3.96Å; F1983-V2039 HydrophobicContact CZ-CG1 4.15Å; L1987-V2039 HydrophobicContact CD2-CG1 3.59Å; L1987-V2039 VanDerWaalsContact CD2-CG1 3.46Å; L1987-V2039 WeakPolarHBondContact CD2-O 3.38Å; L2035-V2039 HydrophobicContact CB-CB 4.29Å; L2035-V2039 HydrophobicContact CB-CG1 4.2Å; L2035-V2039 HydrophobicContact CD1-CG1 4.43Å; L2035-V2039 HydrophobicContact CD2-CG1 3.92Å; L2035-V2039 HydrophobicContact CG-CG1 4.41Å; E2036-V2039 HydrophobicContact CB-CB 4.42Å; E2036-V2039 HydrophobicContact CB-CG2 4.04Å; E2036-V2039 CarbonylContact O-C 3.56Å; E2036-V2039 WeakPolarHBondContact O-CA 3.41Å; E2036-V2039 WeakPolarHBondContact O-CB 3.35Å; E2036-V2039 PolarHBondContact O-N 3.18Å; P2037-V2039 VanDerWaalsContact C-N 3.28Å; P2037-V2039 PolarHBondContact O-N 3.19Å; V2039-L2041 VanDerWaalsContact C-N 3.33Å; V2039-L2041 PolarHBondContact O-N 2.84Å; V2039-H2042 PolarHBondContact O-N 3.12Å; V2039-W2043 VanDerWaalsContact O-CB 3.31Å; V2039-W2043 WeakPolarHBondContact O-CB 3.32Å; V2039-W2043 PolarHBondContact O-N 3.11Å
2040R93.1Very high91.2Very high41 Ų4142.8 Ų42.816%0.15521%0.21CC..Hα-helixtrans-59.7-43171.9-59.7174.7-161.7163.22.7111.6L2032 R2033 L2035 E2036 P2037 H2038 H2042 W2043 L2044 T2674L2032-R2040 HydrophobicContact CB-CG 4.17Å; L2032-R2040 WeakPolarHBondContact O-CD 3.41Å; L2032-R2040 PolarHBondContact O-NE 3.3Å; R2033-R2040 PolarHBondContact O-NH2 3.05Å; L2035-R2040 HydrophobicContact CB-CG 3.89Å; L2035-R2040 VanDerWaalsContact O-CZ 3.26Å; L2035-R2040 PolarHBondContact O-NE 3.18Å; L2035-R2040 PolarHBondContact O-NH2 3.17Å; L2035-R2040 VanDerWaalsContact O-NH2 3.11Å; E2036-R2040 WeakPolarHBondContact O-CG 3.44Å; E2036-R2040 PolarHBondContact O-N 3.18Å; P2037-R2040 WeakPolarHBondContact O-CB 3.29Å; P2037-R2040 PolarHBondContact O-N 3.13Å; P2037-R2040 VanDerWaalsContact O-N 3.1Å; H2038-R2040 VanDerWaalsContact C-N 3.33Å; H2038-R2040 PolarHBondContact O-N 2.96Å; R2040-H2042 PolarHBondContact O-N 3.13Å; R2040-W2043 WeakPolarHBondContact O-CB 3.32Å; R2040-W2043 PolarHBondContact O-N 3.02Å; R2040-L2044 WeakPolarHBondContact O-CB 3.44Å; R2040-L2044 VanDerWaalsContact O-CG 3.29Å; R2040-L2044 WeakPolarHBondContact O-CG 3.43Å; R2040-L2044 PolarHBondContact O-N 3.18Å; R2040-T2674 HydrophobicContact CB-CG2 4.27Å
2041L93.5Very high91.7Very high64.6 Ų64.643.1 Ų43.134%0.33821%0.212SC..Hα-helixtrans-60.2-46.4177.5-133.8108.9000111.2P2037 H2038 V2039 W2043 L2044 Q2045 N2673 T2674 L2677P2037-L2041 WeakPolarHBondContact O-CG 3.4Å; P2037-L2041 PolarHBondContact O-N 3.15Å; P2037-L2041 VanDerWaalsContact O-N 3.09Å; H2038-L2041 WeakPolarHBondContact O-CB 3.33Å; H2038-L2041 PolarHBondContact O-N 3.17Å; V2039-L2041 VanDerWaalsContact C-N 3.33Å; V2039-L2041 PolarHBondContact O-N 2.84Å; L2041-W2043 PolarHBondContact O-N 2.92Å; L2041-L2044 PolarHBondContact O-N 3.23Å; L2041-Q2045 HydrophobicContact CD1-CG 4.29Å; L2041-Q2045 HydrophobicContact CG-CG 4.47Å; L2041-Q2045 VanDerWaalsContact O-CB 3.3Å; L2041-Q2045 WeakPolarHBondContact O-CB 3.43Å; L2041-Q2045 WeakPolarHBondContact O-CG 3.41Å; L2041-Q2045 PolarHBondContact O-N 3.12Å; L2041-N2673 HydrophobicContact CD2-CB 3.67Å; L2041-T2674 WeakPolarHBondContact CD2-OG1 3.37Å; L2041-L2677 HydrophobicContact CB-CD1 4.36Å; L2041-L2677 HydrophobicContact CD2-CD1 3.79Å
2042H94.3Very high92.1Very high50.2 Ų50.250.3 Ų50.323%0.23224%0.238CC..Hα-helixtrans-68.2-35.3176.9-66.8-40.6000113.5L1987 A1988 H2038 V2039 R2040 Q2045 T2046L1987-H2042 HydrophobicContact CD2-CB 4.17Å; L1987-H2042 HydrophobicContact CG-CB 4.09Å; A1988-H2042 VanDerWaalsContact CA-CD2 3.49Å; A1988-H2042 WeakPolarHBondContact CA-CD2 3.43Å; H2038-H2042 AromaticContact CE1-CD2 3.77Å; H2038-H2042 AromaticContact CE1-CE1 3.86Å; H2038-H2042 AromaticContact CE1-NE2 3.07Å; H2038-H2042 PolarHBondContact CE1-NE2 3.45Å; H2038-H2042 AromaticContact ND1-CD2 3.76Å; H2038-H2042 AromaticContact ND1-NE2 3.56Å; H2038-H2042 AromaticContact NE2-NE2 3.96Å; H2038-H2042 PolarHBondContact O-CD2 3.04Å; H2038-H2042 VanDerWaalsContact O-CD2 3.23Å; H2038-H2042 PolarHBondContact O-N 3.2Å; V2039-H2042 PolarHBondContact O-N 3.12Å; R2040-H2042 PolarHBondContact O-N 3.13Å; H2042-Q2045 PolarHBondContact ND1-OE1 3.06Å; H2042-Q2045 PolarHBondContact O-N 3.4Å; H2042-T2046 VanDerWaalsContact O-CB 3.32Å; H2042-T2046 WeakPolarHBondContact O-CB 3.38Å; H2042-T2046 PolarHBondContact O-N 3.13Å; H2042-T2046 PolarHBondContact O-OG1 3.25Å
2043W95.9Very high92.2Very high0 Ų053.7 Ų53.70%025%0.253CS..Hα-helixtrans-60.3-50.2172.6-168.8104.3000110.9L1987 L2012 C2015 L2032 L2035 V2039 R2040 L2041 T2046 L2047 L2199 I2202 V2203L1987-W2043 HydrophobicContact CD2-CB 4.21Å; L2012-W2043 HydrophobicContact CD2-CB 4.43Å; L2012-W2043 VanDerWaalsContact CD2-CD1 3.41Å; L2012-W2043 HydrophobicContact CD2-CD2 4.15Å; L2012-W2043 HydrophobicContact CD2-CG 3.76Å; L2012-W2043 PolarHBondContact O-NE1 3.04Å; C2015-W2043 PolarHBondContact SG-NE1 3.09Å; C2015-W2043 VanDerWaalsContact SG-NE1 3.43Å; L2032-W2043 HydrophobicContact CD1-CD2 4.26Å; L2032-W2043 HydrophobicContact CD1-CE3 3.72Å; L2032-W2043 HydrophobicContact CD1-CZ3 3.93Å; L2032-W2043 HydrophobicContact CD2-CD2 3.7Å; L2032-W2043 HydrophobicContact CD2-CE3 3.89Å; L2032-W2043 HydrophobicContact CD2-CG 4.28Å; L2032-W2043 HydrophobicContact CD2-CH2 4Å; L2032-W2043 HydrophobicContact CD2-CZ2 3.78Å; L2032-W2043 HydrophobicContact CD2-CZ3 4.05Å; L2032-W2043 HydrophobicContact CG-CE3 4.46Å; L2035-W2043 HydrophobicContact CD1-CB 4.31Å; L2035-W2043 HydrophobicContact CD1-CG 4.09Å; V2039-W2043 VanDerWaalsContact O-CB 3.31Å; V2039-W2043 WeakPolarHBondContact O-CB 3.32Å; V2039-W2043 PolarHBondContact O-N 3.11Å; R2040-W2043 WeakPolarHBondContact O-CB 3.32Å; R2040-W2043 PolarHBondContact O-N 3.02Å; L2041-W2043 PolarHBondContact O-N 2.92Å; W2043-T2046 PolarHBondContact O-N 3.18Å; W2043-L2047 HydrophobicContact CE3-CB 4.5Å; W2043-L2047 HydrophobicContact CE3-CD2 4.4Å; W2043-L2047 HydrophobicContact CH2-CD2 3.93Å; W2043-L2047 HydrophobicContact CZ3-CB 4.37Å; W2043-L2047 HydrophobicContact CZ3-CD2 3.55Å; W2043-L2047 PolarHBondContact O-N 3.21Å; W2043-L2199 HydrophobicContact CH2-CB 4.33Å; W2043-L2199 HydrophobicContact CH2-CD2 3.96Å; W2043-L2199 HydrophobicContact CZ2-CD2 3.47Å; W2043-L2199 VanDerWaalsContact CZ2-CD2 3.46Å; W2043-I2202 HydrophobicContact CH2-CB 4.29Å; W2043-I2202 HydrophobicContact CH2-CG2 4.13Å; W2043-I2202 HydrophobicContact CZ2-CD1 4.46Å; W2043-I2202 HydrophobicContact CZ2-CG2 4.25Å; W2043-V2203 HydrophobicContact CH2-CG2 4.13Å; W2043-V2203 HydrophobicContact CZ3-CG2 3.69Å
2044L95.4Very high92.5Very high30 Ų3048.7 Ų48.716%0.15723%0.234CC..Hα-helixtrans-66.6-40.5178.8-71.2167.6000112.2L2032 R2040 L2041 T2046 L2047 L2048 V2203 T2674 L2677L2032-L2044 HydrophobicContact CD1-CD1 4.39Å; L2032-L2044 HydrophobicContact CD1-CD2 4.01Å; L2032-L2044 HydrophobicContact CD1-CG 4.07Å; R2040-L2044 WeakPolarHBondContact O-CB 3.44Å; R2040-L2044 VanDerWaalsContact O-CG 3.29Å; R2040-L2044 WeakPolarHBondContact O-CG 3.43Å; R2040-L2044 PolarHBondContact O-N 3.18Å; L2041-L2044 PolarHBondContact O-N 3.23Å; L2044-T2046 VanDerWaalsContact C-N 3.32Å; L2044-T2046 PolarHBondContact O-N 3.32Å; L2044-L2047 PolarHBondContact O-N 3.07Å; L2044-L2048 VanDerWaalsContact O-CB 3.26Å; L2044-L2048 WeakPolarHBondContact O-CB 3.36Å; L2044-L2048 PolarHBondContact O-N 3.09Å; L2044-V2203 HydrophobicContact CD2-CG1 4.46Å; L2044-V2203 HydrophobicContact CD2-CG2 3.98Å; L2044-T2674 HydrophobicContact CD1-CG2 3.93Å; L2044-T2674 VanDerWaalsContact CD1-O 3.29Å; L2044-T2674 WeakPolarHBondContact CD1-O 3.27Å; L2044-L2677 HydrophobicContact CB-CB 3.94Å; L2044-L2677 HydrophobicContact CB-CD1 4.33Å; L2044-L2677 HydrophobicContact CD1-CB 3.92Å; L2044-L2677 HydrophobicContact CG-CB 4.47Å
2045Q95.2Very high92.4Very high76 Ų7651.5 Ų51.536%0.35525%0.245SC..Hα-helixtrans-60.8-41.9173.1-90168.9-7.200111.8A1991 L2041 H2042 L2048 V2049 L2677A1991-Q2045 HydrophobicContact CB-CG 4.34Å; L2041-Q2045 HydrophobicContact CD1-CG 4.29Å; L2041-Q2045 HydrophobicContact CG-CG 4.47Å; L2041-Q2045 VanDerWaalsContact O-CB 3.3Å; L2041-Q2045 WeakPolarHBondContact O-CB 3.43Å; L2041-Q2045 WeakPolarHBondContact O-CG 3.41Å; L2041-Q2045 PolarHBondContact O-N 3.12Å; H2042-Q2045 PolarHBondContact ND1-OE1 3.06Å; H2042-Q2045 PolarHBondContact O-N 3.4Å; Q2045-L2048 PolarHBondContact O-N 3.1Å; Q2045-V2049 WeakPolarHBondContact O-CG2 3.37Å; Q2045-V2049 PolarHBondContact O-N 3.11Å; Q2045-L2677 HydrophobicContact CG-CD1 4.25Å
2046T95.5Very high92.2Very high0 Ų052.5 Ų52.50%025%0.249CC..Hα-helixtrans-64.4-47.4176.8-57.40000111V1990 L1994 T2008 L2012 H2042 W2043 L2044 L2048 V2049 I2050V1990-T2046 HydrophobicContact CG1-CG2 3.85Å; L1994-T2046 HydrophobicContact CD1-CG2 3.85Å; T2008-T2046 HydrophobicContact CG2-CG2 3.68Å; L2012-T2046 HydrophobicContact CD1-CG2 3.96Å; L2012-T2046 HydrophobicContact CD2-CG2 4.35Å; H2042-T2046 VanDerWaalsContact O-CB 3.32Å; H2042-T2046 WeakPolarHBondContact O-CB 3.38Å; H2042-T2046 PolarHBondContact O-N 3.13Å; H2042-T2046 PolarHBondContact O-OG1 3.25Å; W2043-T2046 PolarHBondContact O-N 3.18Å; L2044-T2046 VanDerWaalsContact C-N 3.32Å; L2044-T2046 PolarHBondContact O-N 3.32Å; T2046-L2048 VanDerWaalsContact C-N 3.33Å; T2046-L2048 PolarHBondContact O-N 3.14Å; T2046-V2049 PolarHBondContact O-N 3.13Å; T2046-I2050 HydrophobicContact CG2-CD1 4.2Å; T2046-I2050 WeakPolarHBondContact O-CG1 3.32Å; T2046-I2050 PolarHBondContact O-N 2.89Å; T2046-I2050 VanDerWaalsContact O-N 3.09Å
2047L95.3Very high91.2Very high3 Ų350.7 Ų50.72%0.01624%0.243CC..Hα-helixtrans-61.1-41.8176.1179.960.7000111.7W2043 L2044 V2049 I2050 L2051 I2196 L2199 V2203 C2681W2043-L2047 HydrophobicContact CE3-CB 4.5Å; W2043-L2047 HydrophobicContact CE3-CD2 4.4Å; W2043-L2047 HydrophobicContact CH2-CD2 3.93Å; W2043-L2047 HydrophobicContact CZ3-CB 4.37Å; W2043-L2047 HydrophobicContact CZ3-CD2 3.55Å; W2043-L2047 PolarHBondContact O-N 3.21Å; L2044-L2047 PolarHBondContact O-N 3.07Å; L2047-V2049 PolarHBondContact O-N 3.37Å; L2047-I2050 PolarHBondContact O-N 2.99Å; L2047-L2051 HydrophobicContact CD1-CD1 4.07Å; L2047-L2051 HydrophobicContact CD1-CG 4.03Å; L2047-L2051 HydrophobicContact CD2-CD1 4.39Å; L2047-L2051 HydrophobicContact CG-CD1 3.83Å; L2047-L2051 HydrophobicContact CG-CG 4.24Å; L2047-L2051 WeakPolarHBondContact O-CB 3.35Å; L2047-L2051 VanDerWaalsContact O-CG 3.28Å; L2047-L2051 WeakPolarHBondContact O-CG 3.39Å; L2047-L2051 PolarHBondContact O-N 3.26Å; L2047-I2196 HydrophobicContact CD1-CD1 4.38Å; L2047-L2199 HydrophobicContact CD1-CB 4.06Å; L2047-L2199 HydrophobicContact CD1-CD1 4.16Å; L2047-L2199 HydrophobicContact CD2-CB 4.33Å; L2047-V2203 HydrophobicContact CD2-CG2 3.7Å; L2047-C2681 HydrophobicContact CD2-CB 4.44Å
2048L95.2Very high89.9Confident70.4 Ų70.449.8 Ų49.837%0.36924%0.236SC..Hα-helixtrans-61.6-42.8177.7-176.263.6000112.2L2044 Q2045 T2046 I2050 L2051 Y2052 L2677 L2680 T2684L2044-L2048 VanDerWaalsContact O-CB 3.26Å; L2044-L2048 WeakPolarHBondContact O-CB 3.36Å; L2044-L2048 PolarHBondContact O-N 3.09Å; Q2045-L2048 PolarHBondContact O-N 3.1Å; T2046-L2048 VanDerWaalsContact C-N 3.33Å; T2046-L2048 PolarHBondContact O-N 3.14Å; L2048-I2050 VanDerWaalsContact C-N 3.34Å; L2048-I2050 PolarHBondContact O-N 3.44Å; L2048-L2051 PolarHBondContact O-N 3.19Å; L2048-Y2052 VanDerWaalsContact O-CB 3.24Å; L2048-Y2052 WeakPolarHBondContact O-CB 3.35Å; L2048-Y2052 PolarHBondContact O-N 3.13Å; L2048-L2677 HydrophobicContact CD2-CD2 4.33Å; L2048-L2680 HydrophobicContact CD1-CB 4.34Å; L2048-T2684 HydrophobicContact CD1-CG2 4.48Å; L2048-T2684 VanDerWaalsContact CD1-OG1 3.25Å; L2048-T2684 WeakPolarHBondContact CD1-OG1 3.44Å
2049V94.8Very high87.7Confident24.8 Ų24.850.7 Ų50.715%0.1525%0.251CS..Hα-helixtrans-64.6-39.6175.4172.10000111.4L1994 D1995 Q2045 T2046 L2047 Y2052 K2053L1994-V2049 HydrophobicContact CB-CG1 3.67Å; D1995-V2049 HydrophobicContact CB-CG1 4.04Å; D1995-V2049 HydrophobicContact CB-CG2 4.37Å; Q2045-V2049 WeakPolarHBondContact O-CG2 3.37Å; Q2045-V2049 PolarHBondContact O-N 3.11Å; T2046-V2049 PolarHBondContact O-N 3.13Å; L2047-V2049 PolarHBondContact O-N 3.37Å; V2049-Y2052 PolarHBondContact O-N 3.32Å; V2049-K2053 VanDerWaalsContact O-CB 3.26Å; V2049-K2053 WeakPolarHBondContact O-CB 3.47Å; V2049-K2053 PolarHBondContact O-N 3.05Å; V2049-K2053 VanDerWaalsContact O-N 3.11Å
2050I93.8Very high85.1Confident1 Ų152.5 Ų52.51%0.00527%0.271CS..Hα-helixtrans-61.6-53.6174.3-66.7168.8000110.2L1994 L2005 T2008 L2009 L2012 T2046 L2047 L2048 Y2052 K2053 Y2054 I2196L1994-I2050 HydrophobicContact CD1-CD1 4.16Å; L1994-I2050 HydrophobicContact CD1-CG1 3.89Å; L2005-I2050 HydrophobicContact CD1-CB 4.47Å; L2005-I2050 HydrophobicContact CD1-CD1 3.99Å; L2005-I2050 HydrophobicContact CD1-CG1 3.89Å; L2005-I2050 HydrophobicContact CD1-CG2 3.95Å; T2008-I2050 HydrophobicContact CG2-CD1 4.37Å; L2009-I2050 HydrophobicContact CD2-CD1 4.03Å; L2009-I2050 HydrophobicContact CD2-CG2 4.4Å; L2012-I2050 HydrophobicContact CD1-CD1 3.96Å; T2046-I2050 HydrophobicContact CG2-CD1 4.2Å; T2046-I2050 WeakPolarHBondContact O-CG1 3.32Å; T2046-I2050 PolarHBondContact O-N 2.89Å; T2046-I2050 VanDerWaalsContact O-N 3.09Å; L2047-I2050 PolarHBondContact O-N 2.99Å; L2048-I2050 VanDerWaalsContact C-N 3.34Å; L2048-I2050 PolarHBondContact O-N 3.44Å; I2050-Y2052 VanDerWaalsContact C-N 3.27Å; I2050-Y2052 PolarHBondContact O-N 3.04Å; I2050-K2053 PolarHBondContact O-N 3.15Å; I2050-Y2054 WeakPolarHBondContact O-CB 3.3Å; I2050-Y2054 PolarHBondContact O-N 3.01Å; I2050-I2196 HydrophobicContact CG2-CD1 3.74Å; I2050-I2196 HydrophobicContact CG2-CG1 4.43Å
2051L93.3Very high82.2Confident21.8 Ų21.854.2 Ų54.211%0.11430%0.302CS..Hα-helixtrans-61.3-30.8-179.8-71.3173.8000113.1L2047 L2048 Y2056 I2196 I2200 C2681 T2684 F2685 R2688L2047-L2051 HydrophobicContact CD1-CD1 4.07Å; L2047-L2051 HydrophobicContact CD1-CG 4.03Å; L2047-L2051 HydrophobicContact CD2-CD1 4.39Å; L2047-L2051 HydrophobicContact CG-CD1 3.83Å; L2047-L2051 HydrophobicContact CG-CG 4.24Å; L2047-L2051 WeakPolarHBondContact O-CB 3.35Å; L2047-L2051 VanDerWaalsContact O-CG 3.28Å; L2047-L2051 WeakPolarHBondContact O-CG 3.39Å; L2047-L2051 PolarHBondContact O-N 3.26Å; L2048-L2051 PolarHBondContact O-N 3.19Å; L2051-Y2056 HydrophobicContact CD2-CD1 4.28Å; L2051-Y2056 HydrophobicContact CD2-CE1 3.99Å; L2051-Y2056 HydrophobicContact CD2-CE2 4.4Å; L2051-I2196 HydrophobicContact CD2-CD1 4.5Å; L2051-I2196 HydrophobicContact CD2-CG2 3.7Å; L2051-I2200 HydrophobicContact CD1-CD1 3.92Å; L2051-I2200 HydrophobicContact CD1-CG1 4.43Å; L2051-I2200 HydrophobicContact CD2-CD1 4.27Å; L2051-C2681 HydrophobicContact CD1-CB 3.91Å; L2051-C2681 WeakPolarHBondContact CD1-O 3.3Å; L2051-T2684 HydrophobicContact CB-CG2 3.9Å; L2051-F2685 HydrophobicContact CD1-CB 4.41Å; L2051-F2685 HydrophobicContact CD2-CB 4.15Å; L2051-F2685 HydrophobicContact CD2-CD2 3.92Å; L2051-F2685 HydrophobicContact CD2-CG 4.42Å; L2051-R2688 VanDerWaalsContact O-CD 3.24Å; L2051-R2688 WeakPolarHBondContact O-CD 3.25Å; L2051-R2688 PolarHBondContact O-NH1 2.98Å
2052Y93.9Very high79.2Confident172 Ų17257.8 Ų57.868%0.67532%0.321SS*.Hα-helixtrans-83.3-35.4-179.2-177-114.6000113.8L2048 V2049 I2050 T2684 R2688L2048-Y2052 VanDerWaalsContact O-CB 3.24Å; L2048-Y2052 WeakPolarHBondContact O-CB 3.35Å; L2048-Y2052 PolarHBondContact O-N 3.13Å; V2049-Y2052 PolarHBondContact O-N 3.32Å; I2050-Y2052 VanDerWaalsContact C-N 3.27Å; I2050-Y2052 PolarHBondContact O-N 3.04Å; Y2052-T2684 HydrophobicContact CD2-CG2 4.35Å; Y2052-R2688 WeakPolarHBondContact O-CD 3.4Å; Y2052-R2688 PolarHBondContact O-NE 3.4Å; Y2052-R2688 PolarHBondContact O-NH1 3.2Å
2053K91.3Very high76.5Confident73.8 Ų73.860.8 Ų60.832%0.32134%0.335SS..Hα-helixtrans-112.6-26-169.4-90.2-178.4167.9177.70116D1995 F1998 V2049 I2050D1995-K2053 PolarHBondContact O-NZ 3.18Å; D1995-K2053 IonicContact OD1-NZ 2.87Å; D1995-K2053 PolarHBondContact OD1-NZ 3.03Å; F1998-K2053 VanDerWaalsContact CE2-O 3.3Å; F1998-K2053 WeakPolarHBondContact CE2-O 3.36Å; V2049-K2053 VanDerWaalsContact O-CB 3.26Å; V2049-K2053 WeakPolarHBondContact O-CB 3.47Å; V2049-K2053 PolarHBondContact O-N 3.05Å; V2049-K2053 VanDerWaalsContact O-N 3.11Å; I2050-K2053 PolarHBondContact O-N 3.15Å
2054Y90.1Very high73.4Confident6.8 Ų6.867.1 Ų67.13%0.02737%0.374CS..  trans-102.9144.1-169.4-70.5-94.9000112.1L1994 F1998 G2001 L2005 I2050 Y2056 R2688L1994-Y2054 WeakPolarHBondContact CA-OH 3.24Å; L1994-Y2054 HydrophobicContact CB-CE2 4.04Å; L1994-Y2054 HydrophobicContact CD2-CE1 4.37Å; L1994-Y2054 HydrophobicContact CD2-CE2 4.09Å; L1994-Y2054 WeakPolarHBondContact O-CE2 3.39Å; L1994-Y2054 PolarHBondContact O-OH 3.23Å; F1998-Y2054 WeakPolarHBondContact CA-OH 3.36Å; F1998-Y2054 HydrophobicContact CD2-CD1 4.28Å; F1998-Y2054 AromaticContact CD2-CE1 3.7Å; F1998-Y2054 HydrophobicContact CD2-CE1 3.7Å; F1998-Y2054 HydrophobicContact CD2-CE2 4.21Å; F1998-Y2054 AromaticContact CD2-CZ 3.64Å; F1998-Y2054 AromaticContact CE2-CD1 3.68Å; F1998-Y2054 HydrophobicContact CE2-CD1 3.68Å; F1998-Y2054 HydrophobicContact CE2-CD2 4.41Å; F1998-Y2054 AromaticContact CE2-CE1 3.55Å; F1998-Y2054 HydrophobicContact CE2-CE1 3.55Å; F1998-Y2054 VanDerWaalsContact CE2-CE1 3.44Å; F1998-Y2054 HydrophobicContact CE2-CE2 4.34Å; F1998-Y2054 HydrophobicContact CE2-CG 4.14Å; F1998-Y2054 AromaticContact CE2-CZ 3.83Å; F1998-Y2054 HydrophobicContact CG-CE1 4.5Å; F1998-Y2054 HydrophobicContact CZ-CD1 4.31Å; F1998-Y2054 HydrophobicContact CZ-CE1 4.31Å; F1998-Y2054 PolarHBondContact O-OH 2.97Å; G2001-Y2054 WeakPolarHBondContact CA-OH 3.41Å; L2005-Y2054 HydrophobicContact CD1-CD1 4.46Å; L2005-Y2054 HydrophobicContact CD1-CG 4.38Å; L2005-Y2054 HydrophobicContact CD2-CD1 3.86Å; L2005-Y2054 HydrophobicContact CD2-CE1 4.46Å; L2005-Y2054 HydrophobicContact CD2-CG 4.27Å; I2050-Y2054 WeakPolarHBondContact O-CB 3.3Å; I2050-Y2054 PolarHBondContact O-N 3.01Å; Y2054-Y2056 WeakPolarHBondContact O-CD1 3.34Å; Y2054-Y2056 WeakPolarHBondContact O-CE1 3.45Å; Y2054-Y2056 PolarHBondContact O-N 2.99Å; Y2054-R2688 PolarHBondContact O-NH1 2.96Å; Y2054-R2688 PolarHBondContact O-NH2 3.18Å
2055E84.8Confident70.3Confident131 Ų13167.5 Ų67.561%0.61239%0.386SS*.  trans-83.4121.5173-66.2-179.3167.300109.6H2063E2055-H2063 IonicContact OE2-CE1 3.39Å; E2055-H2063 PolarHBondContact OE2-CE1 3.3Å
2056Y82.2Confident67Low27.4 Ų27.469.7 Ų69.711%0.10740%0.399CS..  trans-121.42.8-179.348.4-95.6000113.7L2051 Y2054 T2192 R2193 I2196 F2685 E2689 L2692L2051-Y2056 HydrophobicContact CD2-CD1 4.28Å; L2051-Y2056 HydrophobicContact CD2-CE1 3.99Å; L2051-Y2056 HydrophobicContact CD2-CE2 4.4Å; Y2054-Y2056 WeakPolarHBondContact O-CD1 3.34Å; Y2054-Y2056 WeakPolarHBondContact O-CE1 3.45Å; Y2054-Y2056 PolarHBondContact O-N 2.99Å; Y2056-T2192 PolarHBondContact O-OG1 2.77Å; Y2056-R2193 WeakPolarHBondContact O-CA 3.43Å; Y2056-R2193 VanDerWaalsContact O-CB 3.31Å; Y2056-R2193 WeakPolarHBondContact O-CB 3.36Å; Y2056-R2193 WeakPolarHBondContact O-CG 3.11Å; Y2056-R2193 PolarHBondContact O-N 3.03Å; Y2056-I2196 HydrophobicContact CD1-CD1 4.39Å; Y2056-I2196 HydrophobicContact CD1-CG1 4.28Å; Y2056-I2196 HydrophobicContact CD2-CB 4.28Å; Y2056-I2196 HydrophobicContact CD2-CG1 4.08Å; Y2056-I2196 HydrophobicContact CD2-CG2 4.17Å; Y2056-I2196 HydrophobicContact CE2-CG2 4.06Å; Y2056-I2196 HydrophobicContact CG-CB 4.49Å; Y2056-I2196 HydrophobicContact CG-CD1 3.98Å; Y2056-I2196 HydrophobicContact CG-CG1 3.81Å; Y2056-I2196 HydrophobicContact CG-CG2 4.33Å; Y2056-F2685 HydrophobicContact CE2-CD2 4.15Å; Y2056-F2685 HydrophobicContact CE2-CE2 4.06Å; Y2056-E2689 HydrophobicContact CE2-CB 4.26Å; Y2056-E2689 HydrophobicContact CE2-CG 3.7Å; Y2056-L2692 HydrophobicContact CD2-CD1 4.18Å; Y2056-L2692 HydrophobicContact CE2-CD1 4.16Å
2057N68.1Low64Low74.6 Ų74.673.6 Ų73.640%0.39942%0.424SS..  trans-89.4-8.2-172.2-68.3-15.7000114.7P2059 E2689 L2692N2057-P2059 VanDerWaalsContact O-CD 3.27Å; N2057-P2059 WeakPolarHBondContact O-CD 3.4Å; N2057-E2689 VanDerWaalsContact CG-CD 3.4Å; N2057-E2689 PolarHBondContact ND2-OE1 3.04Å; N2057-E2689 PolarHBondContact ND2-OE2 2.87Å; N2057-E2689 VanDerWaalsContact OD1-CD 3.26Å; N2057-E2689 VanDerWaalsContact OD1-CG 3.31Å; N2057-E2689 WeakPolarHBondContact OD1-CG 3.43Å; N2057-E2689 PolarHBondContact OD1-OE2 2.95Å; N2057-L2692 WeakPolarHBondContact OD1-CD1 3.4Å
2058T59.4Low60.8Low61.6 Ų61.679.9 Ų79.938%0.37846%0.457SS..  trans-72.3112.7-175.6-32.70000111.1G2060T2058-G2060 VanDerWaalsContact C-N 3.31Å; T2058-G2060 PolarHBondContact O-N 3.05Å
2059P44.4Very low57.8Low128.4 Ų128.479.9 Ų79.983%0.83446%0.457SS*.SBendtrans-79.278.7-178.723.9-22000110.6N2057N2057-P2059 VanDerWaalsContact O-CD 3.27Å; N2057-P2059 WeakPolarHBondContact O-CD 3.4Å
2060G37.4Very low54.8Low44 Ų4483.2 Ų83.245%0.45448%0.481SS..SBendtrans134.3133.7-176.900000111T2058 N2062T2058-G2060 VanDerWaalsContact C-N 3.31Å; T2058-G2060 PolarHBondContact O-N 3.05Å; G2060-N2062 VanDerWaalsContact C-N 3.34Å; G2060-N2062 PolarHBondContact O-N 3.12Å
2061G33.4Very low51.7Low77.4 Ų77.487.3 Ų87.380%0.79851%0.51SS*.SBendtrans-7030.6-173.500000115.6H2063G2061-H2063 VanDerWaalsContact C-N 3.31Å; G2061-H2063 PolarHBondContact O-N 3.16Å; G2061-H2063 VanDerWaalsContact O-N 3.08Å
2062N29.7Very low48.5Very low139.2 Ų139.289.4 Ų89.474%0.74453%0.531SS*.  trans-95.768.7177.6-82.62000111G2060 T2064G2060-N2062 VanDerWaalsContact C-N 3.34Å; G2060-N2062 PolarHBondContact O-N 3.12Å; N2062-T2064 HydrophobicContact CB-CG2 4.4Å; N2062-T2064 PolarHBondContact O-N 3.21Å; N2062-T2064 VanDerWaalsContact O-N 3.1Å
2063H37.6Very low45.4Very low114 Ų11485.3 Ų85.353%0.52852%0.524SS..  trans-65.4113.6145.9-71-63000107E2055 G2061 G2065E2055-H2063 IonicContact OE2-CE1 3.39Å; E2055-H2063 PolarHBondContact OE2-CE1 3.3Å; G2061-H2063 VanDerWaalsContact C-N 3.31Å; G2061-H2063 PolarHBondContact O-N 3.16Å; G2061-H2063 VanDerWaalsContact O-N 3.08Å; H2063-G2065 VanDerWaalsContact C-N 3.32Å; H2063-G2065 PolarHBondContact O-N 3.04Å
2064T31Very low42.2Very low131.8 Ų131.886.6 Ų86.681%0.80954%0.542SS*.SBendtrans-66.987.3172.446.40000109N2062N2062-T2064 HydrophobicContact CB-CG2 4.4Å; N2062-T2064 PolarHBondContact O-N 3.21Å; N2062-T2064 VanDerWaalsContact O-N 3.1Å
2065G29.6Very low39.3Very low39 Ų3996.1 Ų96.140%0.40258%0.579SS.*SBendtrans179.779.3-167.500000109.8H2063 T2067H2063-G2065 VanDerWaalsContact C-N 3.32Å; H2063-G2065 PolarHBondContact O-N 3.04Å; G2065-T2067 PolarHBondContact O-N 3.18Å; G2065-T2067 PolarHBondContact O-OG1 3.26Å; G2065-T2067 VanDerWaalsContact O-OG1 3.1Å
2066N25.9Very low36.4Very low121 Ų12195.2 Ų95.265%0.64759%0.587SS**  trans-49.898.7-170.2-80.9-18.2000113.6D1901D1901-N2066 HydrophobicContact CB-CB 4.4Å; D1901-N2066 WeakPolarHBondContact CB-O 3.35Å; D1901-N2066 PolarHBondContact OD2-ND2 2.85Å
2067T33.6Very low33.7Very low83.2 Ų83.299.1 Ų99.151%0.5162%0.619SS.*  trans-126.753.4175.739.60000111.2C2002 G2065 I2069C2002-T2067 HydrophobicContact CB-CG2 4.48Å; G2065-T2067 PolarHBondContact O-N 3.18Å; G2065-T2067 PolarHBondContact O-OG1 3.26Å; G2065-T2067 VanDerWaalsContact O-OG1 3.1Å; T2067-I2069 PolarHBondContact O-N 3.09Å
2068N27Very low31.8Very low135.4 Ų135.4100.5 Ų100.572%0.72463%0.634SS**THydrogen-bonded Turntrans-68.266.2171.3-73.7-17.3000111.7
2069I32.6Very low30.3Very low70.6 Ų70.6105.1 Ų105.136%0.36266%0.655SS.*THydrogen-bonded Turntrans-126.6-12.6178.9-56.6-178.8000111.3S1953 T2067S1953-I2069 WeakPolarHBondContact OG-CG2 3.39Å; T2067-I2069 PolarHBondContact O-N 3.09Å
2070S31.4Very low29.6Very low92.4 Ų92.4105.3 Ų105.365%0.64665%0.653SS**SBendtrans-109.60.6178.2-55.70000114.9
2071S28.8Very low29.2Very low87.8 Ų87.8106.9 Ų106.961%0.61466%0.662SS**SBendtrans-122.726.8-175.852.80000113.2T2073S2071-T2073 VanDerWaalsContact C-N 3.31Å; S2071-T2073 PolarHBondContact O-N 3.2Å
2072A26.2Very low29.1Very low67 Ų67108.9 Ų108.955%0.55466%0.661SS**  trans-124.635-175.500000113.5S2074 Y2075A2072-S2074 VanDerWaalsContact C-N 3.27Å; A2072-S2074 PolarHBondContact O-N 3.21Å; A2072-Y2075 WeakPolarHBondContact O-CD2 3.47Å; A2072-Y2075 WeakPolarHBondContact O-CE2 3.48Å
2073T28.6Very low29.1Very low85.6 Ų85.6110.4 Ų110.453%0.52566%0.663SS.*  trans-116.642.2168.433.90000112.3S2071 Y2075S2071-T2073 VanDerWaalsContact C-N 3.31Å; S2071-T2073 PolarHBondContact O-N 3.2Å; T2073-Y2075 HydrophobicContact CG2-CD2 4.38Å; T2073-Y2075 HydrophobicContact CG2-CE2 3.61Å; T2073-Y2075 WeakPolarHBondContact O-CD2 3.26Å; T2073-Y2075 PolarHBondContact O-N 3.31Å
2074S25.1Very low28.8Very low101 Ų101112.3 Ų112.371%0.70668%0.676SS**  trans-119.382172.139.60000110.4A2072 S2076A2072-S2074 VanDerWaalsContact C-N 3.27Å; A2072-S2074 PolarHBondContact O-N 3.21Å; S2074-S2076 PolarHBondContact O-N 3.12Å
2075Y27.4Very low28.9Very low206.2 Ų206.2111.1 Ų111.181%0.80967%0.673SS**  trans-85.5101.6179.8-73.5-79.4000111.5A2072 T2073 S2077A2072-Y2075 WeakPolarHBondContact O-CD2 3.47Å; A2072-Y2075 WeakPolarHBondContact O-CE2 3.48Å; T2073-Y2075 HydrophobicContact CG2-CD2 4.38Å; T2073-Y2075 HydrophobicContact CG2-CE2 3.61Å; T2073-Y2075 WeakPolarHBondContact O-CD2 3.26Å; T2073-Y2075 PolarHBondContact O-N 3.31Å; Y2075-S2077 PolarHBondContact O-N 3.01Å; Y2075-S2077 PolarHBondContact O-OG 3.36Å; Y2075-S2077 VanDerWaalsContact O-OG 3.06Å
2076S24Very low29.1Very low111.2 Ų111.2116.6 Ų116.678%0.77869%0.693SS**  trans-44.3117.2174.2-590000113.7S2074 S2078S2074-S2076 PolarHBondContact O-N 3.12Å; S2076-S2078 PolarHBondContact O-N 3.14Å
2077S26.2Very low29.7Very low110.6 Ų110.6116 Ų11677%0.77370%0.696SS**  trans-116.881.7166.1-70.90000112.1Y2075 I2079Y2075-S2077 PolarHBondContact O-N 3.01Å; Y2075-S2077 PolarHBondContact O-OG 3.36Å; Y2075-S2077 VanDerWaalsContact O-OG 3.06Å; S2077-I2079 PolarHBondContact O-N 3.23Å
2078S28.4Very low29.6Very low103.2 Ų103.2116.9 Ų116.972%0.72271%0.705SS**  trans-80.6110.5171.167.80000114.4S2076S2076-S2078 PolarHBondContact O-N 3.14Å
2079I28.1Very low29.9Very low158.2 Ų158.2117.6 Ų117.681%0.81171%0.709SS**  trans-13.8128.6143.9-56.1166.6000113.8S2077S2077-I2079 PolarHBondContact O-N 3.23Å
2080V30.4Very low29.9Very low132 Ų132118.8 Ų118.880%0.872%0.724SS**  trans-150135.1134.4-149.40000112.1
2081A27.6Very low29.9Very low78.6 Ų78.6119.9 Ų119.965%0.6573%0.727SS**  trans-98.1150.8164.300000110.3H2083A2081-H2083 PolarHBondContact O-N 3.27Å
2082P31Very low30.2Very low118 Ų118122.3 Ų122.377%0.76674%0.738SS**  trans-111.7133.2153.736.4-29.6000114.7
2083H30.3Very low30.5Very low171 Ų171123 Ų12379%0.79275%0.752SS**  trans-98.7129164.4-72.4-70.5000116A2081A2081-H2083 PolarHBondContact O-N 3.27Å
2084I32.6Very low30.7Very low153.8 Ų153.8123 Ų12379%0.78977%0.768SS**  trans84.3120.3141-66.7165.9000116.1
2085S33.2Very low31Very low108 Ų108122.2 Ų122.276%0.75578%0.777SS**  trans60129.2149.155.90000118.4
2086N31.9Very low31.2Very low153.6 Ų153.6115.9 Ų115.982%0.82177%0.774SS**  trans34.6153.4130.4-114.913.6000115.1
2087P39Very low31.5Very low109.2 Ų109.2116.2 Ų116.271%0.70977%0.771SS**  -131.5171.6100.239.4-25.7000116.3
2088S32.3Very low31.7Very low101.4 Ų101.4120.2 Ų120.271%0.70978%0.775SS**  trans91.6143.6153.269.30000117.8
2089N33.4Very low31.8Very low150.6 Ų150.6121.3 Ų121.381%0.80578%0.778SS**  161.9143.6106.2-112.30.8000116.2
2090S31.9Very low31.9Very low95.4 Ų95.4119.3 Ų119.367%0.66778%0.778SS**  trans90.8149.9143.965.50000117.4
2091T32.5Very low31.8Very low116.4 Ų116.4120.5 Ų120.571%0.71478%0.78SS**  156.413951.2-27.30000115.2
2092T33.4Very low32.1Very low137.2 Ų137.2121 Ų12184%0.84278%0.784SS**  trans71.8129.4141.834.10000120.5
2093G32.8Very low32Very low81.4 Ų81.4122.3 Ų122.384%0.83978%0.784SS**  126.5138.6113.400000116
2094G32.4Very low32.2Very low85 Ų85119.3 Ų119.388%0.87678%0.782SS**  trans136.2131.5-172.100000116
2095G31.8Very low32.1Very low85.4 Ų85.4118.9 Ų118.988%0.8878%0.782SS**  trans110.2154.3-171.300000114.7
2096G32.8Very low32Very low73.2 Ų73.2118.7 Ų118.776%0.75578%0.78SS**  trans135.4103.7163.300000116
2097T29.7Very low31.9Very low117.4 Ų117.4118.3 Ų118.372%0.7278%0.777SS**  trans14.1130.9143.454.70000118.9
2098F30.9Very low31.5Very low195.2 Ų195.2118 Ų11886%0.85678%0.777SS**  178.9152.1112.2-86.2-64.7000116.1
2099T29.1Very low31.4Very low126.6 Ų126.6123.5 Ų123.578%0.77778%0.783SS**  trans-123.2144.4174.552.60000117.7
2100S31.1Very low31.4Very low116 Ų116122.3 Ų122.381%0.81178%0.781SS**  trans-177.9140.6153.3650000113.9
2101N28.8Very low31.3Very low157.4 Ų157.4125.6 Ų125.684%0.84279%0.785SS**  trans-152.5157.3153-146.87.2000113.3
2102A32.9Very low31.2Very low88.6 Ų88.6129.5 Ų129.573%0.73279%0.792SS**  trans-141.1128.5-17800000113.7
2103N30.2Very low31Very low145.8 Ų145.8128.7 Ų128.778%0.7879%0.787SS**  trans-113.3139.6165.5-84.8-22000113
2104S32.6Very low30.9Very low107.4 Ų107.4130 Ų13075%0.75178%0.784SS**  trans-158.1140.2142.531.30000113.7
2105N31.2Very low30.9Very low146.4 Ų146.4130.7 Ų130.778%0.78378%0.775SS**  trans-94.8142.7166.6-77.2-34.4000114.3
2106S30.5Very low30.8Very low102.4 Ų102.4135.5 Ų135.572%0.71678%0.775SS**  trans121.3143.9131.973.90000117
2107I30.6Very low30.7Very low146.6 Ų146.6137.3 Ų137.375%0.75278%0.776SS**  trans97.1122.3157.1-74.7164.7000114.3R2109I2107-R2109 HydrophobicContact CG2-CG 3.98Å
2108S31.3Very low30.6Very low102.2 Ų102.2140.9 Ų140.972%0.71578%0.784SS**  158.5140.4126-80.40000116.5
2109R29.4Very low30.6Very low217.2 Ų217.2135.9 Ų135.982%0.8278%0.779SS**  trans105.8135.3157.9-59.5175.1-172.1-178.3-0.2115.6I2107I2107-R2109 HydrophobicContact CG2-CG 3.98Å
2110T32.8Very low30.6Very low125.8 Ų125.8137.5 Ų137.577%0.77278%0.778SS**  -164.3139.196.632.30000114.1
2111H30.5Very low30.5Very low163.6 Ų163.6138.1 Ų138.176%0.75777%0.771SS**  trans40.6135.1164-67.5-82.7000117.2T2113H2111-T2113 HydrophobicContact CB-CG2 4.19Å; H2111-T2113 WeakPolarHBondContact ND1-CG2 3.49Å
2112K29.7Very low30.6Very low198 Ų198138.1 Ų138.186%0.86177%0.766SS**  -169.7142.4116.1-141.8176.2-179.3-1800113.5
2113T30Very low30.5Very low121 Ų121140.8 Ų140.874%0.74277%0.767SS**  trans-134.8148.5156.442.40000114.5H2111H2111-T2113 HydrophobicContact CB-CG2 4.19Å; H2111-T2113 WeakPolarHBondContact ND1-CG2 3.49Å
2114S31Very low30.5Very low109.6 Ų109.6139.8 Ų139.877%0.76676%0.762SS**  trans-140137.7141.448.50000111.1
2115S31.9Very low30.4Very low99 Ų99141.8 Ų141.869%0.69277%0.765SS**  14413297.359.90000111.8
2116E29.1Very low30.5Very low186.8 Ų186.8139 Ų13987%0.87376%0.762SS**  -106.7143.3120.7-78.1149.4160.500112.4
2117S31.2Very low30.5Very low111 Ų111141 Ų14178%0.77677%0.77SS**  trans-165.1150.9135.2320000111.4
2118E27.1Very low30.6Very low192.2 Ų192.2137.6 Ų137.690%0.89877%0.771SS**  trans-91.8143.1170.8-61.9177.4100.100114.6
2119A31.2Very low30.5Very low90.6 Ų90.6140.4 Ų140.475%0.74978%0.778SS**  113.3128.2126.700000115.5
2120Q28.6Very low30.7Very low159.2 Ų159.2135.2 Ų135.274%0.74478%0.775SS**  79.4119.896.9-148.870.9-15.500117.7
2121L30.4Very low30.7Very low129.4 Ų129.4134.8 Ų134.868%0.67778%0.777SS**  trans76.3138.1132.3-62.2175.6000117.1K2377L2121-K2377 HydrophobicContact CB-CD 4.22Å; L2121-K2377 HydrophobicContact CD1-CD 4.32Å; L2121-K2377 PolarHBondContact O-NZ 3.06Å
2122Q29.9Very low30.7Very low156.4 Ų156.4130.5 Ų130.573%0.73178%0.777SS**  -161.9150.3112.8-126.3149.7300114
2123L31.6Very low30.8Very low145.4 Ų145.4128.3 Ų128.376%0.76178%0.78SS**  trans-138.2142.8146-131.567.7000109.3
2124D29.5Very low30.8Very low126.2 Ų126.2125.7 Ų125.768%0.67578%0.777SS**  86.3133.8122-83.5-41.4000117.4
2125N30Very low31Very low148.6 Ų148.6125.8 Ų125.880%0.79578%0.777SS**  trans83.2119.1143.6-102.6-37.1000116.9
2126A33.4Very low31.1Very low87.2 Ų87.2128.2 Ų128.272%0.72178%0.783SS**  trans161.613513700000117.9
2127T31Very low31.4Very low144.6 Ų144.6123.6 Ų123.689%0.88777%0.772SS**  trans4.7143.6142.416.40000117.6
2128G33.2Very low31.6Very low75 Ų75124.7 Ų124.777%0.77377%0.768SS**  trans153.5100.3161.100000116.6
2129N29.8Very low31.7Very low160.8 Ų160.8125.7 Ų125.786%0.8676%0.764SS**  trans-31.1138.8152.7-83.84.1000115.4
2130S32.8Very low31.9Very low108.6 Ų108.6128.7 Ų128.776%0.75977%0.767SS**  146.9151.1117.663.50000116
2131S32.1Very low32.2Very low117.8 Ų117.8127.9 Ų127.982%0.82477%0.768SS**  trans129139.3137.91.40000117
2132G31.7Very low32.7Very low73.2 Ų73.2127.6 Ų127.676%0.75577%0.773SS**  trans113.6122.9163.300000114.8
2133V31.5Very low32.9Very low151.2 Ų151.2123.7 Ų123.792%0.91678%0.776SS**  cis-141.2131.439.6-1770000110.7
2134G30.2Very low33Very low66 Ų66120.8 Ų120.868%0.6878%0.781SS**  trans-165.1150.117000000115.3
2135S35.2Very low33.2Very low111.6 Ų111.6118.5 Ų118.578%0.7879%0.786SS**  trans-165.6157.1159.6-59.40000115.8
2136N32.8Very low33.3Very low150.4 Ų150.4118.9 Ų118.980%0.80479%0.788SS**  trans81.5143.6147.3-72.8-22.4000116.7
2137S35.8Very low33.3Very low91.2 Ų91.2120.6 Ų120.664%0.63879%0.79SS**  154.9150.860.7-82.10000113.8
2138N35Very low33.3Very low132.6 Ų132.6118.7 Ų118.771%0.70978%0.782SS**  trans89.7137.6143.4-61.3-55.9000115.5
2139R31Very low33.3Very low213.6 Ų213.6122.8 Ų122.881%0.80679%0.785SS**  cis143.1151.422.9-95.7179.1-170.9-116.72109.5
2140L34.2Very low33.5Very low154.6 Ų154.6120.3 Ų120.381%0.80978%0.78SS**  cis-172.4158.340.9-100.2157.3000112.1
2141N34.6Very low33.6Very low142.4 Ų142.4119 Ų11976%0.76178%0.784SS**  trans-131.1165.2163.4-145.615.7000111.3G2143N2141-G2143 PolarHBondContact OD1-N 3.41Å
2142P40.5Very low33.5Very low121.2 Ų121.2117.6 Ų117.679%0.78779%0.787SS**  -137.6174.150.938.5-20.7000115.1
2143G34.1Very low33.5Very low76.2 Ų76.2118.1 Ų118.179%0.78679%0.793SS**  130.7138.1128.200000116.3N2141N2141-G2143 PolarHBondContact OD1-N 3.41Å
2144G34.2Very low33.5Very low84.8 Ų84.8114.4 Ų114.487%0.87479%0.785SS**  trans155.8133.8149.800000118.3
2145G33.5Very low33.5Very low76.2 Ų76.2116.8 Ų116.879%0.78679%0.792SS**  trans104.3151.8167.600000116.3
2146N32.2Very low33.2Very low157 Ų157119.2 Ų119.284%0.8480%0.796SS**  cis-130151.8-34.9-113.9-0000112.7
2147V33Very low33.1Very low123.8 Ų123.8116.1 Ų116.175%0.7579%0.791SS**  trans99.1122.5142.7170.40000116.5
2148S32.5Very low32.8Very low104.8 Ų104.8117.7 Ų117.773%0.73380%0.797SS**  trans107143.4148.430.20000116.7
2149I33Very low32.4Very low160.8 Ų160.8118.4 Ų118.483%0.82580%0.801SS**  trans-158.1130.9160.7-75.8176000114.7
2150S34.6Very low32.3Very low109 Ų109114.4 Ų114.476%0.76280%0.8SS**  trans-85.5147.8162.456.30000116.3
2151G33.1Very low31.9Very low80.6 Ų80.6112.2 Ų112.283%0.83180%0.798SS**  107.1138.5123.700000114.3
2152G30.8Very low31.6Very low87.4 Ų87.4109.2 Ų109.290%0.90179%0.793SS**  trans119.3129.417300000114.9
2153G32Very low30.9Very low84.6 Ų84.6108.7 Ų108.787%0.87279%0.793SS**  trans159.7139-176.500000112.1
2154G30.2Very low30.6Very low73.2 Ų73.2114.2 Ų114.276%0.75579%0.791SS**  trans-179.2148172.500000115.7
2155S32Very low30.2Very low117.6 Ų117.6118.4 Ų118.482%0.82279%0.788SS**  trans85.3129.1159-48.40000119.1
2156N28.9Very low29.9Very low161.2 Ų161.2123.8 Ų123.886%0.86279%0.79SS**  trans27.6128.6159.6-59.5-23000117.6
2157A30.8Very low29.6Very low86.2 Ų86.2120.2 Ų120.271%0.71278%0.782SS**  179124.2124.500000113.1
2158T28.7Very low29.4Very low123.4 Ų123.4119.9 Ų119.976%0.75778%0.783SS**  62.1123.3119.560.10000119.8
2159N26.5Very low29.3Very low148 Ų148120.2 Ų120.279%0.79179%0.785SS**  trans60.6118.4149-59.6-4.4000120.8
2160T28.9Very low29Very low128.8 Ų128.8117.7 Ų117.779%0.7978%0.782SS**  trans157.3132.1135.237.80000115.1Y2164T2160-Y2164 PolarHBondContact O-OH 3Å
2161S25.4Very low28.7Very low108.2 Ų108.2120.4 Ų120.476%0.75779%0.787SS**  trans-48.1122.6164.6-53.80000113.9S2163 D2799S2161-S2163 PolarHBondContact O-N 3.42Å; S2161-D2799 WeakPolarHBondContact CB-OD2 3.43Å; S2161-D2799 PolarHBondContact OG-OD2 3.1Å
2162A28.2Very low28.6Very low80.8 Ų80.8124.7 Ų124.767%0.66879%0.79SS**  trans-111.9120.9172.500000113.1Y2164A2162-Y2164 HydrophobicContact CB-CD1 4.16Å; A2162-Y2164 HydrophobicContact CB-CD2 4.2Å; A2162-Y2164 HydrophobicContact CB-CE1 3.69Å; A2162-Y2164 HydrophobicContact CB-CE2 3.78Å; A2162-Y2164 HydrophobicContact CB-CG 4.38Å; A2162-Y2164 VanDerWaalsContact CB-CZ 3.42Å; A2162-Y2164 PolarHBondContact O-N 3.18Å
2163S25.9Very low28.5Very low110.8 Ų110.8124.3 Ų124.378%0.77579%0.785SS**  trans-71.4125.3166.5-54.70000110.5S2161 Q2165S2161-S2163 PolarHBondContact O-N 3.42Å; S2163-Q2165 VanDerWaalsContact C-N 3.32Å; S2163-Q2165 PolarHBondContact O-N 2.93Å
2164Y28.4Very low28.3Very low191.6 Ų191.6124.4 Ų124.475%0.75179%0.786SS**  trans-108.7112.8162.4-75.3-75.5000110.2T2160 A2162 F2166T2160-Y2164 PolarHBondContact O-OH 3Å; A2162-Y2164 HydrophobicContact CB-CD1 4.16Å; A2162-Y2164 HydrophobicContact CB-CD2 4.2Å; A2162-Y2164 HydrophobicContact CB-CE1 3.69Å; A2162-Y2164 HydrophobicContact CB-CE2 3.78Å; A2162-Y2164 HydrophobicContact CB-CG 4.38Å; A2162-Y2164 VanDerWaalsContact CB-CZ 3.42Å; A2162-Y2164 PolarHBondContact O-N 3.18Å; Y2164-F2166 VanDerWaalsContact CB-CD2 3.46Å; Y2164-F2166 VanDerWaalsContact CB-CE2 3.49Å; Y2164-F2166 HydrophobicContact CD1-CD2 4.31Å; Y2164-F2166 AromaticContact CD1-CE2 3.65Å; Y2164-F2166 HydrophobicContact CD1-CE2 3.92Å; Y2164-F2166 HydrophobicContact CD1-CZ 4.33Å; Y2164-F2166 HydrophobicContact CD2-CE2 4.09Å; Y2164-F2166 HydrophobicContact CE1-CE2 4.32Å; Y2164-F2166 HydrophobicContact CG-CD2 4.17Å; Y2164-F2166 AromaticContact CG-CE2 3.69Å; Y2164-F2166 HydrophobicContact CG-CE2 3.69Å; Y2164-F2166 HydrophobicContact CG-CZ 4.2Å
2165Q26.1Very low28.2Very low172.2 Ų172.2124.8 Ų124.881%0.80579%0.79SS**  trans-71.2116.4153.7-67.1-176.3-18.100109.9S2163S2163-Q2165 VanDerWaalsContact C-N 3.32Å; S2163-Q2165 PolarHBondContact O-N 2.93Å
2166F27.7Very low28Very low189.4 Ų189.4123.5 Ų123.583%0.83180%0.796SS**  trans-114.9110160.9-93.3-78.3000110.1Y2164Y2164-F2166 VanDerWaalsContact CB-CD2 3.46Å; Y2164-F2166 VanDerWaalsContact CB-CE2 3.49Å; Y2164-F2166 HydrophobicContact CD1-CD2 4.31Å; Y2164-F2166 AromaticContact CD1-CE2 3.65Å; Y2164-F2166 HydrophobicContact CD1-CE2 3.92Å; Y2164-F2166 HydrophobicContact CD1-CZ 4.33Å; Y2164-F2166 HydrophobicContact CD2-CE2 4.09Å; Y2164-F2166 HydrophobicContact CE1-CE2 4.32Å; Y2164-F2166 HydrophobicContact CG-CD2 4.17Å; Y2164-F2166 AromaticContact CG-CE2 3.69Å; Y2164-F2166 HydrophobicContact CG-CE2 3.69Å; Y2164-F2166 HydrophobicContact CG-CZ 4.2Å
2167A25.6Very low27.9Very low81.2 Ų81.2119.1 Ų119.167%0.67179%0.788SS**  trans-108.9130.9159.300000108.3S2169A2167-S2169 PolarHBondContact O-N 3.36Å; A2167-S2169 PolarHBondContact O-OG 3.14Å
2168P28.8Very low27.6Very low118 Ų118122.7 Ų122.777%0.76680%0.796SS**  trans-91.1134.9159.727-21.4000110.9
2169S29.3Very low27.6Very low111.8 Ų111.8122.8 Ų122.878%0.78280%0.796SS**  trans85.2112131.7-56.50000114.7A2167A2167-S2169 PolarHBondContact O-N 3.36Å; A2167-S2169 PolarHBondContact O-OG 3.14Å
2170S26.3Very low27.6Very low107.6 Ų107.6123 Ų12375%0.75280%0.798SS**  trans-82.4133.4154.757.40000113.8D2221S2170-D2221 WeakPolarHBondContact CB-OD1 3.41Å; S2170-D2221 PolarHBondContact OG-OD1 2.91Å
2171L29.6Very low27.5Very low166.6 Ų166.6124.4 Ų124.487%0.87280%0.799SS**  trans-160.6136.1156-104.1158000109.3
2172L29.7Very low27.5Very low171 Ų171127.4 Ų127.490%0.89581%0.806SS**  trans-95138.5167.3-75.2115.8000112.8
2173G28.8Very low27.4Very low78.2 Ų78.2128.7 Ų128.781%0.80681%0.81SS**  trans148.8112.6167.200000114.3
2174G28.6Very low27.3Very low86 Ų86128.1 Ų128.189%0.88781%0.806SS**  trans-172.2146.4-145.600000115.3
2175G28.8Very low27.4Very low82 Ų82124.5 Ų124.585%0.84581%0.806SS**  trans132.5110.4171.300000113.8
2176G26.2Very low27.4Very low90.2 Ų90.2120.8 Ų120.893%0.9380%0.799SS**  trans-91.3133.9173.400000115.3
2177G27.6Very low27.6Very low69 Ų69118.4 Ų118.471%0.71180%0.795SS**  trans-177.1100.3169.600000113.6T2179G2177-T2179 PolarHBondContact O-N 2.84Å; G2177-T2179 VanDerWaalsContact O-N 3.08Å
2178N25.1Very low27.8Very low162 Ų162118.6 Ų118.687%0.86680%0.797SS**  trans-71.5121.4176.9-70.2-9.8000113.6
2179T28.4Very low28.2Very low125 Ų125120.5 Ų120.577%0.76780%0.799SS**  trans-155.6110.7156.846.60000113.2G2177 L2181G2177-T2179 PolarHBondContact O-N 2.84Å; G2177-T2179 VanDerWaalsContact O-N 3.08Å; T2179-L2181 PolarHBondContact O-N 2.96Å
2180N25.7Very low29.1Very low153.6 Ų153.6116.9 Ų116.982%0.82178%0.779SS**  trans9107.8157.5-61.7-21.9000117.6L2182N2180-L2182 PolarHBondContact O-N 2.99Å
2181L27.1Very low31.1Very low157.8 Ų157.8113.7 Ų113.783%0.82676%0.764SS**  trans-166.174.8164.3-67.1173.4000115.7T2179T2179-L2181 PolarHBondContact O-N 2.96Å
2182L26Very low33.5Very low170.4 Ų170.4107.9 Ų107.989%0.89274%0.735SS**  trans171.1119.1148.7-87.9108.7000114.3N2180N2180-L2182 PolarHBondContact O-N 2.99Å
2183S25.7Very low36Very low107.4 Ų107.4104.9 Ų104.975%0.75171%0.712SS**  trans-119.4128.4175.76.80000112.6
2184S24.3Very low38.7Very low98.6 Ų98.6102.2 Ų102.269%0.6968%0.684SS**  trans-55.2127.8170.9-560000115.3S2186S2184-S2186 VanDerWaalsContact C-N 3.32Å; S2184-S2186 WeakPolarHBondContact CB-OG 3.44Å; S2184-S2186 PolarHBondContact O-N 3.09Å; S2184-S2186 VanDerWaalsContact O-N 3.11Å
2185P29.6Very low41.4Very low116.2 Ų116.299.5 Ų99.576%0.75565%0.649SS**  trans-82.754.817535.2-35.7000112.7N2187P2185-N2187 PolarHBondContact O-N 3.05Å
2186S27.3Very low44.3Very low95.6 Ų95.695.7 Ų95.767%0.66961%0.609SS**  trans-82.676.5170.860.90000111.7S2184S2184-S2186 VanDerWaalsContact C-N 3.32Å; S2184-S2186 WeakPolarHBondContact CB-OG 3.44Å; S2184-S2186 PolarHBondContact O-N 3.09Å; S2184-S2186 VanDerWaalsContact O-N 3.11Å
2187N30.7Very low47.3Very low139 Ų13994 Ų9474%0.74358%0.577SS**SBendtrans152.3124.1167-85.5-37.7000112.6P2185 I2189P2185-N2187 PolarHBondContact O-N 3.05Å; N2187-I2189 VanDerWaalsContact C-N 3.34Å; N2187-I2189 HydrophobicContact CB-CD1 3.76Å; N2187-I2189 HydrophobicContact CB-CG1 3.77Å; N2187-I2189 PolarHBondContact O-N 3.19Å
2188A31.3Very low50.2Low85.2 Ų85.293.1 Ų93.170%0.70455%0.552SS**  trans-60.570.9164.500000114G2190 G2191 M2195A2188-G2190 PolarHBondContact O-N 3.16Å; A2188-G2191 PolarHBondContact O-N 3.09Å; A2188-G2191 VanDerWaalsContact O-N 3.1Å; A2188-M2195 HydrophobicContact CB-CE 4.28Å
2189I36.3Very low53.4Low157 Ų15785.4 Ų85.481%0.80551%0.511SS*.THydrogen-bonded Turntrans-7552.5176.2-62.9173000110.6N2187N2187-I2189 VanDerWaalsContact C-N 3.34Å; N2187-I2189 HydrophobicContact CB-CD1 3.76Å; N2187-I2189 HydrophobicContact CB-CG1 3.77Å; N2187-I2189 PolarHBondContact O-N 3.19Å
2190G47.2Very low56.4Low36.6 Ų36.680.6 Ų80.638%0.37748%0.481SS..THydrogen-bonded Turntrans-165.97176.900000116A2188 T2192 R2193 G2194A2188-G2190 PolarHBondContact O-N 3.16Å; G2190-T2192 PolarHBondContact O-N 2.91Å; G2190-R2193 VanDerWaalsContact O-CB 3.27Å; G2190-R2193 WeakPolarHBondContact O-CB 3.36Å; G2190-R2193 PolarHBondContact O-N 2.87Å; G2190-R2193 VanDerWaalsContact O-N 3.13Å; G2190-G2194 PolarHBondContact O-N 3.14Å; G2190-G2194 VanDerWaalsContact O-N 3.14Å
2191G68.4Low59.5Low40.8 Ų40.876 Ų7642%0.42145%0.454SS..Hα-helixtrans42.9-140.7-177.700000113.6A2188 R2193 G2194 M2195A2188-G2191 PolarHBondContact O-N 3.09Å; A2188-G2191 VanDerWaalsContact O-N 3.1Å; G2191-R2193 VanDerWaalsContact C-N 3.31Å; G2191-R2193 PolarHBondContact O-N 2.82Å; G2191-G2194 PolarHBondContact O-N 3.22Å; G2191-M2195 PolarHBondContact O-N 3.02Å; G2191-M2195 VanDerWaalsContact O-N 3.11Å
2192T80Confident62.6Low45 Ų4568.4 Ų68.428%0.27642%0.415SS..Hα-helixtrans-61.5-35.1174.129.80000112.6L2005 L2009 Y2056 G2190 G2194 M2195 I2196L2005-T2192 HydrophobicContact CD2-CG2 4.26Å; L2009-T2192 HydrophobicContact CD1-CG2 4.05Å; Y2056-T2192 PolarHBondContact O-OG1 2.77Å; G2190-T2192 PolarHBondContact O-N 2.91Å; T2192-G2194 PolarHBondContact O-N 2.86Å; T2192-M2195 WeakPolarHBondContact O-CB 3.39Å; T2192-M2195 PolarHBondContact O-N 2.94Å; T2192-M2195 VanDerWaalsContact O-N 3.15Å; T2192-I2196 HydrophobicContact CG2-CD1 4.2Å; T2192-I2196 WeakPolarHBondContact O-CG1 3.43Å; T2192-I2196 PolarHBondContact O-N 3.16Å; T2192-I2196 VanDerWaalsContact O-N 3.11Å
2193R84Confident65.8Low106.4 Ų106.460.7 Ų60.740%0.40237%0.374SS..Hα-helixtrans-56.7-53.6176.5-173.9-171.8150.4164.70.6111.9Y2056 G2190 G2191 M2195 I2196 E2197 L2692Y2056-R2193 WeakPolarHBondContact O-CA 3.43Å; Y2056-R2193 VanDerWaalsContact O-CB 3.31Å; Y2056-R2193 WeakPolarHBondContact O-CB 3.36Å; Y2056-R2193 WeakPolarHBondContact O-CG 3.11Å; Y2056-R2193 PolarHBondContact O-N 3.03Å; G2190-R2193 VanDerWaalsContact O-CB 3.27Å; G2190-R2193 WeakPolarHBondContact O-CB 3.36Å; G2190-R2193 PolarHBondContact O-N 2.87Å; G2190-R2193 VanDerWaalsContact O-N 3.13Å; G2191-R2193 VanDerWaalsContact C-N 3.31Å; G2191-R2193 PolarHBondContact O-N 2.82Å; R2193-M2195 VanDerWaalsContact C-N 3.34Å; R2193-M2195 PolarHBondContact O-N 3.09Å; R2193-I2196 WeakPolarHBondContact O-CB 3.27Å; R2193-I2196 PolarHBondContact O-N 3.35Å; R2193-I2196 VanDerWaalsContact O-N 3.09Å; R2193-E2197 HydrophobicContact CG-CG 4.48Å; R2193-E2197 IonicContact CZ-OE1 3.11Å; R2193-E2197 VanDerWaalsContact CZ-OE1 3.22Å; R2193-E2197 VanDerWaalsContact NE-CD 3.35Å; R2193-E2197 IonicContact NE-OE1 3.27Å; R2193-E2197 PolarHBondContact NE-OE1 3.19Å; R2193-E2197 IonicContact NE-OE2 3.47Å; R2193-E2197 PolarHBondContact NE-OE2 2.9Å; R2193-E2197 IonicContact NH2-OE1 2.91Å; R2193-E2197 PolarHBondContact NH2-OE1 2.96Å; R2193-E2197 WeakPolarHBondContact O-CG 3.35Å; R2193-E2197 PolarHBondContact O-N 3.13Å; R2193-L2692 HydrophobicContact CG-CD1 3.85Å; R2193-L2692 HydrophobicContact CG-CD2 4.38Å
2194G83.8Confident69Low22.4 Ų22.456.5 Ų56.523%0.23134%0.344CS..Hα-helixtrans-63.6-30.3-179.400000113G2190 G2191 T2192 I2196 E2197 Y2198G2190-G2194 PolarHBondContact O-N 3.14Å; G2190-G2194 VanDerWaalsContact O-N 3.14Å; G2191-G2194 PolarHBondContact O-N 3.22Å; T2192-G2194 PolarHBondContact O-N 2.86Å; G2194-I2196 VanDerWaalsContact C-N 3.35Å; G2194-E2197 WeakPolarHBondContact CA-OE2 3.32Å; G2194-E2197 PolarHBondContact O-N 3.18Å; G2194-Y2198 WeakPolarHBondContact O-CB 3.34Å; G2194-Y2198 PolarHBondContact O-N 3.12Å; G2194-Y2198 VanDerWaalsContact O-N 3.1Å
2195M86.2Confident72.1Confident30.2 Ų30.253.3 Ų53.315%0.14932%0.319CS..Hα-helixtrans-66.4-41.4171.3-67.9-179.8167.100112L2009 V2010 Q2013 A2188 G2191 T2192 R2193 Y2198 L2199L2009-M2195 HydrophobicContact CB-CB 4.32Å; L2009-M2195 HydrophobicContact CB-SD 3.98Å; L2009-M2195 HydrophobicContact CD1-CB 4.36Å; L2009-M2195 HydrophobicContact CD1-SD 4.33Å; V2010-M2195 HydrophobicContact CG2-CE 3.53Å; V2010-M2195 VanDerWaalsContact CG2-CE 3.47Å; V2010-M2195 HydrophobicContact CG2-SD 4.1Å; Q2013-M2195 PolarHBondContact NE2-O 3.05Å; Q2013-M2195 VanDerWaalsContact NE2-O 3.08Å; A2188-M2195 HydrophobicContact CB-CE 4.28Å; G2191-M2195 PolarHBondContact O-N 3.02Å; G2191-M2195 VanDerWaalsContact O-N 3.11Å; T2192-M2195 WeakPolarHBondContact O-CB 3.39Å; T2192-M2195 PolarHBondContact O-N 2.94Å; T2192-M2195 VanDerWaalsContact O-N 3.15Å; R2193-M2195 VanDerWaalsContact C-N 3.34Å; R2193-M2195 PolarHBondContact O-N 3.09Å; M2195-Y2198 WeakPolarHBondContact O-CB 3.26Å; M2195-Y2198 PolarHBondContact O-N 2.78Å; M2195-L2199 WeakPolarHBondContact O-CD1 3.42Å; M2195-L2199 VanDerWaalsContact O-CG 3.24Å; M2195-L2199 WeakPolarHBondContact O-CG 3.36Å; M2195-L2199 PolarHBondContact O-N 3.27Å; M2195-L2199 VanDerWaalsContact O-N 3.08Å
2196I89.7Confident75Confident1.4 Ų1.448.2 Ų48.21%0.00729%0.285CS..Hα-helixtrans-69.5-42.4177.4-67.9-107.2000111.4L2009 L2047 I2050 L2051 Y2056 T2192 R2193 G2194 Y2198 L2199 I2200 F2685L2009-I2196 HydrophobicContact CD1-CD1 4.3Å; L2009-I2196 HydrophobicContact CD1-CG1 4.37Å; L2009-I2196 HydrophobicContact CD2-CD1 3.8Å; L2009-I2196 HydrophobicContact CD2-CG1 4.03Å; L2047-I2196 HydrophobicContact CD1-CD1 4.38Å; I2050-I2196 HydrophobicContact CG2-CD1 3.74Å; I2050-I2196 HydrophobicContact CG2-CG1 4.43Å; L2051-I2196 HydrophobicContact CD2-CD1 4.5Å; L2051-I2196 HydrophobicContact CD2-CG2 3.7Å; Y2056-I2196 HydrophobicContact CD1-CD1 4.39Å; Y2056-I2196 HydrophobicContact CD1-CG1 4.28Å; Y2056-I2196 HydrophobicContact CD2-CB 4.28Å; Y2056-I2196 HydrophobicContact CD2-CG1 4.08Å; Y2056-I2196 HydrophobicContact CD2-CG2 4.17Å; Y2056-I2196 HydrophobicContact CE2-CG2 4.06Å; Y2056-I2196 HydrophobicContact CG-CB 4.49Å; Y2056-I2196 HydrophobicContact CG-CD1 3.98Å; Y2056-I2196 HydrophobicContact CG-CG1 3.81Å; Y2056-I2196 HydrophobicContact CG-CG2 4.33Å; T2192-I2196 HydrophobicContact CG2-CD1 4.2Å; T2192-I2196 WeakPolarHBondContact O-CG1 3.43Å; T2192-I2196 PolarHBondContact O-N 3.16Å; T2192-I2196 VanDerWaalsContact O-N 3.11Å; R2193-I2196 WeakPolarHBondContact O-CB 3.27Å; R2193-I2196 PolarHBondContact O-N 3.35Å; R2193-I2196 VanDerWaalsContact O-N 3.09Å; G2194-I2196 VanDerWaalsContact C-N 3.35Å; I2196-Y2198 VanDerWaalsContact C-N 3.31Å; I2196-Y2198 PolarHBondContact O-N 3.13Å; I2196-L2199 PolarHBondContact O-N 3.13Å; I2196-L2199 VanDerWaalsContact O-N 3.1Å; I2196-I2200 HydrophobicContact CG2-CD1 3.94Å; I2196-I2200 HydrophobicContact CG2-CG1 4.32Å; I2196-I2200 VanDerWaalsContact O-CG1 3.28Å; I2196-I2200 WeakPolarHBondContact O-CG1 3.42Å; I2196-I2200 PolarHBondContact O-N 3.12Å; I2196-F2685 HydrophobicContact CG2-CD2 4.19Å; I2196-F2685 HydrophobicContact CG2-CE2 3.92Å
2197E88.5Confident78Confident54.8 Ų54.844.8 Ų44.826%0.25626%0.26SS..Hα-helixtrans-58-42.5174.9-72.1168.8151.800111.4R2193 G2194 L2199 I2200 Q2201 Y2696R2193-E2197 HydrophobicContact CG-CG 4.48Å; R2193-E2197 IonicContact CZ-OE1 3.11Å; R2193-E2197 VanDerWaalsContact CZ-OE1 3.22Å; R2193-E2197 VanDerWaalsContact NE-CD 3.35Å; R2193-E2197 IonicContact NE-OE1 3.27Å; R2193-E2197 PolarHBondContact NE-OE1 3.19Å; R2193-E2197 IonicContact NE-OE2 3.47Å; R2193-E2197 PolarHBondContact NE-OE2 2.9Å; R2193-E2197 IonicContact NH2-OE1 2.91Å; R2193-E2197 PolarHBondContact NH2-OE1 2.96Å; R2193-E2197 WeakPolarHBondContact O-CG 3.35Å; R2193-E2197 PolarHBondContact O-N 3.13Å; G2194-E2197 WeakPolarHBondContact CA-OE2 3.32Å; G2194-E2197 PolarHBondContact O-N 3.18Å; E2197-L2199 PolarHBondContact O-N 2.77Å; E2197-I2200 PolarHBondContact O-N 3.01Å; E2197-Q2201 PolarHBondContact O-N 3.17Å; E2197-Q2201 VanDerWaalsContact O-N 3.09Å; E2197-Y2696 HydrophobicContact CG-CE2 4.46Å
2198Y88.4Confident80.8Confident49 Ų4941.6 Ų41.619%0.19224%0.243CC..Hα-helixtrans-62.8-41.4173.5-172.2-79.2000112.9Q2013 Q2026 P2028 F2030 G2194 M2195 I2196 Q2201 I2202Q2013-Y2198 HydrophobicContact CB-CD1 4.22Å; Q2013-Y2198 HydrophobicContact CB-CE1 4.01Å; Q2013-Y2198 HydrophobicContact CG-CD1 3.74Å; Q2013-Y2198 HydrophobicContact CG-CE1 3.96Å; Q2026-Y2198 PolarHBondContact O-OH 3.15Å; P2028-Y2198 HydrophobicContact CB-CD1 4.13Å; P2028-Y2198 HydrophobicContact CB-CD2 3.89Å; P2028-Y2198 HydrophobicContact CB-CE1 4.07Å; P2028-Y2198 HydrophobicContact CB-CE2 3.81Å; P2028-Y2198 HydrophobicContact CB-CG 4.05Å; P2028-Y2198 VanDerWaalsContact CD-CE2 3.45Å; P2028-Y2198 HydrophobicContact CG-CD2 3.66Å; P2028-Y2198 HydrophobicContact CG-CE2 3.85Å; P2028-Y2198 HydrophobicContact CG-CG 4.1Å; F2030-Y2198 WeakPolarHBondContact CE1-OH 3.35Å; F2030-Y2198 AromaticContact CZ-CE1 3.96Å; F2030-Y2198 HydrophobicContact CZ-CE1 4.07Å; F2030-Y2198 WeakPolarHBondContact CZ-OH 3.32Å; G2194-Y2198 WeakPolarHBondContact O-CB 3.34Å; G2194-Y2198 PolarHBondContact O-N 3.12Å; G2194-Y2198 VanDerWaalsContact O-N 3.1Å; M2195-Y2198 WeakPolarHBondContact O-CB 3.26Å; M2195-Y2198 PolarHBondContact O-N 2.78Å; I2196-Y2198 VanDerWaalsContact C-N 3.31Å; I2196-Y2198 PolarHBondContact O-N 3.13Å; Y2198-Q2201 PolarHBondContact O-N 3.01Å; Y2198-I2202 HydrophobicContact CD1-CD1 3.8Å; Y2198-I2202 HydrophobicContact CE1-CD1 3.66Å; Y2198-I2202 HydrophobicContact CE1-CG1 4.48Å; Y2198-I2202 WeakPolarHBondContact O-CG1 3.43Å; Y2198-I2202 PolarHBondContact O-N 3.19Å
2199L92Very high83.3Confident0 Ų038.8 Ų38.80%022%0.217CC..Hα-helixtrans-68.4-38.5177.5-68.9169.1000112.1L2009 L2012 Q2013 W2043 L2047 M2195 I2196 E2197 Q2201 I2202 V2203L2009-L2199 HydrophobicContact CD2-CD1 3.54Å; L2009-L2199 VanDerWaalsContact CD2-CD1 3.49Å; L2012-L2199 HydrophobicContact CB-CD1 4.25Å; L2012-L2199 HydrophobicContact CB-CD2 3.71Å; L2012-L2199 HydrophobicContact CD1-CD1 4.33Å; Q2013-L2199 HydrophobicContact CB-CD2 4.39Å; Q2013-L2199 HydrophobicContact CG-CD1 4.45Å; Q2013-L2199 HydrophobicContact CG-CD2 3.79Å; Q2013-L2199 HydrophobicContact CG-CG 4.01Å; W2043-L2199 HydrophobicContact CH2-CB 4.33Å; W2043-L2199 HydrophobicContact CH2-CD2 3.96Å; W2043-L2199 HydrophobicContact CZ2-CD2 3.47Å; W2043-L2199 VanDerWaalsContact CZ2-CD2 3.46Å; L2047-L2199 HydrophobicContact CD1-CB 4.06Å; L2047-L2199 HydrophobicContact CD1-CD1 4.16Å; L2047-L2199 HydrophobicContact CD2-CB 4.33Å; M2195-L2199 WeakPolarHBondContact O-CD1 3.42Å; M2195-L2199 VanDerWaalsContact O-CG 3.24Å; M2195-L2199 WeakPolarHBondContact O-CG 3.36Å; M2195-L2199 PolarHBondContact O-N 3.27Å; M2195-L2199 VanDerWaalsContact O-N 3.08Å; I2196-L2199 PolarHBondContact O-N 3.13Å; I2196-L2199 VanDerWaalsContact O-N 3.1Å; E2197-L2199 PolarHBondContact O-N 2.77Å; L2199-Q2201 VanDerWaalsContact C-N 3.34Å; L2199-Q2201 PolarHBondContact O-N 2.88Å; L2199-I2202 HydrophobicContact CD2-CD1 4.47Å; L2199-I2202 PolarHBondContact O-N 3.02Å; L2199-V2203 PolarHBondContact O-N 3.16Å; L2199-V2203 VanDerWaalsContact O-N 3.15Å
2200I92.2Very high85.4Confident24.8 Ų24.833.8 Ų33.813%0.12719%0.191CC..Hα-helixtrans-62.4-41.2173.4-68.8-109000110.6L2051 I2196 E2197 I2202 V2203 L2204 L2682 F2685 M2700L2051-I2200 HydrophobicContact CD1-CD1 3.92Å; L2051-I2200 HydrophobicContact CD1-CG1 4.43Å; L2051-I2200 HydrophobicContact CD2-CD1 4.27Å; I2196-I2200 HydrophobicContact CG2-CD1 3.94Å; I2196-I2200 HydrophobicContact CG2-CG1 4.32Å; I2196-I2200 VanDerWaalsContact O-CG1 3.28Å; I2196-I2200 WeakPolarHBondContact O-CG1 3.42Å; I2196-I2200 PolarHBondContact O-N 3.12Å; E2197-I2200 PolarHBondContact O-N 3.01Å; I2200-I2202 VanDerWaalsContact C-N 3.32Å; I2200-I2202 PolarHBondContact O-N 3.09Å; I2200-V2203 WeakPolarHBondContact O-CA 3.14Å; I2200-V2203 WeakPolarHBondContact O-CB 3.36Å; I2200-V2203 PolarHBondContact O-N 3.22Å; I2200-V2203 VanDerWaalsContact O-N 3.12Å; I2200-L2204 HydrophobicContact CG2-CD1 4.1Å; I2200-L2204 HydrophobicContact CG2-CG 4.43Å; I2200-L2204 WeakPolarHBondContact O-CG 3.33Å; I2200-L2204 PolarHBondContact O-N 3Å; I2200-L2682 HydrophobicContact CG2-CD2 4.18Å; I2200-F2685 HydrophobicContact CB-CE1 4.39Å; I2200-F2685 HydrophobicContact CD1-CB 3.78Å; I2200-F2685 HydrophobicContact CD1-CD1 3.85Å; I2200-F2685 HydrophobicContact CD1-CD2 4.22Å; I2200-F2685 HydrophobicContact CD1-CE1 4.4Å; I2200-F2685 HydrophobicContact CD1-CG 3.71Å; I2200-F2685 HydrophobicContact CG1-CD1 3.88Å; I2200-F2685 HydrophobicContact CG1-CD2 4.12Å; I2200-F2685 HydrophobicContact CG1-CE1 3.98Å; I2200-F2685 HydrophobicContact CG1-CE2 4.23Å; I2200-F2685 HydrophobicContact CG1-CG 3.95Å; I2200-F2685 HydrophobicContact CG1-CZ 4.15Å; I2200-F2685 HydrophobicContact CG2-CD1 4.02Å; I2200-F2685 HydrophobicContact CG2-CE1 3.91Å; I2200-M2700 HydrophobicContact CG2-CE 3.86Å
2201Q91.9Very high86.8Confident56.4 Ų56.434.1 Ų34.126%0.26419%0.185SC..Hα-helixtrans-62.5-37.3176.1-169.461.152.500112.4P2028 E2197 Y2198 L2199 V2203 L2204 N2205P2028-Q2201 HydrophobicContact CB-CB 4.1Å; P2028-Q2201 HydrophobicContact CB-CG 4.14Å; P2028-Q2201 HydrophobicContact CG-CB 3.93Å; P2028-Q2201 HydrophobicContact CG-CG 3.87Å; P2028-Q2201 VanDerWaalsContact O-CG 3.31Å; P2028-Q2201 WeakPolarHBondContact O-CG 3.36Å; E2197-Q2201 PolarHBondContact O-N 3.17Å; E2197-Q2201 VanDerWaalsContact O-N 3.09Å; Y2198-Q2201 PolarHBondContact O-N 3.01Å; L2199-Q2201 VanDerWaalsContact C-N 3.34Å; L2199-Q2201 PolarHBondContact O-N 2.88Å; Q2201-V2203 VanDerWaalsContact C-N 3.32Å; Q2201-V2203 PolarHBondContact O-N 3.19Å; Q2201-L2204 PolarHBondContact O-N 3.07Å; Q2201-N2205 PolarHBondContact NE2-OD1 2.87Å; Q2201-N2205 PolarHBondContact O-N 3.05Å; Q2201-N2205 PolarHBondContact O-ND2 3.07Å; Q2201-N2205 PolarHBondContact O-OD1 3.18Å; Q2201-N2205 VanDerWaalsContact O-OD1 3.12Å
2202I91.7Very high87.2Confident0 Ų036 Ų360%018%0.183CC..Hα-helixtrans-62.5-39.1173.4-65.5163.3000111.3A2016 P2028 F2030 L2032 W2043 Y2198 L2199 I2200 N2205 T2206A2016-I2202 HydrophobicContact CB-CD1 4.39Å; A2016-I2202 HydrophobicContact CB-CG2 4.32Å; P2028-I2202 HydrophobicContact CB-CG1 4.09Å; F2030-I2202 HydrophobicContact CD2-CD1 4.49Å; F2030-I2202 HydrophobicContact CD2-CG1 4.31Å; F2030-I2202 HydrophobicContact CE2-CD1 3.53Å; F2030-I2202 HydrophobicContact CE2-CG1 3.78Å; F2030-I2202 HydrophobicContact CZ-CD1 3.85Å; F2030-I2202 HydrophobicContact CZ-CG1 4.22Å; L2032-I2202 HydrophobicContact CD2-CG2 3.56Å; L2032-I2202 HydrophobicContact CG-CG2 3.93Å; W2043-I2202 HydrophobicContact CH2-CB 4.29Å; W2043-I2202 HydrophobicContact CH2-CG2 4.13Å; W2043-I2202 HydrophobicContact CZ2-CD1 4.46Å; W2043-I2202 HydrophobicContact CZ2-CG2 4.25Å; Y2198-I2202 HydrophobicContact CD1-CD1 3.8Å; Y2198-I2202 HydrophobicContact CE1-CD1 3.66Å; Y2198-I2202 HydrophobicContact CE1-CG1 4.48Å; Y2198-I2202 WeakPolarHBondContact O-CG1 3.43Å; Y2198-I2202 PolarHBondContact O-N 3.19Å; L2199-I2202 HydrophobicContact CD2-CD1 4.47Å; L2199-I2202 PolarHBondContact O-N 3.02Å; I2200-I2202 VanDerWaalsContact C-N 3.32Å; I2200-I2202 PolarHBondContact O-N 3.09Å; I2202-N2205 PolarHBondContact O-N 3.27Å; I2202-T2206 WeakPolarHBondContact O-CB 3.33Å; I2202-T2206 PolarHBondContact O-N 2.91Å; I2202-T2206 PolarHBondContact O-OG1 3.24Å
2203V93.5Very high86.6Confident7.4 Ų7.437.8 Ų37.85%0.04519%0.194CC..Hα-helixtrans-63.5-45.7174.2177.20000110.8W2043 L2044 L2047 L2199 I2200 Q2201 N2205 T2206 L2207 L2682W2043-V2203 HydrophobicContact CH2-CG2 4.13Å; W2043-V2203 HydrophobicContact CZ3-CG2 3.69Å; L2044-V2203 HydrophobicContact CD2-CG1 4.46Å; L2044-V2203 HydrophobicContact CD2-CG2 3.98Å; L2047-V2203 HydrophobicContact CD2-CG2 3.7Å; L2199-V2203 PolarHBondContact O-N 3.16Å; L2199-V2203 VanDerWaalsContact O-N 3.15Å; I2200-V2203 WeakPolarHBondContact O-CA 3.14Å; I2200-V2203 WeakPolarHBondContact O-CB 3.36Å; I2200-V2203 PolarHBondContact O-N 3.22Å; I2200-V2203 VanDerWaalsContact O-N 3.12Å; Q2201-V2203 VanDerWaalsContact C-N 3.32Å; Q2201-V2203 PolarHBondContact O-N 3.19Å; V2203-N2205 PolarHBondContact O-N 3.29Å; V2203-T2206 WeakPolarHBondContact O-CA 3.39Å; V2203-T2206 WeakPolarHBondContact O-CB 3.33Å; V2203-T2206 PolarHBondContact O-N 3.19Å; V2203-T2206 VanDerWaalsContact O-N 3.07Å; V2203-L2207 HydrophobicContact CG1-CD1 3.88Å; V2203-L2207 HydrophobicContact CG1-CG 4.42Å; V2203-L2207 WeakPolarHBondContact O-CG 3.33Å; V2203-L2207 PolarHBondContact O-N 3.02Å; V2203-L2682 HydrophobicContact CB-CD2 4.46Å; V2203-L2682 HydrophobicContact CG1-CD2 3.98Å; V2203-L2682 HydrophobicContact CG1-CG 4.1Å
2204L92.4Very high85.8Confident20.6 Ų20.635.2 Ų35.211%0.10819%0.191CC..Hα-helixtrans-59.9-49.5177.6-69.9169.4000112I2200 Q2201 T2206 L2207 D2208 L2682 Y2696 M2700 I2703I2200-L2204 HydrophobicContact CG2-CD1 4.1Å; I2200-L2204 HydrophobicContact CG2-CG 4.43Å; I2200-L2204 WeakPolarHBondContact O-CG 3.33Å; I2200-L2204 PolarHBondContact O-N 3Å; Q2201-L2204 PolarHBondContact O-N 3.07Å; L2204-T2206 VanDerWaalsContact C-N 3.26Å; L2204-T2206 PolarHBondContact O-N 3Å; L2204-L2207 PolarHBondContact O-N 3.41Å; L2204-D2208 WeakPolarHBondContact O-CB 3.28Å; L2204-D2208 PolarHBondContact O-N 3.1Å; L2204-L2682 HydrophobicContact CD2-CD1 3.91Å; L2204-L2682 HydrophobicContact CD2-CD2 3.86Å; L2204-L2682 HydrophobicContact CG-CD2 4.07Å; L2204-Y2696 HydrophobicContact CD1-CD1 3.75Å; L2204-Y2696 HydrophobicContact CD1-CG 4.14Å; L2204-M2700 HydrophobicContact CD2-CB 4.46Å; L2204-M2700 HydrophobicContact CD2-CG 3.66Å; L2204-I2703 HydrophobicContact CB-CD1 4.43Å; L2204-I2703 HydrophobicContact CD2-CD1 4.06Å
2205N89.3Confident84.7Confident30.2 Ų30.243.2 Ų43.216%0.16122%0.215CC..Hα-helixtrans-57-41.8176-59.9-13.9000111.5P2028 F2030 T2031 Q2201 I2202 V2203 L2207 D2208 S2209P2028-N2205 PolarHBondContact O-ND2 3.17Å; F2030-N2205 PolarHBondContact N-ND2 3.23Å; F2030-N2205 WeakPolarHBondContact O-CB 3.33Å; F2030-N2205 PolarHBondContact O-ND2 3.1Å; T2031-N2205 HydrophobicContact CG2-CB 4.07Å; T2031-N2205 WeakPolarHBondContact CG2-O 3.26Å; Q2201-N2205 PolarHBondContact NE2-OD1 2.87Å; Q2201-N2205 PolarHBondContact O-N 3.05Å; Q2201-N2205 PolarHBondContact O-ND2 3.07Å; Q2201-N2205 PolarHBondContact O-OD1 3.18Å; Q2201-N2205 VanDerWaalsContact O-OD1 3.12Å; I2202-N2205 PolarHBondContact O-N 3.27Å; V2203-N2205 PolarHBondContact O-N 3.29Å; N2205-L2207 VanDerWaalsContact C-N 3.35Å; N2205-L2207 PolarHBondContact O-N 2.92Å; N2205-D2208 PolarHBondContact O-N 3.18Å; N2205-S2209 VanDerWaalsContact O-CB 3.24Å; N2205-S2209 WeakPolarHBondContact O-CB 3.33Å; N2205-S2209 PolarHBondContact O-N 3.25Å; N2205-S2209 PolarHBondContact O-OG 3.23Å; N2205-S2209 VanDerWaalsContact O-OG 3.08Å
2206T90.4Very high83.1Confident9 Ų948.3 Ų48.36%0.05524%0.242CC..Hα-helixtrans-64.4-44-179.6-57.90000110.8T2031 L2032 I2202 V2203 L2204 S2209 H2210 Y2670T2031-T2206 WeakPolarHBondContact CA-OG1 3.35Å; T2031-T2206 WeakPolarHBondContact CB-OG1 3.19Å; L2032-T2206 HydrophobicContact CB-CG2 4.04Å; L2032-T2206 HydrophobicContact CD1-CG2 4.41Å; L2032-T2206 HydrophobicContact CG-CG2 4.3Å; L2032-T2206 PolarHBondContact N-OG1 3.13Å; I2202-T2206 WeakPolarHBondContact O-CB 3.33Å; I2202-T2206 PolarHBondContact O-N 2.91Å; I2202-T2206 PolarHBondContact O-OG1 3.24Å; V2203-T2206 WeakPolarHBondContact O-CA 3.39Å; V2203-T2206 WeakPolarHBondContact O-CB 3.33Å; V2203-T2206 PolarHBondContact O-N 3.19Å; V2203-T2206 VanDerWaalsContact O-N 3.07Å; L2204-T2206 VanDerWaalsContact C-N 3.26Å; L2204-T2206 PolarHBondContact O-N 3Å; T2206-S2209 PolarHBondContact O-N 3.33Å; T2206-S2209 PolarHBondContact O-OG 3.06Å; T2206-H2210 PolarHBondContact O-CD2 2.9Å; T2206-H2210 VanDerWaalsContact O-CD2 3.27Å; T2206-H2210 PolarHBondContact O-N 3.4Å; T2206-Y2670 HydrophobicContact CG2-CD1 4.18Å; T2206-Y2670 HydrophobicContact CG2-CD2 4.38Å; T2206-Y2670 HydrophobicContact CG2-CE1 3.68Å; T2206-Y2670 HydrophobicContact CG2-CE2 3.88Å; T2206-Y2670 VanDerWaalsContact CG2-CZ 3.49Å; T2206-Y2670 VanDerWaalsContact O-CE2 3.29Å; T2206-Y2670 WeakPolarHBondContact O-CE2 3.22Å
2207L91Very high81.1Confident24.6 Ų24.655.5 Ų55.513%0.12927%0.269CS..Hα-helixtrans-68.8-43.8177.4-66.9169.3000112.3V2203 L2204 N2205 S2209 H2210 V2211 I2675 I2679 L2682 I2703 L2707V2203-L2207 HydrophobicContact CG1-CD1 3.88Å; V2203-L2207 HydrophobicContact CG1-CG 4.42Å; V2203-L2207 WeakPolarHBondContact O-CG 3.33Å; V2203-L2207 PolarHBondContact O-N 3.02Å; L2204-L2207 PolarHBondContact O-N 3.41Å; N2205-L2207 VanDerWaalsContact C-N 3.35Å; N2205-L2207 PolarHBondContact O-N 2.92Å; L2207-S2209 VanDerWaalsContact C-N 3.32Å; L2207-S2209 PolarHBondContact O-N 3Å; L2207-H2210 CarbonylContact O-C 3.56Å; L2207-H2210 WeakPolarHBondContact O-CA 3.27Å; L2207-H2210 WeakPolarHBondContact O-CB 3.41Å; L2207-H2210 PolarHBondContact O-N 3.07Å; L2207-H2210 VanDerWaalsContact O-N 3.14Å; L2207-V2211 WeakPolarHBondContact O-CG2 3.45Å; L2207-V2211 PolarHBondContact O-N 2.93Å; L2207-V2211 VanDerWaalsContact O-N 3.1Å; L2207-I2675 HydrophobicContact CD2-CB 4.35Å; L2207-I2675 HydrophobicContact CD2-CG2 3.75Å; L2207-I2679 HydrophobicContact CD1-CG1 4.43Å; L2207-I2679 HydrophobicContact CD2-CG1 4.33Å; L2207-L2682 HydrophobicContact CD1-CD1 3.54Å; L2207-L2682 HydrophobicContact CD1-CG 4.22Å; L2207-I2703 HydrophobicContact CB-CG2 3.61Å; L2207-L2707 HydrophobicContact CB-CD1 4.31Å; L2207-L2707 HydrophobicContact CD2-CD1 4.02Å
2208D88Confident79.1Confident72.2 Ų72.257.3 Ų57.339%0.38629%0.285SS..Hα-helixtrans-63.5-39.5176.9-168.854.9000111.8L2204 N2205 H2210 V2211 H2212 I2703 R2706L2204-D2208 WeakPolarHBondContact O-CB 3.28Å; L2204-D2208 PolarHBondContact O-N 3.1Å; N2205-D2208 PolarHBondContact O-N 3.18Å; D2208-H2210 PolarHBondContact O-N 3.14Å; D2208-H2210 VanDerWaalsContact O-N 3.15Å; D2208-V2211 CarbonylContact O-C 3.57Å; D2208-V2211 VanDerWaalsContact O-C 3.26Å; D2208-V2211 PolarHBondContact O-N 3.01Å; D2208-V2211 VanDerWaalsContact O-N 3.14Å; D2208-H2212 WeakPolarHBondContact O-CA 3.48Å; D2208-H2212 PolarHBondContact O-N 3.18Å; D2208-H2212 VanDerWaalsContact O-N 3.12Å; D2208-I2703 HydrophobicContact CB-CD1 3.8Å; D2208-I2703 HydrophobicContact CB-CG1 4Å; D2208-R2706 IonicContact OD1-CZ 2.7Å; D2208-R2706 IonicContact OD1-NH1 3.05Å; D2208-R2706 PolarHBondContact OD1-NH1 3.02Å; D2208-R2706 VanDerWaalsContact OD1-NH1 3.15Å; D2208-R2706 IonicContact OD1-NH2 3.79Å; D2208-R2706 PolarHBondContact OD1-NH2 3.36Å
2209S83.7Confident76.8Confident25.2 Ų25.262.1 Ų62.118%0.17631%0.314CS..THydrogen-bonded Turntrans-64.2-16.2176.872.80000114.6T2031 R2033 N2205 T2206 L2207 D2668 Y2670T2031-S2209 WeakPolarHBondContact CG2-OG 3.33Å; R2033-S2209 PolarHBondContact NH2-O 2.93Å; R2033-S2209 PolarHBondContact NH2-OG 2.74Å; N2205-S2209 VanDerWaalsContact O-CB 3.24Å; N2205-S2209 WeakPolarHBondContact O-CB 3.33Å; N2205-S2209 PolarHBondContact O-N 3.25Å; N2205-S2209 PolarHBondContact O-OG 3.23Å; N2205-S2209 VanDerWaalsContact O-OG 3.08Å; T2206-S2209 PolarHBondContact O-N 3.33Å; T2206-S2209 PolarHBondContact O-OG 3.06Å; L2207-S2209 VanDerWaalsContact C-N 3.32Å; L2207-S2209 PolarHBondContact O-N 3Å; S2209-D2668 PolarHBondContact O-N 3.05Å; S2209-D2668 WeakPolarHBondContact OG-CB 3.37Å; S2209-D2668 PolarHBondContact OG-OD2 3.4Å; S2209-Y2670 WeakPolarHBondContact OG-CE2 3.37Å
2210H81.8Confident74.4Confident53.4 Ų53.469.5 Ų69.525%0.24735%0.349CS..THydrogen-bonded Turntrans-84.5-31.1173.7-155.8-47.2000113.1T2206 L2207 D2208 H2212 D2668 H2669 Y2670 I2675 F2712T2206-H2210 PolarHBondContact O-CD2 2.9Å; T2206-H2210 VanDerWaalsContact O-CD2 3.27Å; T2206-H2210 PolarHBondContact O-N 3.4Å; L2207-H2210 CarbonylContact O-C 3.56Å; L2207-H2210 WeakPolarHBondContact O-CA 3.27Å; L2207-H2210 WeakPolarHBondContact O-CB 3.41Å; L2207-H2210 PolarHBondContact O-N 3.07Å; L2207-H2210 VanDerWaalsContact O-N 3.14Å; D2208-H2210 PolarHBondContact O-N 3.14Å; D2208-H2210 VanDerWaalsContact O-N 3.15Å; H2210-H2212 PolarHBondContact O-N 3.39Å; H2210-D2668 WeakPolarHBondContact CA-O 3.41Å; H2210-D2668 PolarHBondContact ND1-O 3.13Å; H2210-H2669 AromaticContact CE1-CE1 3.42Å; H2210-H2669 PolarHBondContact CE1-CE1 3.31Å; H2210-H2669 VanDerWaalsContact CE1-CE1 3.42Å; H2210-H2669 AromaticContact CE1-CG 3.97Å; H2210-H2669 AromaticContact CE1-ND1 3.59Å; H2210-H2669 AromaticContact CE1-NE2 3.68Å; H2210-H2669 AromaticContact ND1-ND1 3.79Å; H2210-Y2670 HydrophobicContact CB-CD2 4.08Å; H2210-Y2670 AromaticContact CD2-CD2 3.93Å; H2210-Y2670 PolarHBondContact CD2-N 2.95Å; H2210-I2675 VanDerWaalsContact CD2-CD1 3.46Å; H2210-I2675 WeakPolarHBondContact CD2-CD1 3.35Å; H2210-I2675 WeakPolarHBondContact NE2-CD1 3.45Å; H2210-F2712 AromaticContact CD2-CZ 3.96Å; H2210-F2712 AromaticContact CE1-CE1 3.74Å; H2210-F2712 VanDerWaalsContact CE1-CE1 3.49Å; H2210-F2712 WeakPolarHBondContact CE1-CE1 3.14Å; H2210-F2712 AromaticContact CE1-CZ 3.61Å; H2210-F2712 AromaticContact NE2-CE1 3.55Å; H2210-F2712 WeakPolarHBondContact NE2-CE1 3.24Å; H2210-F2712 AromaticContact NE2-CZ 3.59Å; H2210-F2712 WeakPolarHBondContact NE2-CZ 3.19Å
2211V76.7Confident71.7Confident42 Ų4273.6 Ų73.626%0.25537%0.371SS..SBendtrans-103.359178.8-132.80000110.2L2207 D2208 V2213 I2703 R2706 L2707 A2710L2207-V2211 WeakPolarHBondContact O-CG2 3.45Å; L2207-V2211 PolarHBondContact O-N 2.93Å; L2207-V2211 VanDerWaalsContact O-N 3.1Å; D2208-V2211 CarbonylContact O-C 3.57Å; D2208-V2211 VanDerWaalsContact O-C 3.26Å; D2208-V2211 PolarHBondContact O-N 3.01Å; D2208-V2211 VanDerWaalsContact O-N 3.14Å; V2211-V2213 WeakPolarHBondContact O-CG2 3.39Å; V2211-V2213 PolarHBondContact O-N 2.99Å; V2211-V2213 VanDerWaalsContact O-N 3.1Å; V2211-I2703 HydrophobicContact CG2-CG2 3.99Å; V2211-R2706 HydrophobicContact CB-CB 3.8Å; V2211-R2706 HydrophobicContact CG1-CB 4.13Å; V2211-R2706 HydrophobicContact CG2-CB 3.91Å; V2211-R2706 PolarHBondContact O-NH1 3.25Å; V2211-L2707 HydrophobicContact CG1-CD2 3.49Å; V2211-L2707 VanDerWaalsContact CG1-CD2 3.49Å; V2211-L2707 HydrophobicContact CG1-CG 3.83Å; V2211-L2707 HydrophobicContact CG2-CD2 3.77Å; V2211-L2707 HydrophobicContact CG2-CG 4.48Å; V2211-A2710 HydrophobicContact CG2-CB 4.27Å
2212H75.1Confident69.2Low80.8 Ų80.878.6 Ų78.637%0.37440%0.399SS..  trans-67.6100.8-176.5-174.254.4000112.4D2208 H2210 C2214 C2660 C2663 L2667D2208-H2212 WeakPolarHBondContact O-CA 3.48Å; D2208-H2212 PolarHBondContact O-N 3.18Å; D2208-H2212 VanDerWaalsContact O-N 3.12Å; H2210-H2212 PolarHBondContact O-N 3.39Å; H2212-C2214 PolarHBondContact CD2-SG 2.64Å; H2212-C2214 WeakPolarHBondContact NE2-CA 3.38Å; H2212-C2214 PolarHBondContact NE2-N 3.45Å; H2212-C2214 PolarHBondContact NE2-SG 2.95Å; H2212-C2214 VanDerWaalsContact NE2-SG 3.38Å; H2212-C2214 PolarHBondContact O-N 2.94Å; H2212-C2660 PolarHBondContact NE2-SG 2.89Å; H2212-C2663 PolarHBondContact CE1-SG 3.12Å; H2212-C2663 PolarHBondContact NE2-SG 3.15Å; H2212-C2663 VanDerWaalsContact NE2-SG 3.38Å; H2212-L2667 HydrophobicContact CB-CD2 3.94Å
2213V69.4Low66.5Low83.6 Ų83.685.7 Ų85.751%0.50744%0.435SS..  trans-84.5106.3164.7-177.10000110.3V2211 R2215V2211-V2213 WeakPolarHBondContact O-CG2 3.39Å; V2211-V2213 PolarHBondContact O-N 2.99Å; V2211-V2213 VanDerWaalsContact O-N 3.1Å; V2213-R2215 HydrophobicContact CG1-CB 3.63Å; V2213-R2215 HydrophobicContact CG1-CG 3.96Å; V2213-R2215 PolarHBondContact O-N 3.1Å; V2213-R2215 VanDerWaalsContact O-N 3.07Å
2214C67Low63.7Low50.8 Ų50.888.3 Ų88.334%0.34346%0.458SS..  trans-72.3113.4169.1-100.30000109.9H2212 D2216 R2217 C2660 W2662 C2663H2212-C2214 PolarHBondContact CD2-SG 2.64Å; H2212-C2214 WeakPolarHBondContact NE2-CA 3.38Å; H2212-C2214 PolarHBondContact NE2-N 3.45Å; H2212-C2214 PolarHBondContact NE2-SG 2.95Å; H2212-C2214 VanDerWaalsContact NE2-SG 3.38Å; H2212-C2214 PolarHBondContact O-N 2.94Å; C2214-D2216 VanDerWaalsContact C-N 3.3Å; C2214-D2216 PolarHBondContact O-N 3.07Å; C2214-D2216 PolarHBondContact SG-N 3.21Å; C2214-D2216 VanDerWaalsContact SG-N 3.42Å; C2214-R2217 HydrophobicContact CB-CB 4.35Å; C2214-C2660 WeakPolarHBondContact CB-SG 3.27Å; C2214-C2660 PolarHBondContact SG-SG 2.6Å; C2214-W2662 HydrophobicContact CB-CE3 4.48Å; C2214-W2662 VanDerWaalsContact SG-CB 3.59Å; C2214-C2663 VanDerWaalsContact SG-CB 3.54Å
2215R59Low60.9Low191.8 Ų191.892.5 Ų92.572%0.72449%0.486SS*.  trans-82.183.7173.4-88.5-177.7174.4167.90.2111V2213 R2217V2213-R2215 HydrophobicContact CG1-CB 3.63Å; V2213-R2215 HydrophobicContact CG1-CG 3.96Å; V2213-R2215 PolarHBondContact O-N 3.1Å; V2213-R2215 VanDerWaalsContact O-N 3.07Å; R2215-R2217 VanDerWaalsContact C-N 3.32Å; R2215-R2217 PolarHBondContact O-N 3.12Å
2216D52.7Low58.1Low136 Ų13698.6 Ų98.673%0.72751%0.511SS*.THydrogen-bonded Turntrans-71.691.5172.8-57.5-64000111C2214 P2218 W2662 C2663C2214-D2216 VanDerWaalsContact C-N 3.3Å; C2214-D2216 PolarHBondContact O-N 3.07Å; C2214-D2216 PolarHBondContact SG-N 3.21Å; C2214-D2216 VanDerWaalsContact SG-N 3.42Å; D2216-P2218 VanDerWaalsContact O-CD 3.31Å; D2216-P2218 WeakPolarHBondContact O-CD 3.41Å; D2216-W2662 HydrophobicContact CB-CB 4.11Å; D2216-C2663 WeakPolarHBondContact OD2-CB 3.36Å
2217R49.4Very low55.3Low153.8 Ų153.8104.3 Ų104.358%0.5854%0.541SS*.SBendtrans-87.4124.9172.9-156.3175.7176.3171.6-3.3108.2C2214 R2215 N2219 D2221 I2223 W2662C2214-R2217 HydrophobicContact CB-CB 4.35Å; R2215-R2217 VanDerWaalsContact C-N 3.32Å; R2215-R2217 PolarHBondContact O-N 3.12Å; R2217-N2219 PolarHBondContact O-N 3.32Å; R2217-D2221 PolarHBondContact NH2-O 3.14Å; R2217-I2223 PolarHBondContact NH2-O 3.14Å; R2217-W2662 HydrophobicContact CB-CD2 4.15Å; R2217-W2662 HydrophobicContact CB-CE3 4.42Å; R2217-W2662 HydrophobicContact CB-CG 4.35Å; R2217-W2662 HydrophobicContact CG-CD2 4.43Å; R2217-W2662 HydrophobicContact CG-CZ2 4.26Å
2218P45.4Very low52.5Low91.6 Ų91.6107.2 Ų107.260%0.59556%0.564SS**  trans-62.4137.4170.227.2-33.3000109.7D2216 E2220D2216-P2218 VanDerWaalsContact O-CD 3.31Å; D2216-P2218 WeakPolarHBondContact O-CD 3.41Å; P2218-E2220 VanDerWaalsContact C-N 3.29Å; P2218-E2220 PolarHBondContact O-N 3.13Å; P2218-E2220 VanDerWaalsContact O-N 3.14Å
2219N41.4Very low49.7Very low149.2 Ų149.2110.8 Ų110.880%0.79858%0.579SS**THydrogen-bonded Turntrans-7415.4-173.6-69.2-40.9000113.7R2217 L2222R2217-N2219 PolarHBondContact O-N 3.32Å; N2219-L2222 WeakPolarHBondContact O-CD1 3.31Å; N2219-L2222 WeakPolarHBondContact O-CG 3.27Å
2220E40.6Very low47.2Very low155.6 Ų155.6116.3 Ų116.373%0.72761%0.605SS**THydrogen-bonded Turntrans-73.2-15.5-176.4-60.4-82.3118.800113.6P2218 L2222 T2307 S2451P2218-E2220 VanDerWaalsContact C-N 3.29Å; P2218-E2220 PolarHBondContact O-N 3.13Å; P2218-E2220 VanDerWaalsContact O-N 3.14Å; E2220-L2222 VanDerWaalsContact C-N 3.32Å; E2220-L2222 PolarHBondContact O-N 3.02Å; E2220-T2307 VanDerWaalsContact OE2-CG2 3.3Å; E2220-T2307 WeakPolarHBondContact OE2-CG2 3.47Å; E2220-S2451 WeakPolarHBondContact OE1-CB 3.46Å; E2220-S2451 PolarHBondContact OE1-OG 3.04Å
2221D35.6Very low44.7Very low112.2 Ų112.2123.6 Ų123.660%0.663%0.63SS**  trans-92.975.2170.1-83.9-41.5000112.7S2170 R2217 I2223 A2224S2170-D2221 WeakPolarHBondContact CB-OD1 3.41Å; S2170-D2221 PolarHBondContact OG-OD1 2.91Å; R2217-D2221 PolarHBondContact NH2-O 3.14Å; D2221-I2223 PolarHBondContact O-N 3.13Å; D2221-A2224 PolarHBondContact O-N 3.36Å; D2221-A2224 VanDerWaalsContact O-N 3.09Å
2222L38.7Very low42.5Very low161.6 Ų161.6129.1 Ų129.185%0.84666%0.658SS**  trans-79.357173.8-92.3163.9000112.9N2219 E2220N2219-L2222 WeakPolarHBondContact O-CD1 3.31Å; N2219-L2222 WeakPolarHBondContact O-CG 3.27Å; E2220-L2222 VanDerWaalsContact C-N 3.32Å; E2220-L2222 PolarHBondContact O-N 3.02Å
2223I35.6Very low40.4Very low148.4 Ų148.4134.8 Ų134.876%0.76168%0.676SS**  trans-112.1113.6168-62.2170000110.9R2217 D2221R2217-I2223 PolarHBondContact NH2-O 3.14Å; D2221-I2223 PolarHBondContact O-N 3.13Å
2224A34.4Very low38.5Very low61.8 Ų61.8138.5 Ų138.551%0.51169%0.688SS.*  trans-52.7133.4172.500000114.4D2221 F2226D2221-A2224 PolarHBondContact O-N 3.36Å; D2221-A2224 VanDerWaalsContact O-N 3.09Å; A2224-F2226 HydrophobicContact CB-CD2 3.47Å; A2224-F2226 VanDerWaalsContact CB-CD2 3.47Å; A2224-F2226 HydrophobicContact CB-CE2 3.35Å; A2224-F2226 HydrophobicContact CB-CZ 4.31Å; A2224-F2226 PolarHBondContact O-N 3.1Å
2225P32.8Very low36.8Very low108.8 Ų108.8140.4 Ų140.471%0.70671%0.707SS**  trans-65.4123.6172.428.1-34.1000110.7N2227P2225-N2227 VanDerWaalsContact C-N 3.26Å; P2225-N2227 PolarHBondContact O-N 3.1Å
2226F32.3Very low35.4Very low158 Ų158135.7 Ų135.769%0.69370%0.704SS**  trans-68.286.5-173.6-92.6-90.6000113.4A2224 S2228 Q2229 W2662A2224-F2226 HydrophobicContact CB-CD2 3.47Å; A2224-F2226 VanDerWaalsContact CB-CD2 3.47Å; A2224-F2226 HydrophobicContact CB-CE2 3.35Å; A2224-F2226 HydrophobicContact CB-CZ 4.31Å; A2224-F2226 PolarHBondContact O-N 3.1Å; F2226-S2228 PolarHBondContact O-N 3.34Å; F2226-S2228 VanDerWaalsContact O-N 3.13Å; F2226-S2228 PolarHBondContact O-OG 3.01Å; F2226-Q2229 HydrophobicContact CB-CB 4.15Å; F2226-Q2229 HydrophobicContact CB-CG 3.85Å; F2226-Q2229 HydrophobicContact CD1-CG 3.9Å; F2226-Q2229 HydrophobicContact CG-CG 4.17Å; F2226-Q2229 WeakPolarHBondContact O-CB 3.29Å; F2226-Q2229 PolarHBondContact O-N 3.02Å; F2226-W2662 AromaticContact CE2-CH2 3.96Å; F2226-W2662 HydrophobicContact CE2-CH2 3.96Å; F2226-W2662 HydrophobicContact CE2-CZ3 4.38Å; F2226-W2662 HydrophobicContact CZ-CH2 4.23Å
2227N30.5Very low34.4Very low128.2 Ų128.2136.5 Ų136.569%0.68671%0.708SS**  trans-70.481.8167.6-88.6-18.6000111.1P2225 Q2229 Y2711P2225-N2227 VanDerWaalsContact C-N 3.26Å; P2225-N2227 PolarHBondContact O-N 3.1Å; N2227-Q2229 PolarHBondContact O-N 3.06Å; N2227-Y2711 PolarHBondContact ND2-O 2.95Å; N2227-Y2711 PolarHBondContact OD1-O 3.03Å
2228S31.9Very low33.7Very low86.2 Ų86.2135.8 Ų135.860%0.60372%0.721SS**  trans-112.846.7165.751.90000112.3F2226 L2230F2226-S2228 PolarHBondContact O-N 3.34Å; F2226-S2228 VanDerWaalsContact O-N 3.13Å; F2226-S2228 PolarHBondContact O-OG 3.01Å; S2228-L2230 PolarHBondContact O-N 3.07Å
2229Q30.5Very low33Very low147.6 Ų147.6136.9 Ų136.969%0.6973%0.73SS**  trans-69.577.5161.6-77.8-15114.500110F2226 N2227 R2231 F2712F2226-Q2229 HydrophobicContact CB-CB 4.15Å; F2226-Q2229 HydrophobicContact CB-CG 3.85Å; F2226-Q2229 HydrophobicContact CD1-CG 3.9Å; F2226-Q2229 HydrophobicContact CG-CG 4.17Å; F2226-Q2229 WeakPolarHBondContact O-CB 3.29Å; F2226-Q2229 PolarHBondContact O-N 3.02Å; N2227-Q2229 PolarHBondContact O-N 3.06Å; Q2229-R2231 HydrophobicContact CB-CB 4.46Å; Q2229-R2231 PolarHBondContact O-N 2.91Å; Q2229-F2712 PolarHBondContact NE2-O 3.28Å
2230L31.3Very low32.7Very low141.6 Ų141.6133.8 Ų133.874%0.74173%0.726SS**  trans-122.693.5166.5-112.2167.7000110.2S2228 L2232S2228-L2230 PolarHBondContact O-N 3.07Å; L2230-L2232 PolarHBondContact O-N 3.28Å
2231R29Very low32.4Very low205 Ų205133.6 Ų133.677%0.77473%0.73SS**  trans-23.299.7179.4-96.8179.1178.9141.60.8112.6Q2229 R2233Q2229-R2231 HydrophobicContact CB-CB 4.46Å; Q2229-R2231 PolarHBondContact O-N 2.91Å; R2231-R2233 HydrophobicContact CB-CB 4.48Å; R2231-R2233 HydrophobicContact CG-CB 4.11Å; R2231-R2233 PolarHBondContact O-N 3.18Å
2232L30.9Very low32.4Very low158.6 Ų158.6137.8 Ų137.883%0.8374%0.743SS**  trans-80.596.6144.7-110.191.1000109L2230 A2654L2230-L2232 PolarHBondContact O-N 3.28Å; L2232-A2654 HydrophobicContact CB-CB 4.31Å; L2232-A2654 HydrophobicContact CD1-CB 3.45Å; L2232-A2654 VanDerWaalsContact CD1-CB 3.45Å; L2232-A2654 HydrophobicContact CD2-CB 3.44Å; L2232-A2654 VanDerWaalsContact CD2-CB 3.44Å; L2232-A2654 HydrophobicContact CG-CB 3.87Å
2233R30.4Very low32.2Very low199.4 Ų199.4136.9 Ų136.975%0.75274%0.739SS**  trans-115.3156.2162.6-104.6-172.2167.9170.10.1108.3R2231 A2235R2231-R2233 HydrophobicContact CB-CB 4.48Å; R2231-R2233 HydrophobicContact CG-CB 4.11Å; R2231-R2233 PolarHBondContact O-N 3.18Å; R2233-A2235 PolarHBondContact O-N 3.15Å
2234E28.7Very low32.1Very low161.4 Ų161.4135.7 Ų135.775%0.75474%0.739SS**  trans-13.9100.7175.9-67.2139.3163.300113.4S2236E2234-S2236 WeakPolarHBondContact CB-O 3.21Å; E2234-S2236 PolarHBondContact O-N 2.98Å
2235A30.8Very low32.2Very low90.6 Ų90.6140.2 Ų140.275%0.74975%0.753SS**  trans-117.646.3149.900000112.5R2233 T2647R2233-A2235 PolarHBondContact O-N 3.15Å; A2235-T2647 HydrophobicContact CB-CG2 3.69Å
2236S31.2Very low32.5Very low94 Ų94142 Ų14266%0.65776%0.756SS**SBendtrans-157.5112.8176.758.30000112.6E2234 V2238E2234-S2236 WeakPolarHBondContact CB-O 3.21Å; E2234-S2236 PolarHBondContact O-N 2.98Å; S2236-V2238 PolarHBondContact O-N 2.89Å
2237N30.9Very low32.7Very low153.4 Ų153.4142.6 Ų142.682%0.8276%0.76SS**  trans6595.6168.4-62.9-14.6000114.8
2238V34.1Very low33.1Very low139.2 Ų139.2142.2 Ų142.284%0.84476%0.763SS**  -138.7117.5129.7178.30000109.7S2236 A2240S2236-V2238 PolarHBondContact O-N 2.89Å; V2238-A2240 HydrophobicContact CG1-CB 4.14Å
2239S32.3Very low33.3Very low113.2 Ų113.2144 Ų14479%0.79277%0.77SS**  trans-75.4142.4165.4-56.10000113.3D2241S2239-D2241 PolarHBondContact O-N 2.87Å
2240A34.7Very low33.6Very low85.6 Ų85.6143 Ų14371%0.70777%0.774SS**  trans170.7142.6168.200000113.1L1850 V2238L1850-A2240 HydrophobicContact CD1-CB 3.9Å; V2238-A2240 HydrophobicContact CG1-CB 4.14Å
2241D34Very low34Very low150.4 Ų150.4141.5 Ų141.580%0.80477%0.773SS**  trans-109136.9158.8-71.3-62.4000111.3S2239S2239-D2241 PolarHBondContact O-N 2.87Å
2242F35.3Very low34.6Very low199.8 Ų199.8137.5 Ų137.588%0.87677%0.774SS**  trans-154.4123.5149.8-105.9-85.4000110.9
2243N33.6Very low35Very low143.4 Ų143.4134.6 Ų134.677%0.76777%0.772SS**  trans-155.3153.6169.1-91.1-41.6000112.3
2244T35.5Very low35.4Very low123.8 Ų123.8131.5 Ų131.576%0.7678%0.776SS**  115.7126.3123.1-330000114.7
2245I35.7Very low35.8Very low156.8 Ų156.8129.2 Ų129.280%0.80477%0.774SS**  trans-159115.8134.8-68.1163.6000109.2
2246L38.5Very low36.1Very low146.4 Ų146.4132.1 Ų132.177%0.76678%0.776SS**  86.4119.386.7-153.875.8000114.9
2247E35.9Very low36Very low169.6 Ų169.6135.2 Ų135.279%0.79378%0.78SS**  trans75.6127.1145.3-95.5-179.1-172.700116.8
2248T39.2Very low36.1Very low119.2 Ų119.2135.8 Ų135.873%0.73178%0.778SS**  -177.212778.6-210000113.6
2249V36.3Very low36.1Very low125.8 Ų125.8136.4 Ų136.476%0.76277%0.772SS**  49.4122.7128.7-179.90000119
2250T37.7Very low36.4Very low125.2 Ų125.2140.3 Ų140.377%0.76877%0.77SS**  -163145.780.3-16.90000114.1
2251P40.1Very low36.5Very low111.6 Ų111.6142.7 Ų142.773%0.72577%0.771SS**  trans-117.5-161.8151.140.8-27.3000112.6
2252P41.3Very low36.7Very low120.8 Ų120.8142.1 Ų142.178%0.78477%0.768SS**  cis-133.5-178.3-47.440.3-23.6000114.8
2253A38.7Very low36.9Very low97.4 Ų97.4139.5 Ų139.581%0.80576%0.764SS**  trans164148.7160.900000115.8
2254T39.2Very low37.2Very low134.4 Ų134.4139.9 Ų139.983%0.82577%0.765SS**  trans-133.6-177.1-165.546.40000110.9
2255P37.4Very low37.4Very low111.6 Ų111.6141.4 Ų141.473%0.72576%0.764SS**  trans-121.6-177.3-157.939.8-27.2000115.5
2256I36.1Very low37.3Very low153 Ų153140.9 Ų140.979%0.78576%0.763SS**  trans166.9131.7160.3-78.6165.4000111.8
2257Q28.7Very low37Very low158.2 Ų158.2139.7 Ų139.774%0.73976%0.762SS**  90.1137.651.5-119.5174.5-5300116.2E2259Q2257-E2259 WeakPolarHBondContact CG-OE1 3.43Å; Q2257-E2259 PolarHBondContact NE2-OE1 3.23Å; Q2257-E2259 PolarHBondContact NE2-OE2 3.4Å
2258E34.7Very low36.8Very low165.6 Ų165.6138.1 Ų138.177%0.77476%0.763SS**  trans172.7155.2174.1-84.6151.2-158.900109.9
2259E33.9Very low36.5Very low153.6 Ų153.6139.2 Ų139.272%0.71876%0.763SS**  cis-163.7163.125.6-90.6171.8153.100112.7Q2257Q2257-E2259 WeakPolarHBondContact CG-OE1 3.43Å; Q2257-E2259 PolarHBondContact NE2-OE1 3.23Å; Q2257-E2259 PolarHBondContact NE2-OE2 3.4Å
2260Y37.3Very low36.2Very low193.2 Ų193.2141.2 Ų141.276%0.75877%0.766SS**  trans25153165.6-58.1-66.1000118.8
2261D38.1Very low36.2Very low136.8 Ų136.8140.7 Ų140.773%0.73277%0.765SS**  cis-153.4167.56.9-96-25.8000110.9
2262D38.6Very low35.8Very low137.6 Ų137.6138.7 Ų138.774%0.73677%0.765SS**  trans28.4159.3143.9-83.5-25.7000120
2263D39.1Very low35.3Very low145.8 Ų145.8139.3 Ų139.378%0.7877%0.766SS**  trans79.9138.7154.6-61.2-23.4000118.9
2264D40Very low34.9Very low150.6 Ų150.6140.4 Ų140.481%0.80576%0.763SS**  163.5167.351.3-119.1-19.2000118.1
2265E38.1Very low34.5Very low156.4 Ų156.4139.7 Ų139.773%0.73175%0.753SS**  trans-51.8143.3-171.8-54.9-168.8125.300119.2G2474E2265-G2474 PolarHBondContact OE1-N 2.96Å
2266N34.6Very low34.2Very low146.2 Ų146.2141.7 Ų141.778%0.78276%0.758SS**  trans116.9141.5130.3-89.3-62.3000119.2
2267T33.3Very low33.9Very low120.8 Ų120.8141.7 Ų141.774%0.74176%0.759SS**  trans-134.5129.2165-59.30000113.4I2269T2267-I2269 HydrophobicContact CG2-CD1 3.82Å; T2267-I2269 HydrophobicContact CG2-CG1 3.82Å
2268V31.1Very low33.9Very low135.4 Ų135.4141.6 Ų141.682%0.82176%0.762SS**  trans-126.4116.7165.2-178.60000111.9
2269I32.3Very low33.8Very low143.8 Ų143.8139 Ų13974%0.73776%0.76SS**  trans-122136.5170-74170.7000111.9T2267 P2271T2267-I2269 HydrophobicContact CG2-CD1 3.82Å; T2267-I2269 HydrophobicContact CG2-CG1 3.82Å; I2269-P2271 HydrophobicContact CG2-CG 4.33Å
2270M30.9Very low33.6Very low166.2 Ų166.2136.8 Ų136.882%0.81976%0.762SS**  trans-96.9146.7162.8-101.8-131.4-24.500111.6
2271P36.7Very low33.2Very low115.4 Ų115.4132.8 Ų132.875%0.74976%0.76SS**  trans-113.4152.1175.137-26.7000113.7I2269I2269-P2271 HydrophobicContact CG2-CG 4.33Å
2272G32Very low32.8Very low70.8 Ų70.8133.2 Ų133.273%0.7376%0.763SS**  138.365.6123.500000115.5T2274G2272-T2274 VanDerWaalsContact C-N 3.33Å; G2272-T2274 PolarHBondContact O-N 3.38Å
2273V31.4Very low32.4Very low132.6 Ų132.6134.6 Ų134.680%0.80477%0.765SS**  trans-118.9127.5157.2176.20000109.3I2275V2273-I2275 HydrophobicContact CG1-CG1 4.48Å
2274T30.5Very low32.2Very low120.2 Ų120.2134.3 Ų134.374%0.73776%0.762SS**  trans-105.4146.4168.333.50000112.4G2272 N2276G2272-T2274 VanDerWaalsContact C-N 3.33Å; G2272-T2274 PolarHBondContact O-N 3.38Å; T2274-N2276 PolarHBondContact O-N 3.45Å
2275I29.7Very low31.7Very low120 Ų120133.7 Ų133.762%0.61576%0.759SS**  trans-80.1129.2161.6-54.6168.9000111.4V2273 L2277 E2469 Q2470 L2471V2273-I2275 HydrophobicContact CG1-CG1 4.48Å; I2275-L2277 HydrophobicContact CB-CD1 4.32Å; I2275-L2277 HydrophobicContact CB-CG 4.37Å; I2275-L2277 HydrophobicContact CD1-CD1 4.17Å; I2275-L2277 HydrophobicContact CG2-CB 4.44Å; I2275-L2277 HydrophobicContact CG2-CD1 4.21Å; I2275-L2277 HydrophobicContact CG2-CG 4.23Å; I2275-L2277 PolarHBondContact O-N 2.81Å; I2275-E2469 HydrophobicContact CD1-CG 4.24Å; I2275-Q2470 HydrophobicContact CD1-CB 3.48Å; I2275-Q2470 VanDerWaalsContact CD1-CB 3.48Å; I2275-Q2470 HydrophobicContact CD1-CG 4.28Å; I2275-Q2470 HydrophobicContact CG1-CB 4.24Å; I2275-Q2470 VanDerWaalsContact CG2-NE2 3.34Å; I2275-L2471 HydrophobicContact CD1-CB 4.25Å; I2275-L2471 HydrophobicContact CG1-CB 4.05Å; I2275-L2471 HydrophobicContact CG1-CD2 3.68Å; I2275-L2471 HydrophobicContact CG1-CG 4.49Å
2276N31.2Very low31.5Very low152.6 Ų152.6134 Ų13482%0.81676%0.761SS**  trans-120.6110.8150.5-91.618.3000110.8T2274 L2278T2274-N2276 PolarHBondContact O-N 3.45Å; N2276-L2278 PolarHBondContact O-N 2.65Å; N2276-L2278 VanDerWaalsContact O-N 3.13Å
2277L29.1Very low31.3Very low154.4 Ų154.4135.4 Ų135.481%0.80876%0.76SS**  trans-102134.3166.8-84.9146.9000109.5I2275 P2279I2275-L2277 HydrophobicContact CB-CD1 4.32Å; I2275-L2277 HydrophobicContact CB-CG 4.37Å; I2275-L2277 HydrophobicContact CD1-CD1 4.17Å; I2275-L2277 HydrophobicContact CG2-CB 4.44Å; I2275-L2277 HydrophobicContact CG2-CD1 4.21Å; I2275-L2277 HydrophobicContact CG2-CG 4.23Å; I2275-L2277 PolarHBondContact O-N 2.81Å; L2277-P2279 WeakPolarHBondContact O-CD 3.5Å
2278L30Very low31.2Very low156 Ų156134.6 Ų134.682%0.81776%0.759SS**  trans-51.6138.1165.1-137.579000114.3N2276N2276-L2278 PolarHBondContact O-N 2.65Å; N2276-L2278 VanDerWaalsContact O-N 3.13Å
2279P31.4Very low31.1Very low110.2 Ų110.2135.1 Ų135.172%0.71676%0.757SS**  trans-121.2163.7-16431.3-14.6000113.2L2277L2277-P2279 WeakPolarHBondContact O-CD 3.5Å
2280S29.6Very low31Very low108.6 Ų108.6132.9 Ų132.976%0.75975%0.754SS**  trans56.5131.9160.7-102.70000114
2281C28.7Very low31.1Very low108.2 Ų108.2131.6 Ų131.673%0.73175%0.75SS**  -13516073.7-80.80000110.3
2282N30.5Very low30.8Very low146.2 Ų146.2132.9 Ų132.978%0.78275%0.751SS**  trans-174.5150.7143.3-70.32.8000112.1
2283E30.7Very low30.7Very low166.2 Ų166.2136.1 Ų136.178%0.77775%0.751SS**  cis-150.5150.722.5-81.9176.5136.700111.1
2284L33.9Very low30.7Very low139 Ų139135.1 Ų135.173%0.72875%0.745SS**  151.8146.1100.9-77.8171.8000114.9
2285D30.2Very low30.7Very low138.4 Ų138.4136.7 Ų136.774%0.7475%0.748SS**  trans49.6147.3147.1-56.8-40.8000120.6
2286E32.8Very low30.8Very low163.8 Ų163.8135.8 Ų135.877%0.76575%0.753SS**  cis-161.1144.541.4-103.9-165140.700116
2287K30.4Very low30.7Very low175.4 Ų175.4137 Ų13776%0.76375%0.754SS**  trans6.6142.9147-108.1169.4-158.4148.10119.4
2288S31.6Very low30.8Very low102.6 Ų102.6134.5 Ų134.572%0.71775%0.746SS**  trans113.1148.913770.40000114.7
2289N29Very low30.8Very low146.4 Ų146.4134.8 Ų134.878%0.78374%0.744SS**  cis171.8152.116.1-93.21.3000111.1
2290S31.1Very low30.7Very low96.8 Ų96.8136.2 Ų136.268%0.67774%0.741SS**  100.6166.612452.30000115.5
2291D32.2Very low30.6Very low138.8 Ų138.8137.1 Ų137.174%0.74273%0.733SS**  cis-177.9168-3.9-101.8-44.1000112.6
2292L31.6Very low30.5Very low144.2 Ų144.2141.3 Ų141.376%0.75573%0.733SS**  trans71.4132.8162.6-89.283.7000117.6
2293N30.1Very low30.4Very low138.2 Ų138.2139.8 Ų139.874%0.73973%0.729SS**  148.3158.557.3-101.1-25.5000111.9
2294T30.6Very low30.3Very low110 Ų110136.9 Ų136.968%0.67572%0.723SS**  cis-169.9148.428.4-36.60000113.7
2295L30.2Very low30.1Very low154.4 Ų154.4136.7 Ų136.781%0.80872%0.723SS**  trans38.4143.6147.9-102.561.6000119.7
2296S31.2Very low30Very low101.6 Ų101.6136.6 Ų136.671%0.7172%0.723SS**  cis-168.9147.123-74.10000112.5
2297Q29Very low30Very low178.2 Ų178.2135 Ų13583%0.83372%0.724SS**  5.4162.6126.5-79.5-165.817.600116.5
2298P32.9Very low30Very low101 Ų101130.8 Ų130.866%0.65672%0.722SS**  cis-141.2-175.5-29.540.6-22.1000115.3
2299Q28.5Very low29.9Very low163.6 Ų163.6132.5 Ų132.576%0.76472%0.723SS**  trans74.3152.9151.8-74.9-175.9-4.100117.3
2300Q29.2Very low30Very low138.6 Ų138.6132.2 Ų132.265%0.64872%0.722SS**  cis-163.6154.948.2-110.8-17763.700111.6
2301Q28.1Very low30Very low127 Ų127133.3 Ų133.359%0.59372%0.724SS**  162.7134.852.6-98168.58.400115
2302R27.6Very low29.7Very low196.6 Ų196.6133.3 Ų133.374%0.74272%0.722SS**  161.5135.1118-102.2175.9-111.3-166.8-2.6115.3
2303T28.3Very low29.5Very low114 Ų114131.5 Ų131.570%0.69972%0.721SS**  trans-157.4145.9139.431.10000114.3
2304T28.1Very low29.3Very low106 Ų106133.5 Ų133.565%0.6573%0.728SS**  trans-80132163.749.90000112.6
2305D29.2Very low29.1Very low135.2 Ų135.2132 Ų13272%0.72373%0.727SS**  -174.1141.477-91.6-38.5000110.9
2306N29Very low29Very low136.6 Ų136.6133.7 Ų133.773%0.7373%0.727SS**  trans-98.2127.2165.3-75-36.9000114.4
2307T31.6Very low28.8Very low130.4 Ų130.4137 Ų13780%0.873%0.729SS**  trans-161.2130.9138.829.60000110.8E2220E2220-T2307 VanDerWaalsContact OE2-CG2 3.3Å; E2220-T2307 WeakPolarHBondContact OE2-CG2 3.47Å
2308A30.2Very low28.8Very low86.2 Ų86.2137.6 Ų137.671%0.71273%0.725SS**  -172.6130.361.500000112.1D2310A2308-D2310 VanDerWaalsContact C-N 3.33Å; A2308-D2310 PolarHBondContact O-N 3.21Å
2309D30.8Very low28.7Very low138.2 Ų138.2138.4 Ų138.474%0.73972%0.724SS**  trans-116.1141.6170.3-76.8-55.6000112.5V2311 R2896D2309-V2311 PolarHBondContact O-N 3.44Å; D2309-R2896 IonicContact OD1-CZ 2.82Å; D2309-R2896 IonicContact OD1-NH2 3.49Å; D2309-R2896 PolarHBondContact OD1-NH2 3.27Å
2310D31.3Very low28.6Very low141 Ų141137.3 Ų137.375%0.75472%0.723SS**  trans166.384.9171.3-108.3-11.1000115.7A2308 I2312A2308-D2310 VanDerWaalsContact C-N 3.33Å; A2308-D2310 PolarHBondContact O-N 3.21Å; D2310-I2312 PolarHBondContact O-N 3.39Å
2311V30Very low28.8Very low120 Ų120138.4 Ų138.473%0.72773%0.729SS**  trans-9684146.9-1790000113.8D2309 C2313D2309-V2311 PolarHBondContact O-N 3.44Å; V2311-C2313 VanDerWaalsContact C-N 3.32Å; V2311-C2313 PolarHBondContact O-N 3.49Å; V2311-C2313 VanDerWaalsContact O-N 3.11Å
2312I27.1Very low28.7Very low137.4 Ų137.4140.9 Ų140.971%0.70574%0.737SS**  trans-47.9121.3156-58.7173.6000114D2310 M2314D2310-I2312 PolarHBondContact O-N 3.39Å; I2312-M2314 PolarHBondContact O-N 3.02Å; I2312-M2314 VanDerWaalsContact O-N 3.15Å
2313C26Very low28.8Very low107.4 Ų107.4138.5 Ų138.573%0.72674%0.738SS**  trans111.7109.9144.9-132.30000117.4V2311 A2315V2311-C2313 VanDerWaalsContact C-N 3.32Å; V2311-C2313 PolarHBondContact O-N 3.49Å; V2311-C2313 VanDerWaalsContact O-N 3.11Å; C2313-A2315 PolarHBondContact O-N 3.12Å
2314M25.9Very low28.7Very low179.4 Ų179.4137.9 Ų137.988%0.88473%0.734SS**  trans-119112.4145.4-89.7-105.5-166.500114.9I2312 K2316I2312-M2314 PolarHBondContact O-N 3.02Å; I2312-M2314 VanDerWaalsContact O-N 3.15Å; M2314-K2316 PolarHBondContact O-N 3.16Å
2315A27.7Very low28.6Very low79.6 Ų79.6142 Ų14266%0.65874%0.743SS**  trans-49.29916000000115.9C2313 K2317 W2662C2313-A2315 PolarHBondContact O-N 3.12Å; A2315-K2317 PolarHBondContact O-N 3.23Å; A2315-K2317 VanDerWaalsContact O-N 3.14Å; A2315-W2662 HydrophobicContact CB-CZ2 3.61Å
2316K27.1Very low28.5Very low189 Ų189140.7 Ų140.782%0.82274%0.74SS**  trans-30.3114.1155.6-70.3179.1178.5176.20112.6M2314 Y2318M2314-K2316 PolarHBondContact O-N 3.16Å; K2316-Y2318 PolarHBondContact O-N 3.16Å; K2316-Y2318 VanDerWaalsContact O-N 3.16Å
2317K28.1Very low28.4Very low171.6 Ų171.6142.2 Ų142.275%0.74674%0.743SS**  trans-110.5121.6159.8-102.3-172.7176.1-171.50109.9A2315 D2319 E2718A2315-K2317 PolarHBondContact O-N 3.23Å; A2315-K2317 VanDerWaalsContact O-N 3.14Å; K2317-D2319 WeakPolarHBondContact CD-OD1 3.39Å; K2317-D2319 WeakPolarHBondContact CD-OD2 3.29Å; K2317-D2319 IonicContact NZ-OD1 2.73Å; K2317-D2319 IonicContact NZ-OD2 2.7Å; K2317-D2319 PolarHBondContact O-N 2.99Å; K2317-E2718 IonicContact NZ-OE1 3.24Å; K2317-E2718 PolarHBondContact NZ-OE1 3.44Å
2318Y28.2Very low28.3Very low190 Ų190144.5 Ų144.575%0.74574%0.742SS**  trans-41.4117.1138.8-82.5-91.7000109.6K2316 N2320K2316-Y2318 PolarHBondContact O-N 3.16Å; K2316-Y2318 VanDerWaalsContact O-N 3.16Å; Y2318-N2320 PolarHBondContact O-N 2.92Å
2319D31.3Very low28.2Very low119.2 Ų119.2148.4 Ų148.464%0.63775%0.745SS**  -118.4124116.8-77.9-55.7000110.3K2317 E2321K2317-D2319 WeakPolarHBondContact CD-OD1 3.39Å; K2317-D2319 WeakPolarHBondContact CD-OD2 3.29Å; K2317-D2319 IonicContact NZ-OD1 2.73Å; K2317-D2319 IonicContact NZ-OD2 2.7Å; K2317-D2319 PolarHBondContact O-N 2.99Å; D2319-E2321 VanDerWaalsContact C-N 3.32Å; D2319-E2321 PolarHBondContact O-N 3.19Å
2320N26.6Very low28Very low139.2 Ų139.2147.5 Ų147.574%0.74475%0.745SS**  trans-37.988134.6-86.8-37.2000111.8Y2318 K2322Y2318-N2320 PolarHBondContact O-N 2.92Å; N2320-K2322 PolarHBondContact O-N 3.37Å
2321E31.6Very low27.8Very low162.8 Ų162.8147.6 Ų147.676%0.76175%0.745SS**  trans-96.3111.7156.6-76.4-152.2122.200110.3D2319 I2323 P2720 H2721D2319-E2321 VanDerWaalsContact C-N 3.32Å; D2319-E2321 PolarHBondContact O-N 3.19Å; E2321-I2323 VanDerWaalsContact C-N 3.27Å; E2321-I2323 PolarHBondContact O-N 3.14Å; E2321-P2720 VanDerWaalsContact CD-CG 3.49Å; E2321-P2720 HydrophobicContact CG-CG 4.49Å; E2321-P2720 VanDerWaalsContact OE1-CG 3.26Å; E2321-P2720 WeakPolarHBondContact OE1-CG 3.46Å; E2321-H2721 IonicContact OE1-CE1 2.72Å; E2321-H2721 PolarHBondContact OE1-CE1 2.86Å; E2321-H2721 VanDerWaalsContact OE1-CE1 3.22Å; E2321-H2721 IonicContact OE1-CG 3.45Å; E2321-H2721 IonicContact OE1-ND1 3.94Å; E2321-H2721 PolarHBondContact OE1-ND1 3.27Å; E2321-H2721 IonicContact OE1-NE2 2.73Å; E2321-H2721 IonicContact OE2-CE1 3.34Å; E2321-H2721 PolarHBondContact OE2-CE1 3.11Å; E2321-H2721 IonicContact OE2-ND1 3.11Å; E2321-H2721 PolarHBondContact OE2-ND1 3.21Å
2322K27Very low27.8Very low179.8 Ų179.8147.4 Ų147.478%0.78274%0.744SS**  trans-92.4116.2170.3-99.8-177.7177.4179.10109.1N2320 T2324N2320-K2322 PolarHBondContact O-N 3.37Å; K2322-T2324 PolarHBondContact O-N 3.03Å; K2322-T2324 PolarHBondContact O-OG1 3.39Å
2323I30.1Very low27.9Very low145.2 Ų145.2149.4 Ų149.475%0.74575%0.751SS**  trans-80.2109.4166.6-59.3176.9000109.7E2321 F2325E2321-I2323 VanDerWaalsContact C-N 3.27Å; E2321-I2323 PolarHBondContact O-N 3.14Å; I2323-F2325 HydrophobicContact CG2-CD2 3.78Å; I2323-F2325 HydrophobicContact CG2-CE2 3.94Å; I2323-F2325 PolarHBondContact O-N 3.19Å; I2323-F2325 VanDerWaalsContact O-N 3.1Å
2324T24.8Very low28Very low102.4 Ų102.4149.9 Ų149.963%0.62876%0.755SS**  trans-101.2112.6-174-59.30000108.9K2322 T2326K2322-T2324 PolarHBondContact O-N 3.03Å; K2322-T2324 PolarHBondContact O-OG1 3.39Å; T2324-T2326 VanDerWaalsContact C-N 3.26Å; T2324-T2326 HydrophobicContact CG2-CG2 3.73Å; T2324-T2326 PolarHBondContact O-N 3.28Å
2325F27.6Very low28.2Very low192.2 Ų192.2144.4 Ų144.484%0.84375%0.745SS**  trans-105.2108.4157.8-96.3-86000113.2I2323 E2327I2323-F2325 HydrophobicContact CG2-CD2 3.78Å; I2323-F2325 HydrophobicContact CG2-CE2 3.94Å; I2323-F2325 PolarHBondContact O-N 3.19Å; I2323-F2325 VanDerWaalsContact O-N 3.1Å; F2325-E2327 PolarHBondContact O-N 3.1Å
2326T27.2Very low28.4Very low106.4 Ų106.4148.3 Ų148.365%0.65375%0.754SS**  trans-31101.8158.552.60000114.9T2324 K2328T2324-T2326 VanDerWaalsContact C-N 3.26Å; T2324-T2326 HydrophobicContact CG2-CG2 3.73Å; T2324-T2326 PolarHBondContact O-N 3.28Å; T2326-K2328 PolarHBondContact O-N 3.31Å
2327E26.9Very low28.5Very low169 Ų169147.8 Ų147.879%0.7975%0.752SS**  -45.3123118-161.9179-168.900112.3F2325 Q2329F2325-E2327 PolarHBondContact O-N 3.1Å; E2327-Q2329 PolarHBondContact O-N 3.41Å
2328K27.8Very low28.7Very low178 Ų178145.3 Ų145.377%0.77475%0.751SS**  trans-135.7126.6145.4-98.5171.5-176156.40111.1T2326T2326-K2328 PolarHBondContact O-N 3.31Å
2329Q28.8Very low28.6Very low168 Ų168141.6 Ų141.679%0.78575%0.748SS**  trans-61.6110.9153.3-121.8163.32.900113.9E2327E2327-Q2329 PolarHBondContact O-N 3.41Å
2330T27.6Very low28.6Very low119.6 Ų119.6142.8 Ų142.873%0.73475%0.754SS**  trans-149.2126.3140.854.30000110.7
2331D26.3Very low28.8Very low142.6 Ų142.6140.1 Ų140.176%0.76375%0.751SS**  144.2148.171.2-109.3-22.4000114.2
2332V29.9Very low28.9Very low117 Ų117141.6 Ų141.671%0.70976%0.757SS**  trans108.2115.7139171.90000115.1
2333Q29.3Very low29.2Very low178.6 Ų178.6136 Ų13684%0.83575%0.751SS**  64.9129.8127.2-90.5170.917.100116.5
2334S28.1Very low29.4Very low118.6 Ų118.6136.1 Ų136.183%0.82975%0.753SS**  163.7133.9121.382.90000112.4
2335G30.6Very low29.9Very low63.8 Ų63.8138.4 Ų138.466%0.65876%0.761SS**  trans150.3116.3149.800000115.2
2336N31.6Very low30.3Very low160.4 Ų160.4135.5 Ų135.586%0.85876%0.755SS**  trans81.2132.2153.3-68.2-25.5000118.2
2337K29Very low30.6Very low179.2 Ų179.2136.6 Ų136.678%0.77976%0.756SS**  cis141.2142.517-176.3-174.8174.1-174.30113.3T2339K2337-T2339 WeakPolarHBondContact CE-OG1 3.17Å; K2337-T2339 WeakPolarHBondContact CG-OG1 3.46Å
2338V31.5Very low30.8Very low119.4 Ų119.4132 Ų13272%0.72475%0.754SS**  trans94.4109.6164.3-173.20000113.5
2339T27.7Very low31Very low112 Ų112132.2 Ų132.269%0.68775%0.754SS**  cis100.214531.3-48.70000113.8K2337K2337-T2339 WeakPolarHBondContact CE-OG1 3.17Å; K2337-T2339 WeakPolarHBondContact CG-OG1 3.46Å
2340I30.9Very low31Very low145.4 Ų145.4129 Ų12975%0.74675%0.75SS**  trans94.2114.8168.5-52.2174.7000112.2
2341A31.3Very low31.2Very low82.6 Ų82.6132.2 Ų132.268%0.68375%0.754SS**  cis123.5155.137.500000112.3
2342E32.1Very low31.2Very low193.6 Ų193.6133.4 Ų133.491%0.90575%0.753SS**  trans88.3149.5177.5-62.2165.2176.500113.1
2343G33.3Very low31.2Very low63 Ų63135.6 Ų135.665%0.64976%0.755SS**  cis147.1161.12600000111.4
2344D34.7Very low31.1Very low146.6 Ų146.6131.1 Ų131.178%0.78474%0.744SS**  cis156.6165.122.1-81.8-32.8000113.1
2345D36.5Very low31Very low150.2 Ų150.2133.7 Ų133.780%0.80374%0.743SS**  trans82.6149.1142.8-70.6-18.8000117
2346D34.9Very low30.9Very low132.2 Ų132.2138.5 Ų138.571%0.70775%0.748SS**  cis-174.2171.3-6.4-168.421.7000111.5
2347L33.5Very low30.7Very low129.8 Ų129.8137.1 Ų137.168%0.6874%0.74SS**  trans12.5137.5169-71.4103.8000117.5K2349L2347-K2349 HydrophobicContact CD2-CD 4.42Å
2348G31.8Very low30.8Very low71.2 Ų71.2134 Ų13473%0.73474%0.741SS**  cis161136.726.200000116.6
2349K30.6Very low30.6Very low181.6 Ų181.6137.5 Ų137.579%0.7975%0.746SS**  trans39.3140.9172-62165.6-179.5160.40117.8L2347L2347-K2349 HydrophobicContact CD2-CD 4.42Å
2350S30.2Very low30.6Very low100.8 Ų100.8137.1 Ų137.171%0.70575%0.749SS**  140.3151.687.1-820000115.6
2351K30.3Very low30.5Very low186.8 Ų186.8138.9 Ų138.981%0.81275%0.751SS**  113.7135.894.7-99.4167.1-176.9177.50113.7
2352K28Very low30.4Very low168.4 Ų168.4140.8 Ų140.873%0.73275%0.75SS**  92.2133.375.5-117.4-172.2178.8-149.90113.3
2353H28.7Very low30.4Very low162.6 Ų162.6138.6 Ų138.675%0.75374%0.744SS**  trans73.5150153.2-73.1-61.5000116.2
2354S26.9Very low30.2Very low85.4 Ų85.4142.7 Ų142.760%0.59775%0.75SS**  cis179.8158.7-27.846.40000111.8
2355E27.7Very low29.9Very low173.6 Ų173.6141 Ų14181%0.81175%0.75SS**  trans75.6165.8154.9-83.4152.7154.400117.1
2356E28.3Very low29.6Very low164.6 Ų164.6137.2 Ų137.277%0.76975%0.746SS**  trans100.9133.6170.9-87.3-147.8143.500117.6
2357N25.9Very low29.5Very low130.2 Ų130.2136.2 Ų136.270%0.69675%0.749SS**  trans36115.7132.9-66.8-52.1000119.4
2358S31Very low29.2Very low113.4 Ų113.4134.9 Ų134.979%0.79375%0.751SS**  175.4145.1120.8-83.90000115.6
2359K28Very low29.1Very low193 Ų193138.3 Ų138.384%0.83975%0.752SS**  trans-60129.9166-57.7146.2-178.7167.60114
2360S28.8Very low29.1Very low105 Ų105134.4 Ų134.473%0.73475%0.747SS**  149.3138.411456.10000113.9
2361F28.7Very low29.1Very low182.8 Ų182.8137.1 Ų137.180%0.80275%0.748SS**  88.7140.297.9-96.8-104000114.4L2363F2361-L2363 HydrophobicContact CE1-CD1 4.14Å
2362D28.8Very low29.1Very low122 Ų122138.7 Ų138.765%0.65275%0.749SS**  cis-122.3166.532.7-88.2-46.1000114.4L2364D2362-L2364 HydrophobicContact CB-CD1 4.34Å
2363L30.9Very low29.2Very low148 Ų148137.3 Ų137.378%0.77575%0.75SS**  trans148.8142140.8-73.7169.8000115.3F2361F2361-L2363 HydrophobicContact CE1-CD1 4.14Å
2364L29.6Very low29.3Very low147.8 Ų147.8135.8 Ų135.877%0.77475%0.752SS**  163.815062.5-89.1171.1000113D2362D2362-L2364 HydrophobicContact CB-CD1 4.34Å
2365S29.4Very low29.4Very low112.6 Ų112.6134.8 Ų134.879%0.78775%0.754SS**  156.6125.9129.8-81.20000114
2366G30Very low29.6Very low70.4 Ų70.4132.1 Ų132.173%0.72675%0.753SS**  cis122.7139.420.500000115.9
2367S31.7Very low29.7Very low110.2 Ų110.2132 Ų13277%0.77175%0.751SS**  trans149.9145.8156.28.10000114.7
2368S28.2Very low29.9Very low102 Ų102135.1 Ų135.171%0.71376%0.758SS**  trans180134.6132.959.20000114.6
2369L29.8Very low29.8Very low143.6 Ų143.6135.1 Ų135.175%0.75275%0.753SS**  -164.3148.4114.3-85.6157.9000112.6
2370S29.8Very low30Very low99.2 Ų99.2133.3 Ų133.369%0.69475%0.751SS**  -150.515983.656.90000112.6
2371H30.8Very low30.1Very low157.2 Ų157.2133.8 Ų133.873%0.72875%0.749SS**  trans-136.5145.9160.7-91.5-93.4000113.2
2372R30.5Very low30.4Very low221 Ų221130.8 Ų130.883%0.83475%0.748SS**  trans-160152.3138.9-94.1161.4-178.7-165.5-2.2112.4
2373N28.7Very low30.6Very low139 Ų139134.5 Ų134.574%0.74376%0.758SS**  trans130.9145.9152.5-135.28.1000113.1
2374V32.4Very low30.6Very low131.6 Ų131.6132.2 Ų132.280%0.79875%0.754SS**  trans153.5145.3133.1176.70000112.1
2375G29.5Very low30.6Very low62.6 Ų62.6131.5 Ų131.565%0.64576%0.756SS**  trans-179146.5172.800000114.9
2376C30.1Very low30.8Very low117.4 Ų117.4132.9 Ų132.979%0.79375%0.754SS**  trans-147.4143171.9-87.40000114.3
2377K30.4Very low30.7Very low163.8 Ų163.8134.8 Ų134.871%0.71276%0.756SS**  trans-145.4152.2162.8-89.2169.9-174.3149.80112.4L2121L2121-K2377 HydrophobicContact CB-CD 4.22Å; L2121-K2377 HydrophobicContact CD1-CD 4.32Å; L2121-K2377 PolarHBondContact O-NZ 3.06Å
2378K30.4Very low30.8Very low195.4 Ų195.4137.3 Ų137.385%0.8576%0.757SS**  trans-156130155.3-151.1177.5-179-179.20110.3
2379V29.3Very low30.9Very low113.2 Ų113.2138.7 Ų138.769%0.68676%0.757SS**  trans-174.5129.7155.1169.90000110.1T2381V2379-T2381 HydrophobicContact CG1-CG2 4.16Å
2380I31.5Very low31Very low155 Ų155139.8 Ų139.880%0.79576%0.755SS**  -145.714094-85.3168.2000111.3
2381T31.7Very low31.1Very low114.2 Ų114.2143.1 Ų143.170%0.70176%0.759SS**  trans-107166.7-174.750.70000113.6V2379V2379-T2381 HydrophobicContact CG1-CG2 4.16Å
2382P34.6Very low31.2Very low120 Ų120142.7 Ų142.778%0.77976%0.759SS**  trans-117162.8154.137.5-26.9000113.3
2383K32.6Very low31.3Very low200.4 Ų200.4136.4 Ų136.487%0.87175%0.748SS**  trans-147150.8159.6-77.6-170.5177.6-176.50111.1
2384S32Very low31.4Very low99 Ų99136.5 Ų136.569%0.69274%0.743SS**  trans174.2148.9179.6-179.90000110.6
2385V30.1Very low31.2Very low133.8 Ų133.8139 Ų13981%0.81174%0.739SS**  trans-166.2136.5136.8159.40000112.5
2386I31.9Very low31.3Very low142.4 Ų142.4142.2 Ų142.273%0.7374%0.736SS**  trans174.2130.3161.7-65.9176.4000113.6M2388I2386-M2388 HydrophobicContact CG2-CE 4.09Å; I2386-M2388 HydrophobicContact CG2-CG 3.89Å; I2386-M2388 HydrophobicContact CG2-SD 4.49Å
2387S29.7Very low31.3Very low110.8 Ų110.8144.2 Ų144.278%0.77573%0.734SS**  trans-122.2149.7159.5-168.80000110.3
2388M32.5Very low31.6Very low162 Ų162140.8 Ų140.880%0.79873%0.729SS**  trans-150.8162.7168.6-93.2-152.3-113.600112.8I2386I2386-M2388 HydrophobicContact CG2-CE 4.09Å; I2386-M2388 HydrophobicContact CG2-CG 3.89Å; I2386-M2388 HydrophobicContact CG2-SD 4.49Å
2389N30.6Very low31.5Very low131.4 Ų131.4137.9 Ų137.970%0.70372%0.722SS**  trans-145.1153.6175.9-96.7-52.2000115.4
2390K31Very low31.5Very low166.6 Ų166.6138.1 Ų138.172%0.72472%0.72SS**  103.6148.4124.9-79.7171.2-178.81770115.2
2391H33.4Very low31.4Very low167.4 Ų167.4138.7 Ų138.778%0.77572%0.719SS**  158139.889.5-101.6-70000114.6
2392M31.1Very low31.2Very low148.8 Ų148.8138.1 Ų138.173%0.73372%0.72SS**  -73.1155.8106.6-116.617783.700112.5Q2394M2392-Q2394 HydrophobicContact CE-CG 4.18Å
2393P34.4Very low30.9Very low90 Ų90137.4 Ų137.458%0.58472%0.718SS**  cis-147.4-175.549.741.6-22.1000117.8L2520 L2523P2393-L2520 HydrophobicContact CB-CB 4.09Å; P2393-L2520 HydrophobicContact CG-CB 4.28Å; P2393-L2520 HydrophobicContact CG-CD2 4.46Å; P2393-L2523 WeakPolarHBondContact O-CG 3.5Å
2394Q29.4Very low30.7Very low140 Ų140135.2 Ų135.265%0.65471%0.714SS**  trans82.3151.2152.9-84.5-170.436.800120.2M2392 D2521 S2522 L2523M2392-Q2394 HydrophobicContact CE-CG 4.18Å; Q2394-D2521 VanDerWaalsContact O-O 3.09Å; Q2394-S2522 WeakPolarHBondContact CB-O 3.46Å; Q2394-S2522 PolarHBondContact NE2-O 3.02Å; Q2394-L2523 HydrophobicContact CB-CB 4.31Å; Q2394-L2523 HydrophobicContact CB-CG 4.07Å; Q2394-L2523 HydrophobicContact CG-CB 4.48Å; Q2394-L2523 HydrophobicContact CG-CD2 3.95Å; Q2394-L2523 HydrophobicContact CG-CG 3.88Å
2395R28.2Very low30.5Very low185.8 Ų185.8136.8 Ų136.870%0.70172%0.715SS**  147.7147.394.7-111.2176.3178-177.5-0.9116.6
2396H32Very low30.4Very low128.2 Ų128.2137.4 Ų137.459%0.59471%0.714SS**  trans72.6123.2138.6-67.3-59.9000120.6K2419 N2420 E2421H2396-K2419 HydrophobicContact CB-CG 4.33Å; H2396-N2420 PolarHBondContact CD2-OD1 3.42Å; H2396-N2420 PolarHBondContact NE2-OD1 3.02Å; H2396-E2421 IonicContact CE1-OE1 2.58Å; H2396-E2421 PolarHBondContact CE1-OE1 2.82Å; H2396-E2421 IonicContact CE1-OE2 2.94Å; H2396-E2421 PolarHBondContact CE1-OE2 2.87Å; H2396-E2421 IonicContact CG-OE1 3.66Å; H2396-E2421 IonicContact ND1-OE1 2.76Å; H2396-E2421 PolarHBondContact ND1-OE1 3.23Å; H2396-E2421 IonicContact ND1-OE2 2.73Å; H2396-E2421 PolarHBondContact ND1-OE2 3.45Å
2397Q30.3Very low30.3Very low160.8 Ų160.8135.5 Ų135.575%0.75171%0.713SS**  34162.2107.9-91.2-169.2100116.5K2419Q2397-K2419 WeakPolarHBondContact O-CA 3.47Å
2398P36.3Very low30.1Very low91.4 Ų91.4139.9 Ų139.959%0.59472%0.719SS**  cis-137.9-176.8-14.741.4-23.5000116.5
2399N28.2Very low30Very low134.2 Ų134.2138.5 Ų138.572%0.71871%0.713SS**  trans84.3153.2150.4-83.337.6000119
2400D29.8Very low30Very low118.6 Ų118.6136.7 Ų136.763%0.63471%0.711SS**  cis-141.7151.327.7-94.6-45.3000116.8
2401Q29.7Very low29.9Very low167.2 Ų167.2136.7 Ų136.778%0.78172%0.718SS**  trans55.1129.6146.3-77.3165.372.500122
2402S27.7Very low29.7Very low102.2 Ų102.2137.3 Ų137.372%0.71572%0.719SS**  91137.8119.864.70000120.9
2403S27.7Very low29.7Very low105 Ų105135.8 Ų135.873%0.73472%0.718SS**  trans74.8129.9135.773.50000120.7
2404L27.7Very low29.5Very low152.6 Ų152.6139.6 Ų139.680%0.79973%0.725SS**  trans79140.5143.6-67.2166.7000117.2
2405N28.1Very low29.5Very low133 Ų133139.9 Ų139.971%0.71173%0.73SS**  119.2148.799.1-96.8-8.1000119.4
2406N27.8Very low29.7Very low146.8 Ų146.8136.9 Ų136.979%0.78573%0.728SS**  trans17.4137.8155.8-65.8-25.5000117.7
2407S29.8Very low29.6Very low102 Ų102137.8 Ų137.871%0.71374%0.737SS**  -169131.7129230000112.6I2409 T3285S2407-I2409 PolarHBondContact O-N 2.9Å; S2407-T3285 WeakPolarHBondContact OG-CB 3.45Å; S2407-T3285 PolarHBondContact OG-OG1 3.24Å
2408F26.4Very low29.7Very low203 Ų203137.3 Ų137.389%0.8974%0.735SS**  -60.2122.2124.2-117.4-82.3000111.3
2409I31.3Very low29.5Very low133.4 Ų133.4140.2 Ų140.268%0.68474%0.738SS**  trans-162.6121.3170.1-64.1167.3000110.3S2407 L2411 T3287 T3288S2407-I2409 PolarHBondContact O-N 2.9Å; I2409-L2411 HydrophobicContact CG2-CD1 4.46Å; I2409-L2411 HydrophobicContact CG2-CG 4.49Å; I2409-T3287 HydrophobicContact CG1-CG2 4.23Å; I2409-T3287 HydrophobicContact CG2-CG2 4.23Å; I2409-T3288 HydrophobicContact CG2-CG2 4.46Å
2410S28.6Very low29.6Very low93.4 Ų93.4140.1 Ų140.165%0.65374%0.738SS**  154.8119.2104.2-1670000113.5
2411L30Very low29.7Very low166.8 Ų166.8141.1 Ų141.187%0.87374%0.738SS**  trans-143.6116.7151.7-92.9166.2000112.4I2409I2409-L2411 HydrophobicContact CG2-CD1 4.46Å; I2409-L2411 HydrophobicContact CG2-CG 4.49Å
2412K28.1Very low29.8Very low181 Ų181139.5 Ų139.579%0.78774%0.736SS**  trans-165.8129.1174.8-171.4-176-179.2177.50113.5
2413T31.7Very low30Very low117.2 Ų117.2143.7 Ų143.772%0.71974%0.741SS**  trans112.1131.9160.923.50000114.9
2414K30.4Very low30.2Very low170 Ų170143.4 Ų143.474%0.73974%0.737SS**  -145.4143.1101.5-103.5-179.3163.1-109.10112.2D2416K2414-D2416 IonicContact NZ-OD1 3.16Å; K2414-D2416 PolarHBondContact NZ-OD1 3.33Å; K2414-D2416 IonicContact NZ-OD2 3.22Å; K2414-D2416 PolarHBondContact NZ-OD2 3.31Å
2415L29.8Very low30.4Very low144.4 Ų144.4141.3 Ų141.376%0.75673%0.734SS**  trans-120.1154.9133.7-96.995.7000111.4
2416D32.3Very low30.4Very low124.4 Ų124.4141.3 Ų141.367%0.66574%0.739SS**  trans-171.9148.8167.2-67.4-37.6000111.2K2414K2414-D2416 IonicContact NZ-OD1 3.16Å; K2414-D2416 PolarHBondContact NZ-OD1 3.33Å; K2414-D2416 IonicContact NZ-OD2 3.22Å; K2414-D2416 PolarHBondContact NZ-OD2 3.31Å
2417D30.9Very low30.5Very low146.4 Ų146.4139.1 Ų139.178%0.78374%0.742SS**  trans83141.5158.7-87.4-34.5000115.4
2418E32.3Very low30.4Very low150.8 Ų150.8139.1 Ų139.171%0.70574%0.742SS**  140.1145.2115.9-89.7-147.411700115.2
2419K30.6Very low30.6Very low152 Ų152137.2 Ų137.266%0.66174%0.739SS**  176.3155.3129.5-94.9175.4-175.6124.70114.7H2396 Q2397H2396-K2419 HydrophobicContact CB-CG 4.33Å; Q2397-K2419 WeakPolarHBondContact O-CA 3.47Å
2420N31.1Very low30.5Very low131 Ų131137.2 Ų137.270%0.70174%0.741SS**  114.5142.4123.9-93.10.7000116.9H2396H2396-N2420 PolarHBondContact CD2-OD1 3.42Å; H2396-N2420 PolarHBondContact NE2-OD1 3.02Å
2421E31.4Very low30.6Very low139.8 Ų139.8138 Ų13865%0.65374%0.743SS**  100.5139107-93.6-158134.700119.2H2396H2396-E2421 IonicContact CE1-OE1 2.58Å; H2396-E2421 PolarHBondContact CE1-OE1 2.82Å; H2396-E2421 IonicContact CE1-OE2 2.94Å; H2396-E2421 PolarHBondContact CE1-OE2 2.87Å; H2396-E2421 IonicContact CG-OE1 3.66Å; H2396-E2421 IonicContact ND1-OE1 2.76Å; H2396-E2421 PolarHBondContact ND1-OE1 3.23Å; H2396-E2421 IonicContact ND1-OE2 2.73Å; H2396-E2421 PolarHBondContact ND1-OE2 3.45Å
2422N31.3Very low30.5Very low134.8 Ų134.8140.2 Ų140.272%0.72174%0.742SS**  105.1129.6129.7-77.4-47.3000120.3
2423K32.1Very low30.7Very low190.6 Ų190.6137.8 Ų137.883%0.82974%0.742SS**  trans-178.7178.9150.2-117.3-168.8158.2-179.20116.6A3152 R3153K2423-A3152 CarbonylContact O-C 3.55Å; K2423-R3153 PolarHBondContact O-N 3.49Å
2424P33.5Very low30.7Very low99 Ų99137.8 Ų137.864%0.64374%0.742SS**  trans-112.8172.2-13329.9-18.1000116.5P3151 A3152 R3153P2424-P3151 HydrophobicContact CB-CB 3.84Å; P2424-P3151 HydrophobicContact CG-CB 4.42Å; P2424-A3152 CarbonylContact O-C 3.55Å; P2424-A3152 WeakPolarHBondContact O-CA 3.46Å; P2424-A3152 WeakPolarHBondContact O-CB 3.43Å; P2424-R3153 PolarHBondContact O-N 3.24Å; P2424-R3153 VanDerWaalsContact O-N 3.14Å
2425S30.3Very low31Very low107.2 Ų107.2134.7 Ų134.775%0.7574%0.737SS**  trans-145.6134.9146.557.30000112.4
2426T28.1Very low31.2Very low133.2 Ų133.2136.1 Ų136.182%0.81774%0.74SS**  trans24.7128.8131.849.80000118.3L3150T2426-L3150 WeakPolarHBondContact OG1-CD2 3.24Å
2427A29.8Very low31.2Very low101 Ų101136.8 Ų136.884%0.83574%0.744SS**  trans-168.8130.6156.500000112.2
2428S27.9Very low31.5Very low102.6 Ų102.6136.5 Ų136.572%0.71774%0.738SS**  trans-87.8152.4166.4155.20000112.5D2430S2428-D2430 WeakPolarHBondContact CB-OD1 3.23Å; S2428-D2430 PolarHBondContact OG-OD1 3.4Å; S2428-D2430 PolarHBondContact OG-OD2 3.15Å; S2428-D2430 VanDerWaalsContact OG-OD2 3.1Å
2429I31.2Very low31.5Very low163 Ų163136.5 Ų136.584%0.83674%0.738SS**  trans-134.2122164.1-69.8172.8000108.1
2430D28.3Very low31.6Very low133 Ų133134.1 Ų134.171%0.71174%0.74SS**  trans-96.4150.6176.7-67.8-62.7000111.6S2428 Y2432S2428-D2430 WeakPolarHBondContact CB-OD1 3.23Å; S2428-D2430 PolarHBondContact OG-OD1 3.4Å; S2428-D2430 PolarHBondContact OG-OD2 3.15Å; S2428-D2430 VanDerWaalsContact OG-OD2 3.1Å; D2430-Y2432 PolarHBondContact O-N 3.15Å
2431P31.1Very low31.6Very low108.8 Ų108.8133.5 Ų133.571%0.70674%0.735SS**  trans-99.6113.4-166.536.8-33.1000114
2432Y29.2Very low31.6Very low214.8 Ų214.8132.6 Ų132.684%0.84274%0.739SS**  trans-160.7115.4161.9-81.3-72.1000114.4D2430D2430-Y2432 PolarHBondContact O-N 3.15Å
2433T31.6Very low31.6Very low129 Ų129130.8 Ų130.879%0.79173%0.733SS**  trans-157.6108.8144.4-52.50000111.3T2435T2433-T2435 HydrophobicContact CG2-CG2 4.24Å
2434V31.4Very low31.5Very low117.6 Ų117.6126.4 Ų126.471%0.71372%0.724SS**  trans-70.7130.6156.5176.30000110.1E2438V2434-E2438 HydrophobicContact CG1-CB 4Å; V2434-E2438 VanDerWaalsContact CG1-OE2 3.27Å; V2434-E2438 WeakPolarHBondContact CG1-OE2 3.46Å
2435T36.8Very low31.3Very low106.2 Ų106.2128.9 Ų128.965%0.65273%0.731SS**  trans-94146.3168.238.20000111.5T2433 D2437 E2438T2433-T2435 HydrophobicContact CG2-CG2 4.24Å; T2435-D2437 PolarHBondContact O-N 3.16Å; T2435-D2437 VanDerWaalsContact O-N 3.09Å; T2435-E2438 PolarHBondContact O-N 3.05Å
2436Q33.7Very low31.2Very low172.4 Ų172.4129.7 Ų129.781%0.80673%0.726SS**G310 helixtrans-71.824-172.8-120.8164.5-31.700112.8E2438Q2436-E2438 VanDerWaalsContact C-N 3.34Å; Q2436-E2438 PolarHBondContact O-N 2.97Å
2437D33.3Very low31.3Very low140.6 Ų140.6128.4 Ų128.475%0.75272%0.719SS**G310 helixtrans-109.5-7.2162.2-75.4-45.1000112.4T2435 Q2439 S2440T2435-D2437 PolarHBondContact O-N 3.16Å; T2435-D2437 VanDerWaalsContact O-N 3.09Å; D2437-Q2439 VanDerWaalsContact C-N 3.27Å; D2437-Q2439 PolarHBondContact O-N 3.17Å; D2437-S2440 WeakPolarHBondContact O-CB 3.33Å; D2437-S2440 PolarHBondContact O-N 3.18Å; D2437-S2440 VanDerWaalsContact O-N 3.09Å; D2437-S2440 PolarHBondContact O-OG 3.15Å
2438E35.7Very low31.2Very low139.8 Ų139.8129.1 Ų129.165%0.65371%0.708SS**G310 helixtrans-80.121.8177.9-74.8-166125.700113.5V2434 T2435 Q2436 S2440 R2909V2434-E2438 HydrophobicContact CG1-CB 4Å; V2434-E2438 VanDerWaalsContact CG1-OE2 3.27Å; V2434-E2438 WeakPolarHBondContact CG1-OE2 3.46Å; T2435-E2438 PolarHBondContact O-N 3.05Å; Q2436-E2438 VanDerWaalsContact C-N 3.34Å; Q2436-E2438 PolarHBondContact O-N 2.97Å; E2438-S2440 VanDerWaalsContact C-N 3.25Å; E2438-S2440 PolarHBondContact O-N 3.03Å; E2438-R2909 IonicContact OE1-NH2 3.74Å; E2438-R2909 PolarHBondContact OE1-NH2 3.3Å
2439Q33.6Very low31.2Very low151 Ų151129.9 Ų129.971%0.70671%0.709SS**G310 helixtrans-90.320.4172.7-70.1-178.1-16.900112.3D2437 I2441 D2820D2437-Q2439 VanDerWaalsContact C-N 3.27Å; D2437-Q2439 PolarHBondContact O-N 3.17Å; Q2439-I2441 VanDerWaalsContact C-N 3.33Å; Q2439-I2441 PolarHBondContact O-N 3.49Å; Q2439-D2820 PolarHBondContact NE2-OD1 3.39Å; Q2439-D2820 PolarHBondContact NE2-OD2 2.91Å
2440S31.4Very low31.1Very low100 Ų100129.9 Ų129.970%0.69971%0.705SS**G310 helixtrans-115.6-14.2170.460.90000113.1D2437 E2438 V2442D2437-S2440 WeakPolarHBondContact O-CB 3.33Å; D2437-S2440 PolarHBondContact O-N 3.18Å; D2437-S2440 VanDerWaalsContact O-N 3.09Å; D2437-S2440 PolarHBondContact O-OG 3.15Å; E2438-S2440 VanDerWaalsContact C-N 3.25Å; E2438-S2440 PolarHBondContact O-N 3.03Å; S2440-V2442 VanDerWaalsContact C-N 3.27Å; S2440-V2442 PolarHBondContact O-N 3.43Å
2441I31.5Very low31Very low119.6 Ų119.6128.2 Ų128.261%0.61370%0.704SS**  trans-56.672.1-177.7-44.8177.9000111.8Q2439 T2443 L3133Q2439-I2441 VanDerWaalsContact C-N 3.33Å; Q2439-I2441 PolarHBondContact O-N 3.49Å; I2441-T2443 VanDerWaalsContact C-N 3.28Å; I2441-T2443 WeakPolarHBondContact CG2-OG1 3.36Å; I2441-T2443 PolarHBondContact O-N 3.05Å; I2441-L3133 HydrophobicContact CD1-CD2 4.05Å
2442V31.1Very low30.8Very low119.8 Ų119.8128.6 Ų128.673%0.72671%0.705SS**  trans-99.1122.1149-1790000108.8S2440 P2444S2440-V2442 VanDerWaalsContact C-N 3.27Å; S2440-V2442 PolarHBondContact O-N 3.43Å; V2442-P2444 WeakPolarHBondContact O-CD 3.38Å
2443T32.5Very low30.9Very low98.4 Ų98.4124.9 Ų124.960%0.60470%0.704SS**  trans-71.9136.4177.6-34.40000112.1I2441 L2445 R2868 F2978I2441-T2443 VanDerWaalsContact C-N 3.28Å; I2441-T2443 WeakPolarHBondContact CG2-OG1 3.36Å; I2441-T2443 PolarHBondContact O-N 3.05Å; T2443-L2445 PolarHBondContact O-N 2.91Å; T2443-R2868 PolarHBondContact OG1-NH2 3.03Å; T2443-F2978 HydrophobicContact CG2-CZ 4.1Å
2444P29.4Very low30.7Very low97.2 Ų97.2123.2 Ų123.263%0.63170%0.703SS**  trans-83.3136.3-16731-32000112V2442 L2446V2442-P2444 WeakPolarHBondContact O-CD 3.38Å; P2444-L2446 PolarHBondContact O-N 3.07Å; P2444-L2446 VanDerWaalsContact O-N 3.15Å
2445L28.5Very low30.6Very low150.8 Ų150.8128 Ų12879%0.7971%0.708SS**  trans-71117.9165.3-90.7146.8000109.5T2443 T2447T2443-L2445 PolarHBondContact O-N 2.91Å; L2445-T2447 HydrophobicContact CB-CG2 4.27Å; L2445-T2447 PolarHBondContact O-N 3.11Å; L2445-T2447 PolarHBondContact O-OG1 3.28Å
2446L29.5Very low30.2Very low125 Ų125130.8 Ų130.865%0.65471%0.714SS**  trans-84.3109.9164.5-74.9170.7000109.7P2444 D2448 R2896P2444-L2446 PolarHBondContact O-N 3.07Å; P2444-L2446 VanDerWaalsContact O-N 3.15Å; L2446-D2448 WeakPolarHBondContact CB-OD1 3.24Å; L2446-D2448 PolarHBondContact O-N 3.14Å; L2446-D2448 VanDerWaalsContact O-N 3.16Å; L2446-R2896 PolarHBondContact O-NH2 3.19Å
2447T29.1Very low30Very low106.2 Ų106.2128.9 Ų128.965%0.65271%0.714SS**  trans-72.792.2162.648.90000110.1L2445 T2449L2445-T2447 HydrophobicContact CB-CG2 4.27Å; L2445-T2447 PolarHBondContact O-N 3.11Å; L2445-T2447 PolarHBondContact O-OG1 3.28Å; T2447-T2449 VanDerWaalsContact C-N 3.3Å; T2447-T2449 PolarHBondContact O-N 3.21Å; T2447-T2449 PolarHBondContact O-OG1 3.15Å; T2447-T2449 VanDerWaalsContact O-OG1 3.09Å
2448D28.8Very low29.8Very low115.4 Ų115.4128.4 Ų128.462%0.61772%0.716SS**  trans-71118.1172.8-65.4-39.6000109.9L2446 E2450 R2896L2446-D2448 WeakPolarHBondContact CB-OD1 3.24Å; L2446-D2448 PolarHBondContact O-N 3.14Å; L2446-D2448 VanDerWaalsContact O-N 3.16Å; D2448-E2450 VanDerWaalsContact C-N 3.31Å; D2448-E2450 HydrophobicContact CB-CG 4.33Å; D2448-E2450 PolarHBondContact O-N 3.02Å; D2448-R2896 VanDerWaalsContact CG-NH2 3.34Å; D2448-R2896 IonicContact OD1-NH2 2.68Å; D2448-R2896 PolarHBondContact OD1-NH2 3.27Å; D2448-R2896 IonicContact OD2-CZ 3.18Å; D2448-R2896 IonicContact OD2-NE 3.83Å; D2448-R2896 PolarHBondContact OD2-NE 2.81Å; D2448-R2896 IonicContact OD2-NH2 3.92Å; D2448-R2896 PolarHBondContact OD2-NH2 3.19Å
2449T28.4Very low29.7Very low119 Ų119127.3 Ų127.373%0.7372%0.722SS**  trans-107.786.2175.120.60000109.6T2447 S2451T2447-T2449 VanDerWaalsContact C-N 3.3Å; T2447-T2449 PolarHBondContact O-N 3.21Å; T2447-T2449 PolarHBondContact O-OG1 3.15Å; T2447-T2449 VanDerWaalsContact O-OG1 3.09Å; T2449-S2451 PolarHBondContact O-N 2.97Å; T2449-S2451 PolarHBondContact O-OG 3.21Å
2450E27.2Very low29.5Very low163.8 Ų163.8129.5 Ų129.577%0.76573%0.732SS**  trans-71.5101.4173.1-70.2-169.8127.200112.8D2448 T2452D2448-E2450 VanDerWaalsContact C-N 3.31Å; D2448-E2450 HydrophobicContact CB-CG 4.33Å; D2448-E2450 PolarHBondContact O-N 3.02Å; E2450-T2452 PolarHBondContact O-N 3.23Å
2451S26.9Very low29.4Very low97.4 Ų97.4129.7 Ų129.768%0.68173%0.733SS**  trans-118.980.5161.856.20000112.2E2220 T2449 V2453E2220-S2451 WeakPolarHBondContact OE1-CB 3.46Å; E2220-S2451 PolarHBondContact OE1-OG 3.04Å; T2449-S2451 PolarHBondContact O-N 2.97Å; T2449-S2451 PolarHBondContact O-OG 3.21Å; S2451-V2453 VanDerWaalsContact C-N 3.27Å; S2451-V2453 PolarHBondContact O-N 3.07Å
2452T28.3Very low29.3Very low117.4 Ų117.4131.3 Ų131.372%0.7274%0.74SS**  trans-116.9115.8163.9-34.60000111.2E2450 A2454E2450-T2452 PolarHBondContact O-N 3.23Å; T2452-A2454 PolarHBondContact O-N 3.46Å; T2452-A2454 VanDerWaalsContact O-N 3.16Å
2453V29.6Very low29.2Very low136.4 Ų136.4133.6 Ų133.683%0.82774%0.74SS**  trans-94.4117.9174.4167.40000109.9S2451 R2455S2451-V2453 VanDerWaalsContact C-N 3.27Å; S2451-V2453 PolarHBondContact O-N 3.07Å; V2453-R2455 PolarHBondContact O-N 3.3Å
2454A28.1Very low29.1Very low93.4 Ų93.4135.8 Ų135.877%0.77275%0.747SS**  trans-77.7138.1167.500000111.5T2452T2452-A2454 PolarHBondContact O-N 3.46Å; T2452-A2454 VanDerWaalsContact O-N 3.16Å
2455R29.8Very low29.2Very low218.2 Ų218.2138.7 Ų138.782%0.82375%0.752SS**  trans-140128.7162.4-161.3172.8166.9147.10.3109.5V2453 S2585 I2586 A2587 E2588V2453-R2455 PolarHBondContact O-N 3.3Å; R2455-S2585 PolarHBondContact NH1-O 3.34Å; R2455-I2586 PolarHBondContact NH1-O 3.49Å; R2455-I2586 PolarHBondContact NH2-O 2.97Å; R2455-A2587 PolarHBondContact NH2-O 3.46Å; R2455-E2588 IonicContact CZ-OE2 2.72Å; R2455-E2588 VanDerWaalsContact CZ-OE2 3.24Å; R2455-E2588 IonicContact NE-OE2 3.39Å; R2455-E2588 PolarHBondContact NE-OE2 3.29Å; R2455-E2588 IonicContact NH2-OE1 3.26Å; R2455-E2588 PolarHBondContact NH2-OE1 2.71Å; R2455-E2588 IonicContact NH2-OE2 2.73Å; R2455-E2588 PolarHBondContact NH2-OE2 2.99Å
2456E27Very low29.2Very low164.8 Ų164.8137 Ų13777%0.7775%0.748SS**  trans-71147.2-178-56.2170.4111.200112.5
2457T31.2Very low29.2Very low132.6 Ų132.6135.8 Ų135.881%0.81375%0.749SS**  trans-171.7123.7143.713.50000112.2
2458T29.2Very low29.2Very low129.4 Ų129.4138.7 Ų138.779%0.79476%0.755SS**  trans-75.3154.7161.841.60000113.8
2459P32.1Very low29.3Very low117.6 Ų117.6140.1 Ų140.176%0.76476%0.758SS**  trans-110.1163.1-151.736.1-27.5000114.2
2460E30Very low29.4Very low196.8 Ų196.8140.6 Ų140.692%0.9275%0.752SS**  trans-151.2145150.5-114.5177.2-175.300114.4
2461S28.8Very low29.6Very low105.4 Ų105.4139.4 Ų139.474%0.73775%0.75SS**  trans-148.7153.1176.1-159.60000116.8
2462M30.3Very low29.7Very low152.8 Ų152.8144.6 Ų144.675%0.75376%0.755SS**  trans81.7138.9153-61.2-158.8-171.500117.7
2463K28.7Very low29.8Very low167 Ų167149.9 Ų149.973%0.72676%0.762SS**  cis175.2156.324.2-101.6174.4-175.81710112.6
2464I30.5Very low29.9Very low144.4 Ų144.4146.7 Ų146.774%0.74176%0.756SS**  trans70.6126.6139.1-65.2165.8000115.3
2465Q30.3Very low30Very low159.6 Ų159.6147.8 Ų147.875%0.74676%0.758SS**  cis151.1154.924.5-151.1174.8-29.100111.9
2466T29.4Very low30.2Very low113.4 Ų113.4143.3 Ų143.370%0.69676%0.755SS**  trans163.2157.7144.68.90000113.9
2467C29.5Very low30.3Very low100 Ų100142.2 Ų142.268%0.67675%0.754SS**  cis167.7159.837.5-88.70000114.4
2468E30.1Very low30.1Very low167 Ų167140.7 Ų140.778%0.7875%0.748SS**  73.5156.897.5-77.2167.7138.700116.1
2469E30.4Very low30.2Very low145.6 Ų145.6144.1 Ų144.168%0.6875%0.752SS**  cis-168.2150.37.1-149.2-178.7156.100111.6I2275I2275-E2469 HydrophobicContact CD1-CG 4.24Å
2470Q29.5Very low30Very low128.6 Ų128.6143.8 Ų143.860%0.60175%0.752SS**  trans64.7141.6141.1-63.1-84.611.600121.7I2275I2275-Q2470 HydrophobicContact CD1-CB 3.48Å; I2275-Q2470 VanDerWaalsContact CD1-CB 3.48Å; I2275-Q2470 HydrophobicContact CD1-CG 4.28Å; I2275-Q2470 HydrophobicContact CG1-CB 4.24Å; I2275-Q2470 VanDerWaalsContact CG2-NE2 3.34Å
2471L31.3Very low30.2Very low139.8 Ų139.8140 Ų14073%0.73275%0.745SS**  -179.3140102.7-147.873000114.6I2275I2275-L2471 HydrophobicContact CD1-CB 4.25Å; I2275-L2471 HydrophobicContact CG1-CB 4.05Å; I2275-L2471 HydrophobicContact CG1-CD2 3.68Å; I2275-L2471 HydrophobicContact CG1-CG 4.49Å
2472R29.5Very low30.3Very low206 Ų206144.2 Ų144.278%0.77775%0.75SS**  trans-106.9147.6163-67.1-177.2168.7-179.1-0.3117
2473R31.3Very low30.1Very low230 Ų230148.1 Ų148.187%0.86876%0.756SS**  153.6143.4118.8-90.4168.4-173.2-116.73.1114.1
2474G30.9Very low30.1Very low68.4 Ų68.4146.3 Ų146.371%0.70576%0.759SS**  trans120.6135.3130.800000115E2265E2265-G2474 PolarHBondContact OE1-N 2.96Å
2475S30.6Very low30Very low117 Ų117144.5 Ų144.582%0.81876%0.755SS**  72.7139.169.3-152.80000115.8
2476T32.8Very low29.9Very low123.6 Ų123.6144.5 Ų144.576%0.75876%0.759SS**  -171.7143.792.5490000114.8
2477D29.8Very low29.8Very low140.8 Ų140.8147.8 Ų147.875%0.75376%0.764SS**  trans73.7142.3139.4-93.8-28.5000120.5
2478C26.8Very low29.8Very low101.4 Ų101.4152.9 Ų152.969%0.68578%0.775SS**  59.3132.985.9-83.30000119.3
2479K31.5Very low29.7Very low201 Ų201150.4 Ų150.487%0.87478%0.776SS**  trans162.8142.4141.6-79.6157.2-172.1161.50116
2480S27.2Very low29.6Very low110.6 Ų110.6153.2 Ų153.277%0.77379%0.786SS**  trans-104.1160.4172.457.80000112.5
2481P34.7Very low29.6Very low117 Ų117158.7 Ų158.776%0.7680%0.801SS**  trans-116.7150.7149.335.4-24.3000112.9
2482K31.1Very low29.5Very low193.8 Ų193.8155.5 Ų155.584%0.84380%0.802SS**  trans-103.1124140.5-71.6173.5-178.8174.80114V2484K2482-V2484 WeakPolarHBondContact O-CG2 3.22Å; K2482-V2484 PolarHBondContact O-N 3.1Å
2483R26.7Very low29.5Very low235 Ų235151.2 Ų151.289%0.88780%0.803SS**  trans6.4115.1135.4-131.7-177-173.1163.52.8114.6
2484V29.2Very low29.4Very low129.8 Ų129.8144.3 Ų144.379%0.78780%0.795SS**  trans-115.4130.1156.4177.50000108.6K2482 L2486K2482-V2484 WeakPolarHBondContact O-CG2 3.22Å; K2482-V2484 PolarHBondContact O-N 3.1Å; V2484-L2486 HydrophobicContact CG1-CB 4.37Å; V2484-L2486 HydrophobicContact CG1-CD1 3.65Å; V2484-L2486 HydrophobicContact CG1-CD2 4.31Å; V2484-L2486 HydrophobicContact CG1-CG 3.58Å; V2484-L2486 PolarHBondContact O-N 3.44Å
2485T28Very low29.2Very low106.6 Ų106.6150.4 Ų150.465%0.65480%0.803SS**  trans-115.3116.6177.4-54.70000109K2487T2485-K2487 VanDerWaalsContact C-N 3.34Å; T2485-K2487 PolarHBondContact O-N 3.28Å; T2485-K2487 VanDerWaalsContact O-N 3.13Å
2486L28.6Very low29Very low159.2 Ų159.2150 Ų15083%0.83480%0.795SS**  trans-95.7119.4174-74174.6000110.7V2484V2484-L2486 HydrophobicContact CG1-CB 4.37Å; V2484-L2486 HydrophobicContact CG1-CD1 3.65Å; V2484-L2486 HydrophobicContact CG1-CD2 4.31Å; V2484-L2486 HydrophobicContact CG1-CG 3.58Å; V2484-L2486 PolarHBondContact O-N 3.44Å
2487K27.4Very low28.8Very low183.2 Ų183.2153.1 Ų153.180%0.79780%0.799SS**  trans-99.4138.5172-70.3-176.8175.6-177.50109.4T2485 S2489T2485-K2487 VanDerWaalsContact C-N 3.34Å; T2485-K2487 PolarHBondContact O-N 3.28Å; T2485-K2487 VanDerWaalsContact O-N 3.13Å; K2487-S2489 PolarHBondContact O-N 3.14Å
2488F27.6Very low28.8Very low207 Ų207154.1 Ų154.191%0.90880%0.799SS**  trans-66.6141.6166.4-72.7-81.8000111.1K2490F2488-K2490 PolarHBondContact O-N 3.43Å
2489S29.7Very low29Very low114.2 Ų114.2156 Ų15680%0.79980%0.802SS**  trans-120125.3-174.7-169.40000113K2487 R2491K2487-S2489 PolarHBondContact O-N 3.14Å; S2489-R2491 PolarHBondContact O-N 2.95Å
2490K28.2Very low29Very low205 Ų205153 Ų15389%0.89179%0.791SS**  trans-84.1100.1171.5-171.3174.6-178.4174.30112.7F2488 G2492F2488-K2490 PolarHBondContact O-N 3.43Å; K2490-G2492 PolarHBondContact O-N 3.4Å
2491R29.5Very low29.3Very low243 Ų243155.9 Ų155.992%0.91779%0.79SS**  trans-138.3134.8162.7-124.5-179.3-133.8-171.70.5109.6S2489S2489-R2491 PolarHBondContact O-N 2.95Å
2492G28.5Very low29.1Very low73.4 Ų73.4159.1 Ų159.176%0.75779%0.792SS**  trans174.5128.6-178.500000112.2K2490K2490-G2492 PolarHBondContact O-N 3.4Å
2493S29.5Very low29.2Very low114.6 Ų114.6155.2 Ų155.280%0.80179%0.786SS**  trans164.9123.7153.6-163.40000110.2
2494A28.6Very low29.5Very low85.2 Ų85.2153.4 Ų153.470%0.70479%0.785SS**  trans-93.9133.7136.500000111.7
2495F27.4Very low29.8Very low197.2 Ų197.2152.5 Ų152.587%0.86578%0.782SS**  trans-121146.2146.4-108.9-98000109.5
2496V27.3Very low29.9Very low108.4 Ų108.4155 Ų15566%0.65779%0.789SS**  -179.6131.7128.7167.90000110.9Q2498V2496-Q2498 HydrophobicContact CG1-CG 4.3Å
2497F28.5Very low30Very low188.2 Ų188.2158.6 Ų158.683%0.82579%0.792SS**  trans-138.8142.8133.6-106.4-79.2000112.4
2498Q28.8Very low30.3Very low163 Ų163153.7 Ų153.776%0.76279%0.785SS**  trans-87.2141.1150.5-84.3173.4-30.500113.2V2496V2496-Q2498 HydrophobicContact CG1-CG 4.3Å
2499D31.7Very low30.4Very low141.2 Ų141.2150.5 Ų150.576%0.75578%0.778SS**  -155.5160.5108.4-137.1-6.2000111.2K2501D2499-K2501 IonicContact OD1-NZ 3.09Å; D2499-K2501 PolarHBondContact OD1-NZ 3.43Å; D2499-K2501 IonicContact OD2-NZ 3.64Å; D2499-K2501 PolarHBondContact OD2-NZ 3.5Å; D2499-K2501 VanDerWaalsContact OD2-NZ 3.09Å
2500E30Very low30.5Very low137.8 Ų137.8149.8 Ų149.864%0.64477%0.773SS**  trans-112.1168.4-166.2-89.9-150.2132.700113.2K2502E2500-K2502 PolarHBondContact OE1-N 3.41Å
2501K34.1Very low30.7Very low170.6 Ų170.6145 Ų14574%0.74277%0.765SS**  -179.7125.3105.8-102.2154.7-160.7113.40117.2D2499D2499-K2501 IonicContact OD1-NZ 3.09Å; D2499-K2501 PolarHBondContact OD1-NZ 3.43Å; D2499-K2501 IonicContact OD2-NZ 3.64Å; D2499-K2501 PolarHBondContact OD2-NZ 3.5Å; D2499-K2501 VanDerWaalsContact OD2-NZ 3.09Å
2502K30Very low30.7Very low184.8 Ų184.8138.5 Ų138.580%0.80376%0.757SS**  trans31.6153.4141.9-100.3174.6-178.71660119.2E2500E2500-K2502 PolarHBondContact OE1-N 3.41Å
2503P33.8Very low30.9Very low112 Ų112142.9 Ų142.973%0.72776%0.758SS**  trans-131.5162.8-13639.4-24.4000116.4
2504K32.4Very low30.9Very low196.6 Ų196.6142.2 Ų142.286%0.85575%0.748SS**  102.2147.6129.7-91.6-177178.3-175.40116.5
2505P36.1Very low31Very low112.2 Ų112.2145.6 Ų145.673%0.72975%0.75SS**  trans-117.5-177.4-15439.8-28.2000113.9
2506I31.1Very low31.1Very low157.4 Ų157.4143.7 Ų143.781%0.80774%0.743SS**  trans179.6129.1152.2-92.1151.3000113.8
2507R30.3Very low31.2Very low236.6 Ų236.6142.6 Ų142.689%0.89375%0.746SS**  trans30.7141.4149.2-82.8-179.9176.4152.7-1.8122.6
2508A32.3Very low31.3Very low79 Ų79141.6 Ų141.665%0.65374%0.744SS**  116.9159.985.600000115.9
2509D30.9Very low31.6Very low139.8 Ų139.8137.6 Ų137.675%0.74873%0.732SS**  120.9121.3105.1-88.5-42.8000118.1
2510S31.8Very low31.4Very low99.4 Ų99.4137.4 Ų137.470%0.69573%0.73SS**  trans72.8143.1132.4-22.30000121.5
2511S31.1Very low31.3Very low105.2 Ų105.2136.7 Ų136.774%0.73673%0.731SS**  trans120.1152.214268.40000116.5
2512S31.1Very low31.1Very low106 Ų106132.6 Ų132.674%0.74172%0.723SS**  107.9162.9118.568.70000116
2513H31.5Very low31Very low165.8 Ų165.8130.9 Ų130.977%0.76872%0.722SS**  trans149.9131.3140.7-123.5-122.2000112.9
2514V30.8Very low30.7Very low98.8 Ų98.8129.8 Ų129.860%0.59972%0.717SS**  79.6126.393.8152.30000116.1Q2516V2514-Q2516 HydrophobicContact CG1-CB 4.44Å
2515Q30.4Very low30.6Very low158.6 Ų158.6126.9 Ų126.974%0.74171%0.711SS**  159.1150.585.3-123.2162.5-2600116.3
2516Q28.7Very low30.2Very low156.8 Ų156.8126.3 Ų126.373%0.73371%0.709SS**  106.213282.1-141.9177.4-9.600116.4V2514 Q2518V2514-Q2516 HydrophobicContact CG1-CB 4.44Å; Q2516-Q2518 HydrophobicContact CG-CG 3.53Å
2517A30.8Very low30.1Very low85.2 Ų85.2124.1 Ų124.170%0.70470%0.703SS**  trans154.5102.5147.100000114.7P2519A2517-P2519 VanDerWaalsContact C-CD 3.47Å; A2517-P2519 WeakPolarHBondContact O-CD 3.32Å
2518Q29.9Very low30Very low167.6 Ų167.6118.8 Ų118.878%0.78369%0.692SS**  39.4170.1119-80.5-138.3-49.500116.3Q2516Q2516-Q2518 HydrophobicContact CG-CG 3.53Å
2519P34.7Very low29.8Very low78.2 Ų78.2122.7 Ų122.751%0.50870%0.697SS.*  -142.2-179.4-110.640.3-20.4000117.2A2517A2517-P2519 VanDerWaalsContact C-CD 3.47Å; A2517-P2519 WeakPolarHBondContact O-CD 3.32Å
2520L28.1Very low29.6Very low137.2 Ų137.2122.1 Ų122.172%0.71869%0.692SS**  trans104.2147.9147.7-96.8102.4000116.1P2393P2393-L2520 HydrophobicContact CB-CB 4.09Å; P2393-L2520 HydrophobicContact CG-CB 4.28Å; P2393-L2520 HydrophobicContact CG-CD2 4.46Å
2521D28.2Very low29.5Very low123.4 Ų123.4124.5 Ų124.566%0.6669%0.692SS**  trans-160.4155-174.2-107.3-0.6000114.1Q2394Q2394-D2521 VanDerWaalsContact O-O 3.09Å
2522S28.6Very low29.4Very low83.4 Ų83.4127.5 Ų127.558%0.58369%0.692SS**  cis-178.2160.826.415.70000113.9Q2394Q2394-S2522 WeakPolarHBondContact CB-O 3.46Å; Q2394-S2522 PolarHBondContact NE2-O 3.02Å
2523L29.1Very low29.3Very low150.2 Ų150.2127.6 Ų127.679%0.78669%0.693SS**  trans32.6160.4168.2-74.3168.4000116.8P2393 Q2394P2393-L2523 WeakPolarHBondContact O-CG 3.5Å; Q2394-L2523 HydrophobicContact CB-CB 4.31Å; Q2394-L2523 HydrophobicContact CB-CG 4.07Å; Q2394-L2523 HydrophobicContact CG-CB 4.48Å; Q2394-L2523 HydrophobicContact CG-CD2 3.95Å; Q2394-L2523 HydrophobicContact CG-CG 3.88Å
2524S26.8Very low29.3Very low88.8 Ų88.8129.3 Ų129.362%0.62170%0.698SS**  trans117.4142.1178.463.50000115.1
2525D30Very low29.3Very low135.4 Ų135.4135.6 Ų135.672%0.72471%0.711SS**  trans102.4133133.4-78.2-52.9000118.2
2526S28.1Very low29.4Very low99 Ų99131.9 Ų131.969%0.69271%0.708SS**  trans165.5123.3130.1-81.20000116
2527V28.5Very low29.4Very low111.4 Ų111.4130.9 Ų130.968%0.67571%0.708SS**  77.4117.2124174.60000116.1
2528N28.7Very low29.4Very low125.8 Ų125.8134.9 Ų134.967%0.67371%0.709SS**  trans69.7129.5151.1-67.7-27.9000120.9
2529Q28.2Very low29.5Very low161.6 Ų161.6133.9 Ų133.976%0.75571%0.705SS**  113.5123.9121.2-90.1-174.252.800117.8
2530I26.8Very low29.3Very low125.8 Ų125.8138.1 Ų138.165%0.64572%0.718SS**  116122124.5-82.5175.3000116.1
2531H30.1Very low29.5Very low150.2 Ų150.2137.2 Ų137.270%0.69572%0.723SS**  trans86.6137.1144.5-80.3-117.3000121.1
2532K28.5Very low29.4Very low167.6 Ų167.6140.6 Ų140.673%0.72973%0.731SS**  94.2118.3126.6-76.8166.8-179.6162.30118
2533S29.1Very low29.6Very low109.2 Ų109.2142.3 Ų142.376%0.76474%0.741SS**  79.5145.9111.5-71.50000119.3
2534K30.7Very low29.5Very low200.4 Ų200.4140 Ų14087%0.87174%0.737SS**  trans-162.2142.2138-95.6169.9-177.11750111.5
2535R30.3Very low29.8Very low231.6 Ų231.6143.4 Ų143.487%0.87475%0.745SS**  trans-164.2136.2151.2-145.1-172.4-177.1177.91.4110.5
2536A33.4Very low29.7Very low81.8 Ų81.8142.1 Ų142.168%0.67674%0.744SS**  -179.214154.200000110.9
2537N29.4Very low29.6Very low135.2 Ų135.2144.2 Ų144.272%0.72375%0.746SS**  trans87.2148.8133.7-75.41.3000112.7
2538F30.2Very low29.6Very low169.4 Ų169.4146 Ų14674%0.74375%0.75SS**  cis-164.1152.835.8-107.1-89.1000113.2
2539Q32.5Very low29.5Very low145.6 Ų145.6144.8 Ų144.868%0.6875%0.752SS**  trans49142.7157.8-81.4170-19.900118.1
2540Q30.7Very low29.5Very low167.4 Ų167.4143.4 Ų143.478%0.78276%0.755SS**  92.1122.253.3-93.1169.3-14.800113.6
2541S31.8Very low29.6Very low117.4 Ų117.4142.4 Ų142.482%0.82176%0.759SS**  -176.4151.789.643.70000112.3
2542K26.9Very low29.6Very low194.6 Ų194.6140.4 Ų140.485%0.84676%0.762SS**  trans-103.9156.2148.6-71.4-176.5176.5-178.10108.7
2543P32.3Very low29.6Very low120.2 Ų120.2140.9 Ų140.978%0.78177%0.766SS**  -122.4178.158.517.20.2000113.9
2544S27.6Very low29.7Very low101.2 Ų101.2140.7 Ų140.771%0.70876%0.762SS**  cis103.8128.29.3109.20000115.7
2545M31.2Very low29.6Very low161.2 Ų161.2138.1 Ų138.179%0.79476%0.757SS**  trans-74.9162.4156.6-77.6-67.5-144.200112.6I2547M2545-I2547 HydrophobicContact CB-CD1 4.46Å; M2545-I2547 HydrophobicContact CE-CD1 3.95Å; M2545-I2547 HydrophobicContact CE-CG1 4.12Å; M2545-I2547 HydrophobicContact CG-CD1 4.07Å; M2545-I2547 HydrophobicContact SD-CD1 3.7Å; M2545-I2547 HydrophobicContact SD-CG1 3.63Å
2546P29.6Very low29.5Very low107.6 Ų107.6134.9 Ų134.970%0.69975%0.752SS**  -117.2159.893.830.4-17.9000113.8
2547I26Very low29.2Very low142.6 Ų142.6135.8 Ų135.873%0.73175%0.753SS**  11.9133.2115.8-56.4168.1000112.6M2545M2545-I2547 HydrophobicContact CB-CD1 4.46Å; M2545-I2547 HydrophobicContact CE-CD1 3.95Å; M2545-I2547 HydrophobicContact CE-CG1 4.12Å; M2545-I2547 HydrophobicContact CG-CD1 4.07Å; M2545-I2547 HydrophobicContact SD-CD1 3.7Å; M2545-I2547 HydrophobicContact SD-CG1 3.63Å
2548I28.8Very low29.3Very low149.8 Ų149.8137.7 Ų137.777%0.76876%0.755SS**  trans171129.7158.2-72.7166.6000110.8
2549S26.3Very low29.3Very low100 Ų100135.6 Ų135.670%0.69975%0.752SS**  trans-102.6153.8153.7-44.50000111.8
2550T27.9Very low29.2Very low133 Ų133136.6 Ų136.682%0.81676%0.756SS**  158.5160.5127.736.90000113.5
2551S27.8Very low29.2Very low105.2 Ų105.2134.9 Ų134.974%0.73675%0.752SS**  trans-85.8152.4-176.1510000113.5
2552S31.2Very low29.2Very low107.4 Ų107.4136.5 Ų136.575%0.75175%0.75SS**  171.7129.289.547.70000113.9
2553H28.1Very low29.2Very low178.8 Ų178.8131.5 Ų131.583%0.82874%0.74SS**  25.1164.6123.1-68.4-80.3000113.4
2554P31.9Very low29.1Very low104 Ų104134.2 Ų134.268%0.67574%0.742SS**  cis-132.6-171.4-14.741-24.5000115.4
2555L28.2Very low29.1Very low145.4 Ų145.4136.2 Ų136.276%0.76175%0.745SS**  trans69.2124.1148.7-69.4161.3000116.6
2556E27.4Very low29Very low165 Ų165135.7 Ų135.777%0.77174%0.744SS**  64.7129.884.7-65.6-176.7119.900116.4K2558E2556-K2558 IonicContact OE1-NZ 3.36Å; E2556-K2558 PolarHBondContact OE1-NZ 3.33Å
2557S27.2Very low28.8Very low100.4 Ų100.4135.8 Ų135.870%0.70274%0.743SS**  151.1124.893.548.80000113
2558K31.7Very low29Very low174.6 Ų174.6137.6 Ų137.676%0.75975%0.746SS**  92140.7124.4-76.6-178.9177-166.20112.8E2556E2556-K2558 IonicContact OE1-NZ 3.36Å; E2556-K2558 PolarHBondContact OE1-NZ 3.33Å
2559D30.2Very low28.9Very low127 Ų127136.5 Ų136.568%0.67974%0.742SS**  cis-172.9155.211.2-85.5-30.6000108
2560E30.6Very low29Very low166.4 Ų166.4139.9 Ų139.978%0.77874%0.744SS**  55.9135.9128.8-64.8-162.3121.600117.4
2561L31.5Very low29Very low131.6 Ų131.6140 Ų14069%0.68974%0.739SS**  93.4124.471.4-81.7168.9000114.5
2562L30Very low29.1Very low150 Ų150139.6 Ų139.679%0.78574%0.736SS**  -152.1128.5104.4-80146.6000111.6
2563S28.5Very low29Very low90.6 Ų90.6139.6 Ų139.663%0.63474%0.737SS**  55.2121.281.9-55.20000116.1
2564Q30.1Very low29Very low177.4 Ų177.4136 Ų13683%0.82973%0.732SS**  trans-172133.9142.7-104.3169.324.300112
2565N26.2Very low29Very low141.8 Ų141.8138 Ų13876%0.75874%0.735SS**  trans-46.2139156.9-62.3-46.6000113.4
2566I30.1Very low29Very low151.4 Ų151.4137.7 Ų137.778%0.77673%0.734SS**  -154.4122.8126.5-83.2165.3000107.8F2568I2566-F2568 HydrophobicContact CG2-CD2 3.57Å; I2566-F2568 HydrophobicContact CG2-CE2 3.86Å
2567T25.6Very low29Very low110 Ų110135.1 Ų135.168%0.67573%0.734SS**  trans-11.3122.5136.5-34.90000113.5
2568F28.7Very low29Very low179.6 Ų179.6137.9 Ų137.979%0.78874%0.74SS**  -159.4142120.9-98.2-73.1000112.4I2566I2566-F2568 HydrophobicContact CG2-CD2 3.57Å; I2566-F2568 HydrophobicContact CG2-CE2 3.86Å
2569N27.8Very low28.9Very low127.6 Ų127.6135.6 Ų135.668%0.68274%0.741SS**  trans16.6136.4145-77.8-6.6000118.6
2570K28.3Very low28.9Very low171.2 Ų171.2136.2 Ų136.274%0.74475%0.749SS**  cis109.8135.248.3-130-179.7167.7-139.90113.4
2571D28.2Very low28.7Very low134.6 Ų134.6133.5 Ų133.572%0.7274%0.74SS**  -176.9165102.1-100.7-27.4000114.5
2572S29.4Very low28.6Very low95.8 Ų95.8136.7 Ų136.767%0.6774%0.743SS**  trans137.7146.1178.8600000117
2573S29.7Very low28.4Very low109.4 Ų109.4134.1 Ų134.177%0.76574%0.737SS**  trans106.6126.5151.758.70000115.3
2574S28Very low28.4Very low103.2 Ų103.2140.6 Ų140.672%0.72275%0.748SS**  106140.158.461.30000116.2
2575I30.7Very low28.3Very low144.8 Ų144.8136.2 Ų136.274%0.74374%0.736SS**  trans-155.3135.4147.1-75168.2000110.7
2576N29.1Very low28.4Very low138.8 Ų138.8136.8 Ų136.874%0.74274%0.738SS**  trans-85.2130.8161-61.1-31.2000113L2578N2576-L2578 HydrophobicContact CB-CD1 4.46Å; N2576-L2578 PolarHBondContact O-N 2.92Å
2577S26.7Very low28.3Very low111.8 Ų111.8133.3 Ų133.378%0.78273%0.732SS**  165117.6119.6-174.80000111.4
2578L28.7Very low28.5Very low157.4 Ų157.4137.1 Ų137.182%0.82474%0.742SS**  trans-123.9130.9165.8-88.9159.7000110.2N2576 V2580N2576-L2578 HydrophobicContact CB-CD1 4.46Å; N2576-L2578 PolarHBondContact O-N 2.92Å; L2578-V2580 PolarHBondContact O-N 2.74Å
2579T27.7Very low28.6Very low127.8 Ų127.8131.7 Ų131.778%0.78474%0.737SS**  trans-106.5132.3173.448.20000110.5D2581T2579-D2581 PolarHBondContact O-N 3.46Å
2580V30.6Very low28.5Very low138 Ų138136.1 Ų136.184%0.83675%0.745SS**  trans-110.5102.1171.1-177.80000109.2L2578L2578-V2580 PolarHBondContact O-N 2.74Å
2581D26.6Very low28.5Very low111.2 Ų111.2135 Ų13560%0.59575%0.748SS**  trans-88.3130.2174.9-129.9-30.9000111.3T2579 S2583T2579-D2581 PolarHBondContact O-N 3.46Å; D2581-S2583 PolarHBondContact O-N 3.46Å; D2581-S2583 PolarHBondContact OD1-N 2.72Å; D2581-S2583 PolarHBondContact OD1-OG 3.47Å
2582R29Very low28.4Very low198.4 Ų198.4135.7 Ų135.775%0.74975%0.751SS**  trans-134.793151.3-147.4172.7-155.5150.53.1114.1R2584R2582-R2584 PolarHBondContact O-N 3.42Å
2583S26.4Very low28.3Very low94.4 Ų94.4139.5 Ų139.566%0.6676%0.756SS**  trans-121.6110.9168.5-52.70000113D2581D2581-S2583 PolarHBondContact O-N 3.46Å; D2581-S2583 PolarHBondContact OD1-N 2.72Å; D2581-S2583 PolarHBondContact OD1-OG 3.47Å
2584R29.6Very low28.1Very low229 Ų229142.4 Ų142.486%0.86476%0.757SS**  trans174.5142.7156.9-97.7178.1-179.9-172.10.2113.9R2582R2582-R2584 PolarHBondContact O-N 3.42Å
2585S28.1Very low28.2Very low83.8 Ų83.8140.7 Ų140.759%0.58676%0.755SS**  cis-172.8142.2-30.5127.90000111.6R2455R2455-S2585 PolarHBondContact NH1-O 3.34Å
2586I27.4Very low28.2Very low154.4 Ų154.4141.9 Ų141.979%0.79276%0.762SS**  trans42.7123.6160.1-59.1169.6000112.4R2455R2455-I2586 PolarHBondContact NH1-O 3.49Å; R2455-I2586 PolarHBondContact NH2-O 2.97Å
2587A28.7Very low28.2Very low78.6 Ų78.6143.9 Ų143.965%0.6576%0.764SS**  trans150.8152.7139.900000112.9R2455R2455-A2587 PolarHBondContact NH2-O 3.46Å
2588E29.1Very low28.6Very low189 Ų189144 Ų14488%0.88376%0.762SS**  trans82.8142.7176.3-65.1159.9-153.400114.2R2455R2455-E2588 IonicContact CZ-OE2 2.72Å; R2455-E2588 VanDerWaalsContact CZ-OE2 3.24Å; R2455-E2588 IonicContact NE-OE2 3.39Å; R2455-E2588 PolarHBondContact NE-OE2 3.29Å; R2455-E2588 IonicContact NH2-OE1 3.26Å; R2455-E2588 PolarHBondContact NH2-OE1 2.71Å; R2455-E2588 IonicContact NH2-OE2 2.73Å; R2455-E2588 PolarHBondContact NH2-OE2 2.99Å
2589G29.9Very low28.6Very low66.2 Ų66.2143.1 Ų143.168%0.68276%0.758SS**  cis-164.6152.6-400000111.6
2590Y27.5Very low28.8Very low220 Ų220142.3 Ų142.386%0.86375%0.753SS**  trans-16.3135.4170.2-68.3-94.2000115.4
2591N27Very low28.8Very low149.4 Ų149.4143.6 Ų143.680%0.79975%0.747SS**  151.8146.2121.5-80.5-30.7000114.8
2592L27.3Very low29Very low148.2 Ų148.2143 Ų14378%0.77675%0.752SS**  -173.8127.962.4-168.569000108.4
2593F25.8Very low29Very low175.6 Ų175.6141.5 Ų141.577%0.7775%0.753SS**  trans39.5153135-119.5-122.1000116.1
2594E27.2Very low29.2Very low170.6 Ų170.6142.2 Ų142.280%0.79775%0.754SS**  cis-145157.446.9-103.5168.614700113.3
2595G28.5Very low29.4Very low66.8 Ų66.8136.7 Ų136.769%0.68975%0.746SS**  trans129.6138.7159.400000117.3
2596I32Very low29.5Very low169.8 Ų169.8141.4 Ų141.487%0.87176%0.755SS**  73.5132.2117.3-64.1175.2000115.1
2597K29Very low29.6Very low182.4 Ų182.4143.2 Ų143.279%0.79376%0.758SS**  trans-94.6167174.5-100.1-176.2-178.6-1780111.6D2599K2597-D2599 WeakPolarHBondContact CE-OD2 3.3Å; K2597-D2599 IonicContact NZ-OD1 3.59Å; K2597-D2599 PolarHBondContact NZ-OD1 3.3Å; K2597-D2599 IonicContact NZ-OD2 2.65Å; K2597-D2599 PolarHBondContact NZ-OD2 3.01Å
2598P34.6Very low29.7Very low113.4 Ų113.4147.8 Ų147.874%0.73677%0.766SS**  trans-122.9-177.9136.738-24.1000113.3
2599D28.9Very low29.7Very low138.4 Ų138.4143.2 Ų143.274%0.7475%0.754SS**  trans-129.7159.4154.9-96.8-48.9000112.5K2597 K2601K2597-D2599 WeakPolarHBondContact CE-OD2 3.3Å; K2597-D2599 IonicContact NZ-OD1 3.59Å; K2597-D2599 PolarHBondContact NZ-OD1 3.3Å; K2597-D2599 IonicContact NZ-OD2 2.65Å; K2597-D2599 PolarHBondContact NZ-OD2 3.01Å; D2599-K2601 IonicContact OD1-NZ 3.66Å; D2599-K2601 PolarHBondContact OD1-NZ 2.79Å
2600T31.9Very low29.8Very low111.6 Ų111.6150.5 Ų150.569%0.68576%0.762SS**  trans-137.5144.4163.117.80000114.4
2601K30.5Very low30Very low164 Ų164146.4 Ų146.471%0.71375%0.754SS**  trans149.4146.5131.6-93.6158.7-170.2156.50116.2D2599 G3069 V3070D2599-K2601 IonicContact OD1-NZ 3.66Å; D2599-K2601 PolarHBondContact OD1-NZ 2.79Å; K2601-G3069 VanDerWaalsContact CG-C 3.49Å; K2601-G3069 VanDerWaalsContact CG-O 3.29Å; K2601-G3069 WeakPolarHBondContact CG-O 3.46Å; K2601-V3070 WeakPolarHBondContact CE-O 3.29Å; K2601-V3070 WeakPolarHBondContact CG-O 3.41Å
2602S29.9Very low30.4Very low98.4 Ų98.4144.8 Ų144.869%0.68875%0.752SS**  trans94.7142142.348.20000116.9
2603E30.6Very low30.6Very low167.4 Ų167.4143.2 Ų143.278%0.78275%0.753SS**  -166.7139.657.9-114.6178.112300116.2
2604T30.4Very low30.9Very low109 Ų109140.1 Ų140.167%0.66975%0.753SS**  trans44127.6154.256.60000120.3
2605T32.8Very low31.1Very low112.8 Ų112.8136.4 Ų136.469%0.69275%0.746SS**  158.3126117.242.30000117
2606K30.6Very low31.4Very low183 Ų183143.9 Ų143.980%0.79676%0.755SS**  trans67.8116.7131.5-64.9169.2-175.51680117.8
2607K29.3Very low31.3Very low192.4 Ų192.4139.8 Ų139.884%0.83775%0.747SS**  111.6137.799.7-86.3-175.1176.6-173.90114.4
2608H32.1Very low31.4Very low176.4 Ų176.4137.6 Ų137.682%0.81775%0.748SS**  trans165.8131.7150.9-93.7-84.3000113.9
2609S28.9Very low31.2Very low90.4 Ų90.4139.8 Ų139.863%0.63275%0.754SS**  trans172.9130.3147.260.60000114
2610Y32Very low31.3Very low219.6 Ų219.6137.9 Ų137.986%0.86176%0.757SS**  -170.2133120.7-100.1-80.3000109.8
2611I31.6Very low31.2Very low134.8 Ų134.8139.4 Ų139.469%0.69177%0.767SS**  trans-167.4138.7154.6-79.2171000110.7
2612P34.7Very low31.5Very low116.6 Ų116.6136.2 Ų136.276%0.75777%0.77SS**  trans-114.3164.4163.636.5-26000113.4
2613S32Very low31.5Very low113.2 Ų113.2137.4 Ų137.479%0.79277%0.774SS**  trans165.9138.8145.7-74.50000111.1
2614S31.6Very low31.7Very low110.4 Ų110.4134.7 Ų134.777%0.77277%0.769SS**  cis-152.9146.712.253.10000110.7
2615S31.4Very low31.9Very low92.8 Ų92.8138.7 Ų138.765%0.64978%0.777SS**  -42.6140.7129.155.30000114.7
2616Y34.6Very low31.9Very low225.6 Ų225.6140.3 Ų140.389%0.88578%0.781SS**  -128.2139.969.8-73-92.1000113
2617A29.7Very low32Very low84.2 Ų84.2138.9 Ų138.970%0.69678%0.782SS**  83.1125.691.900000114.1
2618T32.4Very low32Very low134.2 Ų134.2135 Ų13582%0.82378%0.775SS**  -149.6148.775.817.60000112.2
2619N28.9Very low32.2Very low160.8 Ų160.8133.4 Ų133.486%0.8678%0.778SS**  trans-78.9146.2161.1-56.9-27.5000112.7
2620A32.6Very low32.2Very low97.4 Ų97.4136.2 Ų136.281%0.80579%0.785SS**  trans-163.9136.7133.400000112.1
2621T28.8Very low32.4Very low144.4 Ų144.4132.5 Ų132.589%0.88679%0.786SS**  trans-108.8137.4167.5450000113
2622A35.9Very low32.4Very low95.6 Ų95.6132.6 Ų132.679%0.7979%0.788SS**  trans-155.5139.3149.400000110.1
2623T31.2Very low32.4Very low124.6 Ų124.6133.2 Ų133.276%0.76479%0.789SS**  trans-107.6141.9138.3580000113.6
2624T34.6Very low32.5Very low109.8 Ų109.8135 Ų13567%0.67479%0.785SS**  trans84124.1158.5-19.10000115.8
2625F34.4Very low32.6Very low192.8 Ų192.8133.9 Ų133.985%0.84678%0.777SS**  165.6139.498.8-72.2-72.5000118
2626L31.9Very low32.7Very low146.4 Ų146.4137.5 Ų137.577%0.76678%0.784SS**  trans-87155.8158.8-67.4152.3000113.5
2627N32.6Very low32.8Very low154.2 Ų154.2134.1 Ų134.183%0.82578%0.779SS**  trans148125.2139.3-80.9-23.1000115.3
2628T30Very low33Very low111.8 Ų111.8135.2 Ų135.269%0.68678%0.782SS**  49123.6117.6-58.80000114.5
2629T35.6Very low33.1Very low142.8 Ų142.8134 Ų13488%0.87678%0.779SS**  trans-151.2130.7138.129.70000110.7
2630N30.7Very low33.4Very low147.4 Ų147.4131.8 Ų131.879%0.78877%0.773SS**  trans-89.8136.2165.4-97.8-23.5000112.7
2631T35.5Very low33.6Very low143.2 Ų143.2134.6 Ų134.688%0.87978%0.775SS**  trans-148.8146.8144.741.40000108.9
2632N31.9Very low34Very low136.4 Ų136.4134.1 Ų134.173%0.72977%0.772SS**  trans-129.8139-148.2-153.94.4000111Q2634N2632-Q2634 PolarHBondContact OD1-N 3.02Å
2633V35Very low34.5Very low128.4 Ų128.4136 Ų13678%0.77877%0.773SS**  trans-154.6123.5155.4171.20000111.4
2634Q33Very low34.9Very low151 Ų151135.3 Ų135.371%0.70677%0.771SS**  trans-49.9144.2155.5-14394.8400114.8N2632 H2636N2632-Q2634 PolarHBondContact OD1-N 3.02Å; Q2634-H2636 PolarHBondContact NE2-CE1 3.36Å; Q2634-H2636 PolarHBondContact NE2-NE2 3.11Å
2635S33.6Very low35.4Very low88 Ų88133.5 Ų133.562%0.61576%0.763SS**  trans-175138.6143.648.20000113.6
2636H33.7Very low36.3Very low168.4 Ų168.4131 Ų13178%0.7876%0.757SS**  136.9139.5125.1-69.3-69.5000113.8Q2634Q2634-H2636 PolarHBondContact NE2-CE1 3.36Å; Q2634-H2636 PolarHBondContact NE2-NE2 3.11Å
2637I36.7Very low37.4Very low154.6 Ų154.6127.8 Ų127.879%0.79374%0.744SS**  -138.8137.464.9-74.7165.2000112.7
2638S34.3Very low38.3Very low107.8 Ų107.8122.8 Ų122.875%0.75472%0.724SS**  trans-2.1135.5161.3-38.90000119.6
2639S34.2Very low39.5Very low109.2 Ų109.2119.9 Ų119.976%0.76471%0.711SS**  -177.2138.1112.3-124.80000113.3N2641S2639-N2641 PolarHBondContact O-N 3.4Å
2640P34.5Very low40.5Very low112.8 Ų112.8115.6 Ų115.673%0.73269%0.69SS**  trans-94.1142.4-179.836.4-33.2000113.3
2641N36.5Very low41.5Very low157.8 Ų157.8113 Ų11384%0.84468%0.676SS**  trans-175.5111.4157.9-95.8-29.4000111.3S2639 V2643S2639-N2641 PolarHBondContact O-N 3.4Å; N2641-V2643 PolarHBondContact O-N 3.32Å
2642T38.3Very low42.6Very low134 Ų134110.2 Ų110.282%0.82266%0.66SS**  trans-118.5118.7161.70.30000111.4P2644T2642-P2644 WeakPolarHBondContact O-CD 3.27Å
2643V45.6Very low43.6Very low135.2 Ų135.2110 Ų11082%0.81966%0.656SS**PPolyproline II helixtrans-79.8125.2172.2-115.50000110N2641 S2645N2641-V2643 PolarHBondContact O-N 3.32Å; V2643-S2645 PolarHBondContact O-N 3.4Å
2644P40.6Very low44.5Very low109 Ų109106.2 Ų106.271%0.70864%0.638SS**PPolyproline II helixtrans-68132.9168.613.4-10.6000109.1T2642 L2646T2642-P2644 WeakPolarHBondContact O-CD 3.27Å; P2644-L2646 PolarHBondContact O-N 3.13Å
2645S44.4Very low45.5Very low72.8 Ų72.8106.5 Ų106.551%0.50964%0.643SS.*PPolyproline II helixtrans-42131.4176.8-179.50000112.4V2643 T2647 A2648 A2649V2643-S2645 PolarHBondContact O-N 3.4Å; S2645-T2647 PolarHBondContact O-N 3.26Å; S2645-T2647 VanDerWaalsContact O-N 3.09Å; S2645-T2647 PolarHBondContact OG-N 3.17Å; S2645-T2647 PolarHBondContact OG-OG1 3.1Å; S2645-A2648 WeakPolarHBondContact O-CA 3.38Å; S2645-A2648 WeakPolarHBondContact O-CB 3.35Å; S2645-A2648 PolarHBondContact O-N 3.21Å; S2645-A2649 PolarHBondContact O-N 3.02Å
2646L54Low46.8Very low139.4 Ų139.4107.1 Ų107.173%0.7364%0.643SS**Hα-helixtrans-53.7-29.3175.4-166.870.3000112.2P2644 A2648 A2649 A2650P2644-L2646 PolarHBondContact O-N 3.13Å; L2646-A2648 VanDerWaalsContact C-N 3.29Å; L2646-A2648 PolarHBondContact O-N 3.02Å; L2646-A2649 PolarHBondContact O-N 3.17Å; L2646-A2650 WeakPolarHBondContact O-CB 3.34Å; L2646-A2650 PolarHBondContact O-N 3.15Å; L2646-A2650 VanDerWaalsContact O-N 3.15Å
2647T54.9Low48.4Very low80.4 Ų80.4101 Ų10149%0.49362%0.618SS.*Hα-helixtrans-61.2-35.7173.6-43.70000112.8A2235 S2645 A2650 N2651A2235-T2647 HydrophobicContact CB-CG2 3.69Å; S2645-T2647 PolarHBondContact O-N 3.26Å; S2645-T2647 VanDerWaalsContact O-N 3.09Å; S2645-T2647 PolarHBondContact OG-N 3.17Å; S2645-T2647 PolarHBondContact OG-OG1 3.1Å; T2647-A2650 PolarHBondContact O-N 3.38Å; T2647-N2651 VanDerWaalsContact O-CB 3.27Å; T2647-N2651 WeakPolarHBondContact O-CB 3.32Å; T2647-N2651 VanDerWaalsContact O-CG 3.25Å; T2647-N2651 PolarHBondContact O-N 3.1Å; T2647-N2651 PolarHBondContact O-OD1 3.17Å
2648A51Low50.2Low48.6 Ų48.699.3 Ų99.340%0.40261%0.607SS.*Hα-helixtrans-69.5-41.3177.800000111.5S2645 L2646 A2650 N2651 T2652S2645-A2648 WeakPolarHBondContact O-CA 3.38Å; S2645-A2648 WeakPolarHBondContact O-CB 3.35Å; S2645-A2648 PolarHBondContact O-N 3.21Å; L2646-A2648 VanDerWaalsContact C-N 3.29Å; L2646-A2648 PolarHBondContact O-N 3.02Å; A2648-A2650 VanDerWaalsContact C-N 3.35Å; A2648-A2650 PolarHBondContact O-N 2.97Å; A2648-N2651 PolarHBondContact O-N 3.16Å; A2648-T2652 WeakPolarHBondContact O-CB 3.41Å; A2648-T2652 PolarHBondContact O-N 3.27Å; A2648-T2652 PolarHBondContact O-OG1 3.33Å
2649A55.7Low52.5Low49.8 Ų49.899 Ų9941%0.41259%0.589SS.*Hα-helixtrans-63.7-43.817400000111.7S2645 L2646 T2652 M2653S2645-A2649 PolarHBondContact O-N 3.02Å; L2646-A2649 PolarHBondContact O-N 3.17Å; A2649-T2652 PolarHBondContact O-N 3.09Å; A2649-M2653 WeakPolarHBondContact O-CG 3.06Å; A2649-M2653 PolarHBondContact O-N 2.98Å
2650A56.9Low54.9Low53.6 Ų53.694.1 Ų94.144%0.44356%0.555SS.*Hα-helixtrans-61.8-44.1175.600000112.5L2646 T2647 A2648 T2652 M2653 A2654L2646-A2650 WeakPolarHBondContact O-CB 3.34Å; L2646-A2650 PolarHBondContact O-N 3.15Å; L2646-A2650 VanDerWaalsContact O-N 3.15Å; T2647-A2650 PolarHBondContact O-N 3.38Å; A2648-A2650 VanDerWaalsContact C-N 3.35Å; A2648-A2650 PolarHBondContact O-N 2.97Å; A2650-T2652 VanDerWaalsContact C-N 3.32Å; A2650-T2652 PolarHBondContact O-N 3.25Å; A2650-M2653 PolarHBondContact O-N 3Å; A2650-A2654 WeakPolarHBondContact O-CB 3.34Å; A2650-A2654 PolarHBondContact O-N 3.18Å
2651N50.6Low57.2Low91.8 Ų91.892.7 Ų92.749%0.49155%0.546SS..Hα-helixtrans-64.8-37.8175.7-721.6000111.9T2647 A2648 A2654 L2655T2647-N2651 VanDerWaalsContact O-CB 3.27Å; T2647-N2651 WeakPolarHBondContact O-CB 3.32Å; T2647-N2651 VanDerWaalsContact O-CG 3.25Å; T2647-N2651 PolarHBondContact O-N 3.1Å; T2647-N2651 PolarHBondContact O-OD1 3.17Å; A2648-N2651 PolarHBondContact O-N 3.16Å; N2651-A2654 PolarHBondContact O-N 3.22Å; N2651-L2655 VanDerWaalsContact O-CG 3.31Å; N2651-L2655 WeakPolarHBondContact O-CG 3.36Å; N2651-L2655 PolarHBondContact O-N 3.12Å; N2651-L2655 VanDerWaalsContact O-N 3.08Å
2652T58.3Low59.5Low86 Ų8692.2 Ų92.253%0.52853%0.532SS..Hα-helixtrans-64.8-46.9175.8-52.80000110.7A2648 A2649 A2650 A2654 L2655 T2656A2648-T2652 WeakPolarHBondContact O-CB 3.41Å; A2648-T2652 PolarHBondContact O-N 3.27Å; A2648-T2652 PolarHBondContact O-OG1 3.33Å; A2649-T2652 PolarHBondContact O-N 3.09Å; A2650-T2652 VanDerWaalsContact C-N 3.32Å; A2650-T2652 PolarHBondContact O-N 3.25Å; T2652-A2654 VanDerWaalsContact C-N 3.3Å; T2652-A2654 PolarHBondContact O-N 3.1Å; T2652-L2655 PolarHBondContact O-N 3.26Å; T2652-L2655 VanDerWaalsContact O-N 3.1Å; T2652-T2656 WeakPolarHBondContact O-CG2 3.44Å; T2652-T2656 PolarHBondContact O-N 3.16Å; T2652-T2656 VanDerWaalsContact O-N 3.1Å; T2652-T2656 PolarHBondContact O-OG1 3.08Å
2653M54Low61.8Low132.2 Ų132.288.1 Ų88.165%0.65151%0.508SS*.Hα-helixtrans-62.9-34.7175.8-73.7-175.717000112.8A2649 A2650 L2655 T2656 T2657A2649-M2653 WeakPolarHBondContact O-CG 3.06Å; A2649-M2653 PolarHBondContact O-N 2.98Å; A2650-M2653 PolarHBondContact O-N 3Å; M2653-L2655 VanDerWaalsContact C-N 3.31Å; M2653-L2655 PolarHBondContact O-N 3.22Å; M2653-T2656 VanDerWaalsContact CA-OG1 3.32Å; M2653-T2656 WeakPolarHBondContact CA-OG1 3.38Å; M2653-T2656 CarbonylContact O-C 3.34Å; M2653-T2656 WeakPolarHBondContact O-CA 3.47Å; M2653-T2656 PolarHBondContact O-N 3.04Å; M2653-T2656 VanDerWaalsContact O-N 3.12Å; M2653-T2656 PolarHBondContact O-OG1 3.13Å; M2653-T2657 WeakPolarHBondContact O-CG2 3.43Å; M2653-T2657 PolarHBondContact O-N 3.23Å; M2653-T2657 VanDerWaalsContact O-N 3.17Å; M2653-T2657 PolarHBondContact O-OG1 3.3Å
2654A54.5Low63.4Low48 Ų4886.7 Ų86.740%0.39749%0.493SS..Hα-helixtrans-67.5-23.1174.800000113.7L2232 A2650 N2651 T2652 T2656 T2657L2232-A2654 HydrophobicContact CB-CB 4.31Å; L2232-A2654 HydrophobicContact CD1-CB 3.45Å; L2232-A2654 VanDerWaalsContact CD1-CB 3.45Å; L2232-A2654 HydrophobicContact CD2-CB 3.44Å; L2232-A2654 VanDerWaalsContact CD2-CB 3.44Å; L2232-A2654 HydrophobicContact CG-CB 3.87Å; A2650-A2654 WeakPolarHBondContact O-CB 3.34Å; A2650-A2654 PolarHBondContact O-N 3.18Å; N2651-A2654 PolarHBondContact O-N 3.22Å; T2652-A2654 VanDerWaalsContact C-N 3.3Å; T2652-A2654 PolarHBondContact O-N 3.1Å; A2654-T2656 VanDerWaalsContact C-N 3.27Å; A2654-T2657 PolarHBondContact O-OG1 2.85Å; A2654-T2657 VanDerWaalsContact O-OG1 3.13Å
2655L52.4Low65.3Low156.4 Ų156.484.3 Ų84.382%0.81948%0.478SS*.Hα-helixtrans-88.4-18.4173.9-68.5168.3000113N2651 T2652 M2653N2651-L2655 VanDerWaalsContact O-CG 3.31Å; N2651-L2655 WeakPolarHBondContact O-CG 3.36Å; N2651-L2655 PolarHBondContact O-N 3.12Å; N2651-L2655 VanDerWaalsContact O-N 3.08Å; T2652-L2655 PolarHBondContact O-N 3.26Å; T2652-L2655 VanDerWaalsContact O-N 3.1Å; M2653-L2655 VanDerWaalsContact C-N 3.31Å; M2653-L2655 PolarHBondContact O-N 3.22Å
2656T62.1Low67.1Low101.2 Ų101.283.5 Ų83.562%0.62147%0.467SS*.SBendtrans-100.9-0.6175.563.40000114T2652 M2653 A2654 E2658T2652-T2656 WeakPolarHBondContact O-CG2 3.44Å; T2652-T2656 PolarHBondContact O-N 3.16Å; T2652-T2656 VanDerWaalsContact O-N 3.1Å; T2652-T2656 PolarHBondContact O-OG1 3.08Å; M2653-T2656 VanDerWaalsContact CA-OG1 3.32Å; M2653-T2656 WeakPolarHBondContact CA-OG1 3.38Å; M2653-T2656 CarbonylContact O-C 3.34Å; M2653-T2656 WeakPolarHBondContact O-CA 3.47Å; M2653-T2656 PolarHBondContact O-N 3.04Å; M2653-T2656 VanDerWaalsContact O-N 3.12Å; M2653-T2656 PolarHBondContact O-OG1 3.13Å; A2654-T2656 VanDerWaalsContact C-N 3.27Å; T2656-E2658 PolarHBondContact O-N 3.39Å; T2656-E2658 VanDerWaalsContact O-N 3.1Å
2657T67.5Low68.4Low40.8 Ų40.879.4 Ų79.425%0.2545%0.446SS..SBendtrans-83.4110.7173.941.90000110.1M2653 A2654 R2659 I2666M2653-T2657 WeakPolarHBondContact O-CG2 3.43Å; M2653-T2657 PolarHBondContact O-N 3.23Å; M2653-T2657 VanDerWaalsContact O-N 3.17Å; M2653-T2657 PolarHBondContact O-OG1 3.3Å; A2654-T2657 PolarHBondContact O-OG1 2.85Å; A2654-T2657 VanDerWaalsContact O-OG1 3.13Å; T2657-R2659 PolarHBondContact O-N 3.28Å; T2657-R2659 PolarHBondContact OG1-NH2 2.71Å; T2657-I2666 HydrophobicContact CG2-CD1 4.17Å; T2657-I2666 HydrophobicContact CG2-CG2 4.2Å
2658E74.6Confident69.8Low117.8 Ų117.877.4 Ų77.455%0.5543%0.432SS*.  trans-59.7140167.7-64.3-170.6163.400110.4T2656 I2666 L2667 H2669T2656-E2658 PolarHBondContact O-N 3.39Å; T2656-E2658 VanDerWaalsContact O-N 3.1Å; E2658-I2666 WeakPolarHBondContact O-CA 3.43Å; E2658-L2667 HydrophobicContact CB-CB 4.37Å; E2658-L2667 HydrophobicContact CB-CD1 4.28Å; E2658-L2667 HydrophobicContact CB-CG 4.5Å; E2658-L2667 PolarHBondContact O-N 3.16Å; E2658-H2669 IonicContact OE2-CE1 3.75Å; E2658-H2669 PolarHBondContact OE2-CE1 2.86Å; E2658-H2669 VanDerWaalsContact OE2-CE1 3.25Å; E2658-H2669 IonicContact OE2-ND1 3.58Å
2659R82.6Confident71.4Confident103 Ų10380.9 Ų80.939%0.38944%0.44SS..BIsolated β-bridgetrans-128.4143.7-179.3-71.3177.3-178.6-84.4-8.1109.8T2657 P2661 Q2664 C2665 I2666T2657-R2659 PolarHBondContact O-N 3.28Å; T2657-R2659 PolarHBondContact OG1-NH2 2.71Å; R2659-P2661 VanDerWaalsContact O-CD 3.28Å; R2659-P2661 WeakPolarHBondContact O-CD 3.4Å; R2659-Q2664 PolarHBondContact NH1-O 3.07Å; R2659-C2665 CarbonylContact C-O 3.45Å; R2659-C2665 VanDerWaalsContact CA-O 3.25Å; R2659-C2665 WeakPolarHBondContact CA-O 3.41Å; R2659-I2666 HydrophobicContact CG-CG1 4.47Å
2660C83.2Confident72.9Confident5.6 Ų5.681.3 Ų81.34%0.03843%0.431CS..  trans-58.9119.6170.3-179.90000109.5H2212 C2214 W2662 C2663 Q2664 C2665 L2667H2212-C2660 PolarHBondContact NE2-SG 2.89Å; C2214-C2660 WeakPolarHBondContact CB-SG 3.27Å; C2214-C2660 PolarHBondContact SG-SG 2.6Å; C2660-W2662 PolarHBondContact O-N 3.21Å; C2660-W2662 VanDerWaalsContact O-N 3.13Å; C2660-W2662 PolarHBondContact SG-N 3.44Å; C2660-C2663 VanDerWaalsContact CB-SG 3.59Å; C2660-C2663 WeakPolarHBondContact CB-SG 3.49Å; C2660-C2663 PolarHBondContact O-N 3.4Å; C2660-C2663 PolarHBondContact SG-N 3.45Å; C2660-C2663 PolarHBondContact SG-SG 3.12Å; C2660-C2663 VanDerWaalsContact SG-SG 3.67Å; C2660-Q2664 VanDerWaalsContact O-CA 3.28Å; C2660-Q2664 WeakPolarHBondContact O-CA 3.35Å; C2660-Q2664 PolarHBondContact O-N 3.17Å; C2660-C2665 HydrophobicContact CB-CB 4.44Å; C2660-C2665 PolarHBondContact N-O 3.26Å; C2660-L2667 HydrophobicContact CB-CD2 3.98Å
2661P82.9Confident74.4Confident83.4 Ų83.481.6 Ų81.654%0.54243%0.425SS..THydrogen-bonded Turntrans-58-31.2-177.4-27.335.3000113.9R2659 Q2664R2659-P2661 VanDerWaalsContact O-CD 3.28Å; R2659-P2661 WeakPolarHBondContact O-CD 3.4Å; P2661-Q2664 PolarHBondContact O-NE2 3.15Å; P2661-Q2664 VanDerWaalsContact O-NE2 3.13Å
2662W84.7Confident76.3Confident147 Ų14778.9 Ų78.956%0.55741%0.41SS*.THydrogen-bonded Turntrans-81.2-53.7-176.5-59-76.7000112.9C2214 D2216 R2217 F2226 A2315 C2660C2214-W2662 HydrophobicContact CB-CE3 4.48Å; C2214-W2662 VanDerWaalsContact SG-CB 3.59Å; D2216-W2662 HydrophobicContact CB-CB 4.11Å; R2217-W2662 HydrophobicContact CB-CD2 4.15Å; R2217-W2662 HydrophobicContact CB-CE3 4.42Å; R2217-W2662 HydrophobicContact CB-CG 4.35Å; R2217-W2662 HydrophobicContact CG-CD2 4.43Å; R2217-W2662 HydrophobicContact CG-CZ2 4.26Å; F2226-W2662 AromaticContact CE2-CH2 3.96Å; F2226-W2662 HydrophobicContact CE2-CH2 3.96Å; F2226-W2662 HydrophobicContact CE2-CZ3 4.38Å; F2226-W2662 HydrophobicContact CZ-CH2 4.23Å; A2315-W2662 HydrophobicContact CB-CZ2 3.61Å; C2660-W2662 PolarHBondContact O-N 3.21Å; C2660-W2662 VanDerWaalsContact O-N 3.13Å; C2660-W2662 PolarHBondContact SG-N 3.44Å
2663C86.8Confident77.9Confident47.8 Ų47.880.1 Ų80.132%0.32341%0.413SS..THydrogen-bonded Turntrans-103-3.8-174.871.80000115.1H2212 C2214 D2216 C2660 C2665H2212-C2663 PolarHBondContact CE1-SG 3.12Å; H2212-C2663 PolarHBondContact NE2-SG 3.15Å; H2212-C2663 VanDerWaalsContact NE2-SG 3.38Å; C2214-C2663 VanDerWaalsContact SG-CB 3.54Å; D2216-C2663 WeakPolarHBondContact OD2-CB 3.36Å; C2660-C2663 VanDerWaalsContact CB-SG 3.59Å; C2660-C2663 WeakPolarHBondContact CB-SG 3.49Å; C2660-C2663 PolarHBondContact O-N 3.4Å; C2660-C2663 PolarHBondContact SG-N 3.45Å; C2660-C2663 PolarHBondContact SG-SG 3.12Å; C2660-C2663 VanDerWaalsContact SG-SG 3.67Å; C2663-C2665 PolarHBondContact O-N 3.13Å; C2663-C2665 VanDerWaalsContact O-N 3.09Å; C2663-C2665 VanDerWaalsContact SG-CB 3.58Å; C2663-C2665 WeakPolarHBondContact SG-CB 3.4Å
2664Q80.1Confident79.7Confident105.8 Ų105.875.3 Ų75.349%0.49439%0.391SS..  trans60.37-179.8-59.6-63.8-37.200116.1R2659 C2660 P2661R2659-Q2664 PolarHBondContact NH1-O 3.07Å; C2660-Q2664 VanDerWaalsContact O-CA 3.28Å; C2660-Q2664 WeakPolarHBondContact O-CA 3.35Å; C2660-Q2664 PolarHBondContact O-N 3.17Å; P2661-Q2664 PolarHBondContact O-NE2 3.15Å; P2661-Q2664 VanDerWaalsContact O-NE2 3.13Å
2665C81Confident81.6Confident58.2 Ų58.273.5 Ų73.539%0.39338%0.375SS..PPolyproline II helixtrans-60.2148.2167.6-127.70000110.9R2659 C2660 C2663R2659-C2665 CarbonylContact C-O 3.45Å; R2659-C2665 VanDerWaalsContact CA-O 3.25Å; R2659-C2665 WeakPolarHBondContact CA-O 3.41Å; C2660-C2665 HydrophobicContact CB-CB 4.44Å; C2660-C2665 PolarHBondContact N-O 3.26Å; C2663-C2665 PolarHBondContact O-N 3.13Å; C2663-C2665 VanDerWaalsContact O-N 3.09Å; C2663-C2665 VanDerWaalsContact SG-CB 3.58Å; C2663-C2665 WeakPolarHBondContact SG-CB 3.4Å
2666I82Confident83.5Confident57.4 Ų57.466.2 Ų66.229%0.29434%0.337SS..BIsolated β-bridgetrans-71.7138.5175.6-60.1172.3000108.7T2657 E2658 R2659 D2668T2657-I2666 HydrophobicContact CG2-CD1 4.17Å; T2657-I2666 HydrophobicContact CG2-CG2 4.2Å; E2658-I2666 WeakPolarHBondContact O-CA 3.43Å; R2659-I2666 HydrophobicContact CG-CG1 4.47Å; I2666-D2668 WeakPolarHBondContact CG2-OD1 3.45Å; I2666-D2668 PolarHBondContact O-N 3.11Å
2667L81.5Confident85.1Confident52 Ų5264.3 Ų64.327%0.27232%0.323SS..PPolyproline II helixtrans-88.6109.4175-60.9179.1000109.7H2212 E2658 C2660 H2669H2212-L2667 HydrophobicContact CB-CD2 3.94Å; E2658-L2667 HydrophobicContact CB-CB 4.37Å; E2658-L2667 HydrophobicContact CB-CD1 4.28Å; E2658-L2667 HydrophobicContact CB-CG 4.5Å; E2658-L2667 PolarHBondContact O-N 3.16Å; C2660-L2667 HydrophobicContact CB-CD2 3.98Å; L2667-H2669 PolarHBondContact O-N 3.28Å; L2667-H2669 PolarHBondContact O-ND1 2.96Å
2668D83Confident86.4Confident39.2 Ų39.263 Ų6321%0.2132%0.318CS..  trans-91.7116.6-179.2-67.7-6.1000110.5T2031 R2033 S2209 H2210 I2666 Y2670T2031-D2668 WeakPolarHBondContact CB-OD2 3.39Å; T2031-D2668 PolarHBondContact OG1-OD2 3.39Å; R2033-D2668 WeakPolarHBondContact CB-OD2 3.37Å; R2033-D2668 WeakPolarHBondContact CD-OD1 3.38Å; R2033-D2668 IonicContact CZ-OD1 2.68Å; R2033-D2668 IonicContact CZ-OD2 3.15Å; R2033-D2668 IonicContact NE-OD1 3.16Å; R2033-D2668 PolarHBondContact NE-OD1 3.04Å; R2033-D2668 IonicContact NE-OD2 3.11Å; R2033-D2668 PolarHBondContact NE-OD2 3.01Å; R2033-D2668 IonicContact NH2-OD1 2.89Å; R2033-D2668 PolarHBondContact NH2-OD1 2.94Å; R2033-D2668 IonicContact NH2-OD2 2.73Å; R2033-D2668 PolarHBondContact NH2-OD2 2.93Å; S2209-D2668 PolarHBondContact O-N 3.05Å; S2209-D2668 WeakPolarHBondContact OG-CB 3.37Å; S2209-D2668 PolarHBondContact OG-OD2 3.4Å; H2210-D2668 WeakPolarHBondContact CA-O 3.41Å; H2210-D2668 PolarHBondContact ND1-O 3.13Å; I2666-D2668 WeakPolarHBondContact CG2-OD1 3.45Å; I2666-D2668 PolarHBondContact O-N 3.11Å; D2668-Y2670 HydrophobicContact CB-CD2 4.25Å; D2668-Y2670 HydrophobicContact CB-CE2 3.51Å; D2668-Y2670 VanDerWaalsContact CB-CE2 3.4Å; D2668-Y2670 WeakPolarHBondContact CB-OH 3.48Å; D2668-Y2670 WeakPolarHBondContact O-CD2 3.39Å; D2668-Y2670 WeakPolarHBondContact O-CE2 3.2Å; D2668-Y2670 PolarHBondContact OD2-OH 3.04Å
2669H84.2Confident87.5Confident122.8 Ų122.857.5 Ų57.557%0.56929%0.292SS*.  trans-103.3136.5174.5-78.989.7000110.8H2210 E2658 L2667H2210-H2669 AromaticContact CE1-CE1 3.42Å; H2210-H2669 PolarHBondContact CE1-CE1 3.31Å; H2210-H2669 VanDerWaalsContact CE1-CE1 3.42Å; H2210-H2669 AromaticContact CE1-CG 3.97Å; H2210-H2669 AromaticContact CE1-ND1 3.59Å; H2210-H2669 AromaticContact CE1-NE2 3.68Å; H2210-H2669 AromaticContact ND1-ND1 3.79Å; E2658-H2669 IonicContact OE2-CE1 3.75Å; E2658-H2669 PolarHBondContact OE2-CE1 2.86Å; E2658-H2669 VanDerWaalsContact OE2-CE1 3.25Å; E2658-H2669 IonicContact OE2-ND1 3.58Å; L2667-H2669 PolarHBondContact O-N 3.28Å; L2667-H2669 PolarHBondContact O-ND1 2.96Å
2670Y88.5Confident88.1Confident58.2 Ų58.256.6 Ų56.623%0.22830%0.295CS..  trans-130.4150.8-177.7-59.9-85.2000110.6T2031 R2033 T2206 S2209 H2210 D2668 T2674T2031-Y2670 VanDerWaalsContact CB-OH 3.3Å; T2031-Y2670 WeakPolarHBondContact CB-OH 3.45Å; T2031-Y2670 PolarHBondContact OG1-OH 2.94Å; R2033-Y2670 HydrophobicContact CB-CE1 4.46Å; T2206-Y2670 HydrophobicContact CG2-CD1 4.18Å; T2206-Y2670 HydrophobicContact CG2-CD2 4.38Å; T2206-Y2670 HydrophobicContact CG2-CE1 3.68Å; T2206-Y2670 HydrophobicContact CG2-CE2 3.88Å; T2206-Y2670 VanDerWaalsContact CG2-CZ 3.49Å; T2206-Y2670 VanDerWaalsContact O-CE2 3.29Å; T2206-Y2670 WeakPolarHBondContact O-CE2 3.22Å; S2209-Y2670 WeakPolarHBondContact OG-CE2 3.37Å; H2210-Y2670 HydrophobicContact CB-CD2 4.08Å; H2210-Y2670 AromaticContact CD2-CD2 3.93Å; H2210-Y2670 PolarHBondContact CD2-N 2.95Å; D2668-Y2670 HydrophobicContact CB-CD2 4.25Å; D2668-Y2670 HydrophobicContact CB-CE2 3.51Å; D2668-Y2670 VanDerWaalsContact CB-CE2 3.4Å; D2668-Y2670 WeakPolarHBondContact CB-OH 3.48Å; D2668-Y2670 WeakPolarHBondContact O-CD2 3.39Å; D2668-Y2670 WeakPolarHBondContact O-CE2 3.2Å; D2668-Y2670 PolarHBondContact OD2-OH 3.04Å; Y2670-T2674 HydrophobicContact CD1-CG2 3.98Å; Y2670-T2674 HydrophobicContact CG-CG2 4.37Å
2671D88.7Confident88.7Confident59.8 Ų59.858.1 Ų58.132%0.3231%0.305SS..  trans-77.3155.9175.569.3-70.4000112N2673 T2674 I2675D2671-N2673 PolarHBondContact O-N 3.1Å; D2671-N2673 VanDerWaalsContact O-N 3.09Å; D2671-N2673 WeakPolarHBondContact OD2-CA 3.07Å; D2671-N2673 VanDerWaalsContact OD2-CB 3.29Å; D2671-N2673 WeakPolarHBondContact OD2-CB 3.35Å; D2671-N2673 PolarHBondContact OD2-N 3.03Å; D2671-N2673 VanDerWaalsContact OD2-N 3.07Å; D2671-N2673 PolarHBondContact OD2-ND2 2.89Å; D2671-T2674 VanDerWaalsContact CG-OG1 3.3Å; D2671-T2674 PolarHBondContact O-N 3.1Å; D2671-T2674 VanDerWaalsContact O-N 3.11Å; D2671-T2674 VanDerWaalsContact OD1-CB 3.26Å; D2671-T2674 WeakPolarHBondContact OD1-CB 3.38Å; D2671-T2674 PolarHBondContact OD1-N 3Å; D2671-T2674 PolarHBondContact OD1-OG1 3.34Å; D2671-T2674 PolarHBondContact OD2-N 3.05Å; D2671-T2674 PolarHBondContact OD2-OG1 3.11Å; D2671-I2675 WeakPolarHBondContact O-CG1 3.32Å; D2671-I2675 PolarHBondContact O-N 3.12Å; D2671-I2675 VanDerWaalsContact O-N 3.13Å
2672E89.5Confident89.3Confident34.4 Ų34.455.1 Ų55.116%0.16128%0.284CS..Hα-helixtrans-54.3-34.2-178.6-70.6-165.184.300113.1I2675 G2676 F2712 Y2713 N2727 V2728E2672-I2675 PolarHBondContact O-N 3.15Å; E2672-G2676 PolarHBondContact O-N 3.33Å; E2672-F2712 HydrophobicContact CG-CD1 3.93Å; E2672-F2712 HydrophobicContact CG-CE1 4.26Å; E2672-F2712 HydrophobicContact CG-CG 4.34Å; E2672-Y2713 WeakPolarHBondContact OE2-CE2 3.33Å; E2672-Y2713 PolarHBondContact OE2-OH 3.34Å; E2672-N2727 WeakPolarHBondContact OE1-CA 3.33Å; E2672-V2728 HydrophobicContact CB-CG2 3.74Å; E2672-V2728 HydrophobicContact CG-CG2 3.85Å; E2672-V2728 WeakPolarHBondContact O-CG2 3.4Å; E2672-V2728 PolarHBondContact OE1-N 3.12Å
2673N91.3Very high89.8Confident112 Ų11249.3 Ų49.360%0.59927%0.266SS*.Hα-helixtrans-71.1-42.2179.8-51.4-82000111.7L2041 D2671 I2675 G2676 L2677L2041-N2673 HydrophobicContact CD2-CB 3.67Å; D2671-N2673 PolarHBondContact O-N 3.1Å; D2671-N2673 VanDerWaalsContact O-N 3.09Å; D2671-N2673 WeakPolarHBondContact OD2-CA 3.07Å; D2671-N2673 VanDerWaalsContact OD2-CB 3.29Å; D2671-N2673 WeakPolarHBondContact OD2-CB 3.35Å; D2671-N2673 PolarHBondContact OD2-N 3.03Å; D2671-N2673 VanDerWaalsContact OD2-N 3.07Å; D2671-N2673 PolarHBondContact OD2-ND2 2.89Å; N2673-I2675 VanDerWaalsContact C-N 3.33Å; N2673-I2675 PolarHBondContact O-N 3.26Å; N2673-G2676 PolarHBondContact O-N 3.2Å; N2673-L2677 VanDerWaalsContact O-CB 3.29Å; N2673-L2677 WeakPolarHBondContact O-CB 3.39Å; N2673-L2677 VanDerWaalsContact O-CG 3.27Å; N2673-L2677 WeakPolarHBondContact O-CG 3.31Å; N2673-L2677 PolarHBondContact O-N 3.02Å
2674T93Very high90.2Very high30.4 Ų30.448.9 Ų48.919%0.18726%0.262CS..Hα-helixtrans-61.3-42.9174.7-66.40000111R2040 L2041 L2044 Y2670 D2671 G2678R2040-T2674 HydrophobicContact CB-CG2 4.27Å; L2041-T2674 WeakPolarHBondContact CD2-OG1 3.37Å; L2044-T2674 HydrophobicContact CD1-CG2 3.93Å; L2044-T2674 VanDerWaalsContact CD1-O 3.29Å; L2044-T2674 WeakPolarHBondContact CD1-O 3.27Å; Y2670-T2674 HydrophobicContact CD1-CG2 3.98Å; Y2670-T2674 HydrophobicContact CG-CG2 4.37Å; D2671-T2674 VanDerWaalsContact CG-OG1 3.3Å; D2671-T2674 PolarHBondContact O-N 3.1Å; D2671-T2674 VanDerWaalsContact O-N 3.11Å; D2671-T2674 VanDerWaalsContact OD1-CB 3.26Å; D2671-T2674 WeakPolarHBondContact OD1-CB 3.38Å; D2671-T2674 PolarHBondContact OD1-N 3Å; D2671-T2674 PolarHBondContact OD1-OG1 3.34Å; D2671-T2674 PolarHBondContact OD2-N 3.05Å; D2671-T2674 PolarHBondContact OD2-OG1 3.11Å; T2674-G2678 PolarHBondContact O-N 3.22Å
2675I93.6Very high91Very high10.2 Ų10.245.2 Ų45.25%0.05224%0.244CC..Hα-helixtrans-68.5-46.9179.2-58.5167.5000110.6L2207 H2210 D2671 E2672 N2673 L2677 G2678 I2679 L2707 F2712 V2728L2207-I2675 HydrophobicContact CD2-CB 4.35Å; L2207-I2675 HydrophobicContact CD2-CG2 3.75Å; H2210-I2675 VanDerWaalsContact CD2-CD1 3.46Å; H2210-I2675 WeakPolarHBondContact CD2-CD1 3.35Å; H2210-I2675 WeakPolarHBondContact NE2-CD1 3.45Å; D2671-I2675 WeakPolarHBondContact O-CG1 3.32Å; D2671-I2675 PolarHBondContact O-N 3.12Å; D2671-I2675 VanDerWaalsContact O-N 3.13Å; E2672-I2675 PolarHBondContact O-N 3.15Å; N2673-I2675 VanDerWaalsContact C-N 3.33Å; N2673-I2675 PolarHBondContact O-N 3.26Å; I2675-L2677 PolarHBondContact O-N 3.23Å; I2675-G2678 WeakPolarHBondContact O-CA 3.41Å; I2675-G2678 PolarHBondContact O-N 3.26Å; I2675-G2678 VanDerWaalsContact O-N 3.11Å; I2675-I2679 HydrophobicContact CG2-CD1 4.24Å; I2675-I2679 WeakPolarHBondContact O-CG1 3.41Å; I2675-I2679 PolarHBondContact O-N 3.26Å; I2675-L2707 HydrophobicContact CG2-CD1 3.94Å; I2675-L2707 HydrophobicContact CG2-CD2 4.1Å; I2675-F2712 HydrophobicContact CD1-CE1 3.92Å; I2675-F2712 HydrophobicContact CD1-CZ 3.92Å; I2675-V2728 HydrophobicContact CB-CG1 4.41Å; I2675-V2728 HydrophobicContact CB-CG2 3.98Å; I2675-V2728 HydrophobicContact CD1-CG2 4.46Å; I2675-V2728 HydrophobicContact CG2-CB 4.47Å; I2675-V2728 HydrophobicContact CG2-CG1 3.58Å; I2675-V2728 HydrophobicContact CG2-CG2 4.07Å
2676G93.6Very high91.7Very high3.4 Ų3.442.6 Ų42.64%0.03523%0.227CC..Hα-helixtrans-60.8-42.2177.600000113.2E2672 N2673 G2678 I2679 L2680E2672-G2676 PolarHBondContact O-N 3.33Å; N2673-G2676 PolarHBondContact O-N 3.2Å; G2676-G2678 VanDerWaalsContact C-N 3.34Å; G2676-I2679 PolarHBondContact O-N 3.15Å; G2676-L2680 WeakPolarHBondContact O-CB 3.46Å; G2676-L2680 VanDerWaalsContact O-CG 3.31Å; G2676-L2680 WeakPolarHBondContact O-CG 3.41Å; G2676-L2680 PolarHBondContact O-N 3.31Å
2677L94.5Very high92.2Very high60.2 Ų60.244.5 Ų44.532%0.31523%0.234SC..Hα-helixtrans-65.1-37.3172.3-74.5172.1000112.1L2041 L2044 Q2045 L2048 N2673 I2675 L2680 C2681L2041-L2677 HydrophobicContact CB-CD1 4.36Å; L2041-L2677 HydrophobicContact CD2-CD1 3.79Å; L2044-L2677 HydrophobicContact CB-CB 3.94Å; L2044-L2677 HydrophobicContact CB-CD1 4.33Å; L2044-L2677 HydrophobicContact CD1-CB 3.92Å; L2044-L2677 HydrophobicContact CG-CB 4.47Å; Q2045-L2677 HydrophobicContact CG-CD1 4.25Å; L2048-L2677 HydrophobicContact CD2-CD2 4.33Å; N2673-L2677 VanDerWaalsContact O-CB 3.29Å; N2673-L2677 WeakPolarHBondContact O-CB 3.39Å; N2673-L2677 VanDerWaalsContact O-CG 3.27Å; N2673-L2677 WeakPolarHBondContact O-CG 3.31Å; N2673-L2677 PolarHBondContact O-N 3.02Å; I2675-L2677 PolarHBondContact O-N 3.23Å; L2677-L2680 HydrophobicContact CD2-CD1 4.35Å; L2677-L2680 PolarHBondContact O-N 3.19Å; L2677-C2681 WeakPolarHBondContact O-CB 3.25Å; L2677-C2681 PolarHBondContact O-N 2.98Å; L2677-C2681 PolarHBondContact O-SG 3.06Å; L2677-C2681 VanDerWaalsContact O-SG 3.4Å
2678G95.6Very high92.7Very high14.6 Ų14.648.1 Ų48.115%0.15124%0.244CC..Hα-helixtrans-57.8-49.8171.900000112.3T2674 I2675 G2676 L2680 C2681 L2682T2674-G2678 PolarHBondContact O-N 3.22Å; I2675-G2678 WeakPolarHBondContact O-CA 3.41Å; I2675-G2678 PolarHBondContact O-N 3.26Å; I2675-G2678 VanDerWaalsContact O-N 3.11Å; G2676-G2678 VanDerWaalsContact C-N 3.34Å; G2678-L2680 VanDerWaalsContact C-N 3.32Å; G2678-L2680 PolarHBondContact O-N 3.13Å; G2678-C2681 WeakPolarHBondContact O-CB 3.4Å; G2678-C2681 PolarHBondContact O-N 3.19Å; G2678-C2681 VanDerWaalsContact O-N 3.17Å; G2678-L2682 WeakPolarHBondContact O-CG 3.44Å; G2678-L2682 PolarHBondContact O-N 3.03Å
2679I96.1Very high93.1Very high2.8 Ų2.849.4 Ų49.41%0.01425%0.249CC..Hα-helixtrans-61.9-38.8176-61165.3000111L2207 I2675 G2676 C2681 L2682 S2683 T2704 L2707 V2728 I2731 A2732 F2735L2207-I2679 HydrophobicContact CD1-CG1 4.43Å; L2207-I2679 HydrophobicContact CD2-CG1 4.33Å; I2675-I2679 HydrophobicContact CG2-CD1 4.24Å; I2675-I2679 WeakPolarHBondContact O-CG1 3.41Å; I2675-I2679 PolarHBondContact O-N 3.26Å; G2676-I2679 PolarHBondContact O-N 3.15Å; I2679-C2681 PolarHBondContact O-N 2.84Å; I2679-L2682 PolarHBondContact O-N 3.06Å; I2679-S2683 WeakPolarHBondContact O-CB 3.38Å; I2679-S2683 PolarHBondContact O-N 3.12Å; I2679-T2704 HydrophobicContact CD1-CG2 4.44Å; I2679-T2704 HydrophobicContact CG2-CG2 4.29Å; I2679-L2707 HydrophobicContact CD1-CD1 4.14Å; I2679-L2707 HydrophobicContact CG1-CD1 4.42Å; I2679-V2728 HydrophobicContact CD1-CG1 4.06Å; I2679-I2731 HydrophobicContact CB-CG2 3.97Å; I2679-I2731 HydrophobicContact CD1-CG2 4.34Å; I2679-I2731 HydrophobicContact CG2-CG2 3.85Å; I2679-A2732 HydrophobicContact CD1-CB 4.18Å; I2679-F2735 HydrophobicContact CG2-CB 3.55Å; I2679-F2735 HydrophobicContact CG2-CD2 4.24Å; I2679-F2735 HydrophobicContact CG2-CG 3.95Å
2680L95.7Very high93.5Very high84.4 Ų84.446.2 Ų46.244%0.44224%0.239SC..Hα-helixtrans-65.5-36.8176-110.4129.3000112.8L2048 G2676 L2677 G2678 S2683 T2684L2048-L2680 HydrophobicContact CD1-CB 4.34Å; G2676-L2680 WeakPolarHBondContact O-CB 3.46Å; G2676-L2680 VanDerWaalsContact O-CG 3.31Å; G2676-L2680 WeakPolarHBondContact O-CG 3.41Å; G2676-L2680 PolarHBondContact O-N 3.31Å; L2677-L2680 HydrophobicContact CD2-CD1 4.35Å; L2677-L2680 PolarHBondContact O-N 3.19Å; G2678-L2680 VanDerWaalsContact C-N 3.32Å; G2678-L2680 PolarHBondContact O-N 3.13Å; L2680-S2683 WeakPolarHBondContact O-CB 3.45Å; L2680-S2683 PolarHBondContact O-N 3.24Å; L2680-T2684 WeakPolarHBondContact O-CB 3.34Å; L2680-T2684 PolarHBondContact O-N 3.2Å; L2680-T2684 PolarHBondContact O-OG1 3.29Å
2681C96.1Very high93.6Very high35.4 Ų35.446.5 Ų46.524%0.23926%0.26CS..Hα-helixtrans-63.3-46.4171.1-72.90000111.4L2047 L2051 L2677 G2678 I2679 S2683 T2684 F2685L2047-C2681 HydrophobicContact CD2-CB 4.44Å; L2051-C2681 HydrophobicContact CD1-CB 3.91Å; L2051-C2681 WeakPolarHBondContact CD1-O 3.3Å; L2677-C2681 WeakPolarHBondContact O-CB 3.25Å; L2677-C2681 PolarHBondContact O-N 2.98Å; L2677-C2681 PolarHBondContact O-SG 3.06Å; L2677-C2681 VanDerWaalsContact O-SG 3.4Å; G2678-C2681 WeakPolarHBondContact O-CB 3.4Å; G2678-C2681 PolarHBondContact O-N 3.19Å; G2678-C2681 VanDerWaalsContact O-N 3.17Å; I2679-C2681 PolarHBondContact O-N 2.84Å; C2681-S2683 PolarHBondContact O-N 3.18Å; C2681-T2684 PolarHBondContact O-N 3.34Å; C2681-F2685 WeakPolarHBondContact O-CB 3.33Å; C2681-F2685 PolarHBondContact O-N 2.98Å
2682L96.2Very high93.8Very high21.6 Ų21.646.1 Ų46.111%0.11326%0.257CS..Hα-helixtrans-60.5-45.7175.2-63.5179.2000111.6I2200 V2203 L2204 L2207 G2678 I2679 T2684 F2685 V2686 M2700 F2735I2200-L2682 HydrophobicContact CG2-CD2 4.18Å; V2203-L2682 HydrophobicContact CB-CD2 4.46Å; V2203-L2682 HydrophobicContact CG1-CD2 3.98Å; V2203-L2682 HydrophobicContact CG1-CG 4.1Å; L2204-L2682 HydrophobicContact CD2-CD1 3.91Å; L2204-L2682 HydrophobicContact CD2-CD2 3.86Å; L2204-L2682 HydrophobicContact CG-CD2 4.07Å; L2207-L2682 HydrophobicContact CD1-CD1 3.54Å; L2207-L2682 HydrophobicContact CD1-CG 4.22Å; G2678-L2682 WeakPolarHBondContact O-CG 3.44Å; G2678-L2682 PolarHBondContact O-N 3.03Å; I2679-L2682 PolarHBondContact O-N 3.06Å; L2682-T2684 VanDerWaalsContact C-N 3.31Å; L2682-T2684 PolarHBondContact O-N 3.21Å; L2682-F2685 PolarHBondContact O-N 3.08Å; L2682-V2686 WeakPolarHBondContact O-CB 3.35Å; L2682-V2686 VanDerWaalsContact O-CG2 3.28Å; L2682-V2686 WeakPolarHBondContact O-CG2 3.36Å; L2682-V2686 PolarHBondContact O-N 3.04Å; L2682-M2700 HydrophobicContact CD1-CG 4.22Å; L2682-M2700 HydrophobicContact CD2-CE 3.88Å; L2682-M2700 HydrophobicContact CD2-CG 4.25Å; L2682-M2700 HydrophobicContact CD2-SD 4.22Å; L2682-F2735 HydrophobicContact CB-CE2 4.09Å
2683S95.7Very high93.9Very high24.8 Ų24.844.5 Ų44.517%0.17325%0.25CS..Hα-helixtrans-55.5-47.3175.5-169.60000111.8I2679 L2680 C2681 F2685 V2686 H2687I2679-S2683 WeakPolarHBondContact O-CB 3.38Å; I2679-S2683 PolarHBondContact O-N 3.12Å; L2680-S2683 WeakPolarHBondContact O-CB 3.45Å; L2680-S2683 PolarHBondContact O-N 3.24Å; C2681-S2683 PolarHBondContact O-N 3.18Å; S2683-F2685 VanDerWaalsContact C-N 3.34Å; S2683-F2685 PolarHBondContact O-N 3.18Å; S2683-V2686 PolarHBondContact O-N 3.36Å; S2683-H2687 VanDerWaalsContact O-CB 3.27Å; S2683-H2687 WeakPolarHBondContact O-CB 3.38Å; S2683-H2687 PolarHBondContact O-CD2 3.23Å; S2683-H2687 VanDerWaalsContact O-CG 3.27Å; S2683-H2687 PolarHBondContact O-N 3.06Å; S2683-H2687 PolarHBondContact OG-CD2 3.14Å; S2683-H2687 VanDerWaalsContact OG-CD2 3.27Å; S2683-H2687 PolarHBondContact OG-NE2 3.25Å
2684T95.3Very high94Very high40 Ų4041.9 Ų41.925%0.24524%0.244CC..Hα-helixtrans-66.3-40.3-179-55.80000111.7L2048 L2051 Y2052 L2680 C2681 L2682 R2688L2048-T2684 HydrophobicContact CD1-CG2 4.48Å; L2048-T2684 VanDerWaalsContact CD1-OG1 3.25Å; L2048-T2684 WeakPolarHBondContact CD1-OG1 3.44Å; L2051-T2684 HydrophobicContact CB-CG2 3.9Å; Y2052-T2684 HydrophobicContact CD2-CG2 4.35Å; L2680-T2684 WeakPolarHBondContact O-CB 3.34Å; L2680-T2684 PolarHBondContact O-N 3.2Å; L2680-T2684 PolarHBondContact O-OG1 3.29Å; C2681-T2684 PolarHBondContact O-N 3.34Å; L2682-T2684 VanDerWaalsContact C-N 3.31Å; L2682-T2684 PolarHBondContact O-N 3.21Å; T2684-R2688 HydrophobicContact CG2-CG 4.36Å; T2684-R2688 WeakPolarHBondContact O-CB 3.41Å; T2684-R2688 VanDerWaalsContact O-CG 3.29Å; T2684-R2688 WeakPolarHBondContact O-CG 3.41Å; T2684-R2688 PolarHBondContact O-N 3.18Å; T2684-R2688 VanDerWaalsContact O-N 3.11Å
2685F95.5Very high94Very high26.6 Ų26.645 Ų4512%0.11727%0.265CS..Hα-helixtrans-65.2-49.6176.6179.4-123.7000111.9L2051 Y2056 I2196 I2200 C2681 L2682 S2683 H2687 R2688 E2689 L2692 A2693 Y2696 M2700L2051-F2685 HydrophobicContact CD1-CB 4.41Å; L2051-F2685 HydrophobicContact CD2-CB 4.15Å; L2051-F2685 HydrophobicContact CD2-CD2 3.92Å; L2051-F2685 HydrophobicContact CD2-CG 4.42Å; Y2056-F2685 HydrophobicContact CE2-CD2 4.15Å; Y2056-F2685 HydrophobicContact CE2-CE2 4.06Å; I2196-F2685 HydrophobicContact CG2-CD2 4.19Å; I2196-F2685 HydrophobicContact CG2-CE2 3.92Å; I2200-F2685 HydrophobicContact CB-CE1 4.39Å; I2200-F2685 HydrophobicContact CD1-CB 3.78Å; I2200-F2685 HydrophobicContact CD1-CD1 3.85Å; I2200-F2685 HydrophobicContact CD1-CD2 4.22Å; I2200-F2685 HydrophobicContact CD1-CE1 4.4Å; I2200-F2685 HydrophobicContact CD1-CG 3.71Å; I2200-F2685 HydrophobicContact CG1-CD1 3.88Å; I2200-F2685 HydrophobicContact CG1-CD2 4.12Å; I2200-F2685 HydrophobicContact CG1-CE1 3.98Å; I2200-F2685 HydrophobicContact CG1-CE2 4.23Å; I2200-F2685 HydrophobicContact CG1-CG 3.95Å; I2200-F2685 HydrophobicContact CG1-CZ 4.15Å; I2200-F2685 HydrophobicContact CG2-CD1 4.02Å; I2200-F2685 HydrophobicContact CG2-CE1 3.91Å; C2681-F2685 WeakPolarHBondContact O-CB 3.33Å; C2681-F2685 PolarHBondContact O-N 2.98Å; L2682-F2685 PolarHBondContact O-N 3.08Å; S2683-F2685 VanDerWaalsContact C-N 3.34Å; S2683-F2685 PolarHBondContact O-N 3.18Å; F2685-H2687 VanDerWaalsContact C-N 3.32Å; F2685-H2687 PolarHBondContact O-N 3.16Å; F2685-R2688 PolarHBondContact O-N 3.45Å; F2685-E2689 HydrophobicContact CD2-CB 4.38Å; F2685-E2689 HydrophobicContact CE2-CB 4.22Å; F2685-E2689 CarbonylContact O-C 3.42Å; F2685-E2689 PolarHBondContact O-N 3.28Å; F2685-L2692 HydrophobicContact CE2-CB 3.98Å; F2685-L2692 HydrophobicContact CE2-CD1 4.41Å; F2685-L2692 HydrophobicContact CZ-CB 3.81Å; F2685-A2693 HydrophobicContact CD1-CB 3.87Å; F2685-A2693 HydrophobicContact CE1-CB 3.78Å; F2685-A2693 HydrophobicContact CZ-CB 4.21Å; F2685-Y2696 HydrophobicContact CE1-CD2 4.22Å; F2685-M2700 HydrophobicContact CD1-CE 3.73Å; F2685-M2700 HydrophobicContact CE1-CE 3.94Å
2686V95.2Very high94Very high3.6 Ų3.648.6 Ų48.62%0.02228%0.278CS..Hα-helixtrans-60.3-40.8177.4173.50000111.9L2682 S2683 P2690 A2693 L2697 M2700 F2735 T2739 L2743L2682-V2686 WeakPolarHBondContact O-CB 3.35Å; L2682-V2686 VanDerWaalsContact O-CG2 3.28Å; L2682-V2686 WeakPolarHBondContact O-CG2 3.36Å; L2682-V2686 PolarHBondContact O-N 3.04Å; S2683-V2686 PolarHBondContact O-N 3.36Å; V2686-P2690 WeakPolarHBondContact O-CA 3.45Å; V2686-P2690 WeakPolarHBondContact O-CB 3.46Å; V2686-A2693 HydrophobicContact CB-CB 4.31Å; V2686-A2693 HydrophobicContact CG2-CB 3.81Å; V2686-L2697 HydrophobicContact CG1-CD1 4.32Å; V2686-L2697 HydrophobicContact CG2-CD1 4.33Å; V2686-M2700 HydrophobicContact CG2-CE 4.34Å; V2686-M2700 HydrophobicContact CG2-SD 3.62Å; V2686-M2700 VanDerWaalsContact CG2-SD 3.54Å; V2686-M2700 WeakPolarHBondContact CG2-SD 3.46Å; V2686-F2735 HydrophobicContact CG2-CE2 4.29Å; V2686-F2735 HydrophobicContact CG2-CZ 4.45Å; V2686-T2739 HydrophobicContact CG1-CG2 3.97Å; V2686-L2743 HydrophobicContact CG1-CD1 4.03Å
2687H93.1Very high93.9Very high98.4 Ų98.449.4 Ų49.446%0.45628%0.282SS..Hα-helixtrans-74.9-33.6-178.2-111.9-64.2000113.9S2683 F2685 C2738 N2742S2683-H2687 VanDerWaalsContact O-CB 3.27Å; S2683-H2687 WeakPolarHBondContact O-CB 3.38Å; S2683-H2687 PolarHBondContact O-CD2 3.23Å; S2683-H2687 VanDerWaalsContact O-CG 3.27Å; S2683-H2687 PolarHBondContact O-N 3.06Å; S2683-H2687 PolarHBondContact OG-CD2 3.14Å; S2683-H2687 VanDerWaalsContact OG-CD2 3.27Å; S2683-H2687 PolarHBondContact OG-NE2 3.25Å; F2685-H2687 VanDerWaalsContact C-N 3.32Å; F2685-H2687 PolarHBondContact O-N 3.16Å; H2687-C2738 WeakPolarHBondContact NE2-CB 3.46Å; H2687-N2742 PolarHBondContact CE1-ND2 2.92Å
2688R92.9Very high93.9Very high128.2 Ų128.250.8 Ų50.848%0.48428%0.283SS..Hα-helixtrans-86.6-39.9179.7-69.5-170.872.2-158.2-0.1113L2051 Y2052 Y2054 T2684 F2685 P2690L2051-R2688 VanDerWaalsContact O-CD 3.24Å; L2051-R2688 WeakPolarHBondContact O-CD 3.25Å; L2051-R2688 PolarHBondContact O-NH1 2.98Å; Y2052-R2688 WeakPolarHBondContact O-CD 3.4Å; Y2052-R2688 PolarHBondContact O-NE 3.4Å; Y2052-R2688 PolarHBondContact O-NH1 3.2Å; Y2054-R2688 PolarHBondContact O-NH1 2.96Å; Y2054-R2688 PolarHBondContact O-NH2 3.18Å; T2684-R2688 HydrophobicContact CG2-CG 4.36Å; T2684-R2688 WeakPolarHBondContact O-CB 3.41Å; T2684-R2688 VanDerWaalsContact O-CG 3.29Å; T2684-R2688 WeakPolarHBondContact O-CG 3.41Å; T2684-R2688 PolarHBondContact O-N 3.18Å; T2684-R2688 VanDerWaalsContact O-N 3.11Å; F2685-R2688 PolarHBondContact O-N 3.45Å; R2688-P2690 VanDerWaalsContact C-CD 3.47Å; R2688-P2690 WeakPolarHBondContact O-CD 3.12Å
2689E91.4Very high93.7Very high66.2 Ų66.253.3 Ų53.331%0.30929%0.293SS..  trans-132.160.9-171.8-60.9-101.9164.900111.8Y2056 N2057 F2685 G2691 L2692 A2693Y2056-E2689 HydrophobicContact CE2-CB 4.26Å; Y2056-E2689 HydrophobicContact CE2-CG 3.7Å; N2057-E2689 VanDerWaalsContact CG-CD 3.4Å; N2057-E2689 PolarHBondContact ND2-OE1 3.04Å; N2057-E2689 PolarHBondContact ND2-OE2 2.87Å; N2057-E2689 VanDerWaalsContact OD1-CD 3.26Å; N2057-E2689 VanDerWaalsContact OD1-CG 3.31Å; N2057-E2689 WeakPolarHBondContact OD1-CG 3.43Å; N2057-E2689 PolarHBondContact OD1-OE2 2.95Å; F2685-E2689 HydrophobicContact CD2-CB 4.38Å; F2685-E2689 HydrophobicContact CE2-CB 4.22Å; F2685-E2689 CarbonylContact O-C 3.42Å; F2685-E2689 PolarHBondContact O-N 3.28Å; E2689-G2691 PolarHBondContact O-N 3.26Å; E2689-G2691 VanDerWaalsContact O-N 3.09Å; E2689-L2692 HydrophobicContact CB-CB 4.23Å; E2689-L2692 HydrophobicContact CB-CD1 4.3Å; E2689-L2692 HydrophobicContact CB-CG 4.24Å; E2689-L2692 PolarHBondContact O-N 3.11Å; E2689-A2693 PolarHBondContact O-N 3.22Å; E2689-A2693 VanDerWaalsContact O-N 3.11Å
2690P91.3Very high93.7Very high56 Ų5653.5 Ų53.536%0.36429%0.294SS..Hα-helixtrans-58.4-28-175.523.1-34.2000113.4V2686 R2688 L2692 A2693 A2694 L2743V2686-P2690 WeakPolarHBondContact O-CA 3.45Å; V2686-P2690 WeakPolarHBondContact O-CB 3.46Å; R2688-P2690 VanDerWaalsContact C-CD 3.47Å; R2688-P2690 WeakPolarHBondContact O-CD 3.12Å; P2690-L2692 VanDerWaalsContact C-N 3.31Å; P2690-L2692 PolarHBondContact O-N 3.24Å; P2690-A2693 PolarHBondContact O-N 2.92Å; P2690-A2694 WeakPolarHBondContact O-CB 3.44Å; P2690-A2694 PolarHBondContact O-N 3.1Å; P2690-L2743 HydrophobicContact CB-CD2 3.99Å
2691G91.5Very high93.6Very high64.4 Ų64.449.6 Ų49.666%0.66427%0.273SS*.Hα-helixtrans-69.2-26.2174.300000114.6E2689E2689-G2691 PolarHBondContact O-N 3.26Å; E2689-G2691 VanDerWaalsContact O-N 3.09Å
2692L92.3Very high93.5Very high50.4 Ų50.448.4 Ų48.426%0.26426%0.264SS..Hα-helixtrans-89.4-28.9172.6-63.4-173000112.1Y2056 N2057 R2193 F2685 E2689 P2690 P2695 Y2696Y2056-L2692 HydrophobicContact CD2-CD1 4.18Å; Y2056-L2692 HydrophobicContact CE2-CD1 4.16Å; N2057-L2692 WeakPolarHBondContact OD1-CD1 3.4Å; R2193-L2692 HydrophobicContact CG-CD1 3.85Å; R2193-L2692 HydrophobicContact CG-CD2 4.38Å; F2685-L2692 HydrophobicContact CE2-CB 3.98Å; F2685-L2692 HydrophobicContact CE2-CD1 4.41Å; F2685-L2692 HydrophobicContact CZ-CB 3.81Å; E2689-L2692 HydrophobicContact CB-CB 4.23Å; E2689-L2692 HydrophobicContact CB-CD1 4.3Å; E2689-L2692 HydrophobicContact CB-CG 4.24Å; E2689-L2692 PolarHBondContact O-N 3.11Å; P2690-L2692 VanDerWaalsContact C-N 3.31Å; P2690-L2692 PolarHBondContact O-N 3.24Å; L2692-P2695 WeakPolarHBondContact O-CD 3.42Å; L2692-Y2696 WeakPolarHBondContact O-CD2 3.5Å
2693A93.1Very high93.3Very high1 Ų149.4 Ų49.41%0.00827%0.269CS..Hα-helixtrans-75.1-27175.600000113.4F2685 V2686 E2689 P2690 P2695 Y2696 L2697 M2700F2685-A2693 HydrophobicContact CD1-CB 3.87Å; F2685-A2693 HydrophobicContact CE1-CB 3.78Å; F2685-A2693 HydrophobicContact CZ-CB 4.21Å; V2686-A2693 HydrophobicContact CB-CB 4.31Å; V2686-A2693 HydrophobicContact CG2-CB 3.81Å; E2689-A2693 PolarHBondContact O-N 3.22Å; E2689-A2693 VanDerWaalsContact O-N 3.11Å; P2690-A2693 PolarHBondContact O-N 2.92Å; A2693-P2695 VanDerWaalsContact C-CD 3.42Å; A2693-Y2696 CarbonylContact O-C 3.57Å; A2693-Y2696 WeakPolarHBondContact O-CA 3.29Å; A2693-Y2696 PolarHBondContact O-N 3.24Å; A2693-L2697 PolarHBondContact O-N 3.08Å; A2693-M2700 HydrophobicContact CB-CE 4.43Å; A2693-M2700 HydrophobicContact CB-SD 4.43Å
2694A92.2Very high93.3Very high56.8 Ų56.848.2 Ų48.247%0.46926%0.261SS..G310 helixtrans-43.6-49.3-176.900000116.3P2690 Y2696 L2697P2690-A2694 WeakPolarHBondContact O-CB 3.44Å; P2690-A2694 PolarHBondContact O-N 3.1Å; A2694-Y2696 VanDerWaalsContact C-N 3.27Å; A2694-Y2696 PolarHBondContact O-N 3.1Å; A2694-L2697 WeakPolarHBondContact O-CB 3.36Å; A2694-L2697 PolarHBondContact O-N 2.93Å
2695P92.6Very high93.2Very high95.4 Ų95.446.4 Ų46.462%0.61925%0.25SS*.G310 helixtrans-65.2-26.7178.916-22.8000114.1L2692 A2693L2692-P2695 WeakPolarHBondContact O-CD 3.42Å; A2693-P2695 VanDerWaalsContact C-CD 3.42Å
2696Y93.1Very high93Very high85.6 Ų85.648.6 Ų48.634%0.33626%0.258SS..G310 helixtrans-94.3-13.2-179.6-53.5-76.8000113E2197 L2204 F2685 L2692 A2693 A2694 R2698 D2699 M2700E2197-Y2696 HydrophobicContact CG-CE2 4.46Å; L2204-Y2696 HydrophobicContact CD1-CD1 3.75Å; L2204-Y2696 HydrophobicContact CD1-CG 4.14Å; F2685-Y2696 HydrophobicContact CE1-CD2 4.22Å; L2692-Y2696 WeakPolarHBondContact O-CD2 3.5Å; A2693-Y2696 CarbonylContact O-C 3.57Å; A2693-Y2696 WeakPolarHBondContact O-CA 3.29Å; A2693-Y2696 PolarHBondContact O-N 3.24Å; A2694-Y2696 VanDerWaalsContact C-N 3.27Å; A2694-Y2696 PolarHBondContact O-N 3.1Å; Y2696-R2698 VanDerWaalsContact C-N 3.3Å; Y2696-R2698 PolarHBondContact O-N 3.22Å; Y2696-D2699 PolarHBondContact O-N 2.81Å; Y2696-D2699 VanDerWaalsContact O-N 3.09Å; Y2696-M2700 HydrophobicContact CG-CE 4.35Å; Y2696-M2700 WeakPolarHBondContact O-CG 3.29Å; Y2696-M2700 PolarHBondContact O-N 3.08Å
2697L93.6Very high92.8Very high21.6 Ų21.649 Ų4911%0.11326%0.26CS..Hα-helixtrans-59.7-36.7-167.7-176.663.1000113.3V2686 A2693 A2694 D2699 M2700 L2701 T2739 L2743 L2748V2686-L2697 HydrophobicContact CG1-CD1 4.32Å; V2686-L2697 HydrophobicContact CG2-CD1 4.33Å; A2693-L2697 PolarHBondContact O-N 3.08Å; A2694-L2697 WeakPolarHBondContact O-CB 3.36Å; A2694-L2697 PolarHBondContact O-N 2.93Å; L2697-D2699 VanDerWaalsContact C-N 3.34Å; L2697-D2699 PolarHBondContact O-N 3.24Å; L2697-M2700 HydrophobicContact CD1-SD 4.47Å; L2697-M2700 PolarHBondContact O-N 3.19Å; L2697-L2701 HydrophobicContact CD1-CD1 4.34Å; L2697-L2701 HydrophobicContact CD1-CG 4.29Å; L2697-L2701 HydrophobicContact CG-CD1 4.11Å; L2697-L2701 HydrophobicContact CG-CG 4.44Å; L2697-L2701 WeakPolarHBondContact O-CB 3.3Å; L2697-L2701 VanDerWaalsContact O-CG 3.24Å; L2697-L2701 WeakPolarHBondContact O-CG 3.39Å; L2697-L2701 PolarHBondContact O-N 3.19Å; L2697-T2739 HydrophobicContact CD1-CG2 3.81Å; L2697-L2743 HydrophobicContact CD1-CD1 4.05Å; L2697-L2743 HydrophobicContact CD2-CD1 3.57Å; L2697-L2743 HydrophobicContact CG-CD1 4.46Å; L2697-L2748 HydrophobicContact CD2-CD1 3.81Å
2698R92.6Very high92.7Very high89 Ų8944.8 Ų44.834%0.33624%0.242SC..Hα-helixtrans-54.5-51.6173.7175.7-170.5177-100.66.3111.1Y2696 L2701 L2702 T2755 H2756Y2696-R2698 VanDerWaalsContact C-N 3.3Å; Y2696-R2698 PolarHBondContact O-N 3.22Å; R2698-L2701 PolarHBondContact O-N 3.2Å; R2698-L2702 HydrophobicContact CG-CD1 4.06Å; R2698-L2702 WeakPolarHBondContact O-CD1 3.26Å; R2698-L2702 VanDerWaalsContact O-CG 3.32Å; R2698-L2702 WeakPolarHBondContact O-CG 3.32Å; R2698-L2702 PolarHBondContact O-N 3.26Å; R2698-T2755 HydrophobicContact CG-CG2 4.03Å; R2698-H2756 PolarHBondContact NE-O 3.31Å; R2698-H2756 PolarHBondContact NH2-O 3.25Å
2699D92.6Very high92.4Very high66.8 Ų66.841.5 Ų41.536%0.35723%0.234SC..Hα-helixtrans-77.3-34.8-172.4-59.9-13.6000110.3Y2696 L2697 L2701 L2702 I2703Y2696-D2699 PolarHBondContact O-N 2.81Å; Y2696-D2699 VanDerWaalsContact O-N 3.09Å; L2697-D2699 VanDerWaalsContact C-N 3.34Å; L2697-D2699 PolarHBondContact O-N 3.24Å; D2699-L2701 VanDerWaalsContact C-N 3.32Å; D2699-L2701 PolarHBondContact O-N 3.19Å; D2699-L2702 PolarHBondContact O-N 3.04Å; D2699-I2703 HydrophobicContact CB-CD1 4.46Å; D2699-I2703 VanDerWaalsContact O-CB 3.32Å; D2699-I2703 WeakPolarHBondContact O-CB 3.39Å; D2699-I2703 WeakPolarHBondContact O-CD1 3.32Å; D2699-I2703 VanDerWaalsContact O-CG1 3.23Å; D2699-I2703 WeakPolarHBondContact O-CG1 3.44Å; D2699-I2703 PolarHBondContact O-N 3.14Å
2700M94.9Very high92Very high7.8 Ų7.839.5 Ų39.54%0.03823%0.228CC..Hα-helixtrans-55.2-46.3167.8-68.7169.3176.600112.3I2200 L2204 L2682 F2685 V2686 A2693 Y2696 L2697 T2704 F2735I2200-M2700 HydrophobicContact CG2-CE 3.86Å; L2204-M2700 HydrophobicContact CD2-CB 4.46Å; L2204-M2700 HydrophobicContact CD2-CG 3.66Å; L2682-M2700 HydrophobicContact CD1-CG 4.22Å; L2682-M2700 HydrophobicContact CD2-CE 3.88Å; L2682-M2700 HydrophobicContact CD2-CG 4.25Å; L2682-M2700 HydrophobicContact CD2-SD 4.22Å; F2685-M2700 HydrophobicContact CD1-CE 3.73Å; F2685-M2700 HydrophobicContact CE1-CE 3.94Å; V2686-M2700 HydrophobicContact CG2-CE 4.34Å; V2686-M2700 HydrophobicContact CG2-SD 3.62Å; V2686-M2700 VanDerWaalsContact CG2-SD 3.54Å; V2686-M2700 WeakPolarHBondContact CG2-SD 3.46Å; A2693-M2700 HydrophobicContact CB-CE 4.43Å; A2693-M2700 HydrophobicContact CB-SD 4.43Å; Y2696-M2700 HydrophobicContact CG-CE 4.35Å; Y2696-M2700 WeakPolarHBondContact O-CG 3.29Å; Y2696-M2700 PolarHBondContact O-N 3.08Å; L2697-M2700 HydrophobicContact CD1-SD 4.47Å; L2697-M2700 PolarHBondContact O-N 3.19Å; M2700-T2704 VanDerWaalsContact O-CB 3.28Å; M2700-T2704 WeakPolarHBondContact O-CB 3.32Å; M2700-T2704 PolarHBondContact O-N 3.26Å; M2700-T2704 VanDerWaalsContact O-N 3.11Å; M2700-T2704 PolarHBondContact O-OG1 2.94Å; M2700-F2735 HydrophobicContact CB-CZ 4.16Å
2701L94.6Very high91.4Very high2.4 Ų2.442.8 Ų42.81%0.01323%0.234CC..Hα-helixtrans-67.7-44.3178.5-71.4171.5000111.7L2697 R2698 D2699 T2704 A2705 F2735 L2736 T2739 L2748 L2752 F2762L2697-L2701 HydrophobicContact CD1-CD1 4.34Å; L2697-L2701 HydrophobicContact CD1-CG 4.29Å; L2697-L2701 HydrophobicContact CG-CD1 4.11Å; L2697-L2701 HydrophobicContact CG-CG 4.44Å; L2697-L2701 WeakPolarHBondContact O-CB 3.3Å; L2697-L2701 VanDerWaalsContact O-CG 3.24Å; L2697-L2701 WeakPolarHBondContact O-CG 3.39Å; L2697-L2701 PolarHBondContact O-N 3.19Å; R2698-L2701 PolarHBondContact O-N 3.2Å; D2699-L2701 VanDerWaalsContact C-N 3.32Å; D2699-L2701 PolarHBondContact O-N 3.19Å; L2701-T2704 PolarHBondContact O-N 2.95Å; L2701-A2705 VanDerWaalsContact O-CB 3.3Å; L2701-A2705 WeakPolarHBondContact O-CB 3.19Å; L2701-A2705 PolarHBondContact O-N 2.98Å; L2701-F2735 HydrophobicContact CD2-CE1 4.22Å; L2701-L2736 HydrophobicContact CD2-CD2 3.66Å; L2701-T2739 HydrophobicContact CD2-CG2 4Å; L2701-L2748 HydrophobicContact CD1-CD1 4.29Å; L2701-L2752 HydrophobicContact CD1-CD1 4.47Å; L2701-F2762 HydrophobicContact CB-CE2 4.13Å; L2701-F2762 HydrophobicContact CB-CZ 4.36Å
2702L93.4Very high90.8Very high10.2 Ų10.241.7 Ų41.75%0.05321%0.212CC..Hα-helixtrans-63.1-48.2178.3-78153.3000112.4R2698 D2699 T2704 A2705 R2706 I2757 D2759 F2762R2698-L2702 HydrophobicContact CG-CD1 4.06Å; R2698-L2702 WeakPolarHBondContact O-CD1 3.26Å; R2698-L2702 VanDerWaalsContact O-CG 3.32Å; R2698-L2702 WeakPolarHBondContact O-CG 3.32Å; R2698-L2702 PolarHBondContact O-N 3.26Å; D2699-L2702 PolarHBondContact O-N 3.04Å; L2702-T2704 VanDerWaalsContact C-N 3.31Å; L2702-T2704 PolarHBondContact O-N 2.85Å; L2702-A2705 PolarHBondContact O-N 3.12Å; L2702-R2706 WeakPolarHBondContact O-CG 3.24Å; L2702-R2706 PolarHBondContact O-N 3.16Å; L2702-R2706 VanDerWaalsContact O-N 3.1Å; L2702-I2757 HydrophobicContact CD1-CG1 4.5Å; L2702-I2757 HydrophobicContact CD2-CG2 4.17Å; L2702-D2759 HydrophobicContact CD2-CB 4.3Å; L2702-F2762 HydrophobicContact CD1-CD2 3.92Å; L2702-F2762 HydrophobicContact CD1-CE2 3.89Å; L2702-F2762 HydrophobicContact CD1-CG 4.46Å; L2702-F2762 HydrophobicContact CD1-CZ 4.4Å; L2702-F2762 HydrophobicContact CD2-CB 4.41Å; L2702-F2762 HydrophobicContact CD2-CD2 3.83Å; L2702-F2762 HydrophobicContact CD2-CE2 4.36Å; L2702-F2762 HydrophobicContact CD2-CG 4.13Å; L2702-F2762 HydrophobicContact CG-CD2 4.23Å
2703I93.2Very high90.1Very high42.2 Ų42.243.6 Ų43.622%0.21622%0.216CC..Hα-helixtrans-62.3-44.4178.5-66.7162.8000110.1L2204 L2207 D2208 V2211 D2699 A2705 R2706 L2707L2204-I2703 HydrophobicContact CB-CD1 4.43Å; L2204-I2703 HydrophobicContact CD2-CD1 4.06Å; L2207-I2703 HydrophobicContact CB-CG2 3.61Å; D2208-I2703 HydrophobicContact CB-CD1 3.8Å; D2208-I2703 HydrophobicContact CB-CG1 4Å; V2211-I2703 HydrophobicContact CG2-CG2 3.99Å; D2699-I2703 HydrophobicContact CB-CD1 4.46Å; D2699-I2703 VanDerWaalsContact O-CB 3.32Å; D2699-I2703 WeakPolarHBondContact O-CB 3.39Å; D2699-I2703 WeakPolarHBondContact O-CD1 3.32Å; D2699-I2703 VanDerWaalsContact O-CG1 3.23Å; D2699-I2703 WeakPolarHBondContact O-CG1 3.44Å; D2699-I2703 PolarHBondContact O-N 3.14Å; I2703-A2705 VanDerWaalsContact C-N 3.34Å; I2703-A2705 PolarHBondContact O-N 3.32Å; I2703-R2706 WeakPolarHBondContact O-CB 3.41Å; I2703-R2706 PolarHBondContact O-N 2.87Å; I2703-L2707 HydrophobicContact CG2-CD1 4.05Å; I2703-L2707 WeakPolarHBondContact O-CG 3.33Å; I2703-L2707 PolarHBondContact O-N 3.1Å; I2703-L2707 VanDerWaalsContact O-N 3.13Å
2704T94.1Very high89.3Confident0.4 Ų0.448.4 Ų48.40%0.00225%0.25CC..Hα-helixtrans-72.2-29.7-178.4-46.30000112.4I2679 M2700 L2701 L2702 R2706 L2707 A2708 A2732 F2735 L2736I2679-T2704 HydrophobicContact CD1-CG2 4.44Å; I2679-T2704 HydrophobicContact CG2-CG2 4.29Å; M2700-T2704 VanDerWaalsContact O-CB 3.28Å; M2700-T2704 WeakPolarHBondContact O-CB 3.32Å; M2700-T2704 PolarHBondContact O-N 3.26Å; M2700-T2704 VanDerWaalsContact O-N 3.11Å; M2700-T2704 PolarHBondContact O-OG1 2.94Å; L2701-T2704 PolarHBondContact O-N 2.95Å; L2702-T2704 VanDerWaalsContact C-N 3.31Å; L2702-T2704 PolarHBondContact O-N 2.85Å; T2704-R2706 VanDerWaalsContact C-N 3.31Å; T2704-R2706 PolarHBondContact O-N 3.34Å; T2704-L2707 PolarHBondContact O-N 3.22Å; T2704-A2708 WeakPolarHBondContact O-CB 3.36Å; T2704-A2708 PolarHBondContact O-N 3.1Å; T2704-A2732 VanDerWaalsContact CG2-CA 3.5Å; T2704-A2732 HydrophobicContact CG2-CB 3.52Å; T2704-A2732 VanDerWaalsContact CG2-CB 3.49Å; T2704-F2735 HydrophobicContact CG2-CB 4.18Å; T2704-F2735 HydrophobicContact CG2-CD1 3.5Å; T2704-F2735 VanDerWaalsContact CG2-CD1 3.47Å; T2704-F2735 HydrophobicContact CG2-CE1 4.24Å; T2704-F2735 HydrophobicContact CG2-CG 4.11Å; T2704-L2736 HydrophobicContact CG2-CG 4.22Å
2705A93.3Very high88.6Confident1.8 Ų1.850 Ų502%0.01524%0.243CC..Hα-helixtrans-67.1-36171.400000112.7L2701 L2702 I2703 L2707 A2708 N2709 L2736 F2762 T2765L2701-A2705 VanDerWaalsContact O-CB 3.3Å; L2701-A2705 WeakPolarHBondContact O-CB 3.19Å; L2701-A2705 PolarHBondContact O-N 2.98Å; L2702-A2705 PolarHBondContact O-N 3.12Å; I2703-A2705 VanDerWaalsContact C-N 3.34Å; I2703-A2705 PolarHBondContact O-N 3.32Å; A2705-L2707 VanDerWaalsContact C-N 3.33Å; A2705-L2707 PolarHBondContact O-N 3.05Å; A2705-A2708 WeakPolarHBondContact O-CB 3.41Å; A2705-A2708 PolarHBondContact O-N 3.26Å; A2705-N2709 PolarHBondContact O-N 3.07Å; A2705-N2709 PolarHBondContact O-ND2 2.94Å; A2705-L2736 HydrophobicContact CB-CD1 4.4Å; A2705-F2762 HydrophobicContact CB-CD2 3.6Å; A2705-F2762 HydrophobicContact CB-CE2 3.98Å; A2705-T2765 HydrophobicContact CB-CG2 4.06Å; A2705-T2765 WeakPolarHBondContact O-CG2 3.34Å; A2705-T2765 PolarHBondContact O-OG1 2.62Å
2706R91.9Very high87.8Confident73.4 Ų73.446.4 Ų46.428%0.27722%0.218SC..Hα-helixtrans-65.3-43.1171.1-69.8175.2-161.6161.50.2112D2208 V2211 L2702 I2703 T2704 A2708 N2709 A2710 D2759D2208-R2706 IonicContact OD1-CZ 2.7Å; D2208-R2706 IonicContact OD1-NH1 3.05Å; D2208-R2706 PolarHBondContact OD1-NH1 3.02Å; D2208-R2706 VanDerWaalsContact OD1-NH1 3.15Å; D2208-R2706 IonicContact OD1-NH2 3.79Å; D2208-R2706 PolarHBondContact OD1-NH2 3.36Å; V2211-R2706 HydrophobicContact CB-CB 3.8Å; V2211-R2706 HydrophobicContact CG1-CB 4.13Å; V2211-R2706 HydrophobicContact CG2-CB 3.91Å; V2211-R2706 PolarHBondContact O-NH1 3.25Å; L2702-R2706 WeakPolarHBondContact O-CG 3.24Å; L2702-R2706 PolarHBondContact O-N 3.16Å; L2702-R2706 VanDerWaalsContact O-N 3.1Å; I2703-R2706 WeakPolarHBondContact O-CB 3.41Å; I2703-R2706 PolarHBondContact O-N 2.87Å; T2704-R2706 VanDerWaalsContact C-N 3.31Å; T2704-R2706 PolarHBondContact O-N 3.34Å; R2706-A2708 VanDerWaalsContact C-N 3.3Å; R2706-A2708 PolarHBondContact O-N 3.17Å; R2706-N2709 CarbonylContact O-C 3.56Å; R2706-N2709 PolarHBondContact O-N 2.98Å; R2706-N2709 VanDerWaalsContact O-N 3.13Å; R2706-A2710 PolarHBondContact O-N 3.18Å; R2706-A2710 VanDerWaalsContact O-N 3.11Å; R2706-D2759 WeakPolarHBondContact CG-OD2 3.4Å; R2706-D2759 IonicContact CZ-OD2 3.76Å; R2706-D2759 VanDerWaalsContact CZ-OD2 3.24Å; R2706-D2759 IonicContact NE-OD2 2.87Å; R2706-D2759 PolarHBondContact NE-OD2 3.07Å; R2706-D2759 IonicContact NH2-OD2 3.25Å; R2706-D2759 PolarHBondContact NH2-OD2 3.18Å
2707L92Very high86.8Confident11.2 Ų11.245.1 Ų45.16%0.05922%0.22CC..Hα-helixtrans-67.3-27.2177.2-69.2170.1000113.3L2207 V2211 I2675 I2679 I2703 T2704 A2705 A2710 F2712 V2728 A2732L2207-L2707 HydrophobicContact CB-CD1 4.31Å; L2207-L2707 HydrophobicContact CD2-CD1 4.02Å; V2211-L2707 HydrophobicContact CG1-CD2 3.49Å; V2211-L2707 VanDerWaalsContact CG1-CD2 3.49Å; V2211-L2707 HydrophobicContact CG1-CG 3.83Å; V2211-L2707 HydrophobicContact CG2-CD2 3.77Å; V2211-L2707 HydrophobicContact CG2-CG 4.48Å; I2675-L2707 HydrophobicContact CG2-CD1 3.94Å; I2675-L2707 HydrophobicContact CG2-CD2 4.1Å; I2679-L2707 HydrophobicContact CD1-CD1 4.14Å; I2679-L2707 HydrophobicContact CG1-CD1 4.42Å; I2703-L2707 HydrophobicContact CG2-CD1 4.05Å; I2703-L2707 WeakPolarHBondContact O-CG 3.33Å; I2703-L2707 PolarHBondContact O-N 3.1Å; I2703-L2707 VanDerWaalsContact O-N 3.13Å; T2704-L2707 PolarHBondContact O-N 3.22Å; A2705-L2707 VanDerWaalsContact C-N 3.33Å; A2705-L2707 PolarHBondContact O-N 3.05Å; L2707-A2710 WeakPolarHBondContact O-CB 3.46Å; L2707-A2710 PolarHBondContact O-N 3.11Å; L2707-F2712 HydrophobicContact CD2-CZ 4.48Å; L2707-V2728 HydrophobicContact CB-CG1 4.23Å; L2707-V2728 HydrophobicContact CD2-CG1 4.32Å; L2707-A2732 HydrophobicContact CB-CB 4.33Å
2708A90Very high85.5Confident9.2 Ų9.250.8 Ų50.88%0.07625%0.247CC..Hα-helixtrans-68.2-37.4171.400000112.8T2704 A2705 R2706 A2710 A2732 H2733 L2736 T2765T2704-A2708 WeakPolarHBondContact O-CB 3.36Å; T2704-A2708 PolarHBondContact O-N 3.1Å; A2705-A2708 WeakPolarHBondContact O-CB 3.41Å; A2705-A2708 PolarHBondContact O-N 3.26Å; R2706-A2708 VanDerWaalsContact C-N 3.3Å; R2706-A2708 PolarHBondContact O-N 3.17Å; A2708-A2710 VanDerWaalsContact C-N 3.32Å; A2708-A2710 PolarHBondContact O-N 2.98Å; A2708-A2732 HydrophobicContact CB-CB 3.98Å; A2708-H2733 VanDerWaalsContact CB-CD2 3.47Å; A2708-H2733 WeakPolarHBondContact CB-CD2 3.17Å; A2708-L2736 HydrophobicContact CB-CD1 4.26Å; A2708-T2765 HydrophobicContact CB-CG2 3.64Å
2709N85.8Confident84.5Confident59.6 Ų59.650.9 Ų50.932%0.31925%0.253SS..SBendtrans-84.8-1.6175.2-66-20.7000113.7A2705 R2706 Y2711 T2765A2705-N2709 PolarHBondContact O-N 3.07Å; A2705-N2709 PolarHBondContact O-ND2 2.94Å; R2706-N2709 CarbonylContact O-C 3.56Å; R2706-N2709 PolarHBondContact O-N 2.98Å; R2706-N2709 VanDerWaalsContact O-N 3.13Å; N2709-Y2711 PolarHBondContact O-N 3.15Å; N2709-T2765 PolarHBondContact ND2-OG1 3.13Å; N2709-T2765 WeakPolarHBondContact OD1-CG2 3.43Å; N2709-T2765 PolarHBondContact OD1-OG1 3.23Å
2710A84.3Confident83.3Confident24 Ų2451.6 Ų51.620%0.19826%0.261CS..  trans-80.5118.6-176.500000111.1V2211 R2706 L2707 A2708 F2712V2211-A2710 HydrophobicContact CG2-CB 4.27Å; R2706-A2710 PolarHBondContact O-N 3.18Å; R2706-A2710 VanDerWaalsContact O-N 3.11Å; L2707-A2710 WeakPolarHBondContact O-CB 3.46Å; L2707-A2710 PolarHBondContact O-N 3.11Å; A2708-A2710 VanDerWaalsContact C-N 3.32Å; A2708-A2710 PolarHBondContact O-N 2.98Å; A2710-F2712 HydrophobicContact CB-CD2 4.38Å; A2710-F2712 HydrophobicContact CB-CE2 3.89Å; A2710-F2712 HydrophobicContact CB-CZ 4.37Å; A2710-F2712 WeakPolarHBondContact O-CD2 3.36Å; A2710-F2712 PolarHBondContact O-N 3.38Å
2711Y77.6Confident82Confident124.6 Ų124.659.1 Ų59.149%0.48930%0.296SS..  trans-88.3108.5172.7-59.3-69.5000109.8N2227 N2709 Y2713 Q2716 P2717N2227-Y2711 PolarHBondContact ND2-O 2.95Å; N2227-Y2711 PolarHBondContact OD1-O 3.03Å; N2709-Y2711 PolarHBondContact O-N 3.15Å; Y2711-Y2713 VanDerWaalsContact C-N 3.28Å; Y2711-Y2713 PolarHBondContact O-N 3.04Å; Y2711-Q2716 HydrophobicContact CD1-CB 3.89Å; Y2711-Q2716 HydrophobicContact CD1-CG 3.87Å; Y2711-Q2716 HydrophobicContact CE1-CG 4.46Å; Y2711-P2717 HydrophobicContact CD1-CB 4.41Å; Y2711-P2717 HydrophobicContact CD1-CG 3.77Å; Y2711-P2717 HydrophobicContact CD2-CG 3.92Å; Y2711-P2717 HydrophobicContact CE1-CB 4.23Å; Y2711-P2717 HydrophobicContact CE1-CG 3.88Å; Y2711-P2717 HydrophobicContact CE2-CG 4.03Å; Y2711-P2717 HydrophobicContact CG-CG 3.78Å
2712F78.5Confident81Confident42 Ų4262.8 Ų62.818%0.18432%0.318CS..SBendtrans-77.2-16.9177.7-73.1-96.6000112.3H2210 Q2229 E2672 I2675 L2707 A2710 Q2716 V2728H2210-F2712 AromaticContact CD2-CZ 3.96Å; H2210-F2712 AromaticContact CE1-CE1 3.74Å; H2210-F2712 VanDerWaalsContact CE1-CE1 3.49Å; H2210-F2712 WeakPolarHBondContact CE1-CE1 3.14Å; H2210-F2712 AromaticContact CE1-CZ 3.61Å; H2210-F2712 AromaticContact NE2-CE1 3.55Å; H2210-F2712 WeakPolarHBondContact NE2-CE1 3.24Å; H2210-F2712 AromaticContact NE2-CZ 3.59Å; H2210-F2712 WeakPolarHBondContact NE2-CZ 3.19Å; Q2229-F2712 PolarHBondContact NE2-O 3.28Å; E2672-F2712 HydrophobicContact CG-CD1 3.93Å; E2672-F2712 HydrophobicContact CG-CE1 4.26Å; E2672-F2712 HydrophobicContact CG-CG 4.34Å; I2675-F2712 HydrophobicContact CD1-CE1 3.92Å; I2675-F2712 HydrophobicContact CD1-CZ 3.92Å; L2707-F2712 HydrophobicContact CD2-CZ 4.48Å; A2710-F2712 HydrophobicContact CB-CD2 4.38Å; A2710-F2712 HydrophobicContact CB-CE2 3.89Å; A2710-F2712 HydrophobicContact CB-CZ 4.37Å; A2710-F2712 WeakPolarHBondContact O-CD2 3.36Å; A2710-F2712 PolarHBondContact O-N 3.38Å; F2712-Q2716 VanDerWaalsContact N-OE1 3.14Å; F2712-V2728 HydrophobicContact CD2-CB 4.26Å; F2712-V2728 HydrophobicContact CE1-CB 4.38Å; F2712-V2728 HydrophobicContact CE1-CG2 4.3Å; F2712-V2728 HydrophobicContact CE2-CB 3.61Å; F2712-V2728 HydrophobicContact CE2-CG1 3.82Å; F2712-V2728 HydrophobicContact CE2-CG2 4.13Å; F2712-V2728 HydrophobicContact CZ-CB 3.81Å; F2712-V2728 HydrophobicContact CZ-CG1 3.85Å; F2712-V2728 HydrophobicContact CZ-CG2 3.89Å
2713Y78.1Confident79.9Confident90.6 Ų90.667.7 Ų67.736%0.35534%0.344SS..SBendtrans-136.4139.8-179.6-51.3-88.9000110.6E2672 Y2711 W2715 Q2716E2672-Y2713 WeakPolarHBondContact OE2-CE2 3.33Å; E2672-Y2713 PolarHBondContact OE2-OH 3.34Å; Y2711-Y2713 VanDerWaalsContact C-N 3.28Å; Y2711-Y2713 PolarHBondContact O-N 3.04Å; Y2713-W2715 VanDerWaalsContact C-N 3.27Å; Y2713-W2715 VanDerWaalsContact CB-NE1 3.32Å; Y2713-W2715 HydrophobicContact CD1-CZ2 4.46Å; Y2713-W2715 AromaticContact CD1-NE1 3.92Å; Y2713-W2715 HydrophobicContact CD2-CZ2 4.12Å; Y2713-W2715 AromaticContact CG-CE2 3.99Å; Y2713-W2715 AromaticContact CG-CZ2 3.96Å; Y2713-W2715 HydrophobicContact CG-CZ2 4.02Å; Y2713-W2715 AromaticContact CG-NE1 3.81Å; Y2713-W2715 PolarHBondContact O-N 3.06Å; Y2713-W2715 VanDerWaalsContact O-N 3.13Å; Y2713-Q2716 HydrophobicContact CD2-CG 4.37Å; Y2713-Q2716 VanDerWaalsContact O-CB 3.24Å; Y2713-Q2716 WeakPolarHBondContact O-CB 3.28Å; Y2713-Q2716 PolarHBondContact O-N 3.17Å; Y2713-Q2716 VanDerWaalsContact O-N 3.1Å
2714S75.8Confident79Confident102.2 Ų102.267.8 Ų67.872%0.71535%0.348SS*.THydrogen-bonded Turntrans-63.6-24.6-176.150.90000114.7Q2716 P2717S2714-Q2716 VanDerWaalsContact C-N 3.35Å; S2714-P2717 VanDerWaalsContact O-CD 3.3Å; S2714-P2717 WeakPolarHBondContact O-CD 3.34Å
2715W78.5Confident78.2Confident89.2 Ų89.273.9 Ų73.934%0.33839%0.387SS..THydrogen-bonded Turntrans-80.3-15176.558.5-101.3000113.8Y2713 P2717 E2718 L2719 V2722Y2713-W2715 VanDerWaalsContact C-N 3.27Å; Y2713-W2715 VanDerWaalsContact CB-NE1 3.32Å; Y2713-W2715 HydrophobicContact CD1-CZ2 4.46Å; Y2713-W2715 AromaticContact CD1-NE1 3.92Å; Y2713-W2715 HydrophobicContact CD2-CZ2 4.12Å; Y2713-W2715 AromaticContact CG-CE2 3.99Å; Y2713-W2715 AromaticContact CG-CZ2 3.96Å; Y2713-W2715 HydrophobicContact CG-CZ2 4.02Å; Y2713-W2715 AromaticContact CG-NE1 3.81Å; Y2713-W2715 PolarHBondContact O-N 3.06Å; Y2713-W2715 VanDerWaalsContact O-N 3.13Å; W2715-P2717 VanDerWaalsContact C-CD 3.48Å; W2715-E2718 PolarHBondContact O-N 3.16Å; W2715-E2718 VanDerWaalsContact O-N 3.11Å; W2715-L2719 HydrophobicContact CE3-CB 4.28Å; W2715-L2719 HydrophobicContact CE3-CD1 4.46Å; W2715-L2719 PolarHBondContact O-N 3.33Å; W2715-L2719 VanDerWaalsContact O-N 3.13Å; W2715-V2722 HydrophobicContact CH2-CG1 4.46Å; W2715-V2722 HydrophobicContact CZ3-CB 4.25Å; W2715-V2722 HydrophobicContact CZ3-CG1 4.19Å
2716Q75Confident77.4Confident20.6 Ų20.676.3 Ų76.310%0.09641%0.412CS..THydrogen-bonded Turntrans-63.4-34.7-173.1-153.2-176.6-22.200114.3Y2711 F2712 Y2713 S2714 E2718 L2719 P2720 N2727Y2711-Q2716 HydrophobicContact CD1-CB 3.89Å; Y2711-Q2716 HydrophobicContact CD1-CG 3.87Å; Y2711-Q2716 HydrophobicContact CE1-CG 4.46Å; F2712-Q2716 VanDerWaalsContact N-OE1 3.14Å; Y2713-Q2716 HydrophobicContact CD2-CG 4.37Å; Y2713-Q2716 VanDerWaalsContact O-CB 3.24Å; Y2713-Q2716 WeakPolarHBondContact O-CB 3.28Å; Y2713-Q2716 PolarHBondContact O-N 3.17Å; Y2713-Q2716 VanDerWaalsContact O-N 3.1Å; S2714-Q2716 VanDerWaalsContact C-N 3.35Å; Q2716-E2718 VanDerWaalsContact C-N 3.31Å; Q2716-E2718 PolarHBondContact O-N 3.16Å; Q2716-L2719 CarbonylContact O-C 3.57Å; Q2716-P2720 WeakPolarHBondContact O-CA 3.35Å; Q2716-N2727 PolarHBondContact NE2-ND2 3Å
2717P72.5Confident77.2Confident57.4 Ų57.473.3 Ų73.337%0.37340%0.402SS..THydrogen-bonded Turntrans-66.9-29172.2-19.532.2000114.1Y2711 S2714 W2715Y2711-P2717 HydrophobicContact CD1-CB 4.41Å; Y2711-P2717 HydrophobicContact CD1-CG 3.77Å; Y2711-P2717 HydrophobicContact CD2-CG 3.92Å; Y2711-P2717 HydrophobicContact CE1-CB 4.23Å; Y2711-P2717 HydrophobicContact CE1-CG 3.88Å; Y2711-P2717 HydrophobicContact CE2-CG 4.03Å; Y2711-P2717 HydrophobicContact CG-CG 3.78Å; S2714-P2717 VanDerWaalsContact O-CD 3.3Å; S2714-P2717 WeakPolarHBondContact O-CD 3.34Å; W2715-P2717 VanDerWaalsContact C-CD 3.48Å
2718E67.7Low77.1Confident143.2 Ų143.272.8 Ų72.867%0.66940%0.399SS*.THydrogen-bonded Turntrans-82.7-26.3-177.6-55.8-170135.100112.4K2317 W2715 Q2716 P2720K2317-E2718 IonicContact NZ-OE1 3.24Å; K2317-E2718 PolarHBondContact NZ-OE1 3.44Å; W2715-E2718 PolarHBondContact O-N 3.16Å; W2715-E2718 VanDerWaalsContact O-N 3.11Å; Q2716-E2718 VanDerWaalsContact C-N 3.31Å; Q2716-E2718 PolarHBondContact O-N 3.16Å; E2718-P2720 VanDerWaalsContact O-CD 3.31Å; E2718-P2720 WeakPolarHBondContact O-CD 3.38Å
2719L71.4Confident77.1Confident90.2 Ų90.272.8 Ų72.847%0.47240%0.399SS..  trans-126.557-175.8-67.7169.7000111.8W2715 Q2716 H2721 V2722W2715-L2719 HydrophobicContact CE3-CB 4.28Å; W2715-L2719 HydrophobicContact CE3-CD1 4.46Å; W2715-L2719 PolarHBondContact O-N 3.33Å; W2715-L2719 VanDerWaalsContact O-N 3.13Å; Q2716-L2719 CarbonylContact O-C 3.57Å; L2719-H2721 PolarHBondContact O-N 3.07Å; L2719-V2722 HydrophobicContact CB-CB 4.2Å; L2719-V2722 HydrophobicContact CB-CG2 3.93Å; L2719-V2722 HydrophobicContact CD2-CG2 4.42Å; L2719-V2722 WeakPolarHBondContact O-CB 3.4Å; L2719-V2722 PolarHBondContact O-N 3.29Å
2720P66.2Low77.3Confident81 Ų8172 Ų7253%0.52640%0.398SS..THydrogen-bonded Turntrans-64.2-18.9-174.428-36.6000113.7E2321 Q2716 E2718 V2722E2321-P2720 VanDerWaalsContact CD-CG 3.49Å; E2321-P2720 HydrophobicContact CG-CG 4.49Å; E2321-P2720 VanDerWaalsContact OE1-CG 3.26Å; E2321-P2720 WeakPolarHBondContact OE1-CG 3.46Å; Q2716-P2720 WeakPolarHBondContact O-CA 3.35Å; E2718-P2720 VanDerWaalsContact O-CD 3.31Å; E2718-P2720 WeakPolarHBondContact O-CD 3.38Å; P2720-V2722 VanDerWaalsContact C-N 3.32Å; P2720-V2722 PolarHBondContact O-N 3.04Å
2721H68.8Low77.7Confident166.2 Ų166.273 Ų7377%0.76940%0.4SS*.THydrogen-bonded Turntrans-75.1-13.2172.6-57.8-38.6000113.8E2321 L2719 I2723E2321-H2721 IonicContact OE1-CE1 2.72Å; E2321-H2721 PolarHBondContact OE1-CE1 2.86Å; E2321-H2721 VanDerWaalsContact OE1-CE1 3.22Å; E2321-H2721 IonicContact OE1-CG 3.45Å; E2321-H2721 IonicContact OE1-ND1 3.94Å; E2321-H2721 PolarHBondContact OE1-ND1 3.27Å; E2321-H2721 IonicContact OE1-NE2 2.73Å; E2321-H2721 IonicContact OE2-CE1 3.34Å; E2321-H2721 PolarHBondContact OE2-CE1 3.11Å; E2321-H2721 IonicContact OE2-ND1 3.11Å; E2321-H2721 PolarHBondContact OE2-ND1 3.21Å; L2719-H2721 PolarHBondContact O-N 3.07Å; H2721-I2723 PolarHBondContact O-N 3.27Å
2722V71.8Confident78.5Confident78.8 Ų78.867.1 Ų67.148%0.47838%0.377SS..  trans-94.884.6-177.4-176.70000109.9W2715 L2719 P2720 S2724W2715-V2722 HydrophobicContact CH2-CG1 4.46Å; W2715-V2722 HydrophobicContact CZ3-CB 4.25Å; W2715-V2722 HydrophobicContact CZ3-CG1 4.19Å; L2719-V2722 HydrophobicContact CB-CB 4.2Å; L2719-V2722 HydrophobicContact CB-CG2 3.93Å; L2719-V2722 HydrophobicContact CD2-CG2 4.42Å; L2719-V2722 WeakPolarHBondContact O-CB 3.4Å; L2719-V2722 PolarHBondContact O-N 3.29Å; P2720-V2722 VanDerWaalsContact C-N 3.32Å; P2720-V2722 PolarHBondContact O-N 3.04Å; V2722-S2724 PolarHBondContact O-N 3.1Å
2723I72.2Confident79.1Confident114.8 Ų114.867 Ų6759%0.58938%0.377SS*.  trans-80.5112.8178.2-58.9175.6000110H2721 S2730H2721-I2723 PolarHBondContact O-N 3.27Å; I2723-S2730 WeakPolarHBondContact CG2-OG 3.29Å
2724S73.7Confident79.8Confident43.2 Ų43.267.2 Ų67.230%0.30238%0.381SS..  trans-66.4130168.4-175.10000110.4V2722 G2726 N2727V2722-S2724 PolarHBondContact O-N 3.1Å; S2724-G2726 PolarHBondContact O-N 3.07Å; S2724-G2726 VanDerWaalsContact O-N 3.11Å; S2724-N2727 VanDerWaalsContact O-CB 3.27Å; S2724-N2727 WeakPolarHBondContact O-CB 3.28Å; S2724-N2727 PolarHBondContact O-N 3.19Å; S2724-N2727 VanDerWaalsContact O-N 3.11Å
2725P77.1Confident80.7Confident128.6 Ų128.662.5 Ų62.584%0.83535%0.348SS*.THydrogen-bonded Turntrans-67.7112.6-177.727.4-34.1000110.9
2726G76.8Confident81.5Confident52.2 Ų52.258.3 Ų58.354%0.53833%0.332SS..THydrogen-bonded Turntrans100.92.6-176.300000115.1S2724 V2728 I2731S2724-G2726 PolarHBondContact O-N 3.07Å; S2724-G2726 VanDerWaalsContact O-N 3.11Å; G2726-V2728 PolarHBondContact O-N 3.21Å; G2726-I2731 WeakPolarHBondContact O-CD1 3.29Å
2727N87Confident82.4Confident10.2 Ų10.258.8 Ų58.86%0.05533%0.333CS..  trans-50.5133.3176165.8-8000112.4E2672 Q2716 S2724 A2729 S2730 I2731E2672-N2727 WeakPolarHBondContact OE1-CA 3.33Å; Q2716-N2727 PolarHBondContact NE2-ND2 3Å; S2724-N2727 VanDerWaalsContact O-CB 3.27Å; S2724-N2727 WeakPolarHBondContact O-CB 3.28Å; S2724-N2727 PolarHBondContact O-N 3.19Å; S2724-N2727 VanDerWaalsContact O-N 3.11Å; N2727-A2729 VanDerWaalsContact C-N 3.27Å; N2727-A2729 PolarHBondContact O-N 3.06Å; N2727-A2729 WeakPolarHBondContact OD1-CB 3.37Å; N2727-A2729 PolarHBondContact OD1-N 3.08Å; N2727-S2730 PolarHBondContact ND2-OG 3.47Å; N2727-S2730 WeakPolarHBondContact O-CB 3.43Å; N2727-S2730 PolarHBondContact O-N 3.24Å; N2727-S2730 VanDerWaalsContact O-N 3.13Å; N2727-S2730 WeakPolarHBondContact OD1-CB 3.42Å; N2727-S2730 PolarHBondContact OD1-N 3.35Å; N2727-S2730 PolarHBondContact OD1-OG 2.96Å; N2727-S2730 VanDerWaalsContact OD1-OG 3.13Å; N2727-I2731 WeakPolarHBondContact O-CG1 3.29Å; N2727-I2731 PolarHBondContact O-N 3.15Å; N2727-I2731 VanDerWaalsContact O-N 3.16Å
2728V90.8Very high83.5Confident0 Ų057.8 Ų57.80%033%0.327CS..Hα-helixtrans-53.2-42.1177.3172.70000112.1E2672 I2675 I2679 L2707 F2712 G2726 S2730 I2731 A2732E2672-V2728 HydrophobicContact CB-CG2 3.74Å; E2672-V2728 HydrophobicContact CG-CG2 3.85Å; E2672-V2728 WeakPolarHBondContact O-CG2 3.4Å; E2672-V2728 PolarHBondContact OE1-N 3.12Å; I2675-V2728 HydrophobicContact CB-CG1 4.41Å; I2675-V2728 HydrophobicContact CB-CG2 3.98Å; I2675-V2728 HydrophobicContact CD1-CG2 4.46Å; I2675-V2728 HydrophobicContact CG2-CB 4.47Å; I2675-V2728 HydrophobicContact CG2-CG1 3.58Å; I2675-V2728 HydrophobicContact CG2-CG2 4.07Å; I2679-V2728 HydrophobicContact CD1-CG1 4.06Å; L2707-V2728 HydrophobicContact CB-CG1 4.23Å; L2707-V2728 HydrophobicContact CD2-CG1 4.32Å; F2712-V2728 HydrophobicContact CD2-CB 4.26Å; F2712-V2728 HydrophobicContact CE1-CB 4.38Å; F2712-V2728 HydrophobicContact CE1-CG2 4.3Å; F2712-V2728 HydrophobicContact CE2-CB 3.61Å; F2712-V2728 HydrophobicContact CE2-CG1 3.82Å; F2712-V2728 HydrophobicContact CE2-CG2 4.13Å; F2712-V2728 HydrophobicContact CZ-CB 3.81Å; F2712-V2728 HydrophobicContact CZ-CG1 3.85Å; F2712-V2728 HydrophobicContact CZ-CG2 3.89Å; G2726-V2728 PolarHBondContact O-N 3.21Å; V2728-S2730 VanDerWaalsContact C-N 3.3Å; V2728-S2730 PolarHBondContact O-N 3.15Å; V2728-I2731 PolarHBondContact O-N 3.15Å; V2728-I2731 VanDerWaalsContact O-N 3.13Å; V2728-A2732 VanDerWaalsContact O-CB 3.31Å; V2728-A2732 WeakPolarHBondContact O-CB 3.38Å; V2728-A2732 PolarHBondContact O-N 3.19Å
2729A89.4Confident84.8Confident9.2 Ų9.251.1 Ų51.18%0.07630%0.296CS..Hα-helixtrans-61.9-40.1-178.300000112.1N2727 A2732 H2733N2727-A2729 VanDerWaalsContact C-N 3.27Å; N2727-A2729 PolarHBondContact O-N 3.06Å; N2727-A2729 WeakPolarHBondContact OD1-CB 3.37Å; N2727-A2729 PolarHBondContact OD1-N 3.08Å; A2729-A2732 WeakPolarHBondContact O-CB 3.39Å; A2729-A2732 PolarHBondContact O-N 3.29Å; A2729-H2733 WeakPolarHBondContact O-CB 3.29Å; A2729-H2733 PolarHBondContact O-CD2 3.31Å; A2729-H2733 PolarHBondContact O-N 3.18Å
2730S89.2Confident85.8Confident43.8 Ų43.846.9 Ų46.931%0.30627%0.273SS..Hα-helixtrans-70.6-34.8176.6-54.70000112.5I2723 N2727 V2728 A2732 H2733 Q2734I2723-S2730 WeakPolarHBondContact CG2-OG 3.29Å; N2727-S2730 PolarHBondContact ND2-OG 3.47Å; N2727-S2730 WeakPolarHBondContact O-CB 3.43Å; N2727-S2730 PolarHBondContact O-N 3.24Å; N2727-S2730 VanDerWaalsContact O-N 3.13Å; N2727-S2730 WeakPolarHBondContact OD1-CB 3.42Å; N2727-S2730 PolarHBondContact OD1-N 3.35Å; N2727-S2730 PolarHBondContact OD1-OG 2.96Å; N2727-S2730 VanDerWaalsContact OD1-OG 3.13Å; V2728-S2730 VanDerWaalsContact C-N 3.3Å; V2728-S2730 PolarHBondContact O-N 3.15Å; S2730-A2732 VanDerWaalsContact C-N 3.34Å; S2730-H2733 PolarHBondContact O-N 3.24Å; S2730-Q2734 WeakPolarHBondContact O-CB 3.34Å; S2730-Q2734 PolarHBondContact O-N 3.29Å; S2730-Q2734 VanDerWaalsContact O-N 3.09Å
2731I93Very high87.1Confident45.6 Ų45.648.3 Ų48.323%0.23427%0.269CS..Hα-helixtrans-66.1-41.1172.5-60.5171.1000110.1I2679 G2726 N2727 V2728 Q2734 F2735I2679-I2731 HydrophobicContact CB-CG2 3.97Å; I2679-I2731 HydrophobicContact CD1-CG2 4.34Å; I2679-I2731 HydrophobicContact CG2-CG2 3.85Å; G2726-I2731 WeakPolarHBondContact O-CD1 3.29Å; N2727-I2731 WeakPolarHBondContact O-CG1 3.29Å; N2727-I2731 PolarHBondContact O-N 3.15Å; N2727-I2731 VanDerWaalsContact O-N 3.16Å; V2728-I2731 PolarHBondContact O-N 3.15Å; V2728-I2731 VanDerWaalsContact O-N 3.13Å; I2731-Q2734 PolarHBondContact O-N 3.13Å; I2731-F2735 PolarHBondContact O-N 2.99Å
2732A93.9Very high88.2Confident0 Ų044 Ų440%025%0.252CS..Hα-helixtrans-63.2-45.8175.200000112.3I2679 T2704 L2707 A2708 V2728 A2729 S2730 Q2734 F2735 L2736I2679-A2732 HydrophobicContact CD1-CB 4.18Å; T2704-A2732 VanDerWaalsContact CG2-CA 3.5Å; T2704-A2732 HydrophobicContact CG2-CB 3.52Å; T2704-A2732 VanDerWaalsContact CG2-CB 3.49Å; L2707-A2732 HydrophobicContact CB-CB 4.33Å; A2708-A2732 HydrophobicContact CB-CB 3.98Å; V2728-A2732 VanDerWaalsContact O-CB 3.31Å; V2728-A2732 WeakPolarHBondContact O-CB 3.38Å; V2728-A2732 PolarHBondContact O-N 3.19Å; A2729-A2732 WeakPolarHBondContact O-CB 3.39Å; A2729-A2732 PolarHBondContact O-N 3.29Å; S2730-A2732 VanDerWaalsContact C-N 3.34Å; A2732-Q2734 VanDerWaalsContact C-N 3.3Å; A2732-Q2734 PolarHBondContact O-N 2.96Å; A2732-F2735 PolarHBondContact O-N 3.21Å; A2732-L2736 WeakPolarHBondContact O-CB 3.42Å; A2732-L2736 VanDerWaalsContact O-CG 3.29Å; A2732-L2736 WeakPolarHBondContact O-CG 3.37Å; A2732-L2736 PolarHBondContact O-N 3.16Å
2733H92.1Very high89.3Confident39.4 Ų39.441.1 Ų41.118%0.18223%0.234CC..Hα-helixtrans-56.4-44.4173-79.3-142.5000111.2A2708 A2729 S2730 L2736 R2737 V2769A2708-H2733 VanDerWaalsContact CB-CD2 3.47Å; A2708-H2733 WeakPolarHBondContact CB-CD2 3.17Å; A2729-H2733 WeakPolarHBondContact O-CB 3.29Å; A2729-H2733 PolarHBondContact O-CD2 3.31Å; A2729-H2733 PolarHBondContact O-N 3.18Å; S2730-H2733 PolarHBondContact O-N 3.24Å; H2733-L2736 PolarHBondContact O-N 3.07Å; H2733-R2737 WeakPolarHBondContact O-CB 3.35Å; H2733-R2737 VanDerWaalsContact O-CG 3.3Å; H2733-R2737 WeakPolarHBondContact O-CG 3.3Å; H2733-R2737 PolarHBondContact O-N 3.11Å; H2733-V2769 HydrophobicContact CB-CG2 4.37Å
2734Q92.9Very high90.2Very high95.8 Ų95.836.3 Ų36.345%0.44821%0.211SC..Hα-helixtrans-69.6-39.3-179.4-166.862.12100112.7S2730 I2731 A2732 L2736 R2737 C2738S2730-Q2734 WeakPolarHBondContact O-CB 3.34Å; S2730-Q2734 PolarHBondContact O-N 3.29Å; S2730-Q2734 VanDerWaalsContact O-N 3.09Å; I2731-Q2734 PolarHBondContact O-N 3.13Å; A2732-Q2734 VanDerWaalsContact C-N 3.3Å; A2732-Q2734 PolarHBondContact O-N 2.96Å; Q2734-L2736 VanDerWaalsContact C-N 3.32Å; Q2734-L2736 PolarHBondContact O-N 3.17Å; Q2734-R2737 PolarHBondContact O-N 3.21Å; Q2734-C2738 PolarHBondContact NE2-SG 3.32Å; Q2734-C2738 VanDerWaalsContact NE2-SG 3.39Å; Q2734-C2738 WeakPolarHBondContact O-CB 3.29Å; Q2734-C2738 PolarHBondContact O-N 3.19Å; Q2734-C2738 PolarHBondContact O-SG 3.02Å
2735F95.5Very high91Very high3.6 Ų3.639.4 Ų39.42%0.01623%0.23CC..Hα-helixtrans-57.5-46.8171.1169.1-93.6000111.4I2679 L2682 V2686 M2700 L2701 T2704 I2731 A2732 T2739I2679-F2735 HydrophobicContact CG2-CB 3.55Å; I2679-F2735 HydrophobicContact CG2-CD2 4.24Å; I2679-F2735 HydrophobicContact CG2-CG 3.95Å; L2682-F2735 HydrophobicContact CB-CE2 4.09Å; V2686-F2735 HydrophobicContact CG2-CE2 4.29Å; V2686-F2735 HydrophobicContact CG2-CZ 4.45Å; M2700-F2735 HydrophobicContact CB-CZ 4.16Å; L2701-F2735 HydrophobicContact CD2-CE1 4.22Å; T2704-F2735 HydrophobicContact CG2-CB 4.18Å; T2704-F2735 HydrophobicContact CG2-CD1 3.5Å; T2704-F2735 VanDerWaalsContact CG2-CD1 3.47Å; T2704-F2735 HydrophobicContact CG2-CE1 4.24Å; T2704-F2735 HydrophobicContact CG2-CG 4.11Å; I2731-F2735 PolarHBondContact O-N 2.99Å; A2732-F2735 PolarHBondContact O-N 3.21Å; F2735-T2739 WeakPolarHBondContact CE2-OG1 3.35Å; F2735-T2739 HydrophobicContact CZ-CG2 4.46Å; F2735-T2739 WeakPolarHBondContact O-CB 3.39Å; F2735-T2739 PolarHBondContact O-N 3.33Å; F2735-T2739 PolarHBondContact O-OG1 3.16Å
2736L95Very high91.7Very high0 Ų039 Ų390%022%0.221CC..Hα-helixtrans-64.6-46.3-180-70.3170.6000111.1L2701 T2704 A2705 A2708 A2732 H2733 Q2734 T2739 M2740 T2765 I2766 V2769L2701-L2736 HydrophobicContact CD2-CD2 3.66Å; T2704-L2736 HydrophobicContact CG2-CG 4.22Å; A2705-L2736 HydrophobicContact CB-CD1 4.4Å; A2708-L2736 HydrophobicContact CB-CD1 4.26Å; A2732-L2736 WeakPolarHBondContact O-CB 3.42Å; A2732-L2736 VanDerWaalsContact O-CG 3.29Å; A2732-L2736 WeakPolarHBondContact O-CG 3.37Å; A2732-L2736 PolarHBondContact O-N 3.16Å; H2733-L2736 PolarHBondContact O-N 3.07Å; Q2734-L2736 VanDerWaalsContact C-N 3.32Å; Q2734-L2736 PolarHBondContact O-N 3.17Å; L2736-T2739 PolarHBondContact O-N 2.9Å; L2736-M2740 HydrophobicContact CB-CE 4.19Å; L2736-M2740 VanDerWaalsContact O-CB 3.3Å; L2736-M2740 WeakPolarHBondContact O-CB 3.33Å; L2736-M2740 WeakPolarHBondContact O-CE 3.38Å; L2736-M2740 VanDerWaalsContact O-CG 3.27Å; L2736-M2740 WeakPolarHBondContact O-CG 3.38Å; L2736-M2740 PolarHBondContact O-N 3.15Å; L2736-T2765 HydrophobicContact CD1-CG2 4.33Å; L2736-I2766 HydrophobicContact CD2-CD1 4.22Å; L2736-V2769 HydrophobicContact CB-CG1 3.87Å; L2736-V2769 HydrophobicContact CB-CG2 4.49Å; L2736-V2769 HydrophobicContact CD1-CG2 4Å
2737R94Very high92.4Very high32.2 Ų32.237.9 Ų37.912%0.12221%0.21CC..Hα-helixtrans-55.2-56.6174.3-75.8169.6179.8172.73.8111.9H2733 Q2734 T2739 Y2741 V2769 D2772 F2773H2733-R2737 WeakPolarHBondContact O-CB 3.35Å; H2733-R2737 VanDerWaalsContact O-CG 3.3Å; H2733-R2737 WeakPolarHBondContact O-CG 3.3Å; H2733-R2737 PolarHBondContact O-N 3.11Å; Q2734-R2737 PolarHBondContact O-N 3.21Å; R2737-T2739 PolarHBondContact O-N 2.83Å; R2737-Y2741 VanDerWaalsContact O-CB 3.27Å; R2737-Y2741 WeakPolarHBondContact O-CB 3.4Å; R2737-Y2741 PolarHBondContact O-N 3.31Å; R2737-V2769 HydrophobicContact CG-CG1 3.63Å; R2737-V2769 VanDerWaalsContact CZ-O 3.26Å; R2737-V2769 PolarHBondContact NE-O 3.1Å; R2737-V2769 PolarHBondContact NH2-O 2.94Å; R2737-D2772 IonicContact CZ-OD2 3.33Å; R2737-D2772 IonicContact NH1-OD2 2.96Å; R2737-D2772 PolarHBondContact NH2-O 3.34Å; R2737-D2772 IonicContact NH2-OD2 3.28Å; R2737-D2772 PolarHBondContact NH2-OD2 3.22Å; R2737-F2773 HydrophobicContact CB-CD1 4.34Å; R2737-F2773 HydrophobicContact CB-CD2 4.26Å; R2737-F2773 HydrophobicContact CB-CE1 4.12Å; R2737-F2773 HydrophobicContact CB-CE2 4.02Å; R2737-F2773 HydrophobicContact CB-CG 4.42Å; R2737-F2773 HydrophobicContact CB-CZ 3.95Å; R2737-F2773 HydrophobicContact CG-CB 4.33Å; R2737-F2773 HydrophobicContact CG-CD1 4.12Å; R2737-F2773 HydrophobicContact CG-CD2 3.9Å; R2737-F2773 HydrophobicContact CG-CE1 4.39Å; R2737-F2773 HydrophobicContact CG-CE2 4.18Å; R2737-F2773 HydrophobicContact CG-CG 3.86Å; R2737-F2773 HydrophobicContact CG-CZ 4.42Å
2738C94.1Very high92.7Very high36.8 Ų36.838.3 Ų38.325%0.24921%0.212CC..Hα-helixtrans-65.2-42.3-177.3-710000112.6H2687 Q2734 N2742H2687-C2738 WeakPolarHBondContact NE2-CB 3.46Å; Q2734-C2738 PolarHBondContact NE2-SG 3.32Å; Q2734-C2738 VanDerWaalsContact NE2-SG 3.39Å; Q2734-C2738 WeakPolarHBondContact O-CB 3.29Å; Q2734-C2738 PolarHBondContact O-N 3.19Å; Q2734-C2738 PolarHBondContact O-SG 3.02Å; C2738-N2742 VanDerWaalsContact O-CB 3.28Å; C2738-N2742 WeakPolarHBondContact O-CB 3.31Å; C2738-N2742 VanDerWaalsContact O-CG 3.28Å; C2738-N2742 PolarHBondContact O-N 2.99Å; C2738-N2742 VanDerWaalsContact O-N 3.11Å; C2738-N2742 PolarHBondContact O-ND2 3.07Å
2739T94.8Very high92.8Very high2.4 Ų2.438.5 Ų38.52%0.01521%0.212CC..Hα-helixtrans-66-47.6179.8-63.50000111.4V2686 L2697 L2701 F2735 L2736 R2737 L2743V2686-T2739 HydrophobicContact CG1-CG2 3.97Å; L2697-T2739 HydrophobicContact CD1-CG2 3.81Å; L2701-T2739 HydrophobicContact CD2-CG2 4Å; F2735-T2739 WeakPolarHBondContact CE2-OG1 3.35Å; F2735-T2739 HydrophobicContact CZ-CG2 4.46Å; F2735-T2739 WeakPolarHBondContact O-CB 3.39Å; F2735-T2739 PolarHBondContact O-N 3.33Å; F2735-T2739 PolarHBondContact O-OG1 3.16Å; L2736-T2739 PolarHBondContact O-N 2.9Å; R2737-T2739 PolarHBondContact O-N 2.83Å; T2739-L2743 HydrophobicContact CG2-CD1 3.92Å; T2739-L2743 WeakPolarHBondContact O-CB 3.38Å; T2739-L2743 WeakPolarHBondContact O-CG 3.31Å; T2739-L2743 PolarHBondContact O-N 3.09Å; T2739-L2743 VanDerWaalsContact O-N 3.13Å
2740M92.7Very high92.9Very high1 Ų138.9 Ų38.91%0.00521%0.214CC..Hα-helixtrans-66.3-43.8-179.7-69.1-171.3-70.900112.1L2736 L2743 A2744 L2748 F2749 I2766 V2769 L2770 M2777L2736-M2740 HydrophobicContact CB-CE 4.19Å; L2736-M2740 VanDerWaalsContact O-CB 3.3Å; L2736-M2740 WeakPolarHBondContact O-CB 3.33Å; L2736-M2740 WeakPolarHBondContact O-CE 3.38Å; L2736-M2740 VanDerWaalsContact O-CG 3.27Å; L2736-M2740 WeakPolarHBondContact O-CG 3.38Å; L2736-M2740 PolarHBondContact O-N 3.15Å; M2740-L2743 PolarHBondContact O-N 3.04Å; M2740-A2744 VanDerWaalsContact O-CB 3.3Å; M2740-A2744 WeakPolarHBondContact O-CB 3.33Å; M2740-A2744 PolarHBondContact O-N 2.97Å; M2740-L2748 HydrophobicContact CB-CD2 4.43Å; M2740-L2748 HydrophobicContact CG-CD2 4.24Å; M2740-F2749 HydrophobicContact CB-CE1 4.42Å; M2740-F2749 HydrophobicContact CB-CZ 4.11Å; M2740-F2749 HydrophobicContact CG-CE1 4.41Å; M2740-F2749 HydrophobicContact SD-CE1 4.12Å; M2740-F2749 HydrophobicContact SD-CZ 4.46Å; M2740-I2766 HydrophobicContact CE-CD1 4.14Å; M2740-I2766 HydrophobicContact CE-CG2 4.09Å; M2740-I2766 HydrophobicContact SD-CD1 3.87Å; M2740-I2766 HydrophobicContact SD-CG1 4.46Å; M2740-I2766 HydrophobicContact SD-CG2 3.67Å; M2740-V2769 HydrophobicContact CE-CG1 4.15Å; M2740-L2770 HydrophobicContact CE-CD1 4.19Å; M2740-L2770 HydrophobicContact CE-CD2 3.88Å; M2740-L2770 HydrophobicContact CE-CG 3.94Å; M2740-L2770 HydrophobicContact SD-CD1 4.45Å; M2740-M2777 HydrophobicContact CB-CE 3.67Å
2741Y93.7Very high93Very high111 Ų11142.3 Ų42.344%0.43523%0.225SC..Hα-helixtrans-61.4-50.1178.8179.6-98.2000112.2R2737 L2743 A2744 F2773 H2776 M2777R2737-Y2741 VanDerWaalsContact O-CB 3.27Å; R2737-Y2741 WeakPolarHBondContact O-CB 3.4Å; R2737-Y2741 PolarHBondContact O-N 3.31Å; Y2741-L2743 VanDerWaalsContact C-N 3.31Å; Y2741-L2743 PolarHBondContact O-N 3.07Å; Y2741-A2744 PolarHBondContact O-N 2.8Å; Y2741-F2773 HydrophobicContact CD2-CE1 4.46Å; Y2741-H2776 HydrophobicContact CD2-CB 4.32Å; Y2741-H2776 HydrophobicContact CE2-CB 4.23Å; Y2741-H2776 WeakPolarHBondContact CE2-O 3.35Å; Y2741-M2777 HydrophobicContact CD2-CB 4.39Å
2742N92.8Very high93Very high75.8 Ų75.840.8 Ų40.841%0.40522%0.217SC..Hα-helixtrans-70.5-24.6-176.6-71-41.3000113.5H2687 C2738H2687-N2742 PolarHBondContact CE1-ND2 2.92Å; C2738-N2742 VanDerWaalsContact O-CB 3.28Å; C2738-N2742 WeakPolarHBondContact O-CB 3.31Å; C2738-N2742 VanDerWaalsContact O-CG 3.28Å; C2738-N2742 PolarHBondContact O-N 2.99Å; C2738-N2742 VanDerWaalsContact O-N 3.11Å; C2738-N2742 PolarHBondContact O-ND2 3.07Å
2743L93.6Very high93Very high17.8 Ų17.840.8 Ų40.89%0.09322%0.217CC..Hα-helixtrans-102.7-7.2-179.9-58.3-178.3000114.2V2686 P2690 L2697 T2739 M2740 Y2741 P2745 N2746 L2748V2686-L2743 HydrophobicContact CG1-CD1 4.03Å; P2690-L2743 HydrophobicContact CB-CD2 3.99Å; L2697-L2743 HydrophobicContact CD1-CD1 4.05Å; L2697-L2743 HydrophobicContact CD2-CD1 3.57Å; L2697-L2743 HydrophobicContact CG-CD1 4.46Å; T2739-L2743 HydrophobicContact CG2-CD1 3.92Å; T2739-L2743 WeakPolarHBondContact O-CB 3.38Å; T2739-L2743 WeakPolarHBondContact O-CG 3.31Å; T2739-L2743 PolarHBondContact O-N 3.09Å; T2739-L2743 VanDerWaalsContact O-N 3.13Å; M2740-L2743 PolarHBondContact O-N 3.04Å; Y2741-L2743 VanDerWaalsContact C-N 3.31Å; Y2741-L2743 PolarHBondContact O-N 3.07Å; L2743-P2745 VanDerWaalsContact C-CD 3.49Å; L2743-N2746 WeakPolarHBondContact CD2-ND2 3.49Å; L2743-N2746 WeakPolarHBondContact O-CA 3.31Å; L2743-N2746 WeakPolarHBondContact O-CB 3.35Å; L2743-N2746 PolarHBondContact O-N 2.96Å; L2743-L2748 HydrophobicContact CB-CB 4.01Å; L2743-L2748 HydrophobicContact CB-CD2 3.95Å; L2743-L2748 HydrophobicContact CB-CG 4.47Å; L2743-L2748 VanDerWaalsContact O-CB 3.3Å; L2743-L2748 WeakPolarHBondContact O-CB 3.28Å; L2743-L2748 PolarHBondContact O-N 3.23Å
2744A91.6Very high93Very high13.4 Ų13.440.3 Ų40.311%0.11122%0.215CC..G310 helixtrans-49.9-47.8172.300000113.8M2740 Y2741 N2746 G2747 F2749 M2777 L2785M2740-A2744 VanDerWaalsContact O-CB 3.3Å; M2740-A2744 WeakPolarHBondContact O-CB 3.33Å; M2740-A2744 PolarHBondContact O-N 2.97Å; Y2741-A2744 PolarHBondContact O-N 2.8Å; A2744-N2746 PolarHBondContact O-N 3.13Å; A2744-G2747 PolarHBondContact O-N 3.11Å; A2744-G2747 VanDerWaalsContact O-N 3.15Å; A2744-F2749 HydrophobicContact CB-CD2 4.29Å; A2744-F2749 HydrophobicContact CB-CE2 3.67Å; A2744-F2749 HydrophobicContact CB-CZ 4.5Å; A2744-M2777 HydrophobicContact CB-SD 4.38Å; A2744-L2785 HydrophobicContact CB-CD1 4Å
2745P90.5Very high92.9Very high109.2 Ų109.237 Ų3771%0.70920%0.202SC*.G310 helixtrans-66.9-20.5177.98.7-9.2000113.7L2743 G2747L2743-P2745 VanDerWaalsContact C-CD 3.49Å; P2745-G2747 VanDerWaalsContact C-N 3.26Å; P2745-G2747 PolarHBondContact O-N 3.15Å
2746N91.9Very high92.6Very high120.4 Ų120.442.2 Ų42.264%0.64423%0.226SC*.G310 helixtrans-83.48.4177.6-58.4-39.5000112.6L2743 A2744L2743-N2746 WeakPolarHBondContact CD2-ND2 3.49Å; L2743-N2746 WeakPolarHBondContact O-CA 3.31Å; L2743-N2746 WeakPolarHBondContact O-CB 3.35Å; L2743-N2746 PolarHBondContact O-N 2.96Å; A2744-N2746 PolarHBondContact O-N 3.13Å
2747G91Very high92.3Very high29 Ų2943.3 Ų43.330%0.29923%0.231SC..THydrogen-bonded Turntrans80.318.1178.600000114.6A2744 P2745 F2749 T2750 Q2751A2744-G2747 PolarHBondContact O-N 3.11Å; A2744-G2747 VanDerWaalsContact O-N 3.15Å; P2745-G2747 VanDerWaalsContact C-N 3.26Å; P2745-G2747 PolarHBondContact O-N 3.15Å; G2747-F2749 VanDerWaalsContact C-N 3.28Å; G2747-F2749 PolarHBondContact O-N 3.34Å; G2747-F2749 VanDerWaalsContact O-N 3.15Å; G2747-T2750 WeakPolarHBondContact O-CB 3.38Å; G2747-T2750 PolarHBondContact O-N 2.92Å; G2747-T2750 VanDerWaalsContact O-N 3.1Å; G2747-T2750 PolarHBondContact O-OG1 3.33Å; G2747-Q2751 PolarHBondContact O-N 3.21Å
2748L93.3Very high91.8Very high18 Ų1845.6 Ų45.69%0.09425%0.249CC..Hα-helixtrans-46.2-50.2-178.1173.162.4000112.4L2697 L2701 M2740 L2743 T2750 Q2751 L2752L2697-L2748 HydrophobicContact CD2-CD1 3.81Å; L2701-L2748 HydrophobicContact CD1-CD1 4.29Å; M2740-L2748 HydrophobicContact CB-CD2 4.43Å; M2740-L2748 HydrophobicContact CG-CD2 4.24Å; L2743-L2748 HydrophobicContact CB-CB 4.01Å; L2743-L2748 HydrophobicContact CB-CD2 3.95Å; L2743-L2748 HydrophobicContact CB-CG 4.47Å; L2743-L2748 VanDerWaalsContact O-CB 3.3Å; L2743-L2748 WeakPolarHBondContact O-CB 3.28Å; L2743-L2748 PolarHBondContact O-N 3.23Å; L2748-T2750 VanDerWaalsContact C-N 3.32Å; L2748-T2750 PolarHBondContact O-N 3.15Å; L2748-Q2751 PolarHBondContact O-N 3.06Å; L2748-L2752 VanDerWaalsContact O-CB 3.25Å; L2748-L2752 WeakPolarHBondContact O-CB 3.36Å; L2748-L2752 PolarHBondContact O-N 3.22Å
2749F93Very high91.3Very high3.6 Ų3.645.2 Ų45.22%0.01624%0.244CC..Hα-helixtrans-64.1-40.4-176.7-60-61.3000112.5M2740 A2744 G2747 Q2751 L2752 F2753 M2777 P2782 L2785M2740-F2749 HydrophobicContact CB-CE1 4.42Å; M2740-F2749 HydrophobicContact CB-CZ 4.11Å; M2740-F2749 HydrophobicContact CG-CE1 4.41Å; M2740-F2749 HydrophobicContact SD-CE1 4.12Å; M2740-F2749 HydrophobicContact SD-CZ 4.46Å; A2744-F2749 HydrophobicContact CB-CD2 4.29Å; A2744-F2749 HydrophobicContact CB-CE2 3.67Å; A2744-F2749 HydrophobicContact CB-CZ 4.5Å; G2747-F2749 VanDerWaalsContact C-N 3.28Å; G2747-F2749 PolarHBondContact O-N 3.34Å; G2747-F2749 VanDerWaalsContact O-N 3.15Å; F2749-Q2751 VanDerWaalsContact C-N 3.31Å; F2749-Q2751 PolarHBondContact O-N 3.03Å; F2749-L2752 HydrophobicContact CD1-CD2 4.45Å; F2749-L2752 PolarHBondContact O-N 3.16Å; F2749-F2753 HydrophobicContact CB-CD2 4.35Å; F2749-F2753 HydrophobicContact CB-CE2 4.49Å; F2749-F2753 WeakPolarHBondContact O-CB 3.33Å; F2749-F2753 VanDerWaalsContact O-CD2 3.25Å; F2749-F2753 WeakPolarHBondContact O-CD2 3.39Å; F2749-F2753 PolarHBondContact O-N 2.96Å; F2749-M2777 HydrophobicContact CE2-CE 4.48Å; F2749-M2777 HydrophobicContact CE2-SD 3.91Å; F2749-M2777 HydrophobicContact CZ-CE 3.85Å; F2749-M2777 HydrophobicContact CZ-SD 3.86Å; F2749-P2782 HydrophobicContact CD1-CB 3.67Å; F2749-P2782 HydrophobicContact CD1-CG 4.14Å; F2749-P2782 HydrophobicContact CD2-CB 4.24Å; F2749-P2782 HydrophobicContact CE1-CB 3.81Å; F2749-P2782 HydrophobicContact CE1-CG 3.74Å; F2749-P2782 HydrophobicContact CE2-CB 4.35Å; F2749-P2782 HydrophobicContact CE2-CG 4.2Å; F2749-P2782 HydrophobicContact CG-CB 3.9Å; F2749-P2782 HydrophobicContact CZ-CB 4.15Å; F2749-P2782 HydrophobicContact CZ-CG 3.76Å; F2749-L2785 HydrophobicContact CD2-CB 4.4Å; F2749-L2785 HydrophobicContact CD2-CD1 3.75Å; F2749-L2785 HydrophobicContact CE2-CD1 3.97Å
2750T91.8Very high90.7Very high17.8 Ų17.851.1 Ų51.111%0.10928%0.276CS..Hα-helixtrans-58.3-44.6176.1-38.70000111.3G2747 L2748 Q2754 L2786 S2789G2747-T2750 WeakPolarHBondContact O-CB 3.38Å; G2747-T2750 PolarHBondContact O-N 2.92Å; G2747-T2750 VanDerWaalsContact O-N 3.1Å; G2747-T2750 PolarHBondContact O-OG1 3.33Å; L2748-T2750 VanDerWaalsContact C-N 3.32Å; L2748-T2750 PolarHBondContact O-N 3.15Å; T2750-Q2754 WeakPolarHBondContact O-CB 3.4Å; T2750-Q2754 VanDerWaalsContact O-CG 3.26Å; T2750-Q2754 WeakPolarHBondContact O-CG 3.34Å; T2750-Q2754 PolarHBondContact O-N 3Å; T2750-L2786 HydrophobicContact CG2-CD1 4.46Å; T2750-S2789 WeakPolarHBondContact CG2-OG 3.49Å; T2750-S2789 VanDerWaalsContact OG1-CB 3.22Å; T2750-S2789 WeakPolarHBondContact OG1-CB 3.26Å; T2750-S2789 PolarHBondContact OG1-OG 3.18Å; T2750-S2789 VanDerWaalsContact OG1-OG 3.12Å
2751Q91.9Very high90.5Very high115.4 Ų115.454.3 Ų54.354%0.53929%0.293SS..Hα-helixtrans-70.6-40.4177.5-173.258.752.200112.2G2747 L2748 F2749 Q2754 T2755G2747-Q2751 PolarHBondContact O-N 3.21Å; L2748-Q2751 PolarHBondContact O-N 3.06Å; F2749-Q2751 VanDerWaalsContact C-N 3.31Å; F2749-Q2751 PolarHBondContact O-N 3.03Å; Q2751-Q2754 CarbonylContact O-C 3.57Å; Q2751-Q2754 PolarHBondContact O-N 3.25Å; Q2751-T2755 PolarHBondContact NE2-OG1 3.39Å; Q2751-T2755 WeakPolarHBondContact O-CB 3.31Å; Q2751-T2755 PolarHBondContact O-N 3.15Å; Q2751-T2755 VanDerWaalsContact O-N 3.09Å; Q2751-T2755 PolarHBondContact O-OG1 3.16Å
2752L92.9Very high90.4Very high13.4 Ų13.449.1 Ų49.17%0.0727%0.273CS..Hα-helixtrans-63-48.1-179.1-176.263.9000111.5L2701 L2748 F2749 Q2754 T2755 I2757 F2762L2701-L2752 HydrophobicContact CD1-CD1 4.47Å; L2748-L2752 VanDerWaalsContact O-CB 3.25Å; L2748-L2752 WeakPolarHBondContact O-CB 3.36Å; L2748-L2752 PolarHBondContact O-N 3.22Å; F2749-L2752 HydrophobicContact CD1-CD2 4.45Å; F2749-L2752 PolarHBondContact O-N 3.16Å; L2752-Q2754 VanDerWaalsContact C-N 3.26Å; L2752-Q2754 PolarHBondContact O-N 3.25Å; L2752-T2755 WeakPolarHBondContact O-CB 3.34Å; L2752-T2755 PolarHBondContact O-N 3.14Å; L2752-T2755 VanDerWaalsContact O-N 3.08Å; L2752-I2757 HydrophobicContact CD1-CD1 4.12Å; L2752-I2757 HydrophobicContact CG-CD1 4.43Å; L2752-F2762 HydrophobicContact CD1-CE1 3.97Å; L2752-F2762 HydrophobicContact CD1-CZ 3.98Å; L2752-F2762 HydrophobicContact CD2-CE1 4.03Å; L2752-F2762 HydrophobicContact CD2-CZ 4.15Å; L2752-F2762 HydrophobicContact CG-CE1 4.26Å
2753F93.2Very high90.4Very high1.2 Ų1.245.8 Ų45.81%0.00526%0.255CS..Hα-helixtrans-65.3-26.5175.5-81.3-76.6000112.9F2749 T2755 F2763 P2782 L2786 L2804 N2807 Y2811F2749-F2753 HydrophobicContact CB-CD2 4.35Å; F2749-F2753 HydrophobicContact CB-CE2 4.49Å; F2749-F2753 WeakPolarHBondContact O-CB 3.33Å; F2749-F2753 VanDerWaalsContact O-CD2 3.25Å; F2749-F2753 WeakPolarHBondContact O-CD2 3.39Å; F2749-F2753 PolarHBondContact O-N 2.96Å; F2753-T2755 VanDerWaalsContact C-N 3.34Å; F2753-F2763 HydrophobicContact CD1-CE1 4.45Å; F2753-F2763 HydrophobicContact CD1-CZ 4.24Å; F2753-F2763 HydrophobicContact CE1-CE1 4.1Å; F2753-F2763 HydrophobicContact CE1-CZ 4.18Å; F2753-F2763 HydrophobicContact CZ-CE1 4.4Å; F2753-P2782 HydrophobicContact CE2-CB 4.3Å; F2753-L2786 HydrophobicContact CB-CD1 3.84Å; F2753-L2786 HydrophobicContact CB-CD2 4.06Å; F2753-L2786 HydrophobicContact CD1-CD2 4.15Å; F2753-L2786 HydrophobicContact CD2-CB 4.36Å; F2753-L2786 HydrophobicContact CD2-CD1 4.12Å; F2753-L2786 HydrophobicContact CD2-CD2 3.71Å; F2753-L2786 HydrophobicContact CD2-CG 4.27Å; F2753-L2786 HydrophobicContact CE2-CD2 4.17Å; F2753-L2786 HydrophobicContact CG-CD1 4.22Å; F2753-L2786 HydrophobicContact CG-CD2 3.72Å; F2753-L2804 HydrophobicContact CB-CD1 3.91Å; F2753-L2804 WeakPolarHBondContact O-CA 3.39Å; F2753-N2807 HydrophobicContact CD1-CB 3.85Å; F2753-N2807 PolarHBondContact O-ND2 3.14Å; F2753-Y2811 HydrophobicContact CE1-CD2 4.34Å; F2753-Y2811 HydrophobicContact CE1-CG 4.1Å; F2753-Y2811 HydrophobicContact CZ-CD1 4.33Å; F2753-Y2811 AromaticContact CZ-CD2 3.81Å; F2753-Y2811 HydrophobicContact CZ-CD2 3.81Å; F2753-Y2811 HydrophobicContact CZ-CE2 4.43Å; F2753-Y2811 AromaticContact CZ-CG 3.75Å; F2753-Y2811 HydrophobicContact CZ-CG 3.75Å
2754Q92.7Very high90.3Very high28.8 Ų28.851.8 Ų51.814%0.13528%0.276CS..THydrogen-bonded Turntrans-83.8-5.7173.5-71178.5-10.700114.1T2750 Q2751 L2752 T2800 L2804T2750-Q2754 WeakPolarHBondContact O-CB 3.4Å; T2750-Q2754 VanDerWaalsContact O-CG 3.26Å; T2750-Q2754 WeakPolarHBondContact O-CG 3.34Å; T2750-Q2754 PolarHBondContact O-N 3Å; Q2751-Q2754 CarbonylContact O-C 3.57Å; Q2751-Q2754 PolarHBondContact O-N 3.25Å; L2752-Q2754 VanDerWaalsContact C-N 3.26Å; L2752-Q2754 PolarHBondContact O-N 3.25Å; Q2754-T2800 HydrophobicContact CB-CG2 4.39Å; Q2754-L2804 HydrophobicContact CG-CD1 4.48Å
2755T91Very high90.3Very high27.2 Ų27.251.2 Ų51.217%0.16727%0.271CS..SBendtrans-97.1138.2-174.8-64.30000111.2R2698 Q2751 L2752 F2753 I2757 I2803 N2807R2698-T2755 HydrophobicContact CG-CG2 4.03Å; Q2751-T2755 PolarHBondContact NE2-OG1 3.39Å; Q2751-T2755 WeakPolarHBondContact O-CB 3.31Å; Q2751-T2755 PolarHBondContact O-N 3.15Å; Q2751-T2755 VanDerWaalsContact O-N 3.09Å; Q2751-T2755 PolarHBondContact O-OG1 3.16Å; L2752-T2755 WeakPolarHBondContact O-CB 3.34Å; L2752-T2755 PolarHBondContact O-N 3.14Å; L2752-T2755 VanDerWaalsContact O-N 3.08Å; F2753-T2755 VanDerWaalsContact C-N 3.34Å; T2755-I2757 PolarHBondContact O-N 3.15Å; T2755-I2757 VanDerWaalsContact O-N 3.1Å; T2755-I2803 VanDerWaalsContact C-CG2 3.48Å; T2755-I2803 WeakPolarHBondContact O-CG2 3.37Å; T2755-N2807 PolarHBondContact O-ND2 3.22Å
2756H89.7Confident90.4Very high112.4 Ų112.446.1 Ų46.152%0.5224%0.238SC..  trans-66.3112176.8-167.4-64.9000110.7R2698 T2758 I2803R2698-H2756 PolarHBondContact NE-O 3.31Å; R2698-H2756 PolarHBondContact NH2-O 3.25Å; H2756-T2758 WeakPolarHBondContact ND1-CG2 3.4Å; H2756-I2803 HydrophobicContact CB-CD1 4.23Å
2757I88.9Confident90.4Very high21.6 Ų21.640.7 Ų40.711%0.11121%0.209CC..  trans-100.4132.8175.7-71.9157.9000107.5L2702 L2752 T2755 D2759 F2762 F2763L2702-I2757 HydrophobicContact CD1-CG1 4.5Å; L2702-I2757 HydrophobicContact CD2-CG2 4.17Å; L2752-I2757 HydrophobicContact CD1-CD1 4.12Å; L2752-I2757 HydrophobicContact CG-CD1 4.43Å; T2755-I2757 PolarHBondContact O-N 3.15Å; T2755-I2757 VanDerWaalsContact O-N 3.1Å; I2757-D2759 HydrophobicContact CG2-CB 4.49Å; I2757-F2762 HydrophobicContact CD1-CD1 3.84Å; I2757-F2762 HydrophobicContact CD1-CE1 3.88Å; I2757-F2762 HydrophobicContact CG1-CD1 4.44Å; I2757-F2762 HydrophobicContact CG2-CB 3.91Å; I2757-F2762 HydrophobicContact CG2-CD1 4.08Å; I2757-F2762 HydrophobicContact CG2-CG 4.15Å; I2757-F2763 HydrophobicContact CD1-CE1 3.97Å; I2757-F2763 HydrophobicContact CD1-CE2 3.82Å; I2757-F2763 HydrophobicContact CD1-CZ 3.31Å
2758T81.9Confident90.3Very high82.4 Ų82.442.3 Ų42.351%0.50622%0.216SC..  trans-112.824.8-173.961.30000111.7H2756H2756-T2758 WeakPolarHBondContact ND1-CG2 3.4Å
2759D84.4Confident90.1Very high26.8 Ų26.841.5 Ų41.514%0.14321%0.211CC..  trans-144.3103.6-171.3-168-37.2000109L2702 R2706 I2757 N2761 F2762L2702-D2759 HydrophobicContact CD2-CB 4.3Å; R2706-D2759 WeakPolarHBondContact CG-OD2 3.4Å; R2706-D2759 IonicContact CZ-OD2 3.76Å; R2706-D2759 VanDerWaalsContact CZ-OD2 3.24Å; R2706-D2759 IonicContact NE-OD2 2.87Å; R2706-D2759 PolarHBondContact NE-OD2 3.07Å; R2706-D2759 IonicContact NH2-OD2 3.25Å; R2706-D2759 PolarHBondContact NH2-OD2 3.18Å; I2757-D2759 HydrophobicContact CG2-CB 4.49Å; D2759-N2761 PolarHBondContact O-N 3.02Å; D2759-N2761 WeakPolarHBondContact OD1-CB 3.18Å; D2759-N2761 PolarHBondContact OD1-N 3.02Å; D2759-F2762 HydrophobicContact CB-CB 4.29Å; D2759-F2762 VanDerWaalsContact O-CB 3.25Å; D2759-F2762 WeakPolarHBondContact O-CB 3.33Å; D2759-F2762 PolarHBondContact O-N 2.95Å; D2759-F2762 VanDerWaalsContact O-N 3.1Å; D2759-F2762 PolarHBondContact OD1-N 3.19Å
2760D82.1Confident90Very high127.4 Ų127.441.3 Ų41.368%0.68121%0.211SC*.THydrogen-bonded Turntrans-65-25.1-172.5-50.2-51.2000112.2F2762D2760-F2762 VanDerWaalsContact C-N 3.31Å
2761N87.6Confident89.8Confident68.6 Ų68.643.2 Ų43.237%0.36722%0.222SC..THydrogen-bonded Turntrans-81.8-9.8177.4-67.8-81.9000112.8D2759 F2763 R2764 T2765D2759-N2761 PolarHBondContact O-N 3.02Å; D2759-N2761 WeakPolarHBondContact OD1-CB 3.18Å; D2759-N2761 PolarHBondContact OD1-N 3.02Å; N2761-F2763 PolarHBondContact O-N 3.24Å; N2761-R2764 VanDerWaalsContact O-CB 3.31Å; N2761-R2764 WeakPolarHBondContact O-CB 3.42Å; N2761-R2764 PolarHBondContact O-N 3.34Å; N2761-R2764 VanDerWaalsContact O-N 3.13Å; N2761-R2764 PolarHBondContact OD1-NH1 3.43Å; N2761-R2764 VanDerWaalsContact OD1-NH1 3.13Å; N2761-T2765 PolarHBondContact O-N 3Å; N2761-T2765 PolarHBondContact O-OG1 3.17Å; N2761-T2765 VanDerWaalsContact O-OG1 3.1Å
2762F92.8Very high89.3Confident1.8 Ų1.843 Ų431%0.00823%0.225CC..Hα-helixtrans-55.2-54.3-176.7176-101.9000112.3L2701 L2702 A2705 L2752 I2757 D2759 D2760 R2764 T2765 I2766L2701-F2762 HydrophobicContact CB-CE2 4.13Å; L2701-F2762 HydrophobicContact CB-CZ 4.36Å; L2702-F2762 HydrophobicContact CD1-CD2 3.92Å; L2702-F2762 HydrophobicContact CD1-CE2 3.89Å; L2702-F2762 HydrophobicContact CD1-CG 4.46Å; L2702-F2762 HydrophobicContact CD1-CZ 4.4Å; L2702-F2762 HydrophobicContact CD2-CB 4.41Å; L2702-F2762 HydrophobicContact CD2-CD2 3.83Å; L2702-F2762 HydrophobicContact CD2-CE2 4.36Å; L2702-F2762 HydrophobicContact CD2-CG 4.13Å; L2702-F2762 HydrophobicContact CG-CD2 4.23Å; A2705-F2762 HydrophobicContact CB-CD2 3.6Å; A2705-F2762 HydrophobicContact CB-CE2 3.98Å; L2752-F2762 HydrophobicContact CD1-CE1 3.97Å; L2752-F2762 HydrophobicContact CD1-CZ 3.98Å; L2752-F2762 HydrophobicContact CD2-CE1 4.03Å; L2752-F2762 HydrophobicContact CD2-CZ 4.15Å; L2752-F2762 HydrophobicContact CG-CE1 4.26Å; I2757-F2762 HydrophobicContact CD1-CD1 3.84Å; I2757-F2762 HydrophobicContact CD1-CE1 3.88Å; I2757-F2762 HydrophobicContact CG1-CD1 4.44Å; I2757-F2762 HydrophobicContact CG2-CB 3.91Å; I2757-F2762 HydrophobicContact CG2-CD1 4.08Å; I2757-F2762 HydrophobicContact CG2-CG 4.15Å; D2759-F2762 HydrophobicContact CB-CB 4.29Å; D2759-F2762 VanDerWaalsContact O-CB 3.25Å; D2759-F2762 WeakPolarHBondContact O-CB 3.33Å; D2759-F2762 PolarHBondContact O-N 2.95Å; D2759-F2762 VanDerWaalsContact O-N 3.1Å; D2759-F2762 PolarHBondContact OD1-N 3.19Å; D2760-F2762 VanDerWaalsContact C-N 3.31Å; F2762-R2764 VanDerWaalsContact C-N 3.33Å; F2762-R2764 PolarHBondContact O-N 3.19Å; F2762-T2765 WeakPolarHBondContact O-CA 3.46Å; F2762-T2765 VanDerWaalsContact O-CB 3.25Å; F2762-T2765 WeakPolarHBondContact O-CB 3.38Å; F2762-T2765 PolarHBondContact O-N 3Å; F2762-T2765 VanDerWaalsContact O-N 3.11Å; F2762-I2766 HydrophobicContact CD1-CG1 4.3Å; F2762-I2766 HydrophobicContact CE1-CD1 4.47Å; F2762-I2766 HydrophobicContact CE1-CG1 3.85Å; F2762-I2766 HydrophobicContact CE2-CD1 4.02Å; F2762-I2766 HydrophobicContact CE2-CG1 4.18Å; F2762-I2766 HydrophobicContact CZ-CD1 3.89Å; F2762-I2766 HydrophobicContact CZ-CG1 3.78Å; F2762-I2766 WeakPolarHBondContact O-CG1 3.28Å; F2762-I2766 PolarHBondContact O-N 3.24Å
2763F92.9Very high89Confident5.2 Ų5.243.6 Ų43.62%0.02323%0.227CC..Hα-helixtrans-68.7-32.2-178.2-68.8-56.4000113.2F2753 I2757 N2761 T2765 I2766 I2767 N2807 N2810 Y2811F2753-F2763 HydrophobicContact CD1-CE1 4.45Å; F2753-F2763 HydrophobicContact CD1-CZ 4.24Å; F2753-F2763 HydrophobicContact CE1-CE1 4.1Å; F2753-F2763 HydrophobicContact CE1-CZ 4.18Å; F2753-F2763 HydrophobicContact CZ-CE1 4.4Å; I2757-F2763 HydrophobicContact CD1-CE1 3.97Å; I2757-F2763 HydrophobicContact CD1-CE2 3.82Å; I2757-F2763 HydrophobicContact CD1-CZ 3.31Å; N2761-F2763 PolarHBondContact O-N 3.24Å; F2763-T2765 VanDerWaalsContact C-N 3.29Å; F2763-T2765 PolarHBondContact O-N 3.09Å; F2763-I2766 PolarHBondContact O-N 3.11Å; F2763-I2767 WeakPolarHBondContact O-CG1 3.39Å; F2763-I2767 PolarHBondContact O-N 3Å; F2763-N2807 HydrophobicContact CE2-CB 3.72Å; F2763-N2807 WeakPolarHBondContact CE2-OD1 3.4Å; F2763-N2807 HydrophobicContact CZ-CB 3.73Å; F2763-N2810 HydrophobicContact CD2-CB 3.96Å; F2763-N2810 HydrophobicContact CE2-CB 4.45Å; F2763-Y2811 HydrophobicContact CB-CD2 4.06Å; F2763-Y2811 AromaticContact CD1-CD2 3.62Å; F2763-Y2811 HydrophobicContact CD1-CD2 3.62Å; F2763-Y2811 HydrophobicContact CD1-CE2 4.45Å; F2763-Y2811 HydrophobicContact CD1-CG 4.49Å; F2763-Y2811 HydrophobicContact CE1-CD2 4.33Å; F2763-Y2811 HydrophobicContact CG-CD2 4.07Å
2764R92Very high88.6Confident143.4 Ų143.447.2 Ų47.254%0.54124%0.244SC..Hα-helixtrans-57.6-44.5169.7-173.8-179172.9-168.5-0.1111.3N2761 F2762 I2767 S2768 H2814N2761-R2764 VanDerWaalsContact O-CB 3.31Å; N2761-R2764 WeakPolarHBondContact O-CB 3.42Å; N2761-R2764 PolarHBondContact O-N 3.34Å; N2761-R2764 VanDerWaalsContact O-N 3.13Å; N2761-R2764 PolarHBondContact OD1-NH1 3.43Å; N2761-R2764 VanDerWaalsContact OD1-NH1 3.13Å; F2762-R2764 VanDerWaalsContact C-N 3.33Å; F2762-R2764 PolarHBondContact O-N 3.19Å; R2764-I2767 PolarHBondContact O-N 3.24Å; R2764-S2768 WeakPolarHBondContact O-CB 3.35Å; R2764-S2768 PolarHBondContact O-N 3.05Å; R2764-H2814 HydrophobicContact CB-CB 4.46Å; R2764-H2814 VanDerWaalsContact CB-CD2 3.49Å; R2764-H2814 WeakPolarHBondContact CB-CD2 3.26Å
2765T91Very high88.2Confident1.4 Ų1.452.9 Ų52.91%0.00928%0.275CS..Hα-helixtrans-62.8-48.3174.7-46.10000111.3A2705 A2708 N2709 L2736 N2761 F2762 F2763 I2767 S2768 V2769A2705-T2765 HydrophobicContact CB-CG2 4.06Å; A2705-T2765 WeakPolarHBondContact O-CG2 3.34Å; A2705-T2765 PolarHBondContact O-OG1 2.62Å; A2708-T2765 HydrophobicContact CB-CG2 3.64Å; N2709-T2765 PolarHBondContact ND2-OG1 3.13Å; N2709-T2765 WeakPolarHBondContact OD1-CG2 3.43Å; N2709-T2765 PolarHBondContact OD1-OG1 3.23Å; L2736-T2765 HydrophobicContact CD1-CG2 4.33Å; N2761-T2765 PolarHBondContact O-N 3Å; N2761-T2765 PolarHBondContact O-OG1 3.17Å; N2761-T2765 VanDerWaalsContact O-OG1 3.1Å; F2762-T2765 WeakPolarHBondContact O-CA 3.46Å; F2762-T2765 VanDerWaalsContact O-CB 3.25Å; F2762-T2765 WeakPolarHBondContact O-CB 3.38Å; F2762-T2765 PolarHBondContact O-N 3Å; F2762-T2765 VanDerWaalsContact O-N 3.11Å; F2763-T2765 VanDerWaalsContact C-N 3.29Å; F2763-T2765 PolarHBondContact O-N 3.09Å; T2765-I2767 VanDerWaalsContact C-N 3.28Å; T2765-I2767 PolarHBondContact O-N 3.22Å; T2765-S2768 PolarHBondContact O-N 3.04Å; T2765-S2768 VanDerWaalsContact O-N 3.16Å; T2765-V2769 HydrophobicContact CG2-CG2 4.19Å; T2765-V2769 WeakPolarHBondContact O-CB 3.26Å; T2765-V2769 VanDerWaalsContact O-CG2 3.24Å; T2765-V2769 WeakPolarHBondContact O-CG2 3.41Å; T2765-V2769 PolarHBondContact O-N 3.02Å
2766I93.2Very high88Confident3 Ų357.2 Ų57.22%0.01529%0.293CS..Hα-helixtrans-57-43179.5-63.9-46000111.3L2736 M2740 F2762 F2763 V2769 L2770 Y2811L2736-I2766 HydrophobicContact CD2-CD1 4.22Å; M2740-I2766 HydrophobicContact CE-CD1 4.14Å; M2740-I2766 HydrophobicContact CE-CG2 4.09Å; M2740-I2766 HydrophobicContact SD-CD1 3.87Å; M2740-I2766 HydrophobicContact SD-CG1 4.46Å; M2740-I2766 HydrophobicContact SD-CG2 3.67Å; F2762-I2766 HydrophobicContact CD1-CG1 4.3Å; F2762-I2766 HydrophobicContact CE1-CD1 4.47Å; F2762-I2766 HydrophobicContact CE1-CG1 3.85Å; F2762-I2766 HydrophobicContact CE2-CD1 4.02Å; F2762-I2766 HydrophobicContact CE2-CG1 4.18Å; F2762-I2766 HydrophobicContact CZ-CD1 3.89Å; F2762-I2766 HydrophobicContact CZ-CG1 3.78Å; F2762-I2766 WeakPolarHBondContact O-CG1 3.28Å; F2762-I2766 PolarHBondContact O-N 3.24Å; F2763-I2766 PolarHBondContact O-N 3.11Å; I2766-V2769 PolarHBondContact O-N 3.14Å; I2766-L2770 HydrophobicContact CG2-CD1 3.95Å; I2766-L2770 WeakPolarHBondContact O-CB 3.32Å; I2766-L2770 VanDerWaalsContact O-CG 3.29Å; I2766-L2770 WeakPolarHBondContact O-CG 3.31Å; I2766-L2770 PolarHBondContact O-N 3.19Å; I2766-L2770 VanDerWaalsContact O-N 3.13Å; I2766-Y2811 HydrophobicContact CG2-CE2 4.1Å
2767I91.8Very high88Confident6.2 Ų6.252.3 Ų52.33%0.03227%0.27CS..Hα-helixtrans-67-47.8177.1-69.1164.2000110.7F2763 R2764 T2765 V2769 L2770 V2771 I2779 Y2811 H2814 L2815 P2816F2763-I2767 WeakPolarHBondContact O-CG1 3.39Å; F2763-I2767 PolarHBondContact O-N 3Å; R2764-I2767 PolarHBondContact O-N 3.24Å; T2765-I2767 VanDerWaalsContact C-N 3.28Å; T2765-I2767 PolarHBondContact O-N 3.22Å; I2767-V2769 VanDerWaalsContact C-N 3.25Å; I2767-V2769 PolarHBondContact O-N 3.2Å; I2767-L2770 PolarHBondContact O-N 3.22Å; I2767-V2771 HydrophobicContact CG2-CG2 4.42Å; I2767-V2771 WeakPolarHBondContact O-CG2 3.3Å; I2767-V2771 PolarHBondContact O-N 3.09Å; I2767-I2779 HydrophobicContact CG2-CG2 4.46Å; I2767-Y2811 HydrophobicContact CD1-CD1 4.11Å; I2767-Y2811 HydrophobicContact CD1-CD2 4.07Å; I2767-Y2811 HydrophobicContact CD1-CE1 4.02Å; I2767-Y2811 HydrophobicContact CD1-CE2 3.98Å; I2767-Y2811 HydrophobicContact CD1-CG 4.14Å; I2767-Y2811 VanDerWaalsContact CD1-O 3.28Å; I2767-Y2811 WeakPolarHBondContact CD1-O 3.31Å; I2767-Y2811 HydrophobicContact CG1-CD2 4.24Å; I2767-Y2811 HydrophobicContact CG1-CE1 4.11Å; I2767-Y2811 HydrophobicContact CG1-CE2 3.66Å; I2767-H2814 HydrophobicContact CD1-CB 3.69Å; I2767-L2815 HydrophobicContact CD1-CD2 4.12Å; I2767-L2815 HydrophobicContact CD1-CG 4.37Å; I2767-L2815 HydrophobicContact CG1-CD2 4.47Å; I2767-P2816 HydrophobicContact CG2-CG 4.48Å
2768S88.5Confident88.1Confident63.4 Ų63.452.7 Ų52.744%0.44328%0.275SS..Hα-helixtrans-58.2-34.6176.6-166.90000113R2764 T2765 L2770R2764-S2768 WeakPolarHBondContact O-CB 3.35Å; R2764-S2768 PolarHBondContact O-N 3.05Å; T2765-S2768 PolarHBondContact O-N 3.04Å; T2765-S2768 VanDerWaalsContact O-N 3.16Å; S2768-L2770 VanDerWaalsContact C-N 3.31Å; S2768-L2770 PolarHBondContact O-N 3.5Å
2769V89.6Confident88.6Confident0 Ų048.8 Ų48.80%025%0.251CS..Hα-helixtrans-72.2-30176.3168.60000111.8H2733 L2736 R2737 M2740 T2765 I2766 I2767H2733-V2769 HydrophobicContact CB-CG2 4.37Å; L2736-V2769 HydrophobicContact CB-CG1 3.87Å; L2736-V2769 HydrophobicContact CB-CG2 4.49Å; L2736-V2769 HydrophobicContact CD1-CG2 4Å; R2737-V2769 HydrophobicContact CG-CG1 3.63Å; R2737-V2769 VanDerWaalsContact CZ-O 3.26Å; R2737-V2769 PolarHBondContact NE-O 3.1Å; R2737-V2769 PolarHBondContact NH2-O 2.94Å; M2740-V2769 HydrophobicContact CE-CG1 4.15Å; T2765-V2769 HydrophobicContact CG2-CG2 4.19Å; T2765-V2769 WeakPolarHBondContact O-CB 3.26Å; T2765-V2769 VanDerWaalsContact O-CG2 3.24Å; T2765-V2769 WeakPolarHBondContact O-CG2 3.41Å; T2765-V2769 PolarHBondContact O-N 3.02Å; I2766-V2769 PolarHBondContact O-N 3.14Å; I2767-V2769 VanDerWaalsContact C-N 3.25Å; I2767-V2769 PolarHBondContact O-N 3.2Å
2770L91Very high88.9Confident0 Ų047.9 Ų47.90%025%0.246CC..Hα-helixtrans-92.7-15-177.4-69.1177000114.7M2740 I2766 I2767 S2768 D2772 F2773 M2777 I2779 P2782M2740-L2770 HydrophobicContact CE-CD1 4.19Å; M2740-L2770 HydrophobicContact CE-CD2 3.88Å; M2740-L2770 HydrophobicContact CE-CG 3.94Å; M2740-L2770 HydrophobicContact SD-CD1 4.45Å; I2766-L2770 HydrophobicContact CG2-CD1 3.95Å; I2766-L2770 WeakPolarHBondContact O-CB 3.32Å; I2766-L2770 VanDerWaalsContact O-CG 3.29Å; I2766-L2770 WeakPolarHBondContact O-CG 3.31Å; I2766-L2770 PolarHBondContact O-N 3.19Å; I2766-L2770 VanDerWaalsContact O-N 3.13Å; I2767-L2770 PolarHBondContact O-N 3.22Å; S2768-L2770 VanDerWaalsContact C-N 3.31Å; S2768-L2770 PolarHBondContact O-N 3.5Å; L2770-D2772 PolarHBondContact O-N 2.99Å; L2770-F2773 HydrophobicContact CD2-CB 4.46Å; L2770-F2773 HydrophobicContact CD2-CD1 4.03Å; L2770-F2773 PolarHBondContact O-N 3.07Å; L2770-F2773 VanDerWaalsContact O-N 3.16Å; L2770-M2777 HydrophobicContact CD1-CE 4.29Å; L2770-M2777 HydrophobicContact CD2-CB 4.46Å; L2770-M2777 HydrophobicContact CD2-CE 3.56Å; L2770-M2777 VanDerWaalsContact CD2-CE 3.49Å; L2770-M2777 HydrophobicContact CD2-CG 4.48Å; L2770-M2777 HydrophobicContact CG-CE 4.48Å; L2770-I2779 HydrophobicContact CB-CG2 3.81Å; L2770-P2782 HydrophobicContact CD1-CG 3.96Å
2771V86Confident89.4Confident57.4 Ų57.445.6 Ų45.635%0.34823%0.231SC..Hα-helixtrans-58.2-56.7175.8165.60000111.1I2767 F2773 I2779 P2816I2767-V2771 HydrophobicContact CG2-CG2 4.42Å; I2767-V2771 WeakPolarHBondContact O-CG2 3.3Å; I2767-V2771 PolarHBondContact O-N 3.09Å; V2771-F2773 PolarHBondContact O-N 3.09Å; V2771-F2773 VanDerWaalsContact O-N 3.17Å; V2771-I2779 HydrophobicContact CG2-CG2 3.9Å; V2771-P2816 HydrophobicContact CG2-CG 4.2Å
2772D81.2Confident89.7Confident111 Ų11142.4 Ų42.459%0.59421%0.214SC*.THydrogen-bonded Turntrans-81.830.9174.812.9-69.9000113.7R2737 L2770R2737-D2772 IonicContact CZ-OD2 3.33Å; R2737-D2772 IonicContact NH1-OD2 2.96Å; R2737-D2772 PolarHBondContact NH2-O 3.34Å; R2737-D2772 IonicContact NH2-OD2 3.28Å; R2737-D2772 PolarHBondContact NH2-OD2 3.22Å; L2770-D2772 PolarHBondContact O-N 2.99Å
2773F87.1Confident89.7Confident27.2 Ų27.242.3 Ų42.312%0.11921%0.214CC..THydrogen-bonded Turntrans-131.518.9175.6-156.9-120.8000113R2737 Y2741 L2770 V2771 D2775 H2776 M2777R2737-F2773 HydrophobicContact CB-CD1 4.34Å; R2737-F2773 HydrophobicContact CB-CD2 4.26Å; R2737-F2773 HydrophobicContact CB-CE1 4.12Å; R2737-F2773 HydrophobicContact CB-CE2 4.02Å; R2737-F2773 HydrophobicContact CB-CG 4.42Å; R2737-F2773 HydrophobicContact CB-CZ 3.95Å; R2737-F2773 HydrophobicContact CG-CB 4.33Å; R2737-F2773 HydrophobicContact CG-CD1 4.12Å; R2737-F2773 HydrophobicContact CG-CD2 3.9Å; R2737-F2773 HydrophobicContact CG-CE1 4.39Å; R2737-F2773 HydrophobicContact CG-CE2 4.18Å; R2737-F2773 HydrophobicContact CG-CG 3.86Å; R2737-F2773 HydrophobicContact CG-CZ 4.42Å; Y2741-F2773 HydrophobicContact CD2-CE1 4.46Å; L2770-F2773 HydrophobicContact CD2-CB 4.46Å; L2770-F2773 HydrophobicContact CD2-CD1 4.03Å; L2770-F2773 PolarHBondContact O-N 3.07Å; L2770-F2773 VanDerWaalsContact O-N 3.16Å; V2771-F2773 PolarHBondContact O-N 3.09Å; V2771-F2773 VanDerWaalsContact O-N 3.17Å; F2773-D2775 VanDerWaalsContact C-N 3.28Å; F2773-D2775 PolarHBondContact O-N 3.13Å; F2773-D2775 VanDerWaalsContact O-N 3.14Å; F2773-H2776 HydrophobicContact CD1-CB 3.98Å; F2773-H2776 HydrophobicContact CD2-CB 4.41Å; F2773-H2776 HydrophobicContact CE1-CB 3.54Å; F2773-H2776 HydrophobicContact CE2-CB 4.02Å; F2773-H2776 AromaticContact CE2-CD2 3.49Å; F2773-H2776 VanDerWaalsContact CE2-CD2 3.48Å; F2773-H2776 WeakPolarHBondContact CE2-CD2 3.3Å; F2773-H2776 HydrophobicContact CG-CB 4.4Å; F2773-H2776 HydrophobicContact CZ-CB 3.56Å; F2773-H2776 AromaticContact CZ-CD2 3.77Å; F2773-H2776 AromaticContact CZ-CG 3.96Å; F2773-H2776 PolarHBondContact O-N 3.04Å; F2773-H2776 VanDerWaalsContact O-N 3.08Å; F2773-M2777 HydrophobicContact CD1-CB 4.1Å; F2773-M2777 HydrophobicContact CE1-CB 4.33Å; F2773-M2777 PolarHBondContact O-N 3.07Å
2774E84.4Confident89.7Confident75.6 Ų75.643.6 Ų43.635%0.35322%0.223SC..THydrogen-bonded Turntrans-55.1-35.4-173.660.7170.8-170.100114.5H2776 K2823 F2827E2774-H2776 PolarHBondContact O-N 3.07Å; E2774-H2776 VanDerWaalsContact O-N 3.13Å; E2774-K2823 IonicContact OE1-NZ 3.34Å; E2774-K2823 PolarHBondContact OE1-NZ 3.15Å; E2774-K2823 IonicContact OE2-NZ 3.28Å; E2774-F2827 HydrophobicContact CB-CE2 4.1Å; E2774-F2827 HydrophobicContact CB-CZ 4.16Å; E2774-F2827 WeakPolarHBondContact OE2-CE2 3.38Å
2775D84.8Confident89.8Confident149.2 Ų149.238.6 Ų38.680%0.79821%0.207SC*.THydrogen-bonded Turntrans-60.5-23178.3-74.4-38.1000114F2773F2773-D2775 VanDerWaalsContact C-N 3.28Å; F2773-D2775 PolarHBondContact O-N 3.13Å; F2773-D2775 VanDerWaalsContact O-N 3.14Å
2776H87.1Confident89.9Confident117.8 Ų117.838.5 Ų38.555%0.54521%0.207SC..THydrogen-bonded Turntrans-118-39.4-175.6-66.7-48.8000112.8Y2741 F2773 E2774Y2741-H2776 HydrophobicContact CD2-CB 4.32Å; Y2741-H2776 HydrophobicContact CE2-CB 4.23Å; Y2741-H2776 WeakPolarHBondContact CE2-O 3.35Å; F2773-H2776 HydrophobicContact CD1-CB 3.98Å; F2773-H2776 HydrophobicContact CD2-CB 4.41Å; F2773-H2776 HydrophobicContact CE1-CB 3.54Å; F2773-H2776 HydrophobicContact CE2-CB 4.02Å; F2773-H2776 AromaticContact CE2-CD2 3.49Å; F2773-H2776 VanDerWaalsContact CE2-CD2 3.48Å; F2773-H2776 WeakPolarHBondContact CE2-CD2 3.3Å; F2773-H2776 HydrophobicContact CG-CB 4.4Å; F2773-H2776 HydrophobicContact CZ-CB 3.56Å; F2773-H2776 AromaticContact CZ-CD2 3.77Å; F2773-H2776 AromaticContact CZ-CG 3.96Å; F2773-H2776 PolarHBondContact O-N 3.04Å; F2773-H2776 VanDerWaalsContact O-N 3.08Å; E2774-H2776 PolarHBondContact O-N 3.07Å; E2774-H2776 VanDerWaalsContact O-N 3.13Å
2777M90.1Very high89.9Confident9 Ų938.4 Ų38.44%0.04421%0.206CC..  trans-156.4105176.4-172.8161.964.400111.5M2740 Y2741 A2744 F2749 L2770 F2773 Q2781M2740-M2777 HydrophobicContact CB-CE 3.67Å; Y2741-M2777 HydrophobicContact CD2-CB 4.39Å; A2744-M2777 HydrophobicContact CB-SD 4.38Å; F2749-M2777 HydrophobicContact CE2-CE 4.48Å; F2749-M2777 HydrophobicContact CE2-SD 3.91Å; F2749-M2777 HydrophobicContact CZ-CE 3.85Å; F2749-M2777 HydrophobicContact CZ-SD 3.86Å; L2770-M2777 HydrophobicContact CD1-CE 4.29Å; L2770-M2777 HydrophobicContact CD2-CB 4.46Å; L2770-M2777 HydrophobicContact CD2-CE 3.56Å; L2770-M2777 VanDerWaalsContact CD2-CE 3.49Å; L2770-M2777 HydrophobicContact CD2-CG 4.48Å; L2770-M2777 HydrophobicContact CG-CE 4.48Å; F2773-M2777 HydrophobicContact CD1-CB 4.1Å; F2773-M2777 HydrophobicContact CE1-CB 4.33Å; F2773-M2777 PolarHBondContact O-N 3.07Å; M2777-Q2781 HydrophobicContact CG-CB 3.81Å; M2777-Q2781 HydrophobicContact CG-CG 4.02Å; M2777-Q2781 HydrophobicContact SD-CG 4.4Å
2778S90.1Very high89.9Confident29 Ų2942.6 Ų42.620%0.20323%0.226CC..  trans-55.6145.4171.8176.20000112.6F2780 Q2781 F2827S2778-F2780 PolarHBondContact O-N 3.08Å; S2778-F2780 WeakPolarHBondContact OG-CD2 3.32Å; S2778-F2780 PolarHBondContact OG-N 3.12Å; S2778-Q2781 VanDerWaalsContact O-CB 3.3Å; S2778-Q2781 WeakPolarHBondContact O-CB 3.39Å; S2778-Q2781 PolarHBondContact O-N 3.11Å; S2778-F2827 VanDerWaalsContact OG-CZ 3.25Å; S2778-F2827 WeakPolarHBondContact OG-CZ 3.32Å
2779I92.5Very high90Very high1.6 Ų1.641.4 Ų41.41%0.00822%0.217CC..THydrogen-bonded Turntrans-50.9-20.5170.563.9177.1000114.1I2767 L2770 V2771 Y2811 L2815 P2816 F2827I2767-I2779 HydrophobicContact CG2-CG2 4.46Å; L2770-I2779 HydrophobicContact CB-CG2 3.81Å; V2771-I2779 HydrophobicContact CG2-CG2 3.9Å; I2779-Y2811 PolarHBondContact O-OH 3.01Å; I2779-L2815 HydrophobicContact CD1-CD2 4.18Å; I2779-L2815 HydrophobicContact CG1-CD2 4.42Å; I2779-P2816 HydrophobicContact CD1-CG 3.84Å; I2779-F2827 HydrophobicContact CD1-CE1 4.02Å; I2779-F2827 HydrophobicContact CG1-CE1 4.03Å; I2779-F2827 HydrophobicContact CG1-CZ 4.31Å
2780F92Very high90.1Very high7.4 Ų7.441.4 Ų41.43%0.03222%0.217CC..THydrogen-bonded Turntrans-88.3-22.3-179.8-64-63000113.1S2778 P2782 I2783 S2784 L2815 F2827 W2832 I2835S2778-F2780 PolarHBondContact O-N 3.08Å; S2778-F2780 WeakPolarHBondContact OG-CD2 3.32Å; S2778-F2780 PolarHBondContact OG-N 3.12Å; F2780-P2782 VanDerWaalsContact C-CD 3.49Å; F2780-I2783 PolarHBondContact O-N 3.13Å; F2780-I2783 VanDerWaalsContact O-N 3.14Å; F2780-S2784 PolarHBondContact O-N 3.01Å; F2780-S2784 VanDerWaalsContact O-N 3.11Å; F2780-S2784 PolarHBondContact O-OG 3.11Å; F2780-L2815 HydrophobicContact CD1-CD2 4.45Å; F2780-L2815 HydrophobicContact CE1-CD1 4.2Å; F2780-L2815 HydrophobicContact CE1-CD2 4.26Å; F2780-F2827 HydrophobicContact CD2-CE1 4.36Å; F2780-F2827 HydrophobicContact CD2-CZ 4.4Å; F2780-F2827 HydrophobicContact CE2-CD1 4.31Å; F2780-F2827 AromaticContact CE2-CE1 3.97Å; F2780-F2827 HydrophobicContact CE2-CE1 3.98Å; F2780-F2827 HydrophobicContact CE2-CZ 4.46Å; F2780-W2832 HydrophobicContact CE1-CD2 4.46Å; F2780-W2832 HydrophobicContact CE1-CG 4.39Å; F2780-I2835 HydrophobicContact CB-CD1 3.56Å; F2780-I2835 HydrophobicContact CB-CG1 4.48Å; F2780-I2835 HydrophobicContact CD1-CD1 3.47Å; F2780-I2835 VanDerWaalsContact CD1-CD1 3.47Å; F2780-I2835 HydrophobicContact CE1-CD1 4.5Å; F2780-I2835 HydrophobicContact CG-CD1 3.91Å
2781Q92.3Very high90.1Very high79.4 Ų79.443 Ų4337%0.37123%0.226SC..Hα-helixtrans-60.4-36.7-176.5-171.864.5200114.6M2777 S2778 I2783 S2784 L2785M2777-Q2781 HydrophobicContact CG-CB 3.81Å; M2777-Q2781 HydrophobicContact CG-CG 4.02Å; M2777-Q2781 HydrophobicContact SD-CG 4.4Å; S2778-Q2781 VanDerWaalsContact O-CB 3.3Å; S2778-Q2781 WeakPolarHBondContact O-CB 3.39Å; S2778-Q2781 PolarHBondContact O-N 3.11Å; Q2781-I2783 VanDerWaalsContact C-N 3.3Å; Q2781-I2783 PolarHBondContact O-N 3.32Å; Q2781-S2784 PolarHBondContact O-N 3.36Å; Q2781-L2785 HydrophobicContact CG-CD1 3.94Å; Q2781-L2785 HydrophobicContact CG-CG 4.28Å; Q2781-L2785 WeakPolarHBondContact O-CG 3.34Å; Q2781-L2785 PolarHBondContact O-N 3.2Å
2782P93.1Very high90.3Very high0.8 Ų0.847.3 Ų47.31%0.00524%0.24CC..Hα-helixtrans-57.8-39.4174-29.138.8000113.6F2749 F2753 L2770 F2780 L2786 Y2811F2749-P2782 HydrophobicContact CD1-CB 3.67Å; F2749-P2782 HydrophobicContact CD1-CG 4.14Å; F2749-P2782 HydrophobicContact CD2-CB 4.24Å; F2749-P2782 HydrophobicContact CE1-CB 3.81Å; F2749-P2782 HydrophobicContact CE1-CG 3.74Å; F2749-P2782 HydrophobicContact CE2-CB 4.35Å; F2749-P2782 HydrophobicContact CE2-CG 4.2Å; F2749-P2782 HydrophobicContact CG-CB 3.9Å; F2749-P2782 HydrophobicContact CZ-CB 4.15Å; F2749-P2782 HydrophobicContact CZ-CG 3.76Å; F2753-P2782 HydrophobicContact CE2-CB 4.3Å; L2770-P2782 HydrophobicContact CD1-CG 3.96Å; F2780-P2782 VanDerWaalsContact C-CD 3.49Å; P2782-L2786 WeakPolarHBondContact O-CB 3.34Å; P2782-L2786 PolarHBondContact O-N 3.03Å; P2782-L2786 VanDerWaalsContact O-N 3.11Å; P2782-Y2811 HydrophobicContact CB-CE2 4.49Å; P2782-Y2811 WeakPolarHBondContact CG-OH 3.29Å
2783I93.7Very high90.5Very high0 Ų045.2 Ų45.20%023%0.226CC..Hα-helixtrans-73.2-43.2177.4-55.2164000110F2780 Q2781 L2785 L2786 M2787 L2808 Y2811 L2812 L2815 I2835F2780-I2783 PolarHBondContact O-N 3.13Å; F2780-I2783 VanDerWaalsContact O-N 3.14Å; Q2781-I2783 VanDerWaalsContact C-N 3.3Å; Q2781-I2783 PolarHBondContact O-N 3.32Å; I2783-L2785 VanDerWaalsContact C-N 3.34Å; I2783-L2785 PolarHBondContact O-N 3.1Å; I2783-L2786 WeakPolarHBondContact O-CB 3.37Å; I2783-L2786 PolarHBondContact O-N 3.12Å; I2783-M2787 HydrophobicContact CG2-CG 4.06Å; I2783-M2787 WeakPolarHBondContact O-CB 3.42Å; I2783-M2787 VanDerWaalsContact O-CG 3.31Å; I2783-M2787 WeakPolarHBondContact O-CG 3.35Å; I2783-M2787 PolarHBondContact O-N 2.98Å; I2783-L2808 HydrophobicContact CG2-CD1 4.43Å; I2783-Y2811 HydrophobicContact CD1-CD1 3.72Å; I2783-Y2811 HydrophobicContact CD1-CE1 3.69Å; I2783-Y2811 HydrophobicContact CG1-CD1 3.81Å; I2783-Y2811 HydrophobicContact CG1-CE1 3.76Å; I2783-L2812 HydrophobicContact CD1-CD2 3.78Å; I2783-L2815 HydrophobicContact CD1-CD1 4.14Å; I2783-I2835 HydrophobicContact CB-CD1 3.87Å; I2783-I2835 HydrophobicContact CB-CG1 4.28Å; I2783-I2835 HydrophobicContact CD1-CD1 3.8Å; I2783-I2835 HydrophobicContact CG1-CD1 4.42Å; I2783-I2835 HydrophobicContact CG2-CD1 4.15Å; I2783-I2835 HydrophobicContact CG2-CG1 4.22Å; I2783-I2835 HydrophobicContact CG2-CG2 3.81Å
2784S92.9Very high90.2Very high33 Ų3354.2 Ų54.223%0.23127%0.265CS..Hα-helixtrans-58.5-46.4178.9-76.70000112.1F2780 Q2781 L2786 M2787 E2788F2780-S2784 PolarHBondContact O-N 3.01Å; F2780-S2784 VanDerWaalsContact O-N 3.11Å; F2780-S2784 PolarHBondContact O-OG 3.11Å; Q2781-S2784 PolarHBondContact O-N 3.36Å; S2784-L2786 VanDerWaalsContact C-N 3.34Å; S2784-L2786 PolarHBondContact O-N 3.09Å; S2784-M2787 PolarHBondContact O-N 3.01Å; S2784-E2788 VanDerWaalsContact O-CB 3.32Å; S2784-E2788 WeakPolarHBondContact O-CB 3.31Å; S2784-E2788 PolarHBondContact O-N 3.25Å
2785L92.7Very high90Very high37.6 Ų37.655 Ų5520%0.19728%0.28CS..Hα-helixtrans-66.5-39.2176.9-69.8170.9000112.5A2744 F2749 Q2781 I2783 E2788 S2789A2744-L2785 HydrophobicContact CB-CD1 4Å; F2749-L2785 HydrophobicContact CD2-CB 4.4Å; F2749-L2785 HydrophobicContact CD2-CD1 3.75Å; F2749-L2785 HydrophobicContact CE2-CD1 3.97Å; Q2781-L2785 HydrophobicContact CG-CD1 3.94Å; Q2781-L2785 HydrophobicContact CG-CG 4.28Å; Q2781-L2785 WeakPolarHBondContact O-CG 3.34Å; Q2781-L2785 PolarHBondContact O-N 3.2Å; I2783-L2785 VanDerWaalsContact C-N 3.34Å; I2783-L2785 PolarHBondContact O-N 3.1Å; L2785-E2788 PolarHBondContact O-N 3.07Å; L2785-S2789 WeakPolarHBondContact O-CB 3.37Å; L2785-S2789 PolarHBondContact O-N 3.13Å; L2785-S2789 VanDerWaalsContact O-N 3.17Å
2786L93.7Very high89.8Confident0 Ų048.7 Ų48.70%025%0.246CC..Hα-helixtrans-59.9-51.2173.1179.170.6000111.1T2750 F2753 P2782 I2783 S2784 E2788 S2789 L2790 L2804 L2808T2750-L2786 HydrophobicContact CG2-CD1 4.46Å; F2753-L2786 HydrophobicContact CB-CD1 3.84Å; F2753-L2786 HydrophobicContact CB-CD2 4.06Å; F2753-L2786 HydrophobicContact CD1-CD2 4.15Å; F2753-L2786 HydrophobicContact CD2-CB 4.36Å; F2753-L2786 HydrophobicContact CD2-CD1 4.12Å; F2753-L2786 HydrophobicContact CD2-CD2 3.71Å; F2753-L2786 HydrophobicContact CD2-CG 4.27Å; F2753-L2786 HydrophobicContact CE2-CD2 4.17Å; F2753-L2786 HydrophobicContact CG-CD1 4.22Å; F2753-L2786 HydrophobicContact CG-CD2 3.72Å; P2782-L2786 WeakPolarHBondContact O-CB 3.34Å; P2782-L2786 PolarHBondContact O-N 3.03Å; P2782-L2786 VanDerWaalsContact O-N 3.11Å; I2783-L2786 WeakPolarHBondContact O-CB 3.37Å; I2783-L2786 PolarHBondContact O-N 3.12Å; S2784-L2786 VanDerWaalsContact C-N 3.34Å; S2784-L2786 PolarHBondContact O-N 3.09Å; L2786-E2788 VanDerWaalsContact C-N 3.34Å; L2786-E2788 PolarHBondContact O-N 3.16Å; L2786-S2789 WeakPolarHBondContact O-CB 3.26Å; L2786-S2789 PolarHBondContact O-N 2.96Å; L2786-S2789 VanDerWaalsContact O-N 3.14Å; L2786-L2790 HydrophobicContact CD1-CD1 3.89Å; L2786-L2790 HydrophobicContact CD1-CG 4.29Å; L2786-L2790 HydrophobicContact CD2-CD1 4.43Å; L2786-L2790 HydrophobicContact CG-CD1 3.79Å; L2786-L2790 HydrophobicContact CG-CG 4.43Å; L2786-L2790 WeakPolarHBondContact O-CB 3.42Å; L2786-L2790 VanDerWaalsContact O-CG 3.31Å; L2786-L2790 WeakPolarHBondContact O-CG 3.3Å; L2786-L2790 PolarHBondContact O-N 3.03Å; L2786-L2804 HydrophobicContact CD1-CD1 3.97Å; L2786-L2804 HydrophobicContact CD2-CD1 4.14Å; L2786-L2808 HydrophobicContact CD2-CD1 4.17Å
2787M92.9Very high89.5Confident0.4 Ų0.445.2 Ų45.20%0.00223%0.234CC..Hα-helixtrans-64.7-38.1-180-70-60.6113.500112I2783 S2784 S2789 L2790 N2791 L2808 P2838 L2839 F2842I2783-M2787 HydrophobicContact CG2-CG 4.06Å; I2783-M2787 WeakPolarHBondContact O-CB 3.42Å; I2783-M2787 VanDerWaalsContact O-CG 3.31Å; I2783-M2787 WeakPolarHBondContact O-CG 3.35Å; I2783-M2787 PolarHBondContact O-N 2.98Å; S2784-M2787 PolarHBondContact O-N 3.01Å; M2787-S2789 VanDerWaalsContact C-N 3.29Å; M2787-S2789 PolarHBondContact O-N 3.27Å; M2787-L2790 HydrophobicContact CE-CD1 3.96Å; M2787-N2791 WeakPolarHBondContact O-CB 3.3Å; M2787-N2791 VanDerWaalsContact O-CG 3.3Å; M2787-N2791 PolarHBondContact O-N 3.04Å; M2787-N2791 PolarHBondContact O-ND2 3.16Å; M2787-L2808 HydrophobicContact CE-CD2 3.81Å; M2787-P2838 HydrophobicContact CB-CB 3.71Å; M2787-P2838 HydrophobicContact CG-CB 4.3Å; M2787-L2839 HydrophobicContact CE-CD1 4.13Å; M2787-L2839 HydrophobicContact SD-CB 4.34Å; M2787-L2839 HydrophobicContact SD-CD1 3.66Å; M2787-F2842 HydrophobicContact CE-CD1 4.13Å; M2787-F2842 HydrophobicContact CE-CG 4.26Å; M2787-F2842 HydrophobicContact SD-CB 3.59Å; M2787-F2842 VanDerWaalsContact SD-CB 3.59Å; M2787-F2842 HydrophobicContact SD-CD1 4.06Å; M2787-F2842 HydrophobicContact SD-CG 3.87Å
2788E91.7Very high89.2Confident95.6 Ų95.647.9 Ų47.945%0.44725%0.249SC..Hα-helixtrans-61.9-43.9174.4-171.7-176.2-17300111.3S2784 L2785 L2786 N2791 K2792S2784-E2788 VanDerWaalsContact O-CB 3.32Å; S2784-E2788 WeakPolarHBondContact O-CB 3.31Å; S2784-E2788 PolarHBondContact O-N 3.25Å; L2785-E2788 PolarHBondContact O-N 3.07Å; L2786-E2788 VanDerWaalsContact C-N 3.34Å; L2786-E2788 PolarHBondContact O-N 3.16Å; E2788-N2791 PolarHBondContact O-N 3.33Å; E2788-K2792 VanDerWaalsContact CD-NZ 3.31Å; E2788-K2792 HydrophobicContact CG-CD 4.22Å; E2788-K2792 VanDerWaalsContact CG-CE 3.49Å; E2788-K2792 WeakPolarHBondContact O-CB 3.33Å; E2788-K2792 WeakPolarHBondContact O-CD 3.34Å; E2788-K2792 VanDerWaalsContact O-CG 3.26Å; E2788-K2792 WeakPolarHBondContact O-CG 3.33Å; E2788-K2792 PolarHBondContact O-N 3.21Å; E2788-K2792 VanDerWaalsContact O-N 3.13Å; E2788-K2792 VanDerWaalsContact OE1-CE 3.25Å; E2788-K2792 WeakPolarHBondContact OE1-CE 3.45Å; E2788-K2792 IonicContact OE1-NZ 2.95Å; E2788-K2792 PolarHBondContact OE1-NZ 3.2Å; E2788-K2792 IonicContact OE2-NZ 2.62Å
2789S90.9Very high88.8Confident36.8 Ų36.853.2 Ų53.226%0.25728%0.275SS..Hα-helixtrans-64.1-51.9177.7-166.30000112.1T2750 L2785 L2786 M2787 N2791 K2792 Q2793T2750-S2789 WeakPolarHBondContact CG2-OG 3.49Å; T2750-S2789 VanDerWaalsContact OG1-CB 3.22Å; T2750-S2789 WeakPolarHBondContact OG1-CB 3.26Å; T2750-S2789 PolarHBondContact OG1-OG 3.18Å; T2750-S2789 VanDerWaalsContact OG1-OG 3.12Å; L2785-S2789 WeakPolarHBondContact O-CB 3.37Å; L2785-S2789 PolarHBondContact O-N 3.13Å; L2785-S2789 VanDerWaalsContact O-N 3.17Å; L2786-S2789 WeakPolarHBondContact O-CB 3.26Å; L2786-S2789 PolarHBondContact O-N 2.96Å; L2786-S2789 VanDerWaalsContact O-N 3.14Å; M2787-S2789 VanDerWaalsContact C-N 3.29Å; M2787-S2789 PolarHBondContact O-N 3.27Å; S2789-N2791 VanDerWaalsContact C-N 3.32Å; S2789-N2791 PolarHBondContact O-N 3.23Å; S2789-K2792 PolarHBondContact O-N 3.12Å; S2789-Q2793 WeakPolarHBondContact O-CG 3.4Å; S2789-Q2793 PolarHBondContact O-N 3.05Å; S2789-Q2793 VanDerWaalsContact O-N 3.14Å
2790L90.9Very high88.5Confident0 Ų054.9 Ų54.90%029%0.285CS..Hα-helixtrans-66.7-33.1-178.6-65.4171.8000112.8L2786 M2787 Q2793 L2804 F2842 K2845L2786-L2790 HydrophobicContact CD1-CD1 3.89Å; L2786-L2790 HydrophobicContact CD1-CG 4.29Å; L2786-L2790 HydrophobicContact CD2-CD1 4.43Å; L2786-L2790 HydrophobicContact CG-CD1 3.79Å; L2786-L2790 HydrophobicContact CG-CG 4.43Å; L2786-L2790 WeakPolarHBondContact O-CB 3.42Å; L2786-L2790 VanDerWaalsContact O-CG 3.31Å; L2786-L2790 WeakPolarHBondContact O-CG 3.3Å; L2786-L2790 PolarHBondContact O-N 3.03Å; M2787-L2790 HydrophobicContact CE-CD1 3.96Å; L2790-Q2793 PolarHBondContact O-N 3.24Å; L2790-L2804 HydrophobicContact CD1-CD1 4.18Å; L2790-L2804 HydrophobicContact CD1-CD2 3.86Å; L2790-L2804 HydrophobicContact CD1-CG 4.5Å; L2790-L2804 HydrophobicContact CD2-CD2 3.92Å; L2790-F2842 HydrophobicContact CB-CD2 4.05Å; L2790-F2842 HydrophobicContact CB-CE2 4.29Å; L2790-F2842 HydrophobicContact CD1-CD2 4.13Å; L2790-F2842 HydrophobicContact CD1-CE2 3.84Å; L2790-F2842 HydrophobicContact CD1-CZ 4.32Å; L2790-K2845 PolarHBondContact O-NZ 3.25Å
2791N92.1Very high88.3Confident35.2 Ų35.254.6 Ų54.619%0.18828%0.284CS..Hα-helixtrans-74.5-30.1176.2-75.4-49.8000112.6M2787 E2788 S2789 P2838 L2841 F2842 K2845M2787-N2791 WeakPolarHBondContact O-CB 3.3Å; M2787-N2791 VanDerWaalsContact O-CG 3.3Å; M2787-N2791 PolarHBondContact O-N 3.04Å; M2787-N2791 PolarHBondContact O-ND2 3.16Å; E2788-N2791 PolarHBondContact O-N 3.33Å; S2789-N2791 VanDerWaalsContact C-N 3.32Å; S2789-N2791 PolarHBondContact O-N 3.23Å; N2791-P2838 PolarHBondContact ND2-O 3.18Å; N2791-L2841 HydrophobicContact CB-CD2 4.16Å; N2791-L2841 WeakPolarHBondContact OD1-CG 3.32Å; N2791-F2842 WeakPolarHBondContact OD1-CA 3.32Å; N2791-F2842 PolarHBondContact OD1-N 3.14Å; N2791-K2845 VanDerWaalsContact C-NZ 3.3Å; N2791-K2845 PolarHBondContact O-NZ 2.99Å
2792K90.8Very high88.1Confident147 Ų14753.1 Ų53.164%0.63928%0.281SS*.Hα-helixtrans-70.5-30.2173.1-75.6170.7-176.7172.70113.9E2788 S2789E2788-K2792 VanDerWaalsContact CD-NZ 3.31Å; E2788-K2792 HydrophobicContact CG-CD 4.22Å; E2788-K2792 VanDerWaalsContact CG-CE 3.49Å; E2788-K2792 WeakPolarHBondContact O-CB 3.33Å; E2788-K2792 WeakPolarHBondContact O-CD 3.34Å; E2788-K2792 VanDerWaalsContact O-CG 3.26Å; E2788-K2792 WeakPolarHBondContact O-CG 3.33Å; E2788-K2792 PolarHBondContact O-N 3.21Å; E2788-K2792 VanDerWaalsContact O-N 3.13Å; E2788-K2792 VanDerWaalsContact OE1-CE 3.25Å; E2788-K2792 WeakPolarHBondContact OE1-CE 3.45Å; E2788-K2792 IonicContact OE1-NZ 2.95Å; E2788-K2792 PolarHBondContact OE1-NZ 3.2Å; E2788-K2792 IonicContact OE2-NZ 2.62Å; S2789-K2792 PolarHBondContact O-N 3.12Å
2793Q85.6Confident88Confident65.6 Ų65.655.5 Ų55.531%0.30729%0.293SS..SBendtrans-66.1138.6178.4-69.5172.54.500111.7S2789 L2790 S2795 K2845S2789-Q2793 WeakPolarHBondContact O-CG 3.4Å; S2789-Q2793 PolarHBondContact O-N 3.05Å; S2789-Q2793 VanDerWaalsContact O-N 3.14Å; L2790-Q2793 PolarHBondContact O-N 3.24Å; Q2793-S2795 WeakPolarHBondContact CB-O 3.35Å; Q2793-K2845 PolarHBondContact O-NZ 3.05Å
2794K80.4Confident88Confident216.2 Ų216.255.5 Ų55.594%0.9429%0.293SS*.SBendtrans-73-33.9179.3-70.1-176.7178.91780113.2
2795S78.8Confident88Confident93.8 Ų93.853.9 Ų53.966%0.65628%0.282SS*.SBendtrans-129.6145.9178.149.20000109Q2793Q2793-S2795 WeakPolarHBondContact CB-O 3.35Å
2796I81.7Confident87.9Confident16.8 Ų16.855.2 Ų55.29%0.08629%0.287CS..  trans-86.8139.9171.8-64.4167.8000108L2798 L2801 F2842 K2845 V2849I2796-L2798 WeakPolarHBondContact O-CD1 3.31Å; I2796-L2798 PolarHBondContact O-N 3.13Å; I2796-L2798 VanDerWaalsContact O-N 3.16Å; I2796-L2801 HydrophobicContact CG2-CB 4.47Å; I2796-L2801 HydrophobicContact CG2-CD1 3.97Å; I2796-L2801 HydrophobicContact CG2-CD2 4.15Å; I2796-L2801 HydrophobicContact CG2-CG 4.45Å; I2796-F2842 HydrophobicContact CD1-CD2 4.37Å; I2796-F2842 HydrophobicContact CD1-CE2 3.9Å; I2796-K2845 HydrophobicContact CD1-CB 4.1Å; I2796-K2845 HydrophobicContact CD1-CD 4.11Å; I2796-K2845 HydrophobicContact CD1-CG 4.05Å; I2796-K2845 HydrophobicContact CG1-CD 4.41Å; I2796-V2849 HydrophobicContact CD1-CG2 4.03Å
2797S81Confident87.9Confident44 Ų4455.6 Ų55.631%0.30829%0.289SS..  trans-75.7104.6174.841.70000110.8D2799 T2800 L2801S2797-D2799 VanDerWaalsContact C-N 3.28Å; S2797-D2799 PolarHBondContact O-N 3.22Å; S2797-T2800 WeakPolarHBondContact CB-OG1 3.39Å; S2797-T2800 PolarHBondContact O-N 3.1Å; S2797-T2800 PolarHBondContact O-OG1 3.15Å; S2797-T2800 PolarHBondContact OG-OG1 2.92Å; S2797-L2801 PolarHBondContact O-N 3.2Å; S2797-L2801 VanDerWaalsContact O-N 3.1Å
2798L82.7Confident87.9Confident65.4 Ų65.455.6 Ų55.634%0.34229%0.289SS..THydrogen-bonded Turntrans-57.8-37.7-177.2-80.8105.4000112.7I2796 T2800 L2801 P2802 V2849 P2851I2796-L2798 WeakPolarHBondContact O-CD1 3.31Å; I2796-L2798 PolarHBondContact O-N 3.13Å; I2796-L2798 VanDerWaalsContact O-N 3.16Å; L2798-T2800 VanDerWaalsContact C-N 3.32Å; L2798-T2800 PolarHBondContact O-N 3.04Å; L2798-L2801 WeakPolarHBondContact O-CB 3.26Å; L2798-L2801 PolarHBondContact O-N 3.08Å; L2798-P2802 VanDerWaalsContact O-CD 3.28Å; L2798-P2802 WeakPolarHBondContact O-CD 3.39Å; L2798-V2849 HydrophobicContact CD1-CG1 3.93Å; L2798-V2849 HydrophobicContact CD2-CG1 4.14Å; L2798-V2849 HydrophobicContact CG-CG1 4.18Å; L2798-P2851 HydrophobicContact CD1-CG 4.34Å; L2798-P2851 HydrophobicContact CD2-CG 3.82Å
2799D82.1Confident88Confident141.6 Ų141.651 Ų5176%0.75727%0.268SS*.THydrogen-bonded Turntrans-65.8-34-175.6-45.9-53.6000113.1S2161 S2797S2161-D2799 WeakPolarHBondContact CB-OD2 3.43Å; S2161-D2799 PolarHBondContact OG-OD2 3.1Å; S2797-D2799 VanDerWaalsContact C-N 3.28Å; S2797-D2799 PolarHBondContact O-N 3.22Å
2800T86.1Confident88Confident36.8 Ų36.850.7 Ų50.723%0.22626%0.264CS..THydrogen-bonded Turntrans-91.5-13.4177.756.50000113.3Q2754 S2797 L2798 P2802 I2803 L2804Q2754-T2800 HydrophobicContact CB-CG2 4.39Å; S2797-T2800 WeakPolarHBondContact CB-OG1 3.39Å; S2797-T2800 PolarHBondContact O-N 3.1Å; S2797-T2800 PolarHBondContact O-OG1 3.15Å; S2797-T2800 PolarHBondContact OG-OG1 2.92Å; L2798-T2800 VanDerWaalsContact C-N 3.32Å; L2798-T2800 PolarHBondContact O-N 3.04Å; T2800-P2802 VanDerWaalsContact C-CD 3.47Å; T2800-P2802 VanDerWaalsContact C-N 3.34Å; T2800-I2803 PolarHBondContact O-N 3.13Å; T2800-L2804 VanDerWaalsContact O-CB 3.31Å; T2800-L2804 WeakPolarHBondContact O-CB 3.31Å; T2800-L2804 PolarHBondContact O-N 3.34Å
2801L88.4Confident88.2Confident0 Ų050.8 Ų50.80%026%0.264CS..Hα-helixtrans-59.8-35.7-174.6-175.657.3000114I2796 S2797 L2798 I2803 L2804 L2805 F2842 L2846 V2849 P2853I2796-L2801 HydrophobicContact CG2-CB 4.47Å; I2796-L2801 HydrophobicContact CG2-CD1 3.97Å; I2796-L2801 HydrophobicContact CG2-CD2 4.15Å; I2796-L2801 HydrophobicContact CG2-CG 4.45Å; S2797-L2801 PolarHBondContact O-N 3.2Å; S2797-L2801 VanDerWaalsContact O-N 3.1Å; L2798-L2801 WeakPolarHBondContact O-CB 3.26Å; L2798-L2801 PolarHBondContact O-N 3.08Å; L2801-I2803 PolarHBondContact O-N 3.15Å; L2801-L2804 HydrophobicContact CD1-CD2 4.17Å; L2801-L2804 PolarHBondContact O-N 3.15Å; L2801-L2805 HydrophobicContact CD1-CD1 4Å; L2801-L2805 HydrophobicContact CD1-CD2 4.31Å; L2801-L2805 HydrophobicContact CD1-CG 3.87Å; L2801-L2805 HydrophobicContact CG-CD1 4.13Å; L2801-L2805 HydrophobicContact CG-CG 4.42Å; L2801-L2805 WeakPolarHBondContact O-CG 3.31Å; L2801-L2805 PolarHBondContact O-N 3.21Å; L2801-L2805 VanDerWaalsContact O-N 3.07Å; L2801-F2842 HydrophobicContact CD1-CZ 4.48Å; L2801-L2846 HydrophobicContact CD1-CD1 4.21Å; L2801-L2846 HydrophobicContact CD2-CD1 3.87Å; L2801-L2846 HydrophobicContact CG-CD1 4.49Å; L2801-V2849 HydrophobicContact CD2-CG1 4.43Å; L2801-P2853 HydrophobicContact CD2-CB 4.29Å; L2801-P2853 HydrophobicContact CD2-CG 3.92Å
2802P88.8Confident88.1Confident48.75 Ų48.7549.3 Ų49.332%0.31726%0.256SS..Hα-helixtrans-61.2-49.3176-2635.4000113.3L2798 T2800 L2804 L2805 E2806 N2855L2798-P2802 VanDerWaalsContact O-CD 3.28Å; L2798-P2802 WeakPolarHBondContact O-CD 3.39Å; T2800-P2802 VanDerWaalsContact C-CD 3.47Å; T2800-P2802 VanDerWaalsContact C-N 3.34Å; P2802-L2804 VanDerWaalsContact C-N 3.33Å; P2802-L2804 PolarHBondContact O-N 3.25Å; P2802-L2805 PolarHBondContact O-N 3.13Å; P2802-E2806 PolarHBondContact O-N 3.02Å; P2802-N2855 VanDerWaalsContact CA-CG 3.5Å; P2802-N2855 WeakPolarHBondContact CA-ND2 3.23Å; P2802-N2855 VanDerWaalsContact CA-OD1 3.3Å; P2802-N2855 WeakPolarHBondContact CA-OD1 3.33Å; P2802-N2855 HydrophobicContact CB-CB 4.21Å; P2802-N2855 WeakPolarHBondContact CB-OD1 3.31Å; P2802-N2855 PolarHBondContact O-ND2 2.77Å
2803I90.9Very high88.1Confident51 Ų5146.3 Ų46.326%0.26224%0.244SC..Hα-helixtrans-65.1-41.5179-63.8167.2000110.3T2755 H2756 T2800 L2801 L2805 E2806 N2807T2755-I2803 VanDerWaalsContact C-CG2 3.48Å; T2755-I2803 WeakPolarHBondContact O-CG2 3.37Å; H2756-I2803 HydrophobicContact CB-CD1 4.23Å; T2800-I2803 PolarHBondContact O-N 3.13Å; L2801-I2803 PolarHBondContact O-N 3.15Å; I2803-L2805 PolarHBondContact O-N 3.03Å; I2803-E2806 PolarHBondContact O-N 3.11Å; I2803-N2807 WeakPolarHBondContact CG2-ND2 3.38Å; I2803-N2807 VanDerWaalsContact O-CB 3.31Å; I2803-N2807 WeakPolarHBondContact O-CB 3.32Å; I2803-N2807 PolarHBondContact O-N 3.09Å; I2803-N2807 PolarHBondContact O-ND2 3.18Å
2804L92.6Very high88.2Confident0.25 Ų0.2546.3 Ų46.30%0.00124%0.244CC..Hα-helixtrans-59.7-46.1178.6172.960.3000113.1F2753 Q2754 L2786 L2790 T2800 L2801 P2802 L2808 F2842F2753-L2804 HydrophobicContact CB-CD1 3.91Å; F2753-L2804 WeakPolarHBondContact O-CA 3.39Å; Q2754-L2804 HydrophobicContact CG-CD1 4.48Å; L2786-L2804 HydrophobicContact CD1-CD1 3.97Å; L2786-L2804 HydrophobicContact CD2-CD1 4.14Å; L2790-L2804 HydrophobicContact CD1-CD1 4.18Å; L2790-L2804 HydrophobicContact CD1-CD2 3.86Å; L2790-L2804 HydrophobicContact CD1-CG 4.5Å; L2790-L2804 HydrophobicContact CD2-CD2 3.92Å; T2800-L2804 VanDerWaalsContact O-CB 3.31Å; T2800-L2804 WeakPolarHBondContact O-CB 3.31Å; T2800-L2804 PolarHBondContact O-N 3.34Å; L2801-L2804 HydrophobicContact CD1-CD2 4.17Å; L2801-L2804 PolarHBondContact O-N 3.15Å; P2802-L2804 VanDerWaalsContact C-N 3.33Å; P2802-L2804 PolarHBondContact O-N 3.25Å; L2804-L2808 WeakPolarHBondContact O-CB 3.44Å; L2804-L2808 PolarHBondContact O-N 3.01Å; L2804-F2842 HydrophobicContact CD2-CZ 4.48Å
2805L92.3Very high88.6Confident0 Ų036.5 Ų36.50%020%0.202CC..Hα-helixtrans-69.1-37.2179.4-68.2173.6000111.7L2801 P2802 I2803 L2808 A2809 F2842 L2846 T2858 I2862L2801-L2805 HydrophobicContact CD1-CD1 4Å; L2801-L2805 HydrophobicContact CD1-CD2 4.31Å; L2801-L2805 HydrophobicContact CD1-CG 3.87Å; L2801-L2805 HydrophobicContact CG-CD1 4.13Å; L2801-L2805 HydrophobicContact CG-CG 4.42Å; L2801-L2805 WeakPolarHBondContact O-CG 3.31Å; L2801-L2805 PolarHBondContact O-N 3.21Å; L2801-L2805 VanDerWaalsContact O-N 3.07Å; P2802-L2805 PolarHBondContact O-N 3.13Å; I2803-L2805 PolarHBondContact O-N 3.03Å; L2805-L2808 PolarHBondContact O-N 2.89Å; L2805-A2809 WeakPolarHBondContact O-CB 3.33Å; L2805-A2809 PolarHBondContact O-N 3.15Å; L2805-F2842 HydrophobicContact CD2-CE1 4.11Å; L2805-F2842 HydrophobicContact CD2-CZ 4.29Å; L2805-L2846 HydrophobicContact CD1-CD1 4.48Å; L2805-L2846 HydrophobicContact CD1-CD2 4.36Å; L2805-L2846 HydrophobicContact CD2-CD2 4.01Å; L2805-T2858 HydrophobicContact CB-CG2 4.19Å; L2805-T2858 WeakPolarHBondContact O-CG2 3.38Å; L2805-I2862 HydrophobicContact CB-CD1 4.46Å; L2805-I2862 HydrophobicContact CD2-CD1 3.89Å
2806E91.8Very high88.8Confident63.75 Ų63.7533.8 Ų33.830%0.29818%0.182SC..Hα-helixtrans-69.8-48.2179.6-162.957-14300111.8P2802 I2803 L2808 A2809 N2810 T2858 R2861P2802-E2806 PolarHBondContact O-N 3.02Å; I2803-E2806 PolarHBondContact O-N 3.11Å; E2806-L2808 VanDerWaalsContact C-N 3.3Å; E2806-L2808 PolarHBondContact O-N 3.08Å; E2806-A2809 PolarHBondContact O-N 3.13Å; E2806-N2810 WeakPolarHBondContact O-CB 3.36Å; E2806-N2810 VanDerWaalsContact O-CG 3.22Å; E2806-N2810 PolarHBondContact O-N 3.24Å; E2806-N2810 PolarHBondContact O-OD1 3.02Å; E2806-T2858 WeakPolarHBondContact OE2-CG2 3.43Å; E2806-T2858 PolarHBondContact OE2-OG1 3.07Å; E2806-R2861 IonicContact OE1-CZ 3.44Å; E2806-R2861 IonicContact OE1-NH1 3.62Å; E2806-R2861 PolarHBondContact OE1-NH1 2.92Å; E2806-R2861 IonicContact OE2-NH1 2.83Å
2807N93.2Very high88.6Confident8.75 Ų8.7537.7 Ų37.75%0.04720%0.203CC..Hα-helixtrans-60.4-38.7173.8-76.6-22.6000112.3F2753 T2755 F2763 I2803 N2810 Y2811F2753-N2807 HydrophobicContact CD1-CB 3.85Å; F2753-N2807 PolarHBondContact O-ND2 3.14Å; T2755-N2807 PolarHBondContact O-ND2 3.22Å; F2763-N2807 HydrophobicContact CE2-CB 3.72Å; F2763-N2807 WeakPolarHBondContact CE2-OD1 3.4Å; F2763-N2807 HydrophobicContact CZ-CB 3.73Å; I2803-N2807 WeakPolarHBondContact CG2-ND2 3.38Å; I2803-N2807 VanDerWaalsContact O-CB 3.31Å; I2803-N2807 WeakPolarHBondContact O-CB 3.32Å; I2803-N2807 PolarHBondContact O-N 3.09Å; I2803-N2807 PolarHBondContact O-ND2 3.18Å; N2807-N2810 PolarHBondContact O-N 3.07Å; N2807-Y2811 PolarHBondContact O-N 3.27Å
2808L93.8Very high88.4Confident0 Ų040.3 Ų40.30%021%0.213CC..Hα-helixtrans-67.7-39.9176.7-179.757.3000112I2783 L2786 M2787 L2804 L2805 E2806 Y2811 L2812 L2839 F2842 I2862I2783-L2808 HydrophobicContact CG2-CD1 4.43Å; L2786-L2808 HydrophobicContact CD2-CD1 4.17Å; M2787-L2808 HydrophobicContact CE-CD2 3.81Å; L2804-L2808 WeakPolarHBondContact O-CB 3.44Å; L2804-L2808 PolarHBondContact O-N 3.01Å; L2805-L2808 PolarHBondContact O-N 2.89Å; E2806-L2808 VanDerWaalsContact C-N 3.3Å; E2806-L2808 PolarHBondContact O-N 3.08Å; L2808-Y2811 PolarHBondContact O-N 3.31Å; L2808-L2812 HydrophobicContact CD1-CD1 4.07Å; L2808-L2812 HydrophobicContact CD1-CG 4.21Å; L2808-L2812 HydrophobicContact CG-CD1 4.06Å; L2808-L2812 WeakPolarHBondContact O-CB 3.4Å; L2808-L2812 WeakPolarHBondContact O-CD1 3.45Å; L2808-L2812 VanDerWaalsContact O-CG 3.26Å; L2808-L2812 WeakPolarHBondContact O-CG 3.31Å; L2808-L2812 PolarHBondContact O-N 3.38Å; L2808-L2812 VanDerWaalsContact O-N 3.08Å; L2808-L2839 HydrophobicContact CD2-CD1 4.36Å; L2808-F2842 HydrophobicContact CD2-CE1 4.49Å; L2808-I2862 HydrophobicContact CB-CD1 4.38Å; L2808-I2862 HydrophobicContact CD2-CD1 4.09Å; L2808-I2862 HydrophobicContact CG-CD1 4.17Å
2809A92.7Very high88Confident0 Ų040.1 Ų40.10%022%0.215CC..Hα-helixtrans-61.6-47.7172.500000111.2L2805 E2806 Y2811 L2812 E2813 T2858 R2861 I2862L2805-A2809 WeakPolarHBondContact O-CB 3.33Å; L2805-A2809 PolarHBondContact O-N 3.15Å; E2806-A2809 PolarHBondContact O-N 3.13Å; A2809-Y2811 VanDerWaalsContact C-N 3.29Å; A2809-Y2811 PolarHBondContact O-N 3.03Å; A2809-L2812 PolarHBondContact O-N 3.16Å; A2809-E2813 WeakPolarHBondContact O-CB 3.32Å; A2809-E2813 PolarHBondContact O-N 3.07Å; A2809-T2858 HydrophobicContact CB-CG2 3.85Å; A2809-R2861 HydrophobicContact CB-CB 4.23Å; A2809-I2862 HydrophobicContact CB-CG1 4Å
2810N91.8Very high87.3Confident30 Ų3039.6 Ų39.616%0.1621%0.212CC..Hα-helixtrans-64.8-28.8-178.9-66.6-9.1000113.3F2763 E2806 N2807 H2814 R2861F2763-N2810 HydrophobicContact CD2-CB 3.96Å; F2763-N2810 HydrophobicContact CE2-CB 4.45Å; E2806-N2810 WeakPolarHBondContact O-CB 3.36Å; E2806-N2810 VanDerWaalsContact O-CG 3.22Å; E2806-N2810 PolarHBondContact O-N 3.24Å; E2806-N2810 PolarHBondContact O-OD1 3.02Å; N2807-N2810 PolarHBondContact O-N 3.07Å; N2810-H2814 PolarHBondContact O-ND1 3.13Å; N2810-R2861 PolarHBondContact OD1-NH2 3.36Å
2811Y93.7Very high87Confident1.5 Ų1.541.5 Ų41.51%0.00622%0.221CC..Hα-helixtrans-75.8-45.3171.7-168.7-84000112.1F2753 F2763 I2766 I2767 I2779 P2782 I2783 N2807 L2808 A2809 E2813 H2814 L2815F2753-Y2811 HydrophobicContact CE1-CD2 4.34Å; F2753-Y2811 HydrophobicContact CE1-CG 4.1Å; F2753-Y2811 HydrophobicContact CZ-CD1 4.33Å; F2753-Y2811 AromaticContact CZ-CD2 3.81Å; F2753-Y2811 HydrophobicContact CZ-CD2 3.81Å; F2753-Y2811 HydrophobicContact CZ-CE2 4.43Å; F2753-Y2811 AromaticContact CZ-CG 3.75Å; F2753-Y2811 HydrophobicContact CZ-CG 3.75Å; F2763-Y2811 HydrophobicContact CB-CD2 4.06Å; F2763-Y2811 AromaticContact CD1-CD2 3.62Å; F2763-Y2811 HydrophobicContact CD1-CD2 3.62Å; F2763-Y2811 HydrophobicContact CD1-CE2 4.45Å; F2763-Y2811 HydrophobicContact CD1-CG 4.49Å; F2763-Y2811 HydrophobicContact CE1-CD2 4.33Å; F2763-Y2811 HydrophobicContact CG-CD2 4.07Å; I2766-Y2811 HydrophobicContact CG2-CE2 4.1Å; I2767-Y2811 HydrophobicContact CD1-CD1 4.11Å; I2767-Y2811 HydrophobicContact CD1-CD2 4.07Å; I2767-Y2811 HydrophobicContact CD1-CE1 4.02Å; I2767-Y2811 HydrophobicContact CD1-CE2 3.98Å; I2767-Y2811 HydrophobicContact CD1-CG 4.14Å; I2767-Y2811 VanDerWaalsContact CD1-O 3.28Å; I2767-Y2811 WeakPolarHBondContact CD1-O 3.31Å; I2767-Y2811 HydrophobicContact CG1-CD2 4.24Å; I2767-Y2811 HydrophobicContact CG1-CE1 4.11Å; I2767-Y2811 HydrophobicContact CG1-CE2 3.66Å; I2779-Y2811 PolarHBondContact O-OH 3.01Å; P2782-Y2811 HydrophobicContact CB-CE2 4.49Å; P2782-Y2811 WeakPolarHBondContact CG-OH 3.29Å; I2783-Y2811 HydrophobicContact CD1-CD1 3.72Å; I2783-Y2811 HydrophobicContact CD1-CE1 3.69Å; I2783-Y2811 HydrophobicContact CG1-CD1 3.81Å; I2783-Y2811 HydrophobicContact CG1-CE1 3.76Å; N2807-Y2811 PolarHBondContact O-N 3.27Å; L2808-Y2811 PolarHBondContact O-N 3.31Å; A2809-Y2811 VanDerWaalsContact C-N 3.29Å; A2809-Y2811 PolarHBondContact O-N 3.03Å; Y2811-E2813 VanDerWaalsContact C-N 3.27Å; Y2811-E2813 PolarHBondContact O-N 3.45Å; Y2811-H2814 PolarHBondContact O-N 3.07Å; Y2811-L2815 HydrophobicContact CE1-CD2 4.02Å
2812L92Very high86.7Confident4.75 Ų4.7546.1 Ų46.13%0.02525%0.253CS..Hα-helixtrans-63.3-32.7179.1-71169000112.7I2783 L2808 A2809 H2814 L2815 W2832 I2862 Y2865I2783-L2812 HydrophobicContact CD1-CD2 3.78Å; L2808-L2812 HydrophobicContact CD1-CD1 4.07Å; L2808-L2812 HydrophobicContact CD1-CG 4.21Å; L2808-L2812 HydrophobicContact CG-CD1 4.06Å; L2808-L2812 WeakPolarHBondContact O-CB 3.4Å; L2808-L2812 WeakPolarHBondContact O-CD1 3.45Å; L2808-L2812 VanDerWaalsContact O-CG 3.26Å; L2808-L2812 WeakPolarHBondContact O-CG 3.31Å; L2808-L2812 PolarHBondContact O-N 3.38Å; L2808-L2812 VanDerWaalsContact O-N 3.08Å; A2809-L2812 PolarHBondContact O-N 3.16Å; L2812-H2814 VanDerWaalsContact C-N 3.29Å; L2812-H2814 PolarHBondContact O-N 3.23Å; L2812-L2815 HydrophobicContact CD2-CD1 3.9Å; L2812-L2815 PolarHBondContact O-N 3.39Å; L2812-W2832 HydrophobicContact CD2-CH2 3.89Å; L2812-W2832 HydrophobicContact CD2-CZ3 4.18Å; L2812-I2862 HydrophobicContact CD1-CB 4.36Å; L2812-I2862 HydrophobicContact CD1-CG1 4.33Å; L2812-I2862 HydrophobicContact CD1-CG2 3.81Å; L2812-Y2865 HydrophobicContact CB-CD2 3.9Å; L2812-Y2865 HydrophobicContact CB-CG 4.23Å
2813E90.1Very high86.4Confident83.25 Ų83.2550.1 Ų50.139%0.38927%0.265SS..Hα-helixtrans-63.1-31.5177-174.5156.616500113.6A2809 Y2811 R2861 Y2865A2809-E2813 WeakPolarHBondContact O-CB 3.32Å; A2809-E2813 PolarHBondContact O-N 3.07Å; Y2811-E2813 VanDerWaalsContact C-N 3.27Å; Y2811-E2813 PolarHBondContact O-N 3.45Å; E2813-R2861 IonicContact OE1-NH2 3.22Å; E2813-R2861 IonicContact OE2-CZ 2.91Å; E2813-R2861 IonicContact OE2-NE 3.58Å; E2813-R2861 PolarHBondContact OE2-NE 3.25Å; E2813-R2861 IonicContact OE2-NH2 3.58Å; E2813-R2861 PolarHBondContact OE2-NH2 3.06Å; E2813-Y2865 HydrophobicContact CB-CD2 4.34Å; E2813-Y2865 HydrophobicContact CB-CE1 4.2Å; E2813-Y2865 HydrophobicContact CB-CE2 3.64Å; E2813-Y2865 HydrophobicContact CG-CE1 4.14Å; E2813-Y2865 HydrophobicContact CG-CE2 4.18Å; E2813-Y2865 VanDerWaalsContact CG-OH 3.29Å; E2813-Y2865 WeakPolarHBondContact CG-OH 3.32Å; E2813-Y2865 PolarHBondContact OE1-OH 3.04Å; E2813-Y2865 WeakPolarHBondContact OE2-CE2 3.33Å; E2813-Y2865 VanDerWaalsContact OE2-CZ 3.29Å; E2813-Y2865 PolarHBondContact OE2-OH 3.31Å
2814H87.4Confident86Confident65 Ų6550.1 Ų50.130%0.30127%0.266SS..THydrogen-bonded Turntrans-97.43.7-175.2-73.8105.6000114.2R2764 I2767 N2810 Y2811 L2812R2764-H2814 HydrophobicContact CB-CB 4.46Å; R2764-H2814 VanDerWaalsContact CB-CD2 3.49Å; R2764-H2814 WeakPolarHBondContact CB-CD2 3.26Å; I2767-H2814 HydrophobicContact CD1-CB 3.69Å; N2810-H2814 PolarHBondContact O-ND1 3.13Å; Y2811-H2814 PolarHBondContact O-N 3.07Å; L2812-H2814 VanDerWaalsContact C-N 3.29Å; L2812-H2814 PolarHBondContact O-N 3.23Å
2815L89.5Confident85.6Confident11.5 Ų11.551.8 Ų51.86%0.0628%0.275CS..SBendtrans-67.2145.7176.2-75173000111.5I2767 I2779 F2780 I2783 Y2811 L2812 N2817 W2832I2767-L2815 HydrophobicContact CD1-CD2 4.12Å; I2767-L2815 HydrophobicContact CD1-CG 4.37Å; I2767-L2815 HydrophobicContact CG1-CD2 4.47Å; I2779-L2815 HydrophobicContact CD1-CD2 4.18Å; I2779-L2815 HydrophobicContact CG1-CD2 4.42Å; F2780-L2815 HydrophobicContact CD1-CD2 4.45Å; F2780-L2815 HydrophobicContact CE1-CD1 4.2Å; F2780-L2815 HydrophobicContact CE1-CD2 4.26Å; I2783-L2815 HydrophobicContact CD1-CD1 4.14Å; Y2811-L2815 HydrophobicContact CE1-CD2 4.02Å; L2812-L2815 HydrophobicContact CD2-CD1 3.9Å; L2812-L2815 PolarHBondContact O-N 3.39Å; L2815-N2817 PolarHBondContact O-N 3.06Å; L2815-W2832 HydrophobicContact CB-CZ2 4.43Å; L2815-W2832 HydrophobicContact CD1-CH2 3.88Å; L2815-W2832 HydrophobicContact CD1-CZ2 3.61Å
2816P82.2Confident85.2Confident36.5 Ų36.558.6 Ų58.624%0.23731%0.306CS..PPolyproline II helixtrans-59.2132.3177.2-12.819.8000112.1I2767 V2771 I2779 I2828I2767-P2816 HydrophobicContact CG2-CG 4.48Å; V2771-P2816 HydrophobicContact CG2-CG 4.2Å; I2779-P2816 HydrophobicContact CD1-CG 3.84Å; P2816-I2828 HydrophobicContact CB-CD1 3.94Å; P2816-I2828 HydrophobicContact CG-CD1 3.98Å; P2816-I2828 HydrophobicContact CG-CG1 4.26Å
2817N77.8Confident85Confident99.75 Ų99.7557.6 Ų57.653%0.53330%0.301SS..PPolyproline II helixtrans-72.3169.2165.8-70.5-73.7000109.9L2815 I2828 R2868L2815-N2817 PolarHBondContact O-N 3.06Å; N2817-I2828 WeakPolarHBondContact O-CD1 3.33Å; N2817-R2868 PolarHBondContact OD1-NE 3.26Å; N2817-R2868 PolarHBondContact OD1-NH2 2.96Å
2818L75.9Confident84.7Confident97.75 Ų97.7557.3 Ų57.351%0.51230%0.299SS..PPolyproline II helixtrans-57.5142.9167.2-64.9154.5000110.3N2825 I2828 P2870L2818-N2825 VanDerWaalsContact CA-OD1 3.29Å; L2818-N2825 WeakPolarHBondContact CA-OD1 3.43Å; L2818-N2825 WeakPolarHBondContact CB-OD1 3.48Å; L2818-N2825 HydrophobicContact CD2-CB 3.99Å; L2818-N2825 WeakPolarHBondContact CD2-OD1 3.35Å; L2818-I2828 HydrophobicContact CD2-CG2 4.45Å; L2818-P2870 HydrophobicContact CD1-CB 4.27Å; L2818-P2870 HydrophobicContact CD1-CG 4.2Å; L2818-P2870 HydrophobicContact CD2-CB 4.42Å; L2818-P2870 HydrophobicContact CD2-CG 4.3Å
2819T76Confident84.4Confident61.75 Ų61.7558.8 Ų58.838%0.37931%0.312SS..  trans-120-170.6179660000109.5D2821 L2824 N2825T2819-D2821 VanDerWaalsContact C-N 3.32Å; T2819-D2821 PolarHBondContact OG1-N 3.12Å; T2819-D2821 VanDerWaalsContact OG1-N 3.15Å; T2819-L2824 HydrophobicContact CG2-CD2 3.98Å; T2819-N2825 PolarHBondContact N-OD1 3.17Å; T2819-N2825 PolarHBondContact O-ND2 3.43Å; T2819-N2825 PolarHBondContact O-OD1 3.25Å
2820D66.1Low84.2Confident131.5 Ų131.560.9 Ų60.970%0.70333%0.326SS*.SBendtrans-80.7-13.7170.9-62.8-55.4000113.2Q2439 S2822 Y3658Q2439-D2820 PolarHBondContact NE2-OD1 3.39Å; Q2439-D2820 PolarHBondContact NE2-OD2 2.91Å; D2820-S2822 PolarHBondContact O-N 2.99Å; D2820-Y3658 PolarHBondContact OD1-OH 3.41Å
2821D79.4Confident84.1Confident76.5 Ų76.559.8 Ų59.841%0.40932%0.322SS..  trans-78.6112.7177.8178.616.5000112.1T2819 K2823 L2824 N2825T2819-D2821 VanDerWaalsContact C-N 3.32Å; T2819-D2821 PolarHBondContact OG1-N 3.12Å; T2819-D2821 VanDerWaalsContact OG1-N 3.15Å; D2821-K2823 VanDerWaalsContact C-N 3.29Å; D2821-K2823 PolarHBondContact O-N 3.35Å; D2821-K2823 WeakPolarHBondContact OD1-CB 3.13Å; D2821-K2823 PolarHBondContact OD1-N 3.28Å; D2821-L2824 HydrophobicContact CB-CB 4.07Å; D2821-L2824 PolarHBondContact O-N 3.08Å; D2821-L2824 WeakPolarHBondContact OD2-CB 3.47Å; D2821-L2824 PolarHBondContact OD2-N 3.05Å; D2821-L2824 VanDerWaalsContact OD2-N 3.15Å; D2821-N2825 VanDerWaalsContact O-CB 3.31Å; D2821-N2825 WeakPolarHBondContact O-CB 3.4Å; D2821-N2825 PolarHBondContact O-N 3.04Å; D2821-N2825 PolarHBondContact O-ND2 3.16Å
2822S82.5Confident84Confident95.5 Ų95.560.4 Ų60.467%0.66832%0.324SS*.Hα-helixtrans-53.4-34.9172.764.80000115.2D2820 H2826D2820-S2822 PolarHBondContact O-N 2.99Å; S2822-H2826 WeakPolarHBondContact O-CB 3.23Å; S2822-H2826 PolarHBondContact O-N 3.27Å; S2822-H2826 VanDerWaalsContact O-N 3.08Å
2823K82.5Confident84Confident134 Ų13462.8 Ų62.858%0.58334%0.339SS*.Hα-helixtrans-71.2-52.8178.9-155-154.1170.7-162.30110E2774 D2821 N2825 H2826 F2827E2774-K2823 IonicContact OE1-NZ 3.34Å; E2774-K2823 PolarHBondContact OE1-NZ 3.15Å; E2774-K2823 IonicContact OE2-NZ 3.28Å; D2821-K2823 VanDerWaalsContact C-N 3.29Å; D2821-K2823 PolarHBondContact O-N 3.35Å; D2821-K2823 WeakPolarHBondContact OD1-CB 3.13Å; D2821-K2823 PolarHBondContact OD1-N 3.28Å; K2823-N2825 VanDerWaalsContact C-N 3.29Å; K2823-N2825 PolarHBondContact O-N 3.19Å; K2823-H2826 WeakPolarHBondContact O-CB 3.28Å; K2823-H2826 PolarHBondContact O-N 3.18Å; K2823-H2826 VanDerWaalsContact O-N 3.15Å; K2823-F2827 PolarHBondContact O-N 3.09Å
2824L81.8Confident84Confident51 Ų5164.1 Ų64.127%0.26735%0.349SS..Hα-helixtrans-59.3-40.5177-17756.2000111.6T2819 D2821 H2826 F2827 I2828T2819-L2824 HydrophobicContact CG2-CD2 3.98Å; D2821-L2824 HydrophobicContact CB-CB 4.07Å; D2821-L2824 PolarHBondContact O-N 3.08Å; D2821-L2824 WeakPolarHBondContact OD2-CB 3.47Å; D2821-L2824 PolarHBondContact OD2-N 3.05Å; D2821-L2824 VanDerWaalsContact OD2-N 3.15Å; L2824-H2826 PolarHBondContact O-N 2.96Å; L2824-F2827 HydrophobicContact CD1-CD1 4.18Å; L2824-F2827 WeakPolarHBondContact O-CB 3.19Å; L2824-F2827 PolarHBondContact O-N 3.27Å; L2824-I2828 HydrophobicContact CD1-CD1 4.04Å; L2824-I2828 HydrophobicContact CD1-CG1 4.24Å; L2824-I2828 HydrophobicContact CG-CD1 3.85Å; L2824-I2828 HydrophobicContact CG-CG1 4.48Å; L2824-I2828 WeakPolarHBondContact O-CB 3.39Å; L2824-I2828 VanDerWaalsContact O-CG1 3.25Å; L2824-I2828 WeakPolarHBondContact O-CG1 3.27Å; L2824-I2828 PolarHBondContact O-N 3.01Å
2825N84.9Confident84.3Confident36 Ų3661.1 Ų61.119%0.19334%0.335CS..Hα-helixtrans-61.9-41174.4-74.3-18.3000113.1L2818 T2819 D2821 K2823 A2829L2818-N2825 VanDerWaalsContact CA-OD1 3.29Å; L2818-N2825 WeakPolarHBondContact CA-OD1 3.43Å; L2818-N2825 WeakPolarHBondContact CB-OD1 3.48Å; L2818-N2825 HydrophobicContact CD2-CB 3.99Å; L2818-N2825 WeakPolarHBondContact CD2-OD1 3.35Å; T2819-N2825 PolarHBondContact N-OD1 3.17Å; T2819-N2825 PolarHBondContact O-ND2 3.43Å; T2819-N2825 PolarHBondContact O-OD1 3.25Å; D2821-N2825 VanDerWaalsContact O-CB 3.31Å; D2821-N2825 WeakPolarHBondContact O-CB 3.4Å; D2821-N2825 PolarHBondContact O-N 3.04Å; D2821-N2825 PolarHBondContact O-ND2 3.16Å; K2823-N2825 VanDerWaalsContact C-N 3.29Å; K2823-N2825 PolarHBondContact O-N 3.19Å; N2825-A2829 VanDerWaalsContact O-CB 3.27Å; N2825-A2829 WeakPolarHBondContact O-CB 3.43Å; N2825-A2829 PolarHBondContact O-N 2.97Å
2826H85.2Confident84.4Confident141.5 Ų141.560.6 Ų60.666%0.65533%0.332SS*.Hα-helixtrans-65.3-44.6175.1-174.6-71.4000111.3S2822 K2823 L2824 A2829 S2830S2822-H2826 WeakPolarHBondContact O-CB 3.23Å; S2822-H2826 PolarHBondContact O-N 3.27Å; S2822-H2826 VanDerWaalsContact O-N 3.08Å; K2823-H2826 WeakPolarHBondContact O-CB 3.28Å; K2823-H2826 PolarHBondContact O-N 3.18Å; K2823-H2826 VanDerWaalsContact O-N 3.15Å; L2824-H2826 PolarHBondContact O-N 2.96Å; H2826-A2829 PolarHBondContact O-N 2.99Å; H2826-S2830 WeakPolarHBondContact O-CB 3.22Å; H2826-S2830 PolarHBondContact O-N 3.21Å; H2826-S2830 PolarHBondContact O-OG 2.96Å
2827F85.9Confident84.9Confident43.5 Ų43.560.2 Ų60.219%0.19134%0.335CS..Hα-helixtrans-57.3-51175.1169.5-97.4000111.7E2774 S2778 I2779 F2780 K2823 L2824 A2829 S2830 G2831E2774-F2827 HydrophobicContact CB-CE2 4.1Å; E2774-F2827 HydrophobicContact CB-CZ 4.16Å; E2774-F2827 WeakPolarHBondContact OE2-CE2 3.38Å; S2778-F2827 VanDerWaalsContact OG-CZ 3.25Å; S2778-F2827 WeakPolarHBondContact OG-CZ 3.32Å; I2779-F2827 HydrophobicContact CD1-CE1 4.02Å; I2779-F2827 HydrophobicContact CG1-CE1 4.03Å; I2779-F2827 HydrophobicContact CG1-CZ 4.31Å; F2780-F2827 HydrophobicContact CD2-CE1 4.36Å; F2780-F2827 HydrophobicContact CD2-CZ 4.4Å; F2780-F2827 HydrophobicContact CE2-CD1 4.31Å; F2780-F2827 AromaticContact CE2-CE1 3.97Å; F2780-F2827 HydrophobicContact CE2-CE1 3.98Å; F2780-F2827 HydrophobicContact CE2-CZ 4.46Å; K2823-F2827 PolarHBondContact O-N 3.09Å; L2824-F2827 HydrophobicContact CD1-CD1 4.18Å; L2824-F2827 WeakPolarHBondContact O-CB 3.19Å; L2824-F2827 PolarHBondContact O-N 3.27Å; F2827-A2829 VanDerWaalsContact C-N 3.35Å; F2827-A2829 PolarHBondContact O-N 3.09Å; F2827-S2830 WeakPolarHBondContact CA-OG 3.29Å; F2827-S2830 PolarHBondContact O-N 3.07Å; F2827-S2830 VanDerWaalsContact O-N 3.17Å; F2827-S2830 PolarHBondContact O-OG 3.32Å; F2827-G2831 PolarHBondContact O-N 3.31Å
2828I87.2Confident85.7Confident1.25 Ų1.2557.7 Ų57.71%0.00632%0.324CS..Hα-helixtrans-57-49.1176.4-70.9168.1000110.5P2816 N2817 L2818 L2824 S2830 G2831 W2832P2816-I2828 HydrophobicContact CB-CD1 3.94Å; P2816-I2828 HydrophobicContact CG-CD1 3.98Å; P2816-I2828 HydrophobicContact CG-CG1 4.26Å; N2817-I2828 WeakPolarHBondContact O-CD1 3.33Å; L2818-I2828 HydrophobicContact CD2-CG2 4.45Å; L2824-I2828 HydrophobicContact CD1-CD1 4.04Å; L2824-I2828 HydrophobicContact CD1-CG1 4.24Å; L2824-I2828 HydrophobicContact CG-CD1 3.85Å; L2824-I2828 HydrophobicContact CG-CG1 4.48Å; L2824-I2828 WeakPolarHBondContact O-CB 3.39Å; L2824-I2828 VanDerWaalsContact O-CG1 3.25Å; L2824-I2828 WeakPolarHBondContact O-CG1 3.27Å; L2824-I2828 PolarHBondContact O-N 3.01Å; I2828-S2830 VanDerWaalsContact C-N 3.34Å; I2828-S2830 PolarHBondContact O-N 2.97Å; I2828-G2831 PolarHBondContact O-N 3.17Å; I2828-W2832 PolarHBondContact O-N 3.21Å; I2828-W2832 VanDerWaalsContact O-N 3.08Å
2829A87.3Confident86.5Confident32.75 Ų32.7553.1 Ų53.127%0.27130%0.3SS..Hα-helixtrans-61.8-40179.700000112.9N2825 H2826 F2827 T2833 P2870N2825-A2829 VanDerWaalsContact O-CB 3.27Å; N2825-A2829 WeakPolarHBondContact O-CB 3.43Å; N2825-A2829 PolarHBondContact O-N 2.97Å; H2826-A2829 PolarHBondContact O-N 2.99Å; F2827-A2829 VanDerWaalsContact C-N 3.35Å; F2827-A2829 PolarHBondContact O-N 3.09Å; A2829-T2833 PolarHBondContact O-N 3.04Å; A2829-T2833 VanDerWaalsContact O-N 3.08Å; A2829-T2833 PolarHBondContact O-OG1 3.33Å; A2829-P2870 HydrophobicContact CB-CG 4.08Å
2830S89.6Confident87.3Confident44 Ų4450.3 Ų50.331%0.30828%0.283SS..Hα-helixtrans-66.1-47.2177.367.90000112.6H2826 F2827 I2828 W2832 T2833 D2834H2826-S2830 WeakPolarHBondContact O-CB 3.22Å; H2826-S2830 PolarHBondContact O-N 3.21Å; H2826-S2830 PolarHBondContact O-OG 2.96Å; F2827-S2830 WeakPolarHBondContact CA-OG 3.29Å; F2827-S2830 PolarHBondContact O-N 3.07Å; F2827-S2830 VanDerWaalsContact O-N 3.17Å; F2827-S2830 PolarHBondContact O-OG 3.32Å; I2828-S2830 VanDerWaalsContact C-N 3.34Å; I2828-S2830 PolarHBondContact O-N 2.97Å; S2830-W2832 VanDerWaalsContact C-N 3.3Å; S2830-W2832 PolarHBondContact O-N 3.31Å; S2830-T2833 WeakPolarHBondContact CA-OG1 3.42Å; S2830-T2833 WeakPolarHBondContact O-CA 3.07Å; S2830-T2833 PolarHBondContact O-N 3.15Å; S2830-T2833 PolarHBondContact O-OG1 3.19Å; S2830-D2834 PolarHBondContact O-N 2.96Å; S2830-D2834 VanDerWaalsContact O-N 3.09Å
2831G89.7Confident88.6Confident6.25 Ų6.2547.7 Ų47.76%0.06427%0.268CS..Hα-helixtrans-64.4-34.2178.800000113.3F2827 I2828 D2834 I2835F2827-G2831 PolarHBondContact O-N 3.31Å; I2828-G2831 PolarHBondContact O-N 3.17Å; G2831-D2834 PolarHBondContact O-N 3.08Å; G2831-I2835 PolarHBondContact O-N 3.28Å; G2831-I2835 VanDerWaalsContact O-N 3.13Å
2832W91.5Very high89.3Confident13.5 Ų13.544 Ų445%0.05125%0.249CC..Hα-helixtrans-65.3-39.6169-80.6113.9000112.5F2780 L2812 L2815 I2828 S2830 D2834 I2835 I2836 V2866 A2871F2780-W2832 HydrophobicContact CE1-CD2 4.46Å; F2780-W2832 HydrophobicContact CE1-CG 4.39Å; L2812-W2832 HydrophobicContact CD2-CH2 3.89Å; L2812-W2832 HydrophobicContact CD2-CZ3 4.18Å; L2815-W2832 HydrophobicContact CB-CZ2 4.43Å; L2815-W2832 HydrophobicContact CD1-CH2 3.88Å; L2815-W2832 HydrophobicContact CD1-CZ2 3.61Å; I2828-W2832 PolarHBondContact O-N 3.21Å; I2828-W2832 VanDerWaalsContact O-N 3.08Å; S2830-W2832 VanDerWaalsContact C-N 3.3Å; S2830-W2832 PolarHBondContact O-N 3.31Å; W2832-D2834 VanDerWaalsContact C-N 3.27Å; W2832-D2834 PolarHBondContact O-N 3.33Å; W2832-I2835 PolarHBondContact O-N 3.29Å; W2832-I2836 HydrophobicContact CB-CD1 4.29Å; W2832-I2836 HydrophobicContact CE3-CD1 4.32Å; W2832-I2836 HydrophobicContact CE3-CG1 4.2Å; W2832-I2836 VanDerWaalsContact O-CD1 3.24Å; W2832-I2836 WeakPolarHBondContact O-CD1 3.43Å; W2832-I2836 WeakPolarHBondContact O-CG1 3.3Å; W2832-I2836 PolarHBondContact O-N 3.27Å; W2832-I2836 VanDerWaalsContact O-N 3.14Å; W2832-V2866 HydrophobicContact CZ3-CG2 4.37Å; W2832-A2871 HydrophobicContact CB-CB 3.99Å
2833T91.5Very high89.8Confident57 Ų5739.5 Ų39.535%0.3522%0.217SC..Hα-helixtrans-62.4-33.1173.6440000113.2A2829 S2830 A2871 F2875A2829-T2833 PolarHBondContact O-N 3.04Å; A2829-T2833 VanDerWaalsContact O-N 3.08Å; A2829-T2833 PolarHBondContact O-OG1 3.33Å; S2830-T2833 WeakPolarHBondContact CA-OG1 3.42Å; S2830-T2833 WeakPolarHBondContact O-CA 3.07Å; S2830-T2833 PolarHBondContact O-N 3.15Å; S2830-T2833 PolarHBondContact O-OG1 3.19Å; T2833-A2871 HydrophobicContact CG2-CB 3.62Å; T2833-F2875 HydrophobicContact CG2-CE2 4.3Å; T2833-F2875 HydrophobicContact CG2-CZ 4.46Å; T2833-F2875 VanDerWaalsContact O-CZ 3.31Å; T2833-F2875 WeakPolarHBondContact O-CZ 3.46Å
2834D90.6Very high90.2Very high110 Ų11038.2 Ų38.259%0.58821%0.208SC*.Hα-helixtrans-76-34.2-179.8-65.5-32.2000112.9S2830 G2831 W2832 P2838S2830-D2834 PolarHBondContact O-N 2.96Å; S2830-D2834 VanDerWaalsContact O-N 3.09Å; G2831-D2834 PolarHBondContact O-N 3.08Å; W2832-D2834 VanDerWaalsContact C-N 3.27Å; W2832-D2834 PolarHBondContact O-N 3.33Å; D2834-P2838 WeakPolarHBondContact O-CD 3.42Å; D2834-P2838 WeakPolarHBondContact O-CG 3.4Å
2835I92.7Very high90.6Very high1.75 Ų1.7538 Ų381%0.00921%0.206CC..Hα-helixtrans-80.4-38.1-179.7-76.1163.2000113.8F2780 I2783 G2831 W2832 G2837 P2838 L2839F2780-I2835 HydrophobicContact CB-CD1 3.56Å; F2780-I2835 HydrophobicContact CB-CG1 4.48Å; F2780-I2835 HydrophobicContact CD1-CD1 3.47Å; F2780-I2835 VanDerWaalsContact CD1-CD1 3.47Å; F2780-I2835 HydrophobicContact CE1-CD1 4.5Å; F2780-I2835 HydrophobicContact CG-CD1 3.91Å; I2783-I2835 HydrophobicContact CB-CD1 3.87Å; I2783-I2835 HydrophobicContact CB-CG1 4.28Å; I2783-I2835 HydrophobicContact CD1-CD1 3.8Å; I2783-I2835 HydrophobicContact CG1-CD1 4.42Å; I2783-I2835 HydrophobicContact CG2-CD1 4.15Å; I2783-I2835 HydrophobicContact CG2-CG1 4.22Å; I2783-I2835 HydrophobicContact CG2-CG2 3.81Å; G2831-I2835 PolarHBondContact O-N 3.28Å; G2831-I2835 VanDerWaalsContact O-N 3.13Å; W2832-I2835 PolarHBondContact O-N 3.29Å; I2835-G2837 VanDerWaalsContact C-N 3.26Å; I2835-G2837 PolarHBondContact O-N 2.94Å; I2835-P2838 VanDerWaalsContact O-CD 3.28Å; I2835-P2838 WeakPolarHBondContact O-CD 3.35Å; I2835-L2839 HydrophobicContact CG2-CB 4.18Å; I2835-L2839 HydrophobicContact CG2-CD2 4.13Å; I2835-L2839 VanDerWaalsContact O-CB 3.26Å; I2835-L2839 WeakPolarHBondContact O-CB 3.39Å; I2835-L2839 PolarHBondContact O-N 3.15Å
2836I92.6Very high90.9Very high0.25 Ų0.2536.5 Ų36.50%0.00120%0.198CC..Hα-helixtrans-63.4-32.5-167.9-67.9163.1000112W2832 D2840 V2866 S2869 A2871 F2875 L2878W2832-I2836 HydrophobicContact CB-CD1 4.29Å; W2832-I2836 HydrophobicContact CE3-CD1 4.32Å; W2832-I2836 HydrophobicContact CE3-CG1 4.2Å; W2832-I2836 VanDerWaalsContact O-CD1 3.24Å; W2832-I2836 WeakPolarHBondContact O-CD1 3.43Å; W2832-I2836 WeakPolarHBondContact O-CG1 3.3Å; W2832-I2836 PolarHBondContact O-N 3.27Å; W2832-I2836 VanDerWaalsContact O-N 3.14Å; I2836-D2840 VanDerWaalsContact O-CB 3.23Å; I2836-D2840 WeakPolarHBondContact O-CB 3.4Å; I2836-D2840 PolarHBondContact O-N 3.02Å; I2836-V2866 HydrophobicContact CG1-CG1 4.2Å; I2836-V2866 HydrophobicContact CG2-CG1 4.46Å; I2836-S2869 WeakPolarHBondContact CD1-OG 3.36Å; I2836-A2871 HydrophobicContact CD1-CB 3.79Å; I2836-F2875 HydrophobicContact CB-CD1 4.35Å; I2836-F2875 HydrophobicContact CB-CD2 3.94Å; I2836-F2875 HydrophobicContact CB-CE1 4.21Å; I2836-F2875 HydrophobicContact CB-CE2 3.79Å; I2836-F2875 HydrophobicContact CB-CG 4.23Å; I2836-F2875 HydrophobicContact CB-CZ 3.94Å; I2836-F2875 HydrophobicContact CD1-CD2 4.09Å; I2836-F2875 HydrophobicContact CD1-CE2 3.96Å; I2836-F2875 HydrophobicContact CG1-CE2 4.49Å; I2836-F2875 HydrophobicContact CG2-CB 3.99Å; I2836-F2875 HydrophobicContact CG2-CD1 3.79Å; I2836-F2875 HydrophobicContact CG2-CD2 3.5Å; I2836-F2875 VanDerWaalsContact CG2-CD2 3.49Å; I2836-F2875 HydrophobicContact CG2-CE1 4.16Å; I2836-F2875 HydrophobicContact CG2-CE2 3.9Å; I2836-F2875 HydrophobicContact CG2-CG 3.45Å; I2836-F2875 VanDerWaalsContact CG2-CG 3.45Å; I2836-F2875 HydrophobicContact CG2-CZ 4.22Å; I2836-L2878 HydrophobicContact CG2-CD1 4.05Å; I2836-L2878 HydrophobicContact CG2-CD2 4.36Å
2837G92.7Very high91Very high28 Ų2831 Ų3129%0.28918%0.177SC..Hα-helixtrans-63.7-58.117500000113.8I2835 L2839 D2840 L2841I2835-G2837 VanDerWaalsContact C-N 3.26Å; I2835-G2837 PolarHBondContact O-N 2.94Å; G2837-L2839 VanDerWaalsContact C-N 3.28Å; G2837-L2839 PolarHBondContact O-N 2.93Å; G2837-D2840 PolarHBondContact O-N 3.3Å; G2837-L2841 PolarHBondContact O-N 3.17Å; G2837-L2841 VanDerWaalsContact O-N 3.1Å
2838P93.4Very high91.1Very high48 Ų4834.1 Ų34.131%0.31220%0.199SC..Hα-helixtrans-56-36.5172.3-28.535.2000114.3M2787 N2791 D2834 I2835 L2841 F2842M2787-P2838 HydrophobicContact CB-CB 3.71Å; M2787-P2838 HydrophobicContact CG-CB 4.3Å; N2791-P2838 PolarHBondContact ND2-O 3.18Å; D2834-P2838 WeakPolarHBondContact O-CD 3.42Å; D2834-P2838 WeakPolarHBondContact O-CG 3.4Å; I2835-P2838 VanDerWaalsContact O-CD 3.28Å; I2835-P2838 WeakPolarHBondContact O-CD 3.35Å; P2838-L2841 PolarHBondContact O-N 3.08Å; P2838-F2842 PolarHBondContact O-N 3.08Å; P2838-F2842 VanDerWaalsContact O-N 3.07Å
2839L93.2Very high90.9Very high1.5 Ų1.535.1 Ų35.11%0.00821%0.205CC..Hα-helixtrans-72.8-41.6179.1-174.557.5000112.2M2787 L2808 I2835 G2837 L2841 F2842 L2843 V2866M2787-L2839 HydrophobicContact CE-CD1 4.13Å; M2787-L2839 HydrophobicContact SD-CB 4.34Å; M2787-L2839 HydrophobicContact SD-CD1 3.66Å; L2808-L2839 HydrophobicContact CD2-CD1 4.36Å; I2835-L2839 HydrophobicContact CG2-CB 4.18Å; I2835-L2839 HydrophobicContact CG2-CD2 4.13Å; I2835-L2839 VanDerWaalsContact O-CB 3.26Å; I2835-L2839 WeakPolarHBondContact O-CB 3.39Å; I2835-L2839 PolarHBondContact O-N 3.15Å; G2837-L2839 VanDerWaalsContact C-N 3.28Å; G2837-L2839 PolarHBondContact O-N 2.93Å; L2839-L2841 VanDerWaalsContact C-N 3.27Å; L2839-L2841 PolarHBondContact O-N 3.22Å; L2839-F2842 HydrophobicContact CD1-CD1 4.24Å; L2839-F2842 PolarHBondContact O-N 3.16Å; L2839-L2843 HydrophobicContact CD1-CD1 4.37Å; L2839-L2843 HydrophobicContact CD1-CG 4.35Å; L2839-L2843 HydrophobicContact CG-CD1 4.11Å; L2839-L2843 WeakPolarHBondContact O-CB 3.38Å; L2839-L2843 VanDerWaalsContact O-CG 3.26Å; L2839-L2843 WeakPolarHBondContact O-CG 3.41Å; L2839-L2843 PolarHBondContact O-N 3.12Å; L2839-V2866 HydrophobicContact CD2-CG2 3.43Å; L2839-V2866 VanDerWaalsContact CD2-CG2 3.43Å
2840D93.4Very high90.5Very high2.75 Ų2.7539 Ų392%0.01523%0.226CC..Hα-helixtrans-59.1-37.7170.7175.458.3000111.6I2836 G2837 L2843 R2844 T2877 L2878 T2881I2836-D2840 VanDerWaalsContact O-CB 3.23Å; I2836-D2840 WeakPolarHBondContact O-CB 3.4Å; I2836-D2840 PolarHBondContact O-N 3.02Å; G2837-D2840 PolarHBondContact O-N 3.3Å; D2840-L2843 PolarHBondContact O-N 3.21Å; D2840-R2844 WeakPolarHBondContact O-CB 3.37Å; D2840-R2844 WeakPolarHBondContact O-CG 3.37Å; D2840-R2844 PolarHBondContact O-N 2.98Å; D2840-R2844 PolarHBondContact O-NE 3.06Å; D2840-R2844 IonicContact OD1-NE 2.98Å; D2840-R2844 PolarHBondContact OD1-NE 3.41Å; D2840-R2844 IonicContact OD2-CZ 2.87Å; D2840-R2844 VanDerWaalsContact OD2-CZ 3.23Å; D2840-R2844 IonicContact OD2-NE 3.53Å; D2840-R2844 PolarHBondContact OD2-NE 3.28Å; D2840-R2844 IonicContact OD2-NH2 2.96Å; D2840-R2844 PolarHBondContact OD2-NH2 3.05Å; D2840-T2877 PolarHBondContact OD2-OG1 3.11Å; D2840-L2878 HydrophobicContact CB-CD1 4.12Å; D2840-T2881 VanDerWaalsContact OD1-CB 3.23Å; D2840-T2881 WeakPolarHBondContact OD1-CB 3.34Å; D2840-T2881 PolarHBondContact OD1-OG1 3.17Å
2841L92.8Very high90.1Very high76.5 Ų76.541.4 Ų41.440%0.40124%0.24SC..Hα-helixtrans-65.9-43.6174.5-175.563.7000112.3N2791 G2837 P2838 L2839 R2844 K2845N2791-L2841 HydrophobicContact CB-CD2 4.16Å; N2791-L2841 WeakPolarHBondContact OD1-CG 3.32Å; G2837-L2841 PolarHBondContact O-N 3.17Å; G2837-L2841 VanDerWaalsContact O-N 3.1Å; P2838-L2841 PolarHBondContact O-N 3.08Å; L2839-L2841 VanDerWaalsContact C-N 3.27Å; L2839-L2841 PolarHBondContact O-N 3.22Å; L2841-R2844 PolarHBondContact O-N 3Å; L2841-K2845 WeakPolarHBondContact O-CB 3.38Å; L2841-K2845 PolarHBondContact O-N 3.02Å; L2841-K2845 VanDerWaalsContact O-N 3.08Å
2842F93.4Very high89.6Confident0 Ų043.6 Ų43.60%025%0.25CC..Hα-helixtrans-63.3-43.2175.2170-105.2000111.6M2787 L2790 N2791 I2796 L2801 L2804 L2805 L2808 P2838 L2839 R2844 K2845 L2846M2787-F2842 HydrophobicContact CE-CD1 4.13Å; M2787-F2842 HydrophobicContact CE-CG 4.26Å; M2787-F2842 HydrophobicContact SD-CB 3.59Å; M2787-F2842 VanDerWaalsContact SD-CB 3.59Å; M2787-F2842 HydrophobicContact SD-CD1 4.06Å; M2787-F2842 HydrophobicContact SD-CG 3.87Å; L2790-F2842 HydrophobicContact CB-CD2 4.05Å; L2790-F2842 HydrophobicContact CB-CE2 4.29Å; L2790-F2842 HydrophobicContact CD1-CD2 4.13Å; L2790-F2842 HydrophobicContact CD1-CE2 3.84Å; L2790-F2842 HydrophobicContact CD1-CZ 4.32Å; N2791-F2842 WeakPolarHBondContact OD1-CA 3.32Å; N2791-F2842 PolarHBondContact OD1-N 3.14Å; I2796-F2842 HydrophobicContact CD1-CD2 4.37Å; I2796-F2842 HydrophobicContact CD1-CE2 3.9Å; L2801-F2842 HydrophobicContact CD1-CZ 4.48Å; L2804-F2842 HydrophobicContact CD2-CZ 4.48Å; L2805-F2842 HydrophobicContact CD2-CE1 4.11Å; L2805-F2842 HydrophobicContact CD2-CZ 4.29Å; L2808-F2842 HydrophobicContact CD2-CE1 4.49Å; P2838-F2842 PolarHBondContact O-N 3.08Å; P2838-F2842 VanDerWaalsContact O-N 3.07Å; L2839-F2842 HydrophobicContact CD1-CD1 4.24Å; L2839-F2842 PolarHBondContact O-N 3.16Å; F2842-R2844 VanDerWaalsContact C-N 3.34Å; F2842-R2844 PolarHBondContact O-N 3.35Å; F2842-K2845 CarbonylContact O-C 3.6Å; F2842-K2845 WeakPolarHBondContact O-CA 3.47Å; F2842-K2845 WeakPolarHBondContact O-CB 3.44Å; F2842-K2845 PolarHBondContact O-N 3.06Å; F2842-K2845 VanDerWaalsContact O-N 3.12Å; F2842-L2846 HydrophobicContact CE1-CD2 4.49Å; F2842-L2846 WeakPolarHBondContact O-CB 3.42Å; F2842-L2846 PolarHBondContact O-N 2.86Å
2843L93.1Very high89Confident0.25 Ų0.2543.7 Ų43.70%0.00125%0.252CS..Hα-helixtrans-66.9-36.5178.4-70.7175.2000112.2L2839 D2840 K2845 L2846 A2847 T2859 T2881 F2882 L2885L2839-L2843 HydrophobicContact CD1-CD1 4.37Å; L2839-L2843 HydrophobicContact CD1-CG 4.35Å; L2839-L2843 HydrophobicContact CG-CD1 4.11Å; L2839-L2843 WeakPolarHBondContact O-CB 3.38Å; L2839-L2843 VanDerWaalsContact O-CG 3.26Å; L2839-L2843 WeakPolarHBondContact O-CG 3.41Å; L2839-L2843 PolarHBondContact O-N 3.12Å; D2840-L2843 PolarHBondContact O-N 3.21Å; L2843-K2845 VanDerWaalsContact C-N 3.28Å; L2843-K2845 PolarHBondContact O-N 2.98Å; L2843-L2846 HydrophobicContact CD2-CD2 4.07Å; L2843-L2846 PolarHBondContact O-N 3.2Å; L2843-A2847 PolarHBondContact O-N 2.88Å; L2843-A2847 VanDerWaalsContact O-N 3.11Å; L2843-T2859 HydrophobicContact CD2-CG2 3.56Å; L2843-T2859 VanDerWaalsContact CD2-CG2 3.5Å; L2843-T2881 HydrophobicContact CB-CG2 3.74Å; L2843-F2882 HydrophobicContact CD1-CD1 4.48Å; L2843-F2882 HydrophobicContact CD1-CE1 3.67Å; L2843-F2882 HydrophobicContact CD1-CZ 4.42Å; L2843-L2885 HydrophobicContact CB-CD1 3.77Å; L2843-L2885 HydrophobicContact CD2-CD1 3.88Å; L2843-L2885 HydrophobicContact CG-CD1 4.32Å
2844R92.3Very high88.2Confident105.75 Ų105.7547.2 Ų47.240%0.39927%0.268SS..Hα-helixtrans-64.5-34.1169.6-76.7-175.2-83.6114.8-2.9113D2840 L2841 F2842 T2881D2840-R2844 WeakPolarHBondContact O-CB 3.37Å; D2840-R2844 WeakPolarHBondContact O-CG 3.37Å; D2840-R2844 PolarHBondContact O-N 2.98Å; D2840-R2844 PolarHBondContact O-NE 3.06Å; D2840-R2844 IonicContact OD1-NE 2.98Å; D2840-R2844 PolarHBondContact OD1-NE 3.41Å; D2840-R2844 IonicContact OD2-CZ 2.87Å; D2840-R2844 VanDerWaalsContact OD2-CZ 3.23Å; D2840-R2844 IonicContact OD2-NE 3.53Å; D2840-R2844 PolarHBondContact OD2-NE 3.28Å; D2840-R2844 IonicContact OD2-NH2 2.96Å; D2840-R2844 PolarHBondContact OD2-NH2 3.05Å; L2841-R2844 PolarHBondContact O-N 3Å; F2842-R2844 VanDerWaalsContact C-N 3.34Å; F2842-R2844 PolarHBondContact O-N 3.35Å; R2844-T2881 HydrophobicContact CB-CG2 4.46Å; R2844-T2881 VanDerWaalsContact CD-OG1 3.3Å; R2844-T2881 WeakPolarHBondContact CD-OG1 3.37Å; R2844-T2881 HydrophobicContact CG-CG2 3.56Å; R2844-T2881 WeakPolarHBondContact CG-OG1 3.34Å
2845K90.6Very high87.8Confident47.75 Ų47.7543.9 Ų43.921%0.20825%0.25CS..Hα-helixtrans-69.7-43.9172.2-122.8-175-178.7-176.30111.5L2790 N2791 Q2793 I2796 L2841 F2842 L2843 A2847 T2848L2790-K2845 PolarHBondContact O-NZ 3.25Å; N2791-K2845 VanDerWaalsContact C-NZ 3.3Å; N2791-K2845 PolarHBondContact O-NZ 2.99Å; Q2793-K2845 PolarHBondContact O-NZ 3.05Å; I2796-K2845 HydrophobicContact CD1-CB 4.1Å; I2796-K2845 HydrophobicContact CD1-CD 4.11Å; I2796-K2845 HydrophobicContact CD1-CG 4.05Å; I2796-K2845 HydrophobicContact CG1-CD 4.41Å; L2841-K2845 WeakPolarHBondContact O-CB 3.38Å; L2841-K2845 PolarHBondContact O-N 3.02Å; L2841-K2845 VanDerWaalsContact O-N 3.08Å; F2842-K2845 CarbonylContact O-C 3.6Å; F2842-K2845 WeakPolarHBondContact O-CA 3.47Å; F2842-K2845 WeakPolarHBondContact O-CB 3.44Å; F2842-K2845 PolarHBondContact O-N 3.06Å; F2842-K2845 VanDerWaalsContact O-N 3.12Å; L2843-K2845 VanDerWaalsContact C-N 3.28Å; L2843-K2845 PolarHBondContact O-N 2.98Å; K2845-A2847 VanDerWaalsContact C-N 3.25Å; K2845-A2847 PolarHBondContact O-N 3.14Å; K2845-T2848 PolarHBondContact O-N 3.19Å; K2845-T2848 PolarHBondContact O-OG1 3.14Å
2846L89.2Confident87.6Confident4.75 Ų4.7544 Ų443%0.02525%0.251CS..Hα-helixtrans-56.4-38.8178.1-17760.6000111.9L2801 L2805 F2842 L2843 T2848 V2849 L2856 T2859 L2885L2801-L2846 HydrophobicContact CD1-CD1 4.21Å; L2801-L2846 HydrophobicContact CD2-CD1 3.87Å; L2801-L2846 HydrophobicContact CG-CD1 4.49Å; L2805-L2846 HydrophobicContact CD1-CD1 4.48Å; L2805-L2846 HydrophobicContact CD1-CD2 4.36Å; L2805-L2846 HydrophobicContact CD2-CD2 4.01Å; F2842-L2846 HydrophobicContact CE1-CD2 4.49Å; F2842-L2846 WeakPolarHBondContact O-CB 3.42Å; F2842-L2846 PolarHBondContact O-N 2.86Å; L2843-L2846 HydrophobicContact CD2-CD2 4.07Å; L2843-L2846 PolarHBondContact O-N 3.2Å; L2846-T2848 PolarHBondContact O-N 3.07Å; L2846-T2848 VanDerWaalsContact O-N 3.08Å; L2846-V2849 HydrophobicContact CD1-CG2 4.44Å; L2846-V2849 PolarHBondContact O-N 3.01Å; L2846-V2849 VanDerWaalsContact O-N 3.13Å; L2846-L2856 HydrophobicContact CD1-CD1 3.99Å; L2846-L2856 HydrophobicContact CD2-CD1 3.83Å; L2846-L2856 HydrophobicContact CG-CD1 3.8Å; L2846-T2859 HydrophobicContact CD2-CG2 3.98Å; L2846-L2885 HydrophobicContact CB-CD2 4.38Å; L2846-L2885 HydrophobicContact CD2-CD2 4.4Å; L2846-L2885 HydrophobicContact CG-CD2 4.2Å
2847A88.3Confident87.3Confident25.75 Ų25.7545.3 Ų45.321%0.21326%0.261CS..THydrogen-bonded Turntrans-64.2-4.6174.200000115.2L2843 K2845 L2885 I2888L2843-A2847 PolarHBondContact O-N 2.88Å; L2843-A2847 VanDerWaalsContact O-N 3.11Å; K2845-A2847 VanDerWaalsContact C-N 3.25Å; K2845-A2847 PolarHBondContact O-N 3.14Å; A2847-L2885 HydrophobicContact CB-CD2 3.74Å; A2847-L2885 HydrophobicContact CB-CG 4.05Å; A2847-I2888 HydrophobicContact CB-CD1 3.89Å; A2847-I2888 VanDerWaalsContact O-CD1 3.28Å; A2847-I2888 WeakPolarHBondContact O-CD1 3.41Å
2848T87.6Confident87.2Confident107.75 Ų107.7544.8 Ų44.866%0.66125%0.253SS*.THydrogen-bonded Turntrans-115.12.5176.964.10000113.5K2845 L2846K2845-T2848 PolarHBondContact O-N 3.19Å; K2845-T2848 PolarHBondContact O-OG1 3.14Å; L2846-T2848 PolarHBondContact O-N 3.07Å; L2846-T2848 VanDerWaalsContact O-N 3.08Å
2849V84.1Confident87.1Confident23 Ų2342.6 Ų42.614%0.13924%0.238CC..  trans-76.1127.1178.7178.60000110.3I2796 L2798 L2801 L2846I2796-V2849 HydrophobicContact CD1-CG2 4.03Å; L2798-V2849 HydrophobicContact CD1-CG1 3.93Å; L2798-V2849 HydrophobicContact CD2-CG1 4.14Å; L2798-V2849 HydrophobicContact CG-CG1 4.18Å; L2801-V2849 HydrophobicContact CD2-CG1 4.43Å; L2846-V2849 HydrophobicContact CD1-CG2 4.44Å; L2846-V2849 PolarHBondContact O-N 3.01Å; L2846-V2849 VanDerWaalsContact O-N 3.13Å
2850T79Confident87.1Confident114.75 Ų114.7542.7 Ų42.770%0.70424%0.239SC*.SBendtrans-134.6138.1172.549.90000109.6
2851P80.3Confident87.1Confident94 Ų9445.3 Ų45.361%0.6125%0.249SC*.SBendcis-61.8158.1-4.528.8-36.9000113.2L2798L2798-P2851 HydrophobicContact CD1-CG 4.34Å; L2798-P2851 HydrophobicContact CD2-CG 3.82Å
2852I79.3Confident87.1Confident51.75 Ų51.7541.7 Ų41.727%0.26523%0.23SC..PPolyproline II helixtrans-76.9128.6-175.4-63.4167.2000108.9L2856 I2888 N2892 V2893I2852-L2856 HydrophobicContact CG2-CD2 4Å; I2852-I2888 HydrophobicContact CD1-CG2 3.9Å; I2852-I2888 HydrophobicContact CG1-CG2 4.27Å; I2852-I2888 HydrophobicContact CG2-CG2 4.17Å; I2852-N2892 HydrophobicContact CD1-CB 3.76Å; I2852-N2892 WeakPolarHBondContact CD1-OD1 3.32Å; I2852-N2892 HydrophobicContact CG2-CB 4.37Å; I2852-V2893 HydrophobicContact CG2-CG2 3.91Å
2853P78.5Confident87.2Confident16 Ų1641.7 Ų41.710%0.10423%0.23CC..PPolyproline II helixtrans-73.8136.2-178.229-33.5000111.5L2801 N2855 L2856L2801-P2853 HydrophobicContact CD2-CB 4.29Å; L2801-P2853 HydrophobicContact CD2-CG 3.92Å; P2853-N2855 VanDerWaalsContact C-N 3.25Å; P2853-N2855 PolarHBondContact O-N 3.3Å; P2853-L2856 HydrophobicContact CG-CB 4.2Å; P2853-L2856 HydrophobicContact CG-CD1 4.12Å; P2853-L2856 VanDerWaalsContact O-CB 3.29Å; P2853-L2856 WeakPolarHBondContact O-CB 3.36Å; P2853-L2856 PolarHBondContact O-N 2.89Å
2854I75.8Confident87.2Confident131 Ų13141.8 Ų41.867%0.67223%0.231SC*.G310 helixtrans-59.6-34.1-176.6-59.9172.2000111.7L2856 V2893I2854-L2856 VanDerWaalsContact C-N 3.29Å; I2854-L2856 PolarHBondContact O-N 3.01Å; I2854-L2856 VanDerWaalsContact O-N 3.17Å; I2854-V2893 WeakPolarHBondContact O-CG1 3.35Å
2855N82Confident87.1Confident41.25 Ų41.2538.5 Ų38.522%0.22122%0.219CC..G310 helixtrans-84.112.5179.567.5-46.6000114P2802 P2853 A2857 T2858P2802-N2855 VanDerWaalsContact CA-CG 3.5Å; P2802-N2855 WeakPolarHBondContact CA-ND2 3.23Å; P2802-N2855 VanDerWaalsContact CA-OD1 3.3Å; P2802-N2855 WeakPolarHBondContact CA-OD1 3.33Å; P2802-N2855 HydrophobicContact CB-CB 4.21Å; P2802-N2855 WeakPolarHBondContact CB-OD1 3.31Å; P2802-N2855 PolarHBondContact O-ND2 2.77Å; P2853-N2855 VanDerWaalsContact C-N 3.25Å; P2853-N2855 PolarHBondContact O-N 3.3Å; N2855-A2857 PolarHBondContact O-N 3.06Å; N2855-A2857 VanDerWaalsContact O-N 3.1Å; N2855-T2858 WeakPolarHBondContact O-CB 3.38Å; N2855-T2858 PolarHBondContact O-N 3.15Å; N2855-T2858 PolarHBondContact O-OG1 2.81Å
2856L87.6Confident87.2Confident3 Ų336.3 Ų36.32%0.01621%0.209CC..G310 helixtrans-55.9-24-179.2-166.467.2000112.6L2846 I2852 P2853 I2854 T2858 T2859 I2888 I2889 V2893L2846-L2856 HydrophobicContact CD1-CD1 3.99Å; L2846-L2856 HydrophobicContact CD2-CD1 3.83Å; L2846-L2856 HydrophobicContact CG-CD1 3.8Å; I2852-L2856 HydrophobicContact CG2-CD2 4Å; P2853-L2856 HydrophobicContact CG-CB 4.2Å; P2853-L2856 HydrophobicContact CG-CD1 4.12Å; P2853-L2856 VanDerWaalsContact O-CB 3.29Å; P2853-L2856 WeakPolarHBondContact O-CB 3.36Å; P2853-L2856 PolarHBondContact O-N 2.89Å; I2854-L2856 VanDerWaalsContact C-N 3.29Å; I2854-L2856 PolarHBondContact O-N 3.01Å; I2854-L2856 VanDerWaalsContact O-N 3.17Å; L2856-T2858 VanDerWaalsContact C-N 3.26Å; L2856-T2858 PolarHBondContact O-N 3.04Å; L2856-T2859 WeakPolarHBondContact O-CB 3.34Å; L2856-T2859 PolarHBondContact O-N 3.17Å; L2856-T2859 PolarHBondContact O-OG1 3.18Å; L2856-I2888 HydrophobicContact CD2-CB 4.41Å; L2856-I2888 HydrophobicContact CD2-CG2 3.72Å; L2856-I2889 HydrophobicContact CB-CG1 4.25Å; L2856-I2889 HydrophobicContact CD2-CG1 3.66Å; L2856-I2889 HydrophobicContact CG-CD1 4.21Å; L2856-I2889 HydrophobicContact CG-CG1 3.67Å; L2856-V2893 HydrophobicContact CB-CG2 4.31Å
2857A87.3Confident87.3Confident26.75 Ų26.7536.2 Ų36.222%0.22121%0.208CC..G310 helixtrans-55.7-31.1171.800000114.2N2855 T2859 V2860 V2893 F2895N2855-A2857 PolarHBondContact O-N 3.06Å; N2855-A2857 VanDerWaalsContact O-N 3.1Å; A2857-T2859 PolarHBondContact O-N 3.04Å; A2857-T2859 VanDerWaalsContact O-N 3.13Å; A2857-V2860 VanDerWaalsContact O-CB 3.31Å; A2857-V2860 WeakPolarHBondContact O-CB 3.38Å; A2857-V2860 WeakPolarHBondContact O-CG2 3.38Å; A2857-V2860 PolarHBondContact O-N 3.07Å; A2857-V2893 HydrophobicContact CB-CG1 4.19Å; A2857-F2895 HydrophobicContact CB-CB 4.39Å
2858T89.9Confident87.4Confident19.5 Ų19.540.2 Ų40.212%0.1222%0.218CC..G310 helixtrans-57-28.4172.8-64.80000111.8L2805 E2806 A2809 N2855 L2856 V2860 R2861 I2862L2805-T2858 HydrophobicContact CB-CG2 4.19Å; L2805-T2858 WeakPolarHBondContact O-CG2 3.38Å; E2806-T2858 WeakPolarHBondContact OE2-CG2 3.43Å; E2806-T2858 PolarHBondContact OE2-OG1 3.07Å; A2809-T2858 HydrophobicContact CB-CG2 3.85Å; N2855-T2858 WeakPolarHBondContact O-CB 3.38Å; N2855-T2858 PolarHBondContact O-N 3.15Å; N2855-T2858 PolarHBondContact O-OG1 2.81Å; L2856-T2858 VanDerWaalsContact C-N 3.26Å; L2856-T2858 PolarHBondContact O-N 3.04Å; T2858-V2860 PolarHBondContact O-N 3.14Å; T2858-V2860 VanDerWaalsContact O-N 3.12Å; T2858-R2861 WeakPolarHBondContact O-CB 3.34Å; T2858-R2861 PolarHBondContact O-N 3.1Å; T2858-I2862 PolarHBondContact O-N 3Å
2859T91.5Very high87.4Confident0 Ų035.2 Ų35.20%019%0.188CC..Hα-helixtrans-60.2-23.6176-36.70000112.7L2843 L2846 L2856 A2857 R2861 I2862 M2863 L2885L2843-T2859 HydrophobicContact CD2-CG2 3.56Å; L2843-T2859 VanDerWaalsContact CD2-CG2 3.5Å; L2846-T2859 HydrophobicContact CD2-CG2 3.98Å; L2856-T2859 WeakPolarHBondContact O-CB 3.34Å; L2856-T2859 PolarHBondContact O-N 3.17Å; L2856-T2859 PolarHBondContact O-OG1 3.18Å; A2857-T2859 PolarHBondContact O-N 3.04Å; A2857-T2859 VanDerWaalsContact O-N 3.13Å; T2859-R2861 VanDerWaalsContact C-N 3.33Å; T2859-R2861 PolarHBondContact O-N 3Å; T2859-I2862 WeakPolarHBondContact O-CB 3.37Å; T2859-I2862 PolarHBondContact O-N 3.14Å; T2859-M2863 HydrophobicContact CG2-CE 3.97Å; T2859-M2863 HydrophobicContact CG2-CG 4.35Å; T2859-M2863 HydrophobicContact CG2-SD 4.09Å; T2859-M2863 WeakPolarHBondContact O-CB 3.38Å; T2859-M2863 VanDerWaalsContact O-CG 3.32Å; T2859-M2863 WeakPolarHBondContact O-CG 3.35Å; T2859-M2863 PolarHBondContact O-N 3.26Å; T2859-L2885 HydrophobicContact CG2-CD1 4.19Å
2860V93.3Very high87.5Confident4.5 Ų4.536.7 Ų36.73%0.02720%0.198CC..Hα-helixtrans-63.3-38.5174.1-178.70000111.1A2857 T2858 M2863 T2864 I2889 S2899 V2900 L2903A2857-V2860 VanDerWaalsContact O-CB 3.31Å; A2857-V2860 WeakPolarHBondContact O-CB 3.38Å; A2857-V2860 WeakPolarHBondContact O-CG2 3.38Å; A2857-V2860 PolarHBondContact O-N 3.07Å; T2858-V2860 PolarHBondContact O-N 3.14Å; T2858-V2860 VanDerWaalsContact O-N 3.12Å; V2860-M2863 PolarHBondContact O-N 3.09Å; V2860-T2864 WeakPolarHBondContact O-CB 3.24Å; V2860-T2864 PolarHBondContact O-N 3.22Å; V2860-T2864 PolarHBondContact O-OG1 3.03Å; V2860-I2889 HydrophobicContact CG2-CD1 3.97Å; V2860-S2899 WeakPolarHBondContact CG1-O 3.28Å; V2860-V2900 HydrophobicContact CG1-CG2 4.1Å; V2860-V2900 HydrophobicContact CG2-CG2 4.44Å; V2860-L2903 HydrophobicContact CG1-CB 4.43Å; V2860-L2903 HydrophobicContact CG1-CD2 4.14Å
2861R93.2Very high87.9Confident57.25 Ų57.2531.4 Ų31.422%0.21617%0.166CC..Hα-helixtrans-63.4-46.8172.8-73.9168.963.7-148.64110.9E2806 A2809 N2810 E2813 T2858 T2859 M2863 T2864 Y2865E2806-R2861 IonicContact OE1-CZ 3.44Å; E2806-R2861 IonicContact OE1-NH1 3.62Å; E2806-R2861 PolarHBondContact OE1-NH1 2.92Å; E2806-R2861 IonicContact OE2-NH1 2.83Å; A2809-R2861 HydrophobicContact CB-CB 4.23Å; N2810-R2861 PolarHBondContact OD1-NH2 3.36Å; E2813-R2861 IonicContact OE1-NH2 3.22Å; E2813-R2861 IonicContact OE2-CZ 2.91Å; E2813-R2861 IonicContact OE2-NE 3.58Å; E2813-R2861 PolarHBondContact OE2-NE 3.25Å; E2813-R2861 IonicContact OE2-NH2 3.58Å; E2813-R2861 PolarHBondContact OE2-NH2 3.06Å; T2858-R2861 WeakPolarHBondContact O-CB 3.34Å; T2858-R2861 PolarHBondContact O-N 3.1Å; T2859-R2861 VanDerWaalsContact C-N 3.33Å; T2859-R2861 PolarHBondContact O-N 3Å; R2861-M2863 VanDerWaalsContact C-N 3.34Å; R2861-M2863 PolarHBondContact O-N 3.02Å; R2861-T2864 WeakPolarHBondContact O-CB 3.4Å; R2861-T2864 PolarHBondContact O-N 3.17Å; R2861-T2864 VanDerWaalsContact O-N 3.11Å; R2861-Y2865 HydrophobicContact CB-CE2 3.98Å; R2861-Y2865 WeakPolarHBondContact O-CD2 3.25Å; R2861-Y2865 PolarHBondContact O-N 3.01Å
2862I93.9Very high88.2Confident0 Ų026.9 Ų26.90%014%0.137CC..Hα-helixtrans-55.7-49.2175.8-60.6176000110.9L2805 L2808 A2809 L2812 T2858 T2859 T2864 Y2865 V2866L2805-I2862 HydrophobicContact CB-CD1 4.46Å; L2805-I2862 HydrophobicContact CD2-CD1 3.89Å; L2808-I2862 HydrophobicContact CB-CD1 4.38Å; L2808-I2862 HydrophobicContact CD2-CD1 4.09Å; L2808-I2862 HydrophobicContact CG-CD1 4.17Å; A2809-I2862 HydrophobicContact CB-CG1 4Å; L2812-I2862 HydrophobicContact CD1-CB 4.36Å; L2812-I2862 HydrophobicContact CD1-CG1 4.33Å; L2812-I2862 HydrophobicContact CD1-CG2 3.81Å; T2858-I2862 PolarHBondContact O-N 3Å; T2859-I2862 WeakPolarHBondContact O-CB 3.37Å; T2859-I2862 PolarHBondContact O-N 3.14Å; I2862-T2864 VanDerWaalsContact C-N 3.3Å; I2862-T2864 PolarHBondContact O-N 3.24Å; I2862-Y2865 PolarHBondContact O-N 3.28Å; I2862-V2866 HydrophobicContact CG2-CG2 4.49Å; I2862-V2866 WeakPolarHBondContact O-CB 3.15Å; I2862-V2866 VanDerWaalsContact O-CG2 3.27Å; I2862-V2866 WeakPolarHBondContact O-CG2 3.33Å; I2862-V2866 PolarHBondContact O-N 3.25Å
2863M94Very high88.5Confident0 Ų026.2 Ų26.20%014%0.136CC..Hα-helixtrans-59.6-39.8176.7-67.5173.1-169.300112.2T2859 V2860 R2861 V2866 L2867 F2882 L2885 L2886 I2889 L2903T2859-M2863 HydrophobicContact CG2-CE 3.97Å; T2859-M2863 HydrophobicContact CG2-CG 4.35Å; T2859-M2863 HydrophobicContact CG2-SD 4.09Å; T2859-M2863 WeakPolarHBondContact O-CB 3.38Å; T2859-M2863 VanDerWaalsContact O-CG 3.32Å; T2859-M2863 WeakPolarHBondContact O-CG 3.35Å; T2859-M2863 PolarHBondContact O-N 3.26Å; V2860-M2863 PolarHBondContact O-N 3.09Å; R2861-M2863 VanDerWaalsContact C-N 3.34Å; R2861-M2863 PolarHBondContact O-N 3.02Å; M2863-V2866 PolarHBondContact O-N 2.84Å; M2863-L2867 WeakPolarHBondContact O-CG 3.45Å; M2863-L2867 PolarHBondContact O-N 3.22Å; M2863-F2882 HydrophobicContact CB-CD2 3.88Å; M2863-F2882 HydrophobicContact CB-CE1 4.49Å; M2863-F2882 HydrophobicContact CB-CE2 3.67Å; M2863-F2882 HydrophobicContact CB-CG 4.36Å; M2863-F2882 HydrophobicContact CB-CZ 4.03Å; M2863-F2882 HydrophobicContact CE-CB 3.66Å; M2863-F2882 HydrophobicContact CE-CD1 4.39Å; M2863-F2882 HydrophobicContact CE-CD2 4.05Å; M2863-F2882 HydrophobicContact CE-CG 3.79Å; M2863-F2882 WeakPolarHBondContact CE-O 3.47Å; M2863-F2882 HydrophobicContact CG-CD1 3.93Å; M2863-F2882 HydrophobicContact CG-CD2 3.9Å; M2863-F2882 HydrophobicContact CG-CE1 3.96Å; M2863-F2882 HydrophobicContact CG-CE2 3.91Å; M2863-F2882 HydrophobicContact CG-CG 3.91Å; M2863-F2882 HydrophobicContact CG-CZ 3.94Å; M2863-F2882 WeakPolarHBondContact O-CE2 3.5Å; M2863-F2882 HydrophobicContact SD-CB 3.94Å; M2863-F2882 HydrophobicContact SD-CD1 4.26Å; M2863-F2882 HydrophobicContact SD-CD2 4.17Å; M2863-F2882 HydrophobicContact SD-CG 3.87Å; M2863-L2885 HydrophobicContact CE-CB 3.65Å; M2863-L2885 HydrophobicContact CE-CD1 3.81Å; M2863-L2885 HydrophobicContact CE-CG 4.24Å; M2863-L2885 HydrophobicContact SD-CB 4.28Å; M2863-L2885 HydrophobicContact SD-CD1 4.42Å; M2863-L2886 HydrophobicContact CE-CB 4.47Å; M2863-I2889 HydrophobicContact CE-CD1 4.24Å; M2863-L2903 HydrophobicContact CB-CD1 3.64Å; M2863-L2903 HydrophobicContact CB-CD2 4.15Å; M2863-L2903 HydrophobicContact CE-CD2 3.78Å; M2863-L2903 HydrophobicContact SD-CD2 3.84Å
2864T93.2Very high88.9Confident4.25 Ų4.2530.1 Ų30.13%0.02616%0.156CC..Hα-helixtrans-65.7-46.9180-57.90000111.4V2860 R2861 I2862 V2866 L2867 R2868 E2902 L2906V2860-T2864 WeakPolarHBondContact O-CB 3.24Å; V2860-T2864 PolarHBondContact O-N 3.22Å; V2860-T2864 PolarHBondContact O-OG1 3.03Å; R2861-T2864 WeakPolarHBondContact O-CB 3.4Å; R2861-T2864 PolarHBondContact O-N 3.17Å; R2861-T2864 VanDerWaalsContact O-N 3.11Å; I2862-T2864 VanDerWaalsContact C-N 3.3Å; I2862-T2864 PolarHBondContact O-N 3.24Å; T2864-V2866 VanDerWaalsContact C-N 3.32Å; T2864-V2866 PolarHBondContact O-N 3.25Å; T2864-L2867 PolarHBondContact O-N 2.83Å; T2864-R2868 WeakPolarHBondContact O-CB 3.48Å; T2864-R2868 WeakPolarHBondContact O-CG 3.33Å; T2864-R2868 PolarHBondContact O-N 3.12Å; T2864-E2902 HydrophobicContact CG2-CG 4.05Å; T2864-L2906 HydrophobicContact CG2-CD1 3.73Å; T2864-L2906 HydrophobicContact CG2-CD2 3.95Å; T2864-L2906 WeakPolarHBondContact O-CD2 3.29Å
2865Y91.3Very high89.5Confident36.5 Ų36.526.2 Ų26.214%0.14313%0.134CC..Hα-helixtrans-64.2-37.2175.3-59.6-48.7000112.4L2812 E2813 R2861 I2862 L2867 R2868 S2869L2812-Y2865 HydrophobicContact CB-CD2 3.9Å; L2812-Y2865 HydrophobicContact CB-CG 4.23Å; E2813-Y2865 HydrophobicContact CB-CD2 4.34Å; E2813-Y2865 HydrophobicContact CB-CE1 4.2Å; E2813-Y2865 HydrophobicContact CB-CE2 3.64Å; E2813-Y2865 HydrophobicContact CG-CE1 4.14Å; E2813-Y2865 HydrophobicContact CG-CE2 4.18Å; E2813-Y2865 VanDerWaalsContact CG-OH 3.29Å; E2813-Y2865 WeakPolarHBondContact CG-OH 3.32Å; E2813-Y2865 PolarHBondContact OE1-OH 3.04Å; E2813-Y2865 WeakPolarHBondContact OE2-CE2 3.33Å; E2813-Y2865 VanDerWaalsContact OE2-CZ 3.29Å; E2813-Y2865 PolarHBondContact OE2-OH 3.31Å; R2861-Y2865 HydrophobicContact CB-CE2 3.98Å; R2861-Y2865 WeakPolarHBondContact O-CD2 3.25Å; R2861-Y2865 PolarHBondContact O-N 3.01Å; I2862-Y2865 PolarHBondContact O-N 3.28Å; Y2865-L2867 PolarHBondContact O-N 2.82Å; Y2865-R2868 WeakPolarHBondContact O-CB 3.27Å; Y2865-R2868 PolarHBondContact O-N 3.26Å; Y2865-S2869 PolarHBondContact O-N 3.13Å
2866V92.7Very high89.8Confident1 Ų133.2 Ų33.21%0.00616%0.163CC..Hα-helixtrans-65.3-40.8174.1175.80000111.7W2832 I2836 L2839 I2862 M2863 T2864 R2868 S2869 A2872 L2878 F2882W2832-V2866 HydrophobicContact CZ3-CG2 4.37Å; I2836-V2866 HydrophobicContact CG1-CG1 4.2Å; I2836-V2866 HydrophobicContact CG2-CG1 4.46Å; L2839-V2866 HydrophobicContact CD2-CG2 3.43Å; L2839-V2866 VanDerWaalsContact CD2-CG2 3.43Å; I2862-V2866 HydrophobicContact CG2-CG2 4.49Å; I2862-V2866 WeakPolarHBondContact O-CB 3.15Å; I2862-V2866 VanDerWaalsContact O-CG2 3.27Å; I2862-V2866 WeakPolarHBondContact O-CG2 3.33Å; I2862-V2866 PolarHBondContact O-N 3.25Å; M2863-V2866 PolarHBondContact O-N 2.84Å; T2864-V2866 VanDerWaalsContact C-N 3.32Å; T2864-V2866 PolarHBondContact O-N 3.25Å; V2866-R2868 VanDerWaalsContact C-N 3.31Å; V2866-R2868 PolarHBondContact O-N 3.18Å; V2866-S2869 VanDerWaalsContact O-CB 3.32Å; V2866-S2869 WeakPolarHBondContact O-CB 3.28Å; V2866-S2869 PolarHBondContact O-N 3.19Å; V2866-S2869 PolarHBondContact O-OG 3.06Å; V2866-A2872 WeakPolarHBondContact O-CB 3.38Å; V2866-L2878 HydrophobicContact CG1-CD1 4.22Å; V2866-L2878 HydrophobicContact CG1-CD2 3.86Å; V2866-F2882 HydrophobicContact CB-CZ 4.05Å; V2866-F2882 HydrophobicContact CG1-CE2 4.49Å; V2866-F2882 HydrophobicContact CG1-CZ 3.9Å
2867L91.1Very high89.9Confident1.75 Ų1.7536.2 Ų36.21%0.00918%0.181CC..Hα-helixtrans-69.4-25.4173.8-70.2-166000113.4M2863 T2864 Y2865 S2869 A2872 L2878 F2882 L2903 L2906 L2911 L2919M2863-L2867 WeakPolarHBondContact O-CG 3.45Å; M2863-L2867 PolarHBondContact O-N 3.22Å; T2864-L2867 PolarHBondContact O-N 2.83Å; Y2865-L2867 PolarHBondContact O-N 2.82Å; L2867-S2869 PolarHBondContact O-N 3.23Å; L2867-A2872 HydrophobicContact CD2-CB 4.44Å; L2867-L2878 HydrophobicContact CD2-CD2 4.18Å; L2867-F2882 HydrophobicContact CD2-CD2 4.27Å; L2867-F2882 HydrophobicContact CD2-CE2 3.87Å; L2867-F2882 HydrophobicContact CG-CD2 4.36Å; L2867-F2882 HydrophobicContact CG-CE2 3.94Å; L2867-L2903 HydrophobicContact CD1-CD1 3.77Å; L2867-L2903 HydrophobicContact CG-CD1 4.32Å; L2867-L2906 HydrophobicContact CB-CB 4.35Å; L2867-L2906 HydrophobicContact CB-CD2 3.72Å; L2867-L2906 HydrophobicContact CB-CG 3.94Å; L2867-L2906 HydrophobicContact CD1-CB 4.36Å; L2867-L2911 HydrophobicContact CD2-CD2 4.2Å; L2867-L2911 HydrophobicContact CD2-CG 4.44Å; L2867-L2919 HydrophobicContact CD1-CD1 4.38Å
2868R90.3Very high90.1Very high109.5 Ų109.535 Ų3541%0.41317%0.171SC..Hα-helixtrans-70.7-17.2173.1-128179.9-177.7122.73.9112.7T2443 N2817 T2864 Y2865 V2866 E2902 L2906T2443-R2868 PolarHBondContact OG1-NH2 3.03Å; N2817-R2868 PolarHBondContact OD1-NE 3.26Å; N2817-R2868 PolarHBondContact OD1-NH2 2.96Å; T2864-R2868 WeakPolarHBondContact O-CB 3.48Å; T2864-R2868 WeakPolarHBondContact O-CG 3.33Å; T2864-R2868 PolarHBondContact O-N 3.12Å; Y2865-R2868 WeakPolarHBondContact O-CB 3.27Å; Y2865-R2868 PolarHBondContact O-N 3.26Å; V2866-R2868 VanDerWaalsContact C-N 3.31Å; V2866-R2868 PolarHBondContact O-N 3.18Å; R2868-E2902 IonicContact CZ-OE1 3.31Å; R2868-E2902 VanDerWaalsContact CZ-OE1 3.26Å; R2868-E2902 IonicContact NE-OE1 2.87Å; R2868-E2902 IonicContact NH1-OE1 3.49Å; R2868-E2902 PolarHBondContact NH1-OE1 3.03Å; R2868-E2902 IonicContact NH2-OE1 2.7Å; R2868-E2902 PolarHBondContact NH2-OE1 3.19Å; R2868-E2902 IonicContact NH2-OE2 3.83Å; R2868-L2906 HydrophobicContact CB-CD2 4.31Å; R2868-L2906 HydrophobicContact CG-CD1 3.99Å; R2868-L2906 HydrophobicContact CG-CD2 4.22Å
2869S88.3Confident90.2Very high3.75 Ų3.7534.3 Ų34.33%0.02617%0.167CC..SBendtrans-67.9143.817975.60000112.9I2836 Y2865 V2866 L2867 A2871 A2872I2836-S2869 WeakPolarHBondContact CD1-OG 3.36Å; Y2865-S2869 PolarHBondContact O-N 3.13Å; V2866-S2869 VanDerWaalsContact O-CB 3.32Å; V2866-S2869 WeakPolarHBondContact O-CB 3.28Å; V2866-S2869 PolarHBondContact O-N 3.19Å; V2866-S2869 PolarHBondContact O-OG 3.06Å; L2867-S2869 PolarHBondContact O-N 3.23Å; S2869-A2871 PolarHBondContact O-N 3.16Å; S2869-A2871 VanDerWaalsContact O-N 3.15Å; S2869-A2872 WeakPolarHBondContact O-CB 3.43Å; S2869-A2872 PolarHBondContact O-N 3.14Å; S2869-A2872 PolarHBondContact OG-N 3.4Å
2870P85.9Confident90.3Very high54.25 Ų54.2538.4 Ų38.435%0.35219%0.189SC..THydrogen-bonded Turntrans-62.6-24.217825.3-35.1000113.3L2818 A2829L2818-P2870 HydrophobicContact CD1-CB 4.27Å; L2818-P2870 HydrophobicContact CD1-CG 4.2Å; L2818-P2870 HydrophobicContact CD2-CB 4.42Å; L2818-P2870 HydrophobicContact CD2-CG 4.3Å; A2829-P2870 HydrophobicContact CB-CG 4.08Å
2871A86.3Confident90.3Very high3.75 Ų3.7538.4 Ų38.43%0.03119%0.189CC..THydrogen-bonded Turntrans-85.4-16.8-175.300000114.2W2832 T2833 I2836 S2869 S2873 N2874 F2875W2832-A2871 HydrophobicContact CB-CB 3.99Å; T2833-A2871 HydrophobicContact CG2-CB 3.62Å; I2836-A2871 HydrophobicContact CD1-CB 3.79Å; S2869-A2871 PolarHBondContact O-N 3.16Å; S2869-A2871 VanDerWaalsContact O-N 3.15Å; A2871-S2873 VanDerWaalsContact C-N 3.29Å; A2871-S2873 PolarHBondContact O-N 3.25Å; A2871-S2873 VanDerWaalsContact O-N 3.12Å; A2871-N2874 WeakPolarHBondContact O-CB 3.36Å; A2871-N2874 PolarHBondContact O-N 3.18Å; A2871-F2875 HydrophobicContact CB-CE2 4.34Å; A2871-F2875 WeakPolarHBondContact O-CD2 3.16Å
2872A86.1Confident90.4Very high0 Ų035.7 Ų35.70%018%0.179CC..G310 helixtrans-50.4-43.8-169.800000114V2866 L2867 S2869 N2874 F2875 V2910V2866-A2872 WeakPolarHBondContact O-CB 3.38Å; L2867-A2872 HydrophobicContact CD2-CB 4.44Å; S2869-A2872 WeakPolarHBondContact O-CB 3.43Å; S2869-A2872 PolarHBondContact O-N 3.14Å; S2869-A2872 PolarHBondContact OG-N 3.4Å; A2872-N2874 PolarHBondContact O-N 3.04Å; A2872-F2875 PolarHBondContact O-N 3.06Å; A2872-F2875 VanDerWaalsContact O-N 3.15Å; A2872-V2910 HydrophobicContact CB-CG1 4.19Å
2873S86.6Confident90.4Very high36 Ų3636 Ų3625%0.25218%0.181SC..G310 helixtrans-63.7-11.8-175.982.30000114.5A2871 V2910 K2912A2871-S2873 VanDerWaalsContact C-N 3.29Å; A2871-S2873 PolarHBondContact O-N 3.25Å; A2871-S2873 VanDerWaalsContact O-N 3.12Å; S2873-V2910 VanDerWaalsContact CB-O 3.3Å; S2873-V2910 WeakPolarHBondContact CB-O 3.36Å; S2873-K2912 WeakPolarHBondContact O-CD 3.22Å; S2873-K2912 WeakPolarHBondContact O-CE 3.37Å; S2873-K2912 PolarHBondContact O-NZ 3.08Å; S2873-K2912 PolarHBondContact OG-NZ 3.17Å
2874N87.1Confident90.4Very high98.5 Ų98.540.5 Ų40.553%0.52721%0.205SC..G310 helixtrans-87.2-22.4179.7-64.4-35000113.3A2871 A2872 K2876 K2912A2871-N2874 WeakPolarHBondContact O-CB 3.36Å; A2871-N2874 PolarHBondContact O-N 3.18Å; A2872-N2874 PolarHBondContact O-N 3.04Å; N2874-K2876 PolarHBondContact O-N 3.2Å; N2874-K2912 PolarHBondContact OD1-NZ 3.17Å; N2874-K2912 VanDerWaalsContact OD1-NZ 3.07Å
2875F87.6Confident90.4Very high48.5 Ų48.540.3 Ų40.321%0.21320%0.203CC..  trans-89.1100.9-175.1-69.9-90.5000111.6T2833 I2836 A2871 A2872 T2877 L2878T2833-F2875 HydrophobicContact CG2-CE2 4.3Å; T2833-F2875 HydrophobicContact CG2-CZ 4.46Å; T2833-F2875 VanDerWaalsContact O-CZ 3.31Å; T2833-F2875 WeakPolarHBondContact O-CZ 3.46Å; I2836-F2875 HydrophobicContact CB-CD1 4.35Å; I2836-F2875 HydrophobicContact CB-CD2 3.94Å; I2836-F2875 HydrophobicContact CB-CE1 4.21Å; I2836-F2875 HydrophobicContact CB-CE2 3.79Å; I2836-F2875 HydrophobicContact CB-CG 4.23Å; I2836-F2875 HydrophobicContact CB-CZ 3.94Å; I2836-F2875 HydrophobicContact CD1-CD2 4.09Å; I2836-F2875 HydrophobicContact CD1-CE2 3.96Å; I2836-F2875 HydrophobicContact CG1-CE2 4.49Å; I2836-F2875 HydrophobicContact CG2-CB 3.99Å; I2836-F2875 HydrophobicContact CG2-CD1 3.79Å; I2836-F2875 HydrophobicContact CG2-CD2 3.5Å; I2836-F2875 VanDerWaalsContact CG2-CD2 3.49Å; I2836-F2875 HydrophobicContact CG2-CE1 4.16Å; I2836-F2875 HydrophobicContact CG2-CE2 3.9Å; I2836-F2875 HydrophobicContact CG2-CG 3.45Å; I2836-F2875 VanDerWaalsContact CG2-CG 3.45Å; I2836-F2875 HydrophobicContact CG2-CZ 4.22Å; A2871-F2875 HydrophobicContact CB-CE2 4.34Å; A2871-F2875 WeakPolarHBondContact O-CD2 3.16Å; A2872-F2875 PolarHBondContact O-N 3.06Å; A2872-F2875 VanDerWaalsContact O-N 3.15Å; F2875-T2877 VanDerWaalsContact C-N 3.33Å; F2875-T2877 PolarHBondContact O-N 3Å; F2875-L2878 HydrophobicContact CB-CB 4.06Å; F2875-L2878 WeakPolarHBondContact O-CB 3.25Å; F2875-L2878 PolarHBondContact O-N 3.12Å
2876K88Confident90.5Very high188.25 Ų188.2538.5 Ų38.582%0.81820%0.197SC*.THydrogen-bonded Turntrans-66.5-29.2-173.4-66178.5-176.5170.40114.9N2874 P2879N2874-K2876 PolarHBondContact O-N 3.2Å; K2876-P2879 WeakPolarHBondContact O-CD 3.42Å
2877T89.9Confident90.6Very high66 Ų6641.4 Ų41.441%0.40521%0.207SC..THydrogen-bonded Turntrans-81.1-23.3-178.947.50000113.4D2840 F2875 P2879 D2880 T2881D2840-T2877 PolarHBondContact OD2-OG1 3.11Å; F2875-T2877 VanDerWaalsContact C-N 3.33Å; F2875-T2877 PolarHBondContact O-N 3Å; T2877-P2879 VanDerWaalsContact C-CD 3.48Å; T2877-D2880 PolarHBondContact O-N 3.14Å; T2877-D2880 VanDerWaalsContact O-N 3.12Å; T2877-T2881 PolarHBondContact O-N 3.22Å; T2877-T2881 VanDerWaalsContact O-N 3.08Å; T2877-T2881 PolarHBondContact O-OG1 3.16Å
2878L92Very high90.6Very high2.25 Ų2.2542.9 Ų42.91%0.01222%0.215CC..Hα-helixtrans-55.7-43.3-172.7-164.875.8000113.6I2836 D2840 V2866 L2867 F2875 D2880 T2881 F2882I2836-L2878 HydrophobicContact CG2-CD1 4.05Å; I2836-L2878 HydrophobicContact CG2-CD2 4.36Å; D2840-L2878 HydrophobicContact CB-CD1 4.12Å; V2866-L2878 HydrophobicContact CG1-CD1 4.22Å; V2866-L2878 HydrophobicContact CG1-CD2 3.86Å; L2867-L2878 HydrophobicContact CD2-CD2 4.18Å; F2875-L2878 HydrophobicContact CB-CB 4.06Å; F2875-L2878 WeakPolarHBondContact O-CB 3.25Å; F2875-L2878 PolarHBondContact O-N 3.12Å; L2878-D2880 VanDerWaalsContact C-N 3.33Å; L2878-D2880 PolarHBondContact O-N 3.2Å; L2878-T2881 PolarHBondContact O-N 3.04Å; L2878-F2882 HydrophobicContact CD1-CD1 4.2Å; L2878-F2882 HydrophobicContact CD1-CE1 3.4Å; L2878-F2882 VanDerWaalsContact CD1-CE1 3.42Å; L2878-F2882 HydrophobicContact CD1-CE2 4.36Å; L2878-F2882 HydrophobicContact CD1-CZ 3.51Å; L2878-F2882 VanDerWaalsContact CD1-CZ 3.48Å; L2878-F2882 HydrophobicContact CD2-CE2 4.11Å; L2878-F2882 HydrophobicContact CD2-CZ 3.98Å; L2878-F2882 HydrophobicContact CG-CD1 4.24Å; L2878-F2882 HydrophobicContact CG-CD2 4.41Å; L2878-F2882 HydrophobicContact CG-CE1 3.75Å; L2878-F2882 HydrophobicContact CG-CE2 3.96Å; L2878-F2882 HydrophobicContact CG-CZ 3.62Å; L2878-F2882 VanDerWaalsContact O-CB 3.31Å; L2878-F2882 WeakPolarHBondContact O-CB 3.27Å; L2878-F2882 VanDerWaalsContact O-CD1 3.28Å; L2878-F2882 WeakPolarHBondContact O-CD1 3.38Å; L2878-F2882 VanDerWaalsContact O-CG 3.29Å; L2878-F2882 WeakPolarHBondContact O-CG 3.4Å; L2878-F2882 PolarHBondContact O-N 3.1Å
2879P92.4Very high90.7Very high4.5 Ų4.537.7 Ų37.73%0.02920%0.196CC..Hα-helixtrans-67.9-32179.8-18.634.3000112.8K2876 T2877 S2883 L2911 T2915 Q2918K2876-P2879 WeakPolarHBondContact O-CD 3.42Å; T2877-P2879 VanDerWaalsContact C-CD 3.48Å; P2879-S2883 WeakPolarHBondContact O-CB 3.35Å; P2879-S2883 PolarHBondContact O-N 3Å; P2879-S2883 PolarHBondContact O-OG 3.03Å; P2879-L2911 HydrophobicContact CB-CD1 4.1Å; P2879-L2911 HydrophobicContact CG-CD1 3.8Å; P2879-L2911 HydrophobicContact CG-CD2 4.42Å; P2879-T2915 HydrophobicContact CB-CG2 4.45Å; P2879-T2915 HydrophobicContact CG-CG2 4.32Å; P2879-Q2918 HydrophobicContact CB-CB 4.44Å; P2879-Q2918 HydrophobicContact CB-CG 4.21Å
2880D92.9Very high90.9Very high85.25 Ų85.2537.5 Ų37.546%0.45619%0.194SC..Hα-helixtrans-71-44.7177-59.4-50.6000110.5T2877 L2878 F2882 S2883 N2884T2877-D2880 PolarHBondContact O-N 3.14Å; T2877-D2880 VanDerWaalsContact O-N 3.12Å; L2878-D2880 VanDerWaalsContact C-N 3.33Å; L2878-D2880 PolarHBondContact O-N 3.2Å; D2880-F2882 VanDerWaalsContact C-N 3.32Å; D2880-F2882 PolarHBondContact O-N 3.19Å; D2880-S2883 WeakPolarHBondContact O-CB 3.34Å; D2880-S2883 PolarHBondContact O-N 3.23Å; D2880-N2884 PolarHBondContact O-N 3.15Å; D2880-N2884 VanDerWaalsContact O-N 3.07Å; D2880-N2884 PolarHBondContact O-ND2 3.11Å; D2880-N2884 VanDerWaalsContact O-ND2 3.11Å
2881T93.3Very high91.1Very high4.5 Ų4.537.4 Ų37.43%0.02819%0.189CC..Hα-helixtrans-56.4-47.4172.5-59.10000111.4D2840 L2843 R2844 T2877 L2878 N2884 L2885D2840-T2881 VanDerWaalsContact OD1-CB 3.23Å; D2840-T2881 WeakPolarHBondContact OD1-CB 3.34Å; D2840-T2881 PolarHBondContact OD1-OG1 3.17Å; L2843-T2881 HydrophobicContact CB-CG2 3.74Å; R2844-T2881 HydrophobicContact CB-CG2 4.46Å; R2844-T2881 VanDerWaalsContact CD-OG1 3.3Å; R2844-T2881 WeakPolarHBondContact CD-OG1 3.37Å; R2844-T2881 HydrophobicContact CG-CG2 3.56Å; R2844-T2881 WeakPolarHBondContact CG-OG1 3.34Å; T2877-T2881 PolarHBondContact O-N 3.22Å; T2877-T2881 VanDerWaalsContact O-N 3.08Å; T2877-T2881 PolarHBondContact O-OG1 3.16Å; L2878-T2881 PolarHBondContact O-N 3.04Å; T2881-N2884 PolarHBondContact O-N 3.1Å; T2881-L2885 HydrophobicContact CG2-CD1 4.38Å; T2881-L2885 PolarHBondContact O-N 3.05Å; T2881-L2885 VanDerWaalsContact O-N 3.07Å
2882F95.3Very high91.2Very high1 Ų140.2 Ų40.20%0.00420%0.204CC..Hα-helixtrans-68.6-36.5-178.7-7313.9000111.4L2843 M2863 V2866 L2867 L2878 D2880 N2884 L2885 L2886 L2919L2843-F2882 HydrophobicContact CD1-CD1 4.48Å; L2843-F2882 HydrophobicContact CD1-CE1 3.67Å; L2843-F2882 HydrophobicContact CD1-CZ 4.42Å; M2863-F2882 HydrophobicContact CB-CD2 3.88Å; M2863-F2882 HydrophobicContact CB-CE1 4.49Å; M2863-F2882 HydrophobicContact CB-CE2 3.67Å; M2863-F2882 HydrophobicContact CB-CG 4.36Å; M2863-F2882 HydrophobicContact CB-CZ 4.03Å; M2863-F2882 HydrophobicContact CE-CB 3.66Å; M2863-F2882 HydrophobicContact CE-CD1 4.39Å; M2863-F2882 HydrophobicContact CE-CD2 4.05Å; M2863-F2882 HydrophobicContact CE-CG 3.79Å; M2863-F2882 WeakPolarHBondContact CE-O 3.47Å; M2863-F2882 HydrophobicContact CG-CD1 3.93Å; M2863-F2882 HydrophobicContact CG-CD2 3.9Å; M2863-F2882 HydrophobicContact CG-CE1 3.96Å; M2863-F2882 HydrophobicContact CG-CE2 3.91Å; M2863-F2882 HydrophobicContact CG-CG 3.91Å; M2863-F2882 HydrophobicContact CG-CZ 3.94Å; M2863-F2882 WeakPolarHBondContact O-CE2 3.5Å; M2863-F2882 HydrophobicContact SD-CB 3.94Å; M2863-F2882 HydrophobicContact SD-CD1 4.26Å; M2863-F2882 HydrophobicContact SD-CD2 4.17Å; M2863-F2882 HydrophobicContact SD-CG 3.87Å; V2866-F2882 HydrophobicContact CB-CZ 4.05Å; V2866-F2882 HydrophobicContact CG1-CE2 4.49Å; V2866-F2882 HydrophobicContact CG1-CZ 3.9Å; L2867-F2882 HydrophobicContact CD2-CD2 4.27Å; L2867-F2882 HydrophobicContact CD2-CE2 3.87Å; L2867-F2882 HydrophobicContact CG-CD2 4.36Å; L2867-F2882 HydrophobicContact CG-CE2 3.94Å; L2878-F2882 HydrophobicContact CD1-CD1 4.2Å; L2878-F2882 HydrophobicContact CD1-CE1 3.4Å; L2878-F2882 VanDerWaalsContact CD1-CE1 3.42Å; L2878-F2882 HydrophobicContact CD1-CE2 4.36Å; L2878-F2882 HydrophobicContact CD1-CZ 3.51Å; L2878-F2882 VanDerWaalsContact CD1-CZ 3.48Å; L2878-F2882 HydrophobicContact CD2-CE2 4.11Å; L2878-F2882 HydrophobicContact CD2-CZ 3.98Å; L2878-F2882 HydrophobicContact CG-CD1 4.24Å; L2878-F2882 HydrophobicContact CG-CD2 4.41Å; L2878-F2882 HydrophobicContact CG-CE1 3.75Å; L2878-F2882 HydrophobicContact CG-CE2 3.96Å; L2878-F2882 HydrophobicContact CG-CZ 3.62Å; L2878-F2882 VanDerWaalsContact O-CB 3.31Å; L2878-F2882 WeakPolarHBondContact O-CB 3.27Å; L2878-F2882 VanDerWaalsContact O-CD1 3.28Å; L2878-F2882 WeakPolarHBondContact O-CD1 3.38Å; L2878-F2882 VanDerWaalsContact O-CG 3.29Å; L2878-F2882 WeakPolarHBondContact O-CG 3.4Å; L2878-F2882 PolarHBondContact O-N 3.1Å; D2880-F2882 VanDerWaalsContact C-N 3.32Å; D2880-F2882 PolarHBondContact O-N 3.19Å; F2882-N2884 PolarHBondContact O-N 3.46Å; F2882-L2885 PolarHBondContact O-N 3.05Å; F2882-L2886 WeakPolarHBondContact O-CB 3.14Å; F2882-L2886 PolarHBondContact O-N 3.06Å; F2882-L2919 HydrophobicContact CB-CD1 4.41Å; F2882-L2919 HydrophobicContact CB-CD2 3.78Å; F2882-L2919 HydrophobicContact CD2-CD1 4.49Å
2883S94.2Very high91.3Very high7 Ų740.8 Ų40.85%0.04921%0.207CC..Hα-helixtrans-59.8-46172.9-58.20000111.8P2879 D2880 L2886 R2887 Q2918 T2922P2879-S2883 WeakPolarHBondContact O-CB 3.35Å; P2879-S2883 PolarHBondContact O-N 3Å; P2879-S2883 PolarHBondContact O-OG 3.03Å; D2880-S2883 WeakPolarHBondContact O-CB 3.34Å; D2880-S2883 PolarHBondContact O-N 3.23Å; S2883-L2886 PolarHBondContact O-N 3.26Å; S2883-R2887 WeakPolarHBondContact O-CB 3.33Å; S2883-R2887 PolarHBondContact O-N 3.19Å; S2883-Q2918 WeakPolarHBondContact OG-CG 3.37Å; S2883-Q2918 PolarHBondContact OG-NE2 3Å; S2883-T2922 WeakPolarHBondContact CB-OG1 3.38Å; S2883-T2922 PolarHBondContact OG-OG1 3.29Å
2884N93.7Very high91.3Very high93.5 Ų93.544.3 Ų44.350%0.522%0.219SC..Hα-helixtrans-66.9-42-179.3-70.2-41.5000112.1D2880 T2881 F2882 R2887 I2888D2880-N2884 PolarHBondContact O-N 3.15Å; D2880-N2884 VanDerWaalsContact O-N 3.07Å; D2880-N2884 PolarHBondContact O-ND2 3.11Å; D2880-N2884 VanDerWaalsContact O-ND2 3.11Å; T2881-N2884 PolarHBondContact O-N 3.1Å; F2882-N2884 PolarHBondContact O-N 3.46Å; N2884-R2887 PolarHBondContact O-N 3.12Å; N2884-I2888 WeakPolarHBondContact O-CD1 3.4Å; N2884-I2888 VanDerWaalsContact O-CG1 3.31Å; N2884-I2888 WeakPolarHBondContact O-CG1 3.31Å; N2884-I2888 PolarHBondContact O-N 2.99Å; N2884-I2888 VanDerWaalsContact O-N 3.16Å
2885L93.6Very high91.5Very high0 Ų040.1 Ų40.10%020%0.196CC..Hα-helixtrans-66.2-44.2174.3-78.7170.9000112.4L2843 L2846 A2847 T2859 M2863 T2881 F2882 R2887 I2888 I2889L2843-L2885 HydrophobicContact CB-CD1 3.77Å; L2843-L2885 HydrophobicContact CD2-CD1 3.88Å; L2843-L2885 HydrophobicContact CG-CD1 4.32Å; L2846-L2885 HydrophobicContact CB-CD2 4.38Å; L2846-L2885 HydrophobicContact CD2-CD2 4.4Å; L2846-L2885 HydrophobicContact CG-CD2 4.2Å; A2847-L2885 HydrophobicContact CB-CD2 3.74Å; A2847-L2885 HydrophobicContact CB-CG 4.05Å; T2859-L2885 HydrophobicContact CG2-CD1 4.19Å; M2863-L2885 HydrophobicContact CE-CB 3.65Å; M2863-L2885 HydrophobicContact CE-CD1 3.81Å; M2863-L2885 HydrophobicContact CE-CG 4.24Å; M2863-L2885 HydrophobicContact SD-CB 4.28Å; M2863-L2885 HydrophobicContact SD-CD1 4.42Å; T2881-L2885 HydrophobicContact CG2-CD1 4.38Å; T2881-L2885 PolarHBondContact O-N 3.05Å; T2881-L2885 VanDerWaalsContact O-N 3.07Å; F2882-L2885 PolarHBondContact O-N 3.05Å; L2885-R2887 VanDerWaalsContact C-N 3.28Å; L2885-R2887 PolarHBondContact O-N 3.32Å; L2885-I2888 PolarHBondContact O-N 3.14Å; L2885-I2888 VanDerWaalsContact O-N 3.14Å; L2885-I2889 VanDerWaalsContact O-CG1 3.29Å; L2885-I2889 WeakPolarHBondContact O-CG1 3.42Å; L2885-I2889 PolarHBondContact O-N 3.09Å
2886L93.9Very high91.6Very high0 Ų044.3 Ų44.30%021%0.211CC..Hα-helixtrans-61.2-38.3178.6-175.459.9000111.3M2863 F2882 S2883 I2889 V2890 V2900 L2919 M2923M2863-L2886 HydrophobicContact CE-CB 4.47Å; F2882-L2886 WeakPolarHBondContact O-CB 3.14Å; F2882-L2886 PolarHBondContact O-N 3.06Å; S2883-L2886 PolarHBondContact O-N 3.26Å; L2886-I2889 PolarHBondContact O-N 3.12Å; L2886-V2890 HydrophobicContact CD1-CG2 4.24Å; L2886-V2890 WeakPolarHBondContact O-CB 3.37Å; L2886-V2890 VanDerWaalsContact O-CG2 3.26Å; L2886-V2890 WeakPolarHBondContact O-CG2 3.41Å; L2886-V2890 PolarHBondContact O-N 3.17Å; L2886-V2900 HydrophobicContact CD1-CG1 4.11Å; L2886-V2900 HydrophobicContact CD1-CG2 4.48Å; L2886-L2919 HydrophobicContact CD2-CB 4.18Å; L2886-L2919 HydrophobicContact CD2-CD2 4.45Å; L2886-M2923 HydrophobicContact CD1-SD 4.07Å; L2886-M2923 HydrophobicContact CD2-CG 4Å; L2886-M2923 HydrophobicContact CD2-SD 3.8Å; L2886-M2923 HydrophobicContact CG-SD 3.88Å
2887R93.9Very high91.7Very high61.25 Ų61.2535.8 Ų35.823%0.23117%0.174CC..Hα-helixtrans-57.1-53.3170.1171167-65.6-93.30.1112.3S2883 N2884 L2885 I2889 V2890 E2891 T2922 L2926 Q2929S2883-R2887 WeakPolarHBondContact O-CB 3.33Å; S2883-R2887 PolarHBondContact O-N 3.19Å; N2884-R2887 PolarHBondContact O-N 3.12Å; L2885-R2887 VanDerWaalsContact C-N 3.28Å; L2885-R2887 PolarHBondContact O-N 3.32Å; R2887-I2889 VanDerWaalsContact C-N 3.3Å; R2887-I2889 PolarHBondContact O-N 3.1Å; R2887-V2890 PolarHBondContact O-N 3.06Å; R2887-E2891 WeakPolarHBondContact CD-OE1 3.3Å; R2887-E2891 VanDerWaalsContact CG-CD 3.43Å; R2887-E2891 HydrophobicContact CG-CG 4.29Å; R2887-E2891 VanDerWaalsContact CG-OE1 3.28Å; R2887-E2891 WeakPolarHBondContact CG-OE1 3.41Å; R2887-E2891 WeakPolarHBondContact CG-OE2 3.28Å; R2887-E2891 IonicContact CZ-OE1 3.09Å; R2887-E2891 IonicContact NE-OE1 3Å; R2887-E2891 IonicContact NH1-OE1 3.21Å; R2887-E2891 PolarHBondContact NH1-OE1 3.18Å; R2887-E2891 WeakPolarHBondContact O-CB 3.35Å; R2887-E2891 WeakPolarHBondContact O-CG 3.38Å; R2887-E2891 PolarHBondContact O-N 3.24Å; R2887-T2922 HydrophobicContact CB-CG2 4.37Å; R2887-L2926 HydrophobicContact CB-CD1 4.43Å; R2887-L2926 HydrophobicContact CG-CD2 4.25Å; R2887-L2926 VanDerWaalsContact NH1-CD2 3.31Å; R2887-Q2929 VanDerWaalsContact NH2-OE1 3.09Å
2888I91.9Very high91.7Very high33.75 Ų33.7534.1 Ų34.117%0.17316%0.164CC..Hα-helixtrans-60.5-41.3-178.8-64.7162.4000110.9A2847 I2852 L2856 N2884 L2885 N2892A2847-I2888 HydrophobicContact CB-CD1 3.89Å; A2847-I2888 VanDerWaalsContact O-CD1 3.28Å; A2847-I2888 WeakPolarHBondContact O-CD1 3.41Å; I2852-I2888 HydrophobicContact CD1-CG2 3.9Å; I2852-I2888 HydrophobicContact CG1-CG2 4.27Å; I2852-I2888 HydrophobicContact CG2-CG2 4.17Å; L2856-I2888 HydrophobicContact CD2-CB 4.41Å; L2856-I2888 HydrophobicContact CD2-CG2 3.72Å; N2884-I2888 WeakPolarHBondContact O-CD1 3.4Å; N2884-I2888 VanDerWaalsContact O-CG1 3.31Å; N2884-I2888 WeakPolarHBondContact O-CG1 3.31Å; N2884-I2888 PolarHBondContact O-N 2.99Å; N2884-I2888 VanDerWaalsContact O-N 3.16Å; L2885-I2888 PolarHBondContact O-N 3.14Å; L2885-I2888 VanDerWaalsContact O-N 3.14Å; I2888-N2892 WeakPolarHBondContact O-CB 3.33Å; I2888-N2892 PolarHBondContact O-N 3.04Å; I2888-N2892 VanDerWaalsContact O-N 3.16Å; I2888-N2892 PolarHBondContact O-ND2 2.99Å
2889I92.5Very high91.7Very high0 Ų035.3 Ų35.30%017%0.172CC..Hα-helixtrans-61.1-54.4176.5-67.9164.1000110.3L2856 V2860 M2863 L2885 L2886 R2887 E2891 N2892 V2893 F2895L2856-I2889 HydrophobicContact CB-CG1 4.25Å; L2856-I2889 HydrophobicContact CD2-CG1 3.66Å; L2856-I2889 HydrophobicContact CG-CD1 4.21Å; L2856-I2889 HydrophobicContact CG-CG1 3.67Å; V2860-I2889 HydrophobicContact CG2-CD1 3.97Å; M2863-I2889 HydrophobicContact CE-CD1 4.24Å; L2885-I2889 VanDerWaalsContact O-CG1 3.29Å; L2885-I2889 WeakPolarHBondContact O-CG1 3.42Å; L2885-I2889 PolarHBondContact O-N 3.09Å; L2886-I2889 PolarHBondContact O-N 3.12Å; R2887-I2889 VanDerWaalsContact C-N 3.3Å; R2887-I2889 PolarHBondContact O-N 3.1Å; I2889-E2891 VanDerWaalsContact C-N 3.34Å; I2889-E2891 PolarHBondContact O-N 3.31Å; I2889-N2892 PolarHBondContact O-N 3.22Å; I2889-V2893 CarbonylContact O-C 3.4Å; I2889-V2893 WeakPolarHBondContact O-CA 3.45Å; I2889-V2893 PolarHBondContact O-N 3.06Å; I2889-F2895 HydrophobicContact CG2-CB 4.14Å; I2889-F2895 HydrophobicContact CG2-CD1 4.45Å
2890V92.2Very high91.7Very high0 Ų035.1 Ų35.10%017%0.171CC..Hα-helixtrans-64-38.3-176.4171.80000112.5L2886 R2887 F2895 M2923 L2926 I2937 N2941 L2945L2886-V2890 HydrophobicContact CD1-CG2 4.24Å; L2886-V2890 WeakPolarHBondContact O-CB 3.37Å; L2886-V2890 VanDerWaalsContact O-CG2 3.26Å; L2886-V2890 WeakPolarHBondContact O-CG2 3.41Å; L2886-V2890 PolarHBondContact O-N 3.17Å; R2887-V2890 PolarHBondContact O-N 3.06Å; V2890-F2895 HydrophobicContact CB-CE1 4.27Å; V2890-F2895 HydrophobicContact CG1-CE1 4.29Å; V2890-F2895 HydrophobicContact CG2-CD1 4.31Å; V2890-F2895 HydrophobicContact CG2-CE1 3.78Å; V2890-F2895 HydrophobicContact CG2-CZ 4.16Å; V2890-M2923 HydrophobicContact CG2-CE 4.02Å; V2890-M2923 HydrophobicContact CG2-SD 3.83Å; V2890-L2926 HydrophobicContact CB-CD1 4.04Å; V2890-L2926 HydrophobicContact CG1-CD1 4Å; V2890-L2926 HydrophobicContact CG2-CD1 4.45Å; V2890-I2937 HydrophobicContact CG1-CD1 4.27Å; V2890-I2937 HydrophobicContact CG1-CG2 4.4Å; V2890-N2941 PolarHBondContact O-ND2 3.27Å; V2890-L2945 HydrophobicContact CG1-CD1 3.84Å; V2890-L2945 HydrophobicContact CG1-CD2 4.16Å; V2890-L2945 HydrophobicContact CG1-CG 4.18Å
2891E90.3Very high91.7Very high51.5 Ų51.531.9 Ų31.924%0.24115%0.153CC..Hα-helixtrans-72.2-27.6-179.9-72.3172.9175.400113.3R2887 I2889 L2926 P2938R2887-E2891 WeakPolarHBondContact CD-OE1 3.3Å; R2887-E2891 VanDerWaalsContact CG-CD 3.43Å; R2887-E2891 HydrophobicContact CG-CG 4.29Å; R2887-E2891 VanDerWaalsContact CG-OE1 3.28Å; R2887-E2891 WeakPolarHBondContact CG-OE1 3.41Å; R2887-E2891 WeakPolarHBondContact CG-OE2 3.28Å; R2887-E2891 IonicContact CZ-OE1 3.09Å; R2887-E2891 IonicContact NE-OE1 3Å; R2887-E2891 IonicContact NH1-OE1 3.21Å; R2887-E2891 PolarHBondContact NH1-OE1 3.18Å; R2887-E2891 WeakPolarHBondContact O-CB 3.35Å; R2887-E2891 WeakPolarHBondContact O-CG 3.38Å; R2887-E2891 PolarHBondContact O-N 3.24Å; I2889-E2891 VanDerWaalsContact C-N 3.34Å; I2889-E2891 PolarHBondContact O-N 3.31Å; E2891-L2926 HydrophobicContact CG-CD2 3.73Å; E2891-L2926 VanDerWaalsContact OE1-CD2 3.29Å; E2891-L2926 WeakPolarHBondContact OE1-CD2 3.35Å; E2891-P2938 VanDerWaalsContact O-CD 3.3Å; E2891-P2938 WeakPolarHBondContact O-CD 3.28Å
2892N87.1Confident91.6Very high63.25 Ų63.2534.5 Ų34.534%0.33817%0.166SC..Hα-helixtrans-130-14.9-166-55.4-93.5000116.1I2852 I2888 I2889I2852-N2892 HydrophobicContact CD1-CB 3.76Å; I2852-N2892 WeakPolarHBondContact CD1-OD1 3.32Å; I2852-N2892 HydrophobicContact CG2-CB 4.37Å; I2888-N2892 WeakPolarHBondContact O-CB 3.33Å; I2888-N2892 PolarHBondContact O-N 3.04Å; I2888-N2892 VanDerWaalsContact O-N 3.16Å; I2888-N2892 PolarHBondContact O-ND2 2.99Å; I2889-N2892 PolarHBondContact O-N 3.22Å
2893V88.1Confident91.6Very high10.75 Ų10.7534.5 Ų34.57%0.06517%0.165CC..SBendtrans-136.5136.4-167.31800000111.6I2852 I2854 L2856 A2857 I2889 F2895 N2941I2852-V2893 HydrophobicContact CG2-CG2 3.91Å; I2854-V2893 WeakPolarHBondContact O-CG1 3.35Å; L2856-V2893 HydrophobicContact CB-CG2 4.31Å; A2857-V2893 HydrophobicContact CB-CG1 4.19Å; I2889-V2893 CarbonylContact O-C 3.4Å; I2889-V2893 WeakPolarHBondContact O-CA 3.45Å; I2889-V2893 PolarHBondContact O-N 3.06Å; V2893-F2895 PolarHBondContact O-N 3.18Å; V2893-N2941 PolarHBondContact O-ND2 3.03Å
2894H87.4Confident91.5Very high110.5 Ų110.534.2 Ų34.251%0.51216%0.163SC..  trans-68.2127.2174.2-57.7110.7000110.9E2940H2894-E2940 IonicContact CD2-OE1 3.49Å; H2894-E2940 IonicContact CD2-OE2 2.79Å; H2894-E2940 PolarHBondContact CD2-OE2 3.12Å
2895F90.5Very high91.5Very high9.75 Ų9.7529.9 Ų29.94%0.04314%0.141CC..  trans-123.1157.6-179.565.8-89.4000112.4A2857 I2889 V2890 V2893 L2897 V2900 M2923 N2941 K2944A2857-F2895 HydrophobicContact CB-CB 4.39Å; I2889-F2895 HydrophobicContact CG2-CB 4.14Å; I2889-F2895 HydrophobicContact CG2-CD1 4.45Å; V2890-F2895 HydrophobicContact CB-CE1 4.27Å; V2890-F2895 HydrophobicContact CG1-CE1 4.29Å; V2890-F2895 HydrophobicContact CG2-CD1 4.31Å; V2890-F2895 HydrophobicContact CG2-CE1 3.78Å; V2890-F2895 HydrophobicContact CG2-CZ 4.16Å; V2893-F2895 PolarHBondContact O-N 3.18Å; F2895-L2897 HydrophobicContact CE2-CD1 4.41Å; F2895-V2900 HydrophobicContact CD2-CB 4.46Å; F2895-V2900 HydrophobicContact CD2-CG2 3.59Å; F2895-V2900 HydrophobicContact CE2-CB 4.45Å; F2895-V2900 HydrophobicContact CE2-CG2 3.96Å; F2895-V2900 HydrophobicContact CG-CG2 4.41Å; F2895-M2923 HydrophobicContact CZ-CE 4.21Å; F2895-N2941 HydrophobicContact CE1-CB 3.93Å; F2895-N2941 VanDerWaalsContact CE1-CG 3.44Å; F2895-N2941 WeakPolarHBondContact CE1-OD1 3.33Å; F2895-K2944 HydrophobicContact CE2-CB 4.19Å; F2895-K2944 HydrophobicContact CE2-CD 4.37Å; F2895-K2944 HydrophobicContact CZ-CB 3.96Å; F2895-K2944 HydrophobicContact CZ-CD 4.35Å; F2895-K2944 WeakPolarHBondContact O-CD 3.5Å; F2895-K2944 PolarHBondContact O-NZ 3.35Å; F2895-K2944 VanDerWaalsContact O-NZ 3.13Å
2896R89.6Confident91.3Very high138 Ų13831.3 Ų31.352%0.52115%0.148SC..  trans-85.8123.9171.7-168.9179.7175.9-174-4.3109.2D2309 L2446 D2448 T2898 S2899D2309-R2896 IonicContact OD1-CZ 2.82Å; D2309-R2896 IonicContact OD1-NH2 3.49Å; D2309-R2896 PolarHBondContact OD1-NH2 3.27Å; L2446-R2896 PolarHBondContact O-NH2 3.19Å; D2448-R2896 VanDerWaalsContact CG-NH2 3.34Å; D2448-R2896 IonicContact OD1-NH2 2.68Å; D2448-R2896 PolarHBondContact OD1-NH2 3.27Å; D2448-R2896 IonicContact OD2-CZ 3.18Å; D2448-R2896 IonicContact OD2-NE 3.83Å; D2448-R2896 PolarHBondContact OD2-NE 2.81Å; D2448-R2896 IonicContact OD2-NH2 3.92Å; D2448-R2896 PolarHBondContact OD2-NH2 3.19Å; R2896-T2898 VanDerWaalsContact C-N 3.3Å; R2896-T2898 WeakPolarHBondContact CD-OG1 3.3Å; R2896-T2898 HydrophobicContact CG-CG2 4.28Å; R2896-T2898 WeakPolarHBondContact CG-OG1 3.42Å; R2896-T2898 VanDerWaalsContact CZ-OG1 3.28Å; R2896-T2898 PolarHBondContact NE-OG1 3.32Å; R2896-T2898 VanDerWaalsContact NE-OG1 3.13Å; R2896-T2898 PolarHBondContact O-N 3.17Å; R2896-S2899 PolarHBondContact O-N 3.38Å
2897L90.7Very high91.2Very high8.25 Ų8.2531.3 Ų31.34%0.04315%0.148CC..Hα-helixtrans-64.8-34.5-173.2178.157.1000113.1F2895 S2899 V2900 I2901 K2944 Q2947 F2948 M2951 L2966 L2969F2895-L2897 HydrophobicContact CE2-CD1 4.41Å; L2897-S2899 VanDerWaalsContact C-N 3.32Å; L2897-S2899 PolarHBondContact O-N 3.08Å; L2897-V2900 PolarHBondContact O-N 3.12Å; L2897-V2900 VanDerWaalsContact O-N 3.13Å; L2897-I2901 HydrophobicContact CD1-CD1 4.14Å; L2897-I2901 HydrophobicContact CD1-CG1 4.07Å; L2897-I2901 HydrophobicContact CD2-CD1 4.38Å; L2897-I2901 HydrophobicContact CG-CD1 3.82Å; L2897-I2901 HydrophobicContact CG-CG1 4.25Å; L2897-I2901 WeakPolarHBondContact O-CG1 3.39Å; L2897-I2901 PolarHBondContact O-N 3.23Å; L2897-K2944 HydrophobicContact CB-CG 4.49Å; L2897-K2944 HydrophobicContact CD2-CB 4.47Å; L2897-Q2947 HydrophobicContact CD2-CB 3.82Å; L2897-Q2947 HydrophobicContact CD2-CG 3.59Å; L2897-F2948 HydrophobicContact CD1-CB 4.03Å; L2897-F2948 HydrophobicContact CD1-CD2 4.36Å; L2897-M2951 HydrophobicContact CD2-SD 4.43Å; L2897-L2966 HydrophobicContact CB-CD1 4.4Å; L2897-L2966 HydrophobicContact CD2-CD1 3.74Å; L2897-L2966 HydrophobicContact CD2-CG 4.47Å; L2897-L2969 HydrophobicContact CB-CD2 4.16Å; L2897-L2969 HydrophobicContact CD2-CD2 3.91Å; L2897-L2969 HydrophobicContact CG-CD2 3.97Å
2898T91.1Very high91Very high31.25 Ų31.2530 Ų3019%0.19215%0.146CC..Hα-helixtrans-53.2-49.5178.7560000112.5R2896 V2900 I2901 E2902 L2969R2896-T2898 VanDerWaalsContact C-N 3.3Å; R2896-T2898 WeakPolarHBondContact CD-OG1 3.3Å; R2896-T2898 HydrophobicContact CG-CG2 4.28Å; R2896-T2898 WeakPolarHBondContact CG-OG1 3.42Å; R2896-T2898 VanDerWaalsContact CZ-OG1 3.28Å; R2896-T2898 PolarHBondContact NE-OG1 3.32Å; R2896-T2898 VanDerWaalsContact NE-OG1 3.13Å; R2896-T2898 PolarHBondContact O-N 3.17Å; T2898-V2900 VanDerWaalsContact C-N 3.31Å; T2898-V2900 PolarHBondContact O-N 3.07Å; T2898-I2901 PolarHBondContact O-N 3.16Å; T2898-E2902 PolarHBondContact O-N 3.12Å; T2898-L2969 HydrophobicContact CG2-CD1 3.49Å; T2898-L2969 VanDerWaalsContact CG2-CD1 3.47Å; T2898-L2969 HydrophobicContact CG2-CD2 4.11Å; T2898-L2969 HydrophobicContact CG2-CG 4.18Å
2899S90.8Very high90.8Very high27.25 Ų27.2536.1 Ų36.119%0.19117%0.166CC..Hα-helixtrans-65.5-27.7-177.9-51.10000112.9V2860 R2896 L2897 L2903V2860-S2899 WeakPolarHBondContact CG1-O 3.28Å; R2896-S2899 PolarHBondContact O-N 3.38Å; L2897-S2899 VanDerWaalsContact C-N 3.32Å; L2897-S2899 PolarHBondContact O-N 3.08Å; S2899-L2903 VanDerWaalsContact O-CB 3.29Å; S2899-L2903 WeakPolarHBondContact O-CB 3.36Å; S2899-L2903 PolarHBondContact O-N 3.19Å; S2899-L2903 VanDerWaalsContact O-N 3.07Å
2900V93.3Very high90.6Very high0.5 Ų0.538.3 Ų38.30%0.00318%0.18CC..Hα-helixtrans-83.2-34.2176.9-174.60000111.6V2860 L2886 F2895 L2897 T2898 E2902 L2903 C2904 M2923V2860-V2900 HydrophobicContact CG1-CG2 4.1Å; V2860-V2900 HydrophobicContact CG2-CG2 4.44Å; L2886-V2900 HydrophobicContact CD1-CG1 4.11Å; L2886-V2900 HydrophobicContact CD1-CG2 4.48Å; F2895-V2900 HydrophobicContact CD2-CB 4.46Å; F2895-V2900 HydrophobicContact CD2-CG2 3.59Å; F2895-V2900 HydrophobicContact CE2-CB 4.45Å; F2895-V2900 HydrophobicContact CE2-CG2 3.96Å; F2895-V2900 HydrophobicContact CG-CG2 4.41Å; L2897-V2900 PolarHBondContact O-N 3.12Å; L2897-V2900 VanDerWaalsContact O-N 3.13Å; T2898-V2900 VanDerWaalsContact C-N 3.31Å; T2898-V2900 PolarHBondContact O-N 3.07Å; V2900-E2902 VanDerWaalsContact C-N 3.34Å; V2900-L2903 PolarHBondContact O-N 3.41Å; V2900-C2904 VanDerWaalsContact O-CB 3.32Å; V2900-C2904 WeakPolarHBondContact O-CB 3.41Å; V2900-C2904 PolarHBondContact O-N 3.12Å; V2900-C2904 PolarHBondContact O-SG 2.91Å; V2900-C2904 VanDerWaalsContact O-SG 3.34Å; V2900-M2923 HydrophobicContact CG1-CE 3.57Å; V2900-M2923 VanDerWaalsContact CG1-CE 3.5Å; V2900-M2923 HydrophobicContact CG1-CG 4.48Å; V2900-M2923 HydrophobicContact CG1-SD 4Å
2901I92.3Very high90.4Very high17.25 Ų17.2539 Ų399%0.08818%0.184CC..Hα-helixtrans-60.8-47169.1-69170.6000110.1L2897 T2898 C2904 S2905 F2948 M2951 L2969 F2978 T2980L2897-I2901 HydrophobicContact CD1-CD1 4.14Å; L2897-I2901 HydrophobicContact CD1-CG1 4.07Å; L2897-I2901 HydrophobicContact CD2-CD1 4.38Å; L2897-I2901 HydrophobicContact CG-CD1 3.82Å; L2897-I2901 HydrophobicContact CG-CG1 4.25Å; L2897-I2901 WeakPolarHBondContact O-CG1 3.39Å; L2897-I2901 PolarHBondContact O-N 3.23Å; T2898-I2901 PolarHBondContact O-N 3.16Å; I2901-C2904 PolarHBondContact O-N 3.22Å; I2901-S2905 VanDerWaalsContact O-CB 3.32Å; I2901-S2905 WeakPolarHBondContact O-CB 3.34Å; I2901-S2905 PolarHBondContact O-N 3.15Å; I2901-S2905 PolarHBondContact O-OG 2.83Å; I2901-S2905 VanDerWaalsContact O-OG 3.05Å; I2901-F2948 HydrophobicContact CG1-CD2 3.89Å; I2901-F2948 HydrophobicContact CG1-CE2 4.36Å; I2901-M2951 HydrophobicContact CD1-CE 3.89Å; I2901-M2951 HydrophobicContact CD1-SD 3.73Å; I2901-L2969 HydrophobicContact CD1-CD2 4.18Å; I2901-F2978 HydrophobicContact CG2-CB 3.92Å; I2901-F2978 HydrophobicContact CG2-CG 4.42Å; I2901-T2980 HydrophobicContact CG2-CG2 4.31Å
2902E92.1Very high90.1Very high60.5 Ų60.542 Ų4228%0.28320%0.196SC..Hα-helixtrans-59.4-51.1175.4-174.1177.8-168.400111.2T2864 R2868 T2898 V2900 C2904 S2905 L2906T2864-E2902 HydrophobicContact CG2-CG 4.05Å; R2868-E2902 IonicContact CZ-OE1 3.31Å; R2868-E2902 VanDerWaalsContact CZ-OE1 3.26Å; R2868-E2902 IonicContact NE-OE1 2.87Å; R2868-E2902 IonicContact NH1-OE1 3.49Å; R2868-E2902 PolarHBondContact NH1-OE1 3.03Å; R2868-E2902 IonicContact NH2-OE1 2.7Å; R2868-E2902 PolarHBondContact NH2-OE1 3.19Å; R2868-E2902 IonicContact NH2-OE2 3.83Å; T2898-E2902 PolarHBondContact O-N 3.12Å; V2900-E2902 VanDerWaalsContact C-N 3.34Å; E2902-C2904 VanDerWaalsContact C-N 3.33Å; E2902-C2904 PolarHBondContact O-N 3.05Å; E2902-S2905 PolarHBondContact O-N 3.1Å; E2902-S2905 PolarHBondContact O-OG 3.05Å; E2902-L2906 HydrophobicContact CG-CD1 3.74Å; E2902-L2906 HydrophobicContact CG-CG 4.32Å; E2902-L2906 VanDerWaalsContact O-CB 3.25Å; E2902-L2906 WeakPolarHBondContact O-CB 3.4Å; E2902-L2906 WeakPolarHBondContact O-CG 3.34Å; E2902-L2906 PolarHBondContact O-N 3.19Å
2903L93.7Very high89.6Confident0 Ų044.8 Ų44.80%021%0.211CC..Hα-helixtrans-56.1-45.4178.7-179.867.8000112.6V2860 M2863 L2867 S2899 V2900 S2907 L2919V2860-L2903 HydrophobicContact CG1-CB 4.43Å; V2860-L2903 HydrophobicContact CG1-CD2 4.14Å; M2863-L2903 HydrophobicContact CB-CD1 3.64Å; M2863-L2903 HydrophobicContact CB-CD2 4.15Å; M2863-L2903 HydrophobicContact CE-CD2 3.78Å; M2863-L2903 HydrophobicContact SD-CD2 3.84Å; L2867-L2903 HydrophobicContact CD1-CD1 3.77Å; L2867-L2903 HydrophobicContact CG-CD1 4.32Å; S2899-L2903 VanDerWaalsContact O-CB 3.29Å; S2899-L2903 WeakPolarHBondContact O-CB 3.36Å; S2899-L2903 PolarHBondContact O-N 3.19Å; S2899-L2903 VanDerWaalsContact O-N 3.07Å; V2900-L2903 PolarHBondContact O-N 3.41Å; L2903-S2907 VanDerWaalsContact O-CB 3.27Å; L2903-S2907 WeakPolarHBondContact O-CB 3.45Å; L2903-S2907 PolarHBondContact O-N 3.1Å; L2903-L2919 HydrophobicContact CD1-CD1 4.17Å; L2903-L2919 HydrophobicContact CD2-CD1 4.07Å; L2903-L2919 HydrophobicContact CG-CD1 3.81Å
2904C93.6Very high89.1Confident0 Ų056 Ų560%025%0.252CS..Hα-helixtrans-70.5-39.2179.5-74.50000112.7V2900 I2901 E2902 S2907 N2908 F2948 T2980V2900-C2904 VanDerWaalsContact O-CB 3.32Å; V2900-C2904 WeakPolarHBondContact O-CB 3.41Å; V2900-C2904 PolarHBondContact O-N 3.12Å; V2900-C2904 PolarHBondContact O-SG 2.91Å; V2900-C2904 VanDerWaalsContact O-SG 3.34Å; I2901-C2904 PolarHBondContact O-N 3.22Å; E2902-C2904 VanDerWaalsContact C-N 3.33Å; E2902-C2904 PolarHBondContact O-N 3.05Å; C2904-S2907 WeakPolarHBondContact O-CB 3.38Å; C2904-S2907 PolarHBondContact O-N 3.16Å; C2904-N2908 WeakPolarHBondContact O-CB 3.25Å; C2904-N2908 PolarHBondContact O-N 3.19Å; C2904-N2908 VanDerWaalsContact O-N 3.15Å; C2904-F2948 HydrophobicContact CB-CE2 3.87Å; C2904-F2948 HydrophobicContact CB-CZ 3.8Å; C2904-T2980 HydrophobicContact CB-CG2 4.18Å
2905S91.9Very high89Confident4.5 Ų4.552.8 Ų52.83%0.03124%0.24CC..Hα-helixtrans-65.3-41.8174.4161.60000111.9I2901 E2902 S2907 N2908 R2909 F2978 P2979I2901-S2905 VanDerWaalsContact O-CB 3.32Å; I2901-S2905 WeakPolarHBondContact O-CB 3.34Å; I2901-S2905 PolarHBondContact O-N 3.15Å; I2901-S2905 PolarHBondContact O-OG 2.83Å; I2901-S2905 VanDerWaalsContact O-OG 3.05Å; E2902-S2905 PolarHBondContact O-N 3.1Å; E2902-S2905 PolarHBondContact O-OG 3.05Å; S2905-S2907 PolarHBondContact O-N 2.97Å; S2905-N2908 WeakPolarHBondContact O-CB 3.38Å; S2905-N2908 PolarHBondContact O-N 3.03Å; S2905-N2908 VanDerWaalsContact O-N 3.14Å; S2905-R2909 VanDerWaalsContact O-CG 3.28Å; S2905-R2909 WeakPolarHBondContact O-CG 3.32Å; S2905-R2909 PolarHBondContact O-N 2.97Å; S2905-R2909 VanDerWaalsContact O-N 3.09Å; S2905-F2978 WeakPolarHBondContact OG-CA 3.34Å; S2905-P2979 PolarHBondContact OG-O 3.3Å
2906L91.2Very high89Confident28.5 Ų28.555.7 Ų55.715%0.14925%0.253CS..Hα-helixtrans-66.7-39.4176.2-150.881.6000111.6T2864 L2867 R2868 E2902 N2908 R2909 V2910T2864-L2906 HydrophobicContact CG2-CD1 3.73Å; T2864-L2906 HydrophobicContact CG2-CD2 3.95Å; T2864-L2906 WeakPolarHBondContact O-CD2 3.29Å; L2867-L2906 HydrophobicContact CB-CB 4.35Å; L2867-L2906 HydrophobicContact CB-CD2 3.72Å; L2867-L2906 HydrophobicContact CB-CG 3.94Å; L2867-L2906 HydrophobicContact CD1-CB 4.36Å; R2868-L2906 HydrophobicContact CB-CD2 4.31Å; R2868-L2906 HydrophobicContact CG-CD1 3.99Å; R2868-L2906 HydrophobicContact CG-CD2 4.22Å; E2902-L2906 HydrophobicContact CG-CD1 3.74Å; E2902-L2906 HydrophobicContact CG-CG 4.32Å; E2902-L2906 VanDerWaalsContact O-CB 3.25Å; E2902-L2906 WeakPolarHBondContact O-CB 3.4Å; E2902-L2906 WeakPolarHBondContact O-CG 3.34Å; E2902-L2906 PolarHBondContact O-N 3.19Å; L2906-N2908 VanDerWaalsContact C-N 3.32Å; L2906-N2908 PolarHBondContact O-N 2.97Å; L2906-R2909 PolarHBondContact O-N 3.1Å; L2906-R2909 VanDerWaalsContact O-N 3.12Å; L2906-V2910 HydrophobicContact CD1-CG2 3.76Å; L2906-V2910 HydrophobicContact CG-CG2 4.21Å; L2906-V2910 WeakPolarHBondContact O-CB 3.34Å; L2906-V2910 WeakPolarHBondContact O-CG2 3.38Å; L2906-V2910 PolarHBondContact O-N 2.89Å
2907S91.9Very high89Confident0 Ų050.6 Ų50.60%024%0.24CC..Hα-helixtrans-56.4-44.7171.5-170.40000112.1L2903 C2904 S2905 R2909 L2911 K2916L2903-S2907 VanDerWaalsContact O-CB 3.27Å; L2903-S2907 WeakPolarHBondContact O-CB 3.45Å; L2903-S2907 PolarHBondContact O-N 3.1Å; C2904-S2907 WeakPolarHBondContact O-CB 3.38Å; C2904-S2907 PolarHBondContact O-N 3.16Å; S2905-S2907 PolarHBondContact O-N 2.97Å; S2907-R2909 VanDerWaalsContact C-N 3.34Å; S2907-R2909 PolarHBondContact O-N 3.25Å; S2907-L2911 WeakPolarHBondContact O-CB 3.41Å; S2907-L2911 PolarHBondContact O-N 2.97Å; S2907-L2911 VanDerWaalsContact O-N 3.17Å; S2907-L2911 VanDerWaalsContact OG-CD1 3.32Å; S2907-L2911 WeakPolarHBondContact OG-CD1 3.46Å; S2907-K2916 CarbonylContact C-O 3.48Å; S2907-K2916 VanDerWaalsContact C-O 3.26Å; S2907-K2916 PolarHBondContact OG-O 2.88Å
2908N88.5Confident89.1Confident35.5 Ų35.552.6 Ų52.619%0.1925%0.25CC..Hα-helixtrans-65.9-30.2176.8-104.7-10.4000113.9C2904 S2905 L2906 K2916 A2917 P2979 T2980C2904-N2908 WeakPolarHBondContact O-CB 3.25Å; C2904-N2908 PolarHBondContact O-N 3.19Å; C2904-N2908 VanDerWaalsContact O-N 3.15Å; S2905-N2908 WeakPolarHBondContact O-CB 3.38Å; S2905-N2908 PolarHBondContact O-N 3.03Å; S2905-N2908 VanDerWaalsContact O-N 3.14Å; L2906-N2908 VanDerWaalsContact C-N 3.32Å; L2906-N2908 PolarHBondContact O-N 2.97Å; N2908-K2916 VanDerWaalsContact CA-O 3.28Å; N2908-K2916 WeakPolarHBondContact CA-O 3.41Å; N2908-K2916 PolarHBondContact N-O 2.92Å; N2908-K2916 VanDerWaalsContact OD1-C 3.26Å; N2908-K2916 PolarHBondContact OD1-O 3.11Å; N2908-K2916 VanDerWaalsContact OD1-O 3.1Å; N2908-A2917 WeakPolarHBondContact OD1-CA 3.42Å; N2908-A2917 PolarHBondContact OD1-N 3.1Å; N2908-P2979 PolarHBondContact ND2-O 3.19Å; N2908-T2980 VanDerWaalsContact ND2-CA 3.33Å; N2908-T2980 WeakPolarHBondContact ND2-CA 3.38Å; N2908-T2980 PolarHBondContact ND2-O 3.19Å
2909R88.7Confident89.2Confident160 Ų16051.2 Ų51.260%0.60424%0.241SC*.Hα-helixtrans-87.3-35.7-177.8-70.817667.4173.7-0.5113.8E2438 S2905 L2906 S2907E2438-R2909 IonicContact OE1-NH2 3.74Å; E2438-R2909 PolarHBondContact OE1-NH2 3.3Å; S2905-R2909 VanDerWaalsContact O-CG 3.28Å; S2905-R2909 WeakPolarHBondContact O-CG 3.32Å; S2905-R2909 PolarHBondContact O-N 2.97Å; S2905-R2909 VanDerWaalsContact O-N 3.09Å; L2906-R2909 PolarHBondContact O-N 3.1Å; L2906-R2909 VanDerWaalsContact O-N 3.12Å; S2907-R2909 VanDerWaalsContact C-N 3.34Å; S2907-R2909 PolarHBondContact O-N 3.25Å
2910V87.8Confident89.4Confident47.25 Ų47.2549.9 Ų49.929%0.28623%0.232SC..Hα-helixtrans-99.7-31.2-170.1179.30000113.3A2872 S2873 L2906A2872-V2910 HydrophobicContact CB-CG1 4.19Å; S2873-V2910 VanDerWaalsContact CB-O 3.3Å; S2873-V2910 WeakPolarHBondContact CB-O 3.36Å; L2906-V2910 HydrophobicContact CD1-CG2 3.76Å; L2906-V2910 HydrophobicContact CG-CG2 4.21Å; L2906-V2910 WeakPolarHBondContact O-CB 3.34Å; L2906-V2910 WeakPolarHBondContact O-CG2 3.38Å; L2906-V2910 PolarHBondContact O-N 2.89Å
2911L87.9Confident89.4Confident15.5 Ų15.554.8 Ų54.88%0.08125%0.25CS..SBendtrans-86151.4-176.8-57.2-179.7000112.3L2867 P2879 S2907 K2916L2867-L2911 HydrophobicContact CD2-CD2 4.2Å; L2867-L2911 HydrophobicContact CD2-CG 4.44Å; P2879-L2911 HydrophobicContact CB-CD1 4.1Å; P2879-L2911 HydrophobicContact CG-CD1 3.8Å; P2879-L2911 HydrophobicContact CG-CD2 4.42Å; S2907-L2911 WeakPolarHBondContact O-CB 3.41Å; S2907-L2911 PolarHBondContact O-N 2.97Å; S2907-L2911 VanDerWaalsContact O-N 3.17Å; S2907-L2911 VanDerWaalsContact OG-CD1 3.32Å; S2907-L2911 WeakPolarHBondContact OG-CD1 3.46Å; L2911-K2916 WeakPolarHBondContact O-CB 3.45Å
2912K84.5Confident89.6Confident113.25 Ų113.2554.5 Ų54.549%0.49225%0.249SC..  trans-67153.3-179.5-70.5154.3-176.4157.10110.7S2873 N2874 R2914 T2915 K2916S2873-K2912 WeakPolarHBondContact O-CD 3.22Å; S2873-K2912 WeakPolarHBondContact O-CE 3.37Å; S2873-K2912 PolarHBondContact O-NZ 3.08Å; S2873-K2912 PolarHBondContact OG-NZ 3.17Å; N2874-K2912 PolarHBondContact OD1-NZ 3.17Å; N2874-K2912 VanDerWaalsContact OD1-NZ 3.07Å; K2912-R2914 PolarHBondContact O-N 3.46Å; K2912-T2915 PolarHBondContact O-N 3.25Å; K2912-T2915 PolarHBondContact O-OG1 3.1Å; K2912-K2916 PolarHBondContact O-N 3.31Å; K2912-K2916 VanDerWaalsContact O-N 3.08Å
2913D76Confident89.7Confident123 Ų12351.6 Ų51.666%0.65824%0.235SC*.THydrogen-bonded Turntrans-48.8-29.1-167.9-73.8-73.1000117.2T2915 K2916D2913-T2915 VanDerWaalsContact C-N 3.32Å; D2913-T2915 PolarHBondContact O-N 3.25Å; D2913-K2916 WeakPolarHBondContact OD1-CE 3.23Å; D2913-K2916 IonicContact OD1-NZ 3.25Å; D2913-K2916 PolarHBondContact OD1-NZ 3.04Å
2914R77.1Confident89.8Confident246 Ų24651.7 Ų51.793%0.92824%0.236SC*.THydrogen-bonded Turntrans-73.6-20.2178.2-68.2-175.2175.7127.90.2114.1K2912K2912-R2914 PolarHBondContact O-N 3.46Å
2915T86.8Confident89.9Confident42.5 Ų42.553.8 Ų53.826%0.26125%0.247SC..THydrogen-bonded Turntrans-127.3-6.6-174.851.90000114P2879 K2912 D2913 A2917 Q2918P2879-T2915 HydrophobicContact CB-CG2 4.45Å; P2879-T2915 HydrophobicContact CG-CG2 4.32Å; K2912-T2915 PolarHBondContact O-N 3.25Å; K2912-T2915 PolarHBondContact O-OG1 3.1Å; D2913-T2915 VanDerWaalsContact C-N 3.32Å; D2913-T2915 PolarHBondContact O-N 3.25Å; T2915-A2917 VanDerWaalsContact C-N 3.33Å; T2915-A2917 PolarHBondContact O-N 3.27Å; T2915-A2917 VanDerWaalsContact O-N 3.11Å; T2915-Q2918 WeakPolarHBondContact O-CB 3.32Å; T2915-Q2918 PolarHBondContact O-N 3.13Å; T2915-Q2918 VanDerWaalsContact O-N 3.07Å
2916K89.4Confident90Very high71 Ų7153.6 Ų53.631%0.30925%0.246SC..THydrogen-bonded Turntrans-50.9-45.1-179.573.5179.7174.8-170.80114.3S2907 N2908 L2911 K2912 D2913 Q2918S2907-K2916 CarbonylContact C-O 3.48Å; S2907-K2916 VanDerWaalsContact C-O 3.26Å; S2907-K2916 PolarHBondContact OG-O 2.88Å; N2908-K2916 VanDerWaalsContact CA-O 3.28Å; N2908-K2916 WeakPolarHBondContact CA-O 3.41Å; N2908-K2916 PolarHBondContact N-O 2.92Å; N2908-K2916 VanDerWaalsContact OD1-C 3.26Å; N2908-K2916 PolarHBondContact OD1-O 3.11Å; N2908-K2916 VanDerWaalsContact OD1-O 3.1Å; L2911-K2916 WeakPolarHBondContact O-CB 3.45Å; K2912-K2916 PolarHBondContact O-N 3.31Å; K2912-K2916 VanDerWaalsContact O-N 3.08Å; D2913-K2916 WeakPolarHBondContact OD1-CE 3.23Å; D2913-K2916 IonicContact OD1-NZ 3.25Å; D2913-K2916 PolarHBondContact OD1-NZ 3.04Å; K2916-Q2918 VanDerWaalsContact C-N 3.33Å; K2916-Q2918 PolarHBondContact O-N 2.99Å
2917A89.8Confident90.2Very high31 Ų3152.4 Ų52.426%0.25624%0.239SC..THydrogen-bonded Turntrans-91.712.4-178.900000113.9N2908 T2915 R2921 L2985N2908-A2917 WeakPolarHBondContact OD1-CA 3.42Å; N2908-A2917 PolarHBondContact OD1-N 3.1Å; T2915-A2917 VanDerWaalsContact C-N 3.33Å; T2915-A2917 PolarHBondContact O-N 3.27Å; T2915-A2917 VanDerWaalsContact O-N 3.11Å; A2917-R2921 VanDerWaalsContact O-CB 3.25Å; A2917-R2921 WeakPolarHBondContact O-CB 3.41Å; A2917-R2921 PolarHBondContact O-N 3.33Å; A2917-L2985 HydrophobicContact CB-CD1 4.31Å; A2917-L2985 HydrophobicContact CB-CD2 4.46Å
2918Q92.1Very high90.3Very high50.75 Ų50.7554.6 Ų54.624%0.23725%0.248CC..Hα-helixtrans-68.7-39.5-170.817958.524.200113P2879 S2883 T2915 K2916 T2922P2879-Q2918 HydrophobicContact CB-CB 4.44Å; P2879-Q2918 HydrophobicContact CB-CG 4.21Å; S2883-Q2918 WeakPolarHBondContact OG-CG 3.37Å; S2883-Q2918 PolarHBondContact OG-NE2 3Å; T2915-Q2918 WeakPolarHBondContact O-CB 3.32Å; T2915-Q2918 PolarHBondContact O-N 3.13Å; T2915-Q2918 VanDerWaalsContact O-N 3.07Å; K2916-Q2918 VanDerWaalsContact C-N 3.33Å; K2916-Q2918 PolarHBondContact O-N 2.99Å; Q2918-T2922 PolarHBondContact O-N 3.2Å; Q2918-T2922 VanDerWaalsContact O-N 3.09Å; Q2918-T2922 PolarHBondContact O-OG1 3.19Å
2919L94.4Very high90.5Very high1 Ų155.7 Ų55.71%0.00525%0.252CS..Hα-helixtrans-72.1-45.6176.9-57-171.9000111.1L2867 F2882 L2886 L2903 R2921 T2922 M2923L2867-L2919 HydrophobicContact CD1-CD1 4.38Å; F2882-L2919 HydrophobicContact CB-CD1 4.41Å; F2882-L2919 HydrophobicContact CB-CD2 3.78Å; F2882-L2919 HydrophobicContact CD2-CD1 4.49Å; L2886-L2919 HydrophobicContact CD2-CB 4.18Å; L2886-L2919 HydrophobicContact CD2-CD2 4.45Å; L2903-L2919 HydrophobicContact CD1-CD1 4.17Å; L2903-L2919 HydrophobicContact CD2-CD1 4.07Å; L2903-L2919 HydrophobicContact CG-CD1 3.81Å; L2919-R2921 VanDerWaalsContact C-N 3.27Å; L2919-R2921 PolarHBondContact O-N 2.93Å; L2919-T2922 WeakPolarHBondContact O-CA 3.44Å; L2919-T2922 WeakPolarHBondContact O-CB 3.35Å; L2919-T2922 PolarHBondContact O-N 2.96Å; L2919-T2922 VanDerWaalsContact O-N 3.11Å; L2919-M2923 WeakPolarHBondContact O-CG 3.33Å; L2919-M2923 PolarHBondContact O-N 3.13Å; L2919-M2923 VanDerWaalsContact O-N 3.07Å
2920S94Very high90.6Very high0 Ų048.6 Ų48.60%023%0.227CC..Hα-helixtrans-58.3-38.6173.5-49.50000112.3M2923 V2924 T2980S2920-M2923 WeakPolarHBondContact O-CB 3.31Å; S2920-M2923 PolarHBondContact O-N 3.19Å; S2920-V2924 WeakPolarHBondContact O-CG2 3.18Å; S2920-V2924 PolarHBondContact O-N 3.29Å; S2920-T2980 VanDerWaalsContact CB-O 3.22Å; S2920-T2980 WeakPolarHBondContact CB-O 3.24Å; S2920-T2980 PolarHBondContact OG-O 3.24Å
2921R95Very high90.8Very high104 Ų10447 Ų4739%0.39222%0.216SC..Hα-helixtrans-61.6-44.5172.8173.3173-61.1-68.5-0.8111.4A2917 L2919 M2923 V2924 D2925 L2985A2917-R2921 VanDerWaalsContact O-CB 3.25Å; A2917-R2921 WeakPolarHBondContact O-CB 3.41Å; A2917-R2921 PolarHBondContact O-N 3.33Å; L2919-R2921 VanDerWaalsContact C-N 3.27Å; L2919-R2921 PolarHBondContact O-N 2.93Å; R2921-M2923 VanDerWaalsContact C-N 3.31Å; R2921-M2923 PolarHBondContact O-N 2.99Å; R2921-V2924 PolarHBondContact O-N 3.09Å; R2921-D2925 VanDerWaalsContact CG-OD2 3.28Å; R2921-D2925 WeakPolarHBondContact CG-OD2 3.42Å; R2921-D2925 VanDerWaalsContact O-CB 3.3Å; R2921-D2925 WeakPolarHBondContact O-CB 3.4Å; R2921-D2925 VanDerWaalsContact O-CG 3.27Å; R2921-D2925 PolarHBondContact O-N 3.19Å; R2921-L2985 HydrophobicContact CB-CD1 4.23Å; R2921-L2985 HydrophobicContact CB-CD2 4.36Å; R2921-L2985 VanDerWaalsContact NH2-CD2 3.3Å
2922T95Very high90.9Very high9.5 Ų9.549.2 Ų49.26%0.05823%0.225CC..Hα-helixtrans-59.3-42.6177.6-58.60000111.5S2883 R2887 Q2918 L2919 L2926S2883-T2922 WeakPolarHBondContact CB-OG1 3.38Å; S2883-T2922 PolarHBondContact OG-OG1 3.29Å; R2887-T2922 HydrophobicContact CB-CG2 4.37Å; Q2918-T2922 PolarHBondContact O-N 3.2Å; Q2918-T2922 VanDerWaalsContact O-N 3.09Å; Q2918-T2922 PolarHBondContact O-OG1 3.19Å; L2919-T2922 WeakPolarHBondContact O-CA 3.44Å; L2919-T2922 WeakPolarHBondContact O-CB 3.35Å; L2919-T2922 PolarHBondContact O-N 2.96Å; L2919-T2922 VanDerWaalsContact O-N 3.11Å; T2922-L2926 HydrophobicContact CG2-CD1 4.1Å; T2922-L2926 WeakPolarHBondContact O-CB 3.36Å; T2922-L2926 VanDerWaalsContact O-CD1 3.31Å; T2922-L2926 WeakPolarHBondContact O-CD1 3.42Å; T2922-L2926 VanDerWaalsContact O-CG 3.27Å; T2922-L2926 WeakPolarHBondContact O-CG 3.38Å; T2922-L2926 PolarHBondContact O-N 3.14Å
2923M94.9Very high91.2Very high0.25 Ų0.2547 Ų470%0.00122%0.216CC..Hα-helixtrans-62.8-45.6175.4-63.3-66.8-76.900112.5L2886 V2890 F2895 V2900 L2919 S2920 R2921 L2926 F2927 L2945 F2948L2886-M2923 HydrophobicContact CD1-SD 4.07Å; L2886-M2923 HydrophobicContact CD2-CG 4Å; L2886-M2923 HydrophobicContact CD2-SD 3.8Å; L2886-M2923 HydrophobicContact CG-SD 3.88Å; V2890-M2923 HydrophobicContact CG2-CE 4.02Å; V2890-M2923 HydrophobicContact CG2-SD 3.83Å; F2895-M2923 HydrophobicContact CZ-CE 4.21Å; V2900-M2923 HydrophobicContact CG1-CE 3.57Å; V2900-M2923 VanDerWaalsContact CG1-CE 3.5Å; V2900-M2923 HydrophobicContact CG1-CG 4.48Å; V2900-M2923 HydrophobicContact CG1-SD 4Å; L2919-M2923 WeakPolarHBondContact O-CG 3.33Å; L2919-M2923 PolarHBondContact O-N 3.13Å; L2919-M2923 VanDerWaalsContact O-N 3.07Å; S2920-M2923 WeakPolarHBondContact O-CB 3.31Å; S2920-M2923 PolarHBondContact O-N 3.19Å; R2921-M2923 VanDerWaalsContact C-N 3.31Å; R2921-M2923 PolarHBondContact O-N 2.99Å; M2923-L2926 WeakPolarHBondContact O-CB 3.32Å; M2923-L2926 PolarHBondContact O-N 3.37Å; M2923-F2927 PolarHBondContact O-N 3.04Å; M2923-F2927 VanDerWaalsContact O-N 3.13Å; M2923-L2945 HydrophobicContact CB-CD2 4.3Å; M2923-L2945 HydrophobicContact CE-CD2 3.5Å; M2923-L2945 VanDerWaalsContact CE-CD2 3.45Å; M2923-L2945 WeakPolarHBondContact O-CD2 3.17Å; M2923-L2945 HydrophobicContact SD-CD2 4.1Å; M2923-F2948 HydrophobicContact CB-CD1 4.04Å; M2923-F2948 HydrophobicContact CB-CE1 3.63Å; M2923-F2948 HydrophobicContact CB-CZ 4.27Å; M2923-F2948 HydrophobicContact CE-CD1 4.32Å; M2923-F2948 HydrophobicContact CE-CD2 4.34Å; M2923-F2948 HydrophobicContact CE-CE2 4.48Å; M2923-F2948 HydrophobicContact CE-CG 4.22Å; M2923-F2948 HydrophobicContact CG-CE1 4.05Å; M2923-F2948 HydrophobicContact CG-CZ 4.2Å
2924V95.4Very high91.8Very high1.25 Ų1.2550.7 Ų50.71%0.00822%0.22CC..Hα-helixtrans-66.9-42.9178169.80000111.6S2920 R2921 L2926 F2927 Y2928 I2949 A2982 L2985 M2986S2920-V2924 WeakPolarHBondContact O-CG2 3.18Å; S2920-V2924 PolarHBondContact O-N 3.29Å; R2921-V2924 PolarHBondContact O-N 3.09Å; V2924-L2926 VanDerWaalsContact C-N 3.31Å; V2924-L2926 PolarHBondContact O-N 3.09Å; V2924-F2927 PolarHBondContact O-N 3.09Å; V2924-Y2928 VanDerWaalsContact O-CB 3.23Å; V2924-Y2928 WeakPolarHBondContact O-CB 3.38Å; V2924-Y2928 PolarHBondContact O-N 3.2Å; V2924-I2949 HydrophobicContact CG2-CD1 4.24Å; V2924-I2949 HydrophobicContact CG2-CG1 4.21Å; V2924-A2982 HydrophobicContact CG2-CB 4.1Å; V2924-L2985 HydrophobicContact CB-CB 4.41Å; V2924-L2985 HydrophobicContact CG1-CB 4.31Å; V2924-L2985 HydrophobicContact CG2-CB 4.09Å; V2924-M2986 HydrophobicContact CG1-CB 4.16Å; V2924-M2986 HydrophobicContact CG1-SD 3.75Å
2925D94.9Very high92.2Very high45.25 Ų45.2539.5 Ų39.524%0.24218%0.181CC..Hα-helixtrans-62.3-37.5177.4-75.6-25.4000111.6R2921 Q2929R2921-D2925 VanDerWaalsContact CG-OD2 3.28Å; R2921-D2925 WeakPolarHBondContact CG-OD2 3.42Å; R2921-D2925 VanDerWaalsContact O-CB 3.3Å; R2921-D2925 WeakPolarHBondContact O-CB 3.4Å; R2921-D2925 VanDerWaalsContact O-CG 3.27Å; R2921-D2925 PolarHBondContact O-N 3.19Å; D2925-Q2929 VanDerWaalsContact O-CB 3.28Å; D2925-Q2929 WeakPolarHBondContact O-CB 3.45Å; D2925-Q2929 VanDerWaalsContact O-CD 3.28Å; D2925-Q2929 WeakPolarHBondContact O-CG 3.4Å; D2925-Q2929 PolarHBondContact O-N 3.19Å; D2925-Q2929 PolarHBondContact O-NE2 2.99Å
2926L94.4Very high92.1Very high0 Ų039.8 Ų39.80%018%0.184CC..Hα-helixtrans-63.6-50.7173.6-80.8160.3000112.1R2887 V2890 E2891 T2922 M2923 V2924 Y2928 Q2929 S2930 I2937 L2945R2887-L2926 HydrophobicContact CB-CD1 4.43Å; R2887-L2926 HydrophobicContact CG-CD2 4.25Å; R2887-L2926 VanDerWaalsContact NH1-CD2 3.31Å; V2890-L2926 HydrophobicContact CB-CD1 4.04Å; V2890-L2926 HydrophobicContact CG1-CD1 4Å; V2890-L2926 HydrophobicContact CG2-CD1 4.45Å; E2891-L2926 HydrophobicContact CG-CD2 3.73Å; E2891-L2926 VanDerWaalsContact OE1-CD2 3.29Å; E2891-L2926 WeakPolarHBondContact OE1-CD2 3.35Å; T2922-L2926 HydrophobicContact CG2-CD1 4.1Å; T2922-L2926 WeakPolarHBondContact O-CB 3.36Å; T2922-L2926 VanDerWaalsContact O-CD1 3.31Å; T2922-L2926 WeakPolarHBondContact O-CD1 3.42Å; T2922-L2926 VanDerWaalsContact O-CG 3.27Å; T2922-L2926 WeakPolarHBondContact O-CG 3.38Å; T2922-L2926 PolarHBondContact O-N 3.14Å; M2923-L2926 WeakPolarHBondContact O-CB 3.32Å; M2923-L2926 PolarHBondContact O-N 3.37Å; V2924-L2926 VanDerWaalsContact C-N 3.31Å; V2924-L2926 PolarHBondContact O-N 3.09Å; L2926-Y2928 VanDerWaalsContact C-N 3.32Å; L2926-Y2928 PolarHBondContact O-N 3.31Å; L2926-Q2929 WeakPolarHBondContact O-CB 3.38Å; L2926-Q2929 PolarHBondContact O-N 3.23Å; L2926-Q2929 VanDerWaalsContact O-N 3.13Å; L2926-S2930 PolarHBondContact O-N 3.07Å; L2926-S2930 PolarHBondContact O-OG 3.22Å; L2926-S2930 VanDerWaalsContact O-OG 3.07Å; L2926-I2937 HydrophobicContact CB-CD1 4.07Å; L2926-I2937 HydrophobicContact CD2-CD1 4.05Å; L2926-L2945 HydrophobicContact CB-CD1 4.36Å
2927F95.1Very high92.1Very high2.5 Ų2.536.5 Ų36.51%0.01117%0.17CC..Hα-helixtrans-60.8-44.2178.6-175.7-114.7000111.9M2923 V2924 S2930 I2931 L2942 L2945 L2946 I2949 M2986 L3102 L3106M2923-F2927 PolarHBondContact O-N 3.04Å; M2923-F2927 VanDerWaalsContact O-N 3.13Å; V2924-F2927 PolarHBondContact O-N 3.09Å; F2927-S2930 WeakPolarHBondContact O-CB 3.34Å; F2927-S2930 PolarHBondContact O-N 2.94Å; F2927-S2930 VanDerWaalsContact O-N 3.14Å; F2927-I2931 HydrophobicContact CD1-CD1 3.82Å; F2927-I2931 HydrophobicContact CE1-CD1 3.38Å; F2927-I2931 VanDerWaalsContact CE1-CD1 3.41Å; F2927-I2931 HydrophobicContact CE1-CG1 4.33Å; F2927-I2931 HydrophobicContact CE2-CD1 4.43Å; F2927-I2931 HydrophobicContact CG-CD1 4.43Å; F2927-I2931 HydrophobicContact CZ-CD1 3.74Å; F2927-I2931 HydrophobicContact CZ-CG1 4.32Å; F2927-I2931 PolarHBondContact O-N 3.12Å; F2927-L2942 HydrophobicContact CD2-CD1 3.9Å; F2927-L2942 HydrophobicContact CE2-CD1 4.06Å; F2927-L2945 HydrophobicContact CB-CB 4.2Å; F2927-L2945 HydrophobicContact CB-CD1 4.2Å; F2927-L2945 HydrophobicContact CB-CD2 4.34Å; F2927-L2945 HydrophobicContact CD2-CB 3.71Å; F2927-L2945 HydrophobicContact CD2-CD1 4.43Å; F2927-L2945 HydrophobicContact CE2-CB 4.49Å; F2927-L2945 HydrophobicContact CG-CB 4.25Å; F2927-L2946 HydrophobicContact CE1-CD1 4.27Å; F2927-L2946 HydrophobicContact CE2-CB 3.81Å; F2927-L2946 HydrophobicContact CZ-CB 3.86Å; F2927-L2946 HydrophobicContact CZ-CD1 3.78Å; F2927-L2946 HydrophobicContact CZ-CD2 4.48Å; F2927-L2946 HydrophobicContact CZ-CG 4.24Å; F2927-I2949 HydrophobicContact CB-CD1 4.09Å; F2927-I2949 HydrophobicContact CD1-CD1 3.27Å; F2927-I2949 HydrophobicContact CE1-CD1 3.85Å; F2927-I2949 HydrophobicContact CG-CD1 3.83Å; F2927-M2986 HydrophobicContact CD1-CE 3.76Å; F2927-M2986 HydrophobicContact CD1-SD 4.37Å; F2927-M2986 HydrophobicContact CE1-CE 3.89Å; F2927-L3102 HydrophobicContact CE2-CD2 4.48Å; F2927-L3106 HydrophobicContact CE1-CD1 4.07Å; F2927-L3106 HydrophobicContact CE1-CD2 3.81Å; F2927-L3106 HydrophobicContact CZ-CD1 4.39Å; F2927-L3106 HydrophobicContact CZ-CD2 4.01Å; F2927-L3106 HydrophobicContact CZ-CG 4.31Å
2928Y94.6Very high92Very high46.75 Ų46.7535.6 Ų35.618%0.18316%0.162CC..Hα-helixtrans-63.7-38.7174.9171-114000113V2924 L2926 S2930 I2931 K2932 H2989 D2992V2924-Y2928 VanDerWaalsContact O-CB 3.23Å; V2924-Y2928 WeakPolarHBondContact O-CB 3.38Å; V2924-Y2928 PolarHBondContact O-N 3.2Å; L2926-Y2928 VanDerWaalsContact C-N 3.32Å; L2926-Y2928 PolarHBondContact O-N 3.31Å; Y2928-S2930 VanDerWaalsContact C-N 3.3Å; Y2928-S2930 PolarHBondContact O-N 3.11Å; Y2928-I2931 PolarHBondContact O-N 3.23Å; Y2928-K2932 HydrophobicContact CD2-CD 4.45Å; Y2928-K2932 HydrophobicContact CE1-CD 4.46Å; Y2928-K2932 HydrophobicContact CE2-CD 3.75Å; Y2928-K2932 VanDerWaalsContact CE2-CE 3.45Å; Y2928-K2932 HydrophobicContact CE2-CG 4.31Å; Y2928-K2932 PolarHBondContact O-N 2.98Å; Y2928-K2932 VanDerWaalsContact O-N 3.09Å; Y2928-K2932 PolarHBondContact OH-NZ 3.09Å; Y2928-H2989 AromaticContact CD1-CE1 3.96Å; Y2928-H2989 HydrophobicContact CD2-CB 3.95Å; Y2928-H2989 AromaticContact CD2-CG 3.68Å; Y2928-H2989 AromaticContact CD2-ND1 3.65Å; Y2928-H2989 AromaticContact CE1-CE1 3.71Å; Y2928-H2989 AromaticContact CE1-ND1 3.85Å; Y2928-H2989 HydrophobicContact CE2-CB 4.07Å; Y2928-H2989 AromaticContact CE2-CE1 3.9Å; Y2928-H2989 AromaticContact CE2-CG 3.71Å; Y2928-H2989 AromaticContact CE2-ND1 3.22Å; Y2928-H2989 WeakPolarHBondContact CE2-ND1 3.28Å; Y2928-H2989 AromaticContact CZ-CE1 3.6Å; Y2928-H2989 AromaticContact CZ-ND1 3.34Å; Y2928-H2989 VanDerWaalsContact CZ-ND1 3.3Å; Y2928-D2992 HydrophobicContact CE2-CB 4.25Å; Y2928-D2992 WeakPolarHBondContact CE2-OD2 3.38Å; Y2928-D2992 PolarHBondContact OH-OD2 3.16Å
2929Q92.8Very high91.8Very high58.75 Ų58.7534.8 Ų34.828%0.27516%0.159SC..Hα-helixtrans-63.7-35.1172.9-76.1163.717.200111.9R2887 D2925 L2926 K2932 F2933 R2934 A2935R2887-Q2929 VanDerWaalsContact NH2-OE1 3.09Å; D2925-Q2929 VanDerWaalsContact O-CB 3.28Å; D2925-Q2929 WeakPolarHBondContact O-CB 3.45Å; D2925-Q2929 VanDerWaalsContact O-CD 3.28Å; D2925-Q2929 WeakPolarHBondContact O-CG 3.4Å; D2925-Q2929 PolarHBondContact O-N 3.19Å; D2925-Q2929 PolarHBondContact O-NE2 2.99Å; L2926-Q2929 WeakPolarHBondContact O-CB 3.38Å; L2926-Q2929 PolarHBondContact O-N 3.23Å; L2926-Q2929 VanDerWaalsContact O-N 3.13Å; Q2929-K2932 CarbonylContact O-C 3.58Å; Q2929-K2932 PolarHBondContact O-N 3.18Å; Q2929-F2933 PolarHBondContact O-N 3.1Å; Q2929-R2934 WeakPolarHBondContact O-CA 3.33Å; Q2929-R2934 WeakPolarHBondContact O-CB 3.49Å; Q2929-R2934 PolarHBondContact O-N 3.13Å; Q2929-A2935 HydrophobicContact CB-CB 3.79Å; Q2929-A2935 PolarHBondContact O-N 3.26Å
2930S91.1Very high91.5Very high10.5 Ų10.537.6 Ų37.67%0.07317%0.172CC..Hα-helixtrans-73.1-41.6174.3-62.70000113.1L2926 F2927 Y2928 K2932 F2933 A2935 I2937L2926-S2930 PolarHBondContact O-N 3.07Å; L2926-S2930 PolarHBondContact O-OG 3.22Å; L2926-S2930 VanDerWaalsContact O-OG 3.07Å; F2927-S2930 WeakPolarHBondContact O-CB 3.34Å; F2927-S2930 PolarHBondContact O-N 2.94Å; F2927-S2930 VanDerWaalsContact O-N 3.14Å; Y2928-S2930 VanDerWaalsContact C-N 3.3Å; Y2928-S2930 PolarHBondContact O-N 3.11Å; S2930-K2932 PolarHBondContact O-N 3.05Å; S2930-F2933 PolarHBondContact O-N 3.01Å; S2930-A2935 WeakPolarHBondContact CA-O 3.38Å; S2930-A2935 PolarHBondContact OG-O 2.83Å; S2930-I2937 VanDerWaalsContact OG-CD1 3.28Å; S2930-I2937 WeakPolarHBondContact OG-CD1 3.39Å; S2930-I2937 WeakPolarHBondContact OG-CG1 3.37Å
2931I90.9Very high91.4Very high13.25 Ų13.2537.6 Ų37.67%0.06817%0.172CC..Hα-helixtrans-55.5-35.5171.1-78.3174.2000111.6F2927 Y2928 F2933 M2986 F2996 L3106F2927-I2931 HydrophobicContact CD1-CD1 3.82Å; F2927-I2931 HydrophobicContact CE1-CD1 3.38Å; F2927-I2931 VanDerWaalsContact CE1-CD1 3.41Å; F2927-I2931 HydrophobicContact CE1-CG1 4.33Å; F2927-I2931 HydrophobicContact CE2-CD1 4.43Å; F2927-I2931 HydrophobicContact CG-CD1 4.43Å; F2927-I2931 HydrophobicContact CZ-CD1 3.74Å; F2927-I2931 HydrophobicContact CZ-CG1 4.32Å; F2927-I2931 PolarHBondContact O-N 3.12Å; Y2928-I2931 PolarHBondContact O-N 3.23Å; I2931-F2933 VanDerWaalsContact C-N 3.33Å; I2931-F2933 WeakPolarHBondContact O-CE2 3.39Å; I2931-M2986 HydrophobicContact CD1-CE 3.97Å; I2931-F2996 HydrophobicContact CB-CD2 4.39Å; I2931-F2996 HydrophobicContact CB-CE2 4.47Å; I2931-F2996 HydrophobicContact CG1-CD2 4.45Å; I2931-F2996 HydrophobicContact CG1-CE2 4.36Å; I2931-F2996 HydrophobicContact CG2-CB 4.15Å; I2931-F2996 HydrophobicContact CG2-CD2 3.77Å; I2931-F2996 HydrophobicContact CG2-CE2 4.39Å; I2931-F2996 HydrophobicContact CG2-CG 4.13Å; I2931-F2996 WeakPolarHBondContact O-CD2 3.3Å; I2931-L3106 HydrophobicContact CD1-CD1 3.94Å; I2931-L3106 HydrophobicContact CD1-CD2 3.86Å; I2931-L3106 HydrophobicContact CD1-CG 4.45Å; I2931-L3106 HydrophobicContact CG1-CD1 4.24Å
2932K91.5Very high91.2Very high61.75 Ų61.7533.3 Ų33.327%0.26816%0.157SC..THydrogen-bonded Turntrans-88.18.7176.3-69.4-164.8167.11790114.7Y2928 Q2929 S2930 R2934 D2992Y2928-K2932 HydrophobicContact CD2-CD 4.45Å; Y2928-K2932 HydrophobicContact CE1-CD 4.46Å; Y2928-K2932 HydrophobicContact CE2-CD 3.75Å; Y2928-K2932 VanDerWaalsContact CE2-CE 3.45Å; Y2928-K2932 HydrophobicContact CE2-CG 4.31Å; Y2928-K2932 PolarHBondContact O-N 2.98Å; Y2928-K2932 VanDerWaalsContact O-N 3.09Å; Y2928-K2932 PolarHBondContact OH-NZ 3.09Å; Q2929-K2932 CarbonylContact O-C 3.58Å; Q2929-K2932 PolarHBondContact O-N 3.18Å; S2930-K2932 PolarHBondContact O-N 3.05Å; K2932-R2934 HydrophobicContact CB-CG 4.29Å; K2932-R2934 PolarHBondContact O-N 3.17Å; K2932-D2992 WeakPolarHBondContact CE-OD1 3.41Å; K2932-D2992 WeakPolarHBondContact CE-OD2 3.37Å; K2932-D2992 IonicContact NZ-OD1 3.4Å; K2932-D2992 PolarHBondContact NZ-OD1 3.06Å; K2932-D2992 IonicContact NZ-OD2 3.76Å; K2932-D2992 PolarHBondContact NZ-OD2 3.11Å
2933F89.6Confident91.1Very high68.5 Ų68.532.8 Ų32.830%0.315%0.154SC..THydrogen-bonded Turntrans54.536.2-179.6-50.4-74.1000113.4Q2929 S2930 I2931 F2996 T3002 K3005 I3006Q2929-F2933 PolarHBondContact O-N 3.1Å; S2930-F2933 PolarHBondContact O-N 3.01Å; I2931-F2933 VanDerWaalsContact C-N 3.33Å; I2931-F2933 WeakPolarHBondContact O-CE2 3.39Å; F2933-F2996 HydrophobicContact CE1-CE2 4.46Å; F2933-F2996 HydrophobicContact CE2-CD2 4.45Å; F2933-F2996 HydrophobicContact CE2-CE2 4.31Å; F2933-F2996 HydrophobicContact CZ-CD2 4.33Å; F2933-F2996 AromaticContact CZ-CE2 3.75Å; F2933-F2996 HydrophobicContact CZ-CE2 3.75Å; F2933-T3002 HydrophobicContact CE2-CG2 4.12Å; F2933-T3002 HydrophobicContact CZ-CG2 4.12Å; F2933-K3005 HydrophobicContact CD1-CB 4.01Å; F2933-K3005 HydrophobicContact CD2-CB 4.18Å; F2933-K3005 HydrophobicContact CD2-CD 4.15Å; F2933-K3005 HydrophobicContact CE1-CB 3.56Å; F2933-K3005 HydrophobicContact CE2-CB 3.75Å; F2933-K3005 HydrophobicContact CE2-CD 3.7Å; F2933-K3005 HydrophobicContact CE2-CG 4.35Å; F2933-K3005 HydrophobicContact CG-CB 4.3Å; F2933-K3005 HydrophobicContact CZ-CB 3.42Å; F2933-K3005 VanDerWaalsContact CZ-CB 3.42Å; F2933-K3005 HydrophobicContact CZ-CD 4.18Å; F2933-K3005 HydrophobicContact CZ-CG 4.44Å; F2933-I3006 HydrophobicContact CE1-CB 4.47Å; F2933-I3006 HydrophobicContact CE1-CG1 3.78Å; F2933-I3006 HydrophobicContact CZ-CG1 4.12Å
2934R88.7Confident91Very high199.25 Ų199.2533.5 Ų33.575%0.75216%0.157SC*.SBendtrans-106.1-22.5178.3-65180-179.2-175.8-2.6113.4Q2929 K2932Q2929-R2934 WeakPolarHBondContact O-CA 3.33Å; Q2929-R2934 WeakPolarHBondContact O-CB 3.49Å; Q2929-R2934 PolarHBondContact O-N 3.13Å; K2932-R2934 HydrophobicContact CB-CG 4.29Å; K2932-R2934 PolarHBondContact O-N 3.17Å
2935A85.9Confident90.9Very high12.25 Ų12.2533.5 Ų33.510%0.10116%0.156CC..SBendtrans-121.5136.5171.500000109.4Q2929 S2930 I2937Q2929-A2935 HydrophobicContact CB-CB 3.79Å; Q2929-A2935 PolarHBondContact O-N 3.26Å; S2930-A2935 WeakPolarHBondContact CA-O 3.38Å; S2930-A2935 PolarHBondContact OG-O 2.83Å; A2935-I2937 HydrophobicContact CB-CG1 4.38Å
2936C84.8Confident90.9Very high48.25 Ų48.2531.3 Ų31.333%0.32615%0.145SC..  trans-96.6115.9170.2-67.90000107.6S3009 A3013C2936-S3009 PolarHBondContact SG-OG 3.32Å; C2936-S3009 VanDerWaalsContact SG-OG 3.41Å; C2936-A3013 HydrophobicContact CB-CB 4.02Å
2937I88.4Confident90.8Very high1.5 Ų1.531.3 Ų31.31%0.00815%0.145CC..  trans-122.2138179.8-63.3-176.5000107.4V2890 L2926 S2930 A2935 N2941 L2942 L2945 Q3010V2890-I2937 HydrophobicContact CG1-CD1 4.27Å; V2890-I2937 HydrophobicContact CG1-CG2 4.4Å; L2926-I2937 HydrophobicContact CB-CD1 4.07Å; L2926-I2937 HydrophobicContact CD2-CD1 4.05Å; S2930-I2937 VanDerWaalsContact OG-CD1 3.28Å; S2930-I2937 WeakPolarHBondContact OG-CD1 3.39Å; S2930-I2937 WeakPolarHBondContact OG-CG1 3.37Å; A2935-I2937 HydrophobicContact CB-CG1 4.38Å; I2937-N2941 HydrophobicContact CG2-CB 3.71Å; I2937-L2942 HydrophobicContact CG2-CB 4.35Å; I2937-L2945 HydrophobicContact CD1-CD1 3.77Å; I2937-L2945 HydrophobicContact CG2-CD1 4.38Å; I2937-Q3010 PolarHBondContact O-NE2 3.11Å; I2937-Q3010 PolarHBondContact O-OE1 3.41Å
2938P87.9Confident90.7Very high13 Ų1331.3 Ų31.38%0.08415%0.145CC..  trans-49.8146.8175.6-28.335000112.8E2891 E2940 N2941 L2942E2891-P2938 VanDerWaalsContact O-CD 3.3Å; E2891-P2938 WeakPolarHBondContact O-CD 3.28Å; P2938-E2940 PolarHBondContact O-N 3.28Å; P2938-N2941 HydrophobicContact CB-CB 4.31Å; P2938-N2941 PolarHBondContact O-N 2.98Å; P2938-N2941 VanDerWaalsContact O-N 3.11Å; P2938-L2942 WeakPolarHBondContact O-CB 3.37Å; P2938-L2942 PolarHBondContact O-N 3.01Å
2939D88.1Confident90.6Very high32.25 Ų32.2529.2 Ų29.217%0.17214%0.137CC..Hα-helixtrans-60.4-44.1-17454.6-5.2000113.1N2941 L2942 I2943 V2962 S3092 H3094 L3098D2939-N2941 PolarHBondContact O-N 3.21Å; D2939-L2942 PolarHBondContact O-N 3.15Å; D2939-I2943 WeakPolarHBondContact O-CG1 3.39Å; D2939-I2943 PolarHBondContact O-N 2.85Å; D2939-I2943 VanDerWaalsContact O-N 3.12Å; D2939-V2962 HydrophobicContact CB-CG1 4.26Å; D2939-S3092 VanDerWaalsContact OD2-CB 3.26Å; D2939-S3092 WeakPolarHBondContact OD2-CB 3.43Å; D2939-S3092 PolarHBondContact OD2-OG 3.02Å; D2939-H3094 IonicContact OD2-CE1 2.61Å; D2939-H3094 PolarHBondContact OD2-CE1 3.02Å; D2939-H3094 IonicContact OD2-CG 2.65Å; D2939-H3094 IonicContact OD2-ND1 2.69Å; D2939-H3094 PolarHBondContact OD2-ND1 3.4Å; D2939-L3098 HydrophobicContact CB-CD1 4.02Å; D2939-L3098 HydrophobicContact CB-CD2 3.73Å; D2939-L3098 HydrophobicContact CB-CG 4.43Å
2940E87.9Confident90.5Very high61 Ų6126.4 Ų26.429%0.28512%0.124SC..Hα-helixtrans-53.9-51.4169.4-73.1-165.1-15700112.5H2894 P2938 L2942 I2943 K2944 V2962 V2963H2894-E2940 IonicContact CD2-OE1 3.49Å; H2894-E2940 IonicContact CD2-OE2 2.79Å; H2894-E2940 PolarHBondContact CD2-OE2 3.12Å; P2938-E2940 PolarHBondContact O-N 3.28Å; E2940-L2942 VanDerWaalsContact C-N 3.31Å; E2940-L2942 PolarHBondContact O-N 3.11Å; E2940-I2943 PolarHBondContact O-N 2.83Å; E2940-K2944 VanDerWaalsContact O-CG 3.29Å; E2940-K2944 WeakPolarHBondContact O-CG 3.35Å; E2940-K2944 PolarHBondContact O-N 3.07Å; E2940-K2944 WeakPolarHBondContact OE2-CE 3.4Å; E2940-K2944 IonicContact OE2-NZ 3.29Å; E2940-K2944 PolarHBondContact OE2-NZ 2.97Å; E2940-V2962 HydrophobicContact CG-CG1 4.22Å; E2940-V2963 HydrophobicContact CB-CG2 3.92Å; E2940-V2963 HydrophobicContact CG-CG2 4.02Å
2941N91.6Very high90.4Very high0 Ų026.8 Ų26.80%013%0.125CC..Hα-helixtrans-67.8-34.7-174.1-78.53.7000111.2V2890 V2893 F2895 I2937 P2938 D2939 I2943 K2944 L2945V2890-N2941 PolarHBondContact O-ND2 3.27Å; V2893-N2941 PolarHBondContact O-ND2 3.03Å; F2895-N2941 HydrophobicContact CE1-CB 3.93Å; F2895-N2941 VanDerWaalsContact CE1-CG 3.44Å; F2895-N2941 WeakPolarHBondContact CE1-OD1 3.33Å; I2937-N2941 HydrophobicContact CG2-CB 3.71Å; P2938-N2941 HydrophobicContact CB-CB 4.31Å; P2938-N2941 PolarHBondContact O-N 2.98Å; P2938-N2941 VanDerWaalsContact O-N 3.11Å; D2939-N2941 PolarHBondContact O-N 3.21Å; N2941-I2943 VanDerWaalsContact C-N 3.32Å; N2941-I2943 PolarHBondContact O-N 3.5Å; N2941-K2944 PolarHBondContact O-N 3.08Å; N2941-K2944 PolarHBondContact OD1-NZ 3.26Å; N2941-L2945 WeakPolarHBondContact O-CB 3.31Å; N2941-L2945 VanDerWaalsContact O-CG 3.31Å; N2941-L2945 WeakPolarHBondContact O-CG 3.36Å; N2941-L2945 PolarHBondContact O-N 3.2Å
2942L92.1Very high90.3Very high13.5 Ų13.527.7 Ų27.77%0.07113%0.13CC..Hα-helixtrans-66.7-35.4176-173.260.4000112.2F2927 I2937 P2938 D2939 E2940 L2946 L3102F2927-L2942 HydrophobicContact CD2-CD1 3.9Å; F2927-L2942 HydrophobicContact CE2-CD1 4.06Å; I2937-L2942 HydrophobicContact CG2-CB 4.35Å; P2938-L2942 WeakPolarHBondContact O-CB 3.37Å; P2938-L2942 PolarHBondContact O-N 3.01Å; D2939-L2942 PolarHBondContact O-N 3.15Å; E2940-L2942 VanDerWaalsContact C-N 3.31Å; E2940-L2942 PolarHBondContact O-N 3.11Å; L2942-L2946 PolarHBondContact O-N 3.09Å; L2942-L3102 HydrophobicContact CD2-CD1 3.72Å; L2942-L3102 HydrophobicContact CD2-CD2 4.38Å; L2942-L3102 HydrophobicContact CG-CD1 4.26Å; L2942-L3102 HydrophobicContact CG-CD2 4.01Å
2943I92.3Very high90.1Very high0 Ų024.8 Ų24.80%012%0.117CC..Hα-helixtrans-72.2-41.3172-69.4-68.1000111.4D2939 E2940 N2941 L2945 L2946 Q2947 I2957 V2962 V2963 L2966 L3098 H3101 L3102D2939-I2943 WeakPolarHBondContact O-CG1 3.39Å; D2939-I2943 PolarHBondContact O-N 2.85Å; D2939-I2943 VanDerWaalsContact O-N 3.12Å; E2940-I2943 PolarHBondContact O-N 2.83Å; N2941-I2943 VanDerWaalsContact C-N 3.32Å; N2941-I2943 PolarHBondContact O-N 3.5Å; I2943-L2945 VanDerWaalsContact C-N 3.29Å; I2943-L2945 PolarHBondContact O-N 3.36Å; I2943-L2946 PolarHBondContact O-N 3.25Å; I2943-L2946 VanDerWaalsContact O-N 3.11Å; I2943-Q2947 PolarHBondContact O-N 3.18Å; I2943-I2957 HydrophobicContact CD1-CD1 4.03Å; I2943-I2957 HydrophobicContact CG2-CD1 4.03Å; I2943-V2962 HydrophobicContact CG1-CB 4.4Å; I2943-V2962 HydrophobicContact CG1-CG1 4.23Å; I2943-V2962 HydrophobicContact CG1-CG2 4.22Å; I2943-V2963 HydrophobicContact CB-CG2 4.34Å; I2943-V2963 HydrophobicContact CG2-CG2 4.26Å; I2943-L2966 HydrophobicContact CG2-CD2 3.72Å; I2943-L3098 HydrophobicContact CD1-CD1 3.87Å; I2943-L3098 HydrophobicContact CG1-CD1 3.74Å; I2943-H3101 HydrophobicContact CD1-CB 4.03Å; I2943-L3102 HydrophobicContact CD1-CD2 3.83Å; I2943-L3102 HydrophobicContact CD1-CG 4.15Å
2944K92.9Very high89.9Confident13.5 Ų13.521.8 Ų21.86%0.05911%0.105CC..Hα-helixtrans-60.4-36.5173.7-67.2164.4-165.2170.80112.2F2895 L2897 E2940 N2941 Q2947 F2948 V2963 L2966F2895-K2944 HydrophobicContact CE2-CB 4.19Å; F2895-K2944 HydrophobicContact CE2-CD 4.37Å; F2895-K2944 HydrophobicContact CZ-CB 3.96Å; F2895-K2944 HydrophobicContact CZ-CD 4.35Å; F2895-K2944 WeakPolarHBondContact O-CD 3.5Å; F2895-K2944 PolarHBondContact O-NZ 3.35Å; F2895-K2944 VanDerWaalsContact O-NZ 3.13Å; L2897-K2944 HydrophobicContact CB-CG 4.49Å; L2897-K2944 HydrophobicContact CD2-CB 4.47Å; E2940-K2944 VanDerWaalsContact O-CG 3.29Å; E2940-K2944 WeakPolarHBondContact O-CG 3.35Å; E2940-K2944 PolarHBondContact O-N 3.07Å; E2940-K2944 WeakPolarHBondContact OE2-CE 3.4Å; E2940-K2944 IonicContact OE2-NZ 3.29Å; E2940-K2944 PolarHBondContact OE2-NZ 2.97Å; N2941-K2944 PolarHBondContact O-N 3.08Å; N2941-K2944 PolarHBondContact OD1-NZ 3.26Å; K2944-Q2947 PolarHBondContact O-N 3.28Å; K2944-F2948 WeakPolarHBondContact O-CB 3.33Å; K2944-F2948 PolarHBondContact O-N 3.19Å; K2944-V2963 HydrophobicContact CG-CG2 4.44Å; K2944-L2966 HydrophobicContact CG-CD1 4.44Å; K2944-L2966 HydrophobicContact CG-CD2 4.33Å
2945L94.1Very high89.7Confident0.75 Ų0.7512.4 Ų12.40%0.0047%0.07CC..Hα-helixtrans-65.1-40.1172.7-77.2175.6000113.1V2890 M2923 L2926 F2927 I2937 N2941 I2943 F2948 I2949V2890-L2945 HydrophobicContact CG1-CD1 3.84Å; V2890-L2945 HydrophobicContact CG1-CD2 4.16Å; V2890-L2945 HydrophobicContact CG1-CG 4.18Å; M2923-L2945 HydrophobicContact CB-CD2 4.3Å; M2923-L2945 HydrophobicContact CE-CD2 3.5Å; M2923-L2945 VanDerWaalsContact CE-CD2 3.45Å; M2923-L2945 WeakPolarHBondContact O-CD2 3.17Å; M2923-L2945 HydrophobicContact SD-CD2 4.1Å; L2926-L2945 HydrophobicContact CB-CD1 4.36Å; F2927-L2945 HydrophobicContact CB-CB 4.2Å; F2927-L2945 HydrophobicContact CB-CD1 4.2Å; F2927-L2945 HydrophobicContact CB-CD2 4.34Å; F2927-L2945 HydrophobicContact CD2-CB 3.71Å; F2927-L2945 HydrophobicContact CD2-CD1 4.43Å; F2927-L2945 HydrophobicContact CE2-CB 4.49Å; F2927-L2945 HydrophobicContact CG-CB 4.25Å; I2937-L2945 HydrophobicContact CD1-CD1 3.77Å; I2937-L2945 HydrophobicContact CG2-CD1 4.38Å; N2941-L2945 WeakPolarHBondContact O-CB 3.31Å; N2941-L2945 VanDerWaalsContact O-CG 3.31Å; N2941-L2945 WeakPolarHBondContact O-CG 3.36Å; N2941-L2945 PolarHBondContact O-N 3.2Å; I2943-L2945 VanDerWaalsContact C-N 3.29Å; I2943-L2945 PolarHBondContact O-N 3.36Å; L2945-F2948 WeakPolarHBondContact O-CB 3.34Å; L2945-F2948 PolarHBondContact O-N 2.91Å; L2945-I2949 PolarHBondContact O-N 3.11Å
2946L93.8Very high89.9Confident0.5 Ų0.512.3 Ų12.30%0.0037%0.068CC..Hα-helixtrans-67.5-42175.5177.951.4000111.2F2927 L2942 I2943 F2948 I2949 L2950 I2957 L3102 L3106F2927-L2946 HydrophobicContact CE1-CD1 4.27Å; F2927-L2946 HydrophobicContact CE2-CB 3.81Å; F2927-L2946 HydrophobicContact CZ-CB 3.86Å; F2927-L2946 HydrophobicContact CZ-CD1 3.78Å; F2927-L2946 HydrophobicContact CZ-CD2 4.48Å; F2927-L2946 HydrophobicContact CZ-CG 4.24Å; L2942-L2946 PolarHBondContact O-N 3.09Å; I2943-L2946 PolarHBondContact O-N 3.25Å; I2943-L2946 VanDerWaalsContact O-N 3.11Å; L2946-F2948 VanDerWaalsContact C-N 3.34Å; L2946-F2948 PolarHBondContact O-N 3.18Å; L2946-I2949 PolarHBondContact O-N 3.13Å; L2946-L2950 HydrophobicContact CD1-CD1 3.84Å; L2946-L2950 HydrophobicContact CD1-CG 4.17Å; L2946-L2950 HydrophobicContact CG-CD1 3.91Å; L2946-L2950 VanDerWaalsContact O-CB 3.24Å; L2946-L2950 WeakPolarHBondContact O-CB 3.35Å; L2946-L2950 PolarHBondContact O-N 3.23Å; L2946-I2957 HydrophobicContact CB-CD1 3.95Å; L2946-I2957 HydrophobicContact CD2-CD1 4.14Å; L2946-I2957 HydrophobicContact CG-CD1 3.79Å; L2946-I2957 HydrophobicContact CG-CG1 4.25Å; L2946-L3102 HydrophobicContact CD2-CD2 3.97Å; L2946-L3106 HydrophobicContact CD1-CD2 4.42Å; L2946-L3106 HydrophobicContact CD1-CG 4.36Å
2947Q92.5Very high90Very high0 Ų010 Ų100%05%0.053CC..Hα-helixtrans-61.9-41.7175.8-17769.5-2.800111.5L2897 I2943 K2944 I2949 L2950 M2951 T2956 I2957 L2966L2897-Q2947 HydrophobicContact CD2-CB 3.82Å; L2897-Q2947 HydrophobicContact CD2-CG 3.59Å; I2943-Q2947 PolarHBondContact O-N 3.18Å; K2944-Q2947 PolarHBondContact O-N 3.28Å; Q2947-I2949 VanDerWaalsContact C-N 3.32Å; Q2947-I2949 PolarHBondContact O-N 3.04Å; Q2947-L2950 PolarHBondContact O-N 3.16Å; Q2947-M2951 HydrophobicContact CG-CG 4.08Å; Q2947-M2951 HydrophobicContact CG-SD 3.84Å; Q2947-M2951 WeakPolarHBondContact O-CB 3.29Å; Q2947-M2951 VanDerWaalsContact O-CG 3.28Å; Q2947-M2951 WeakPolarHBondContact O-CG 3.37Å; Q2947-M2951 PolarHBondContact O-N 3.07Å; Q2947-T2956 PolarHBondContact NE2-OG1 3.32Å; Q2947-T2956 PolarHBondContact OE1-OG1 3.09Å; Q2947-I2957 HydrophobicContact CB-CD1 3.94Å; Q2947-I2957 HydrophobicContact CB-CG1 4.48Å; Q2947-I2957 VanDerWaalsContact OE1-CG1 3.31Å; Q2947-L2966 HydrophobicContact CB-CD2 3.91Å; Q2947-L2966 HydrophobicContact CB-CG 4.41Å; Q2947-L2966 HydrophobicContact CG-CD1 4.38Å; Q2947-L2966 HydrophobicContact CG-CD2 4.16Å; Q2947-L2966 HydrophobicContact CG-CG 4.11Å; Q2947-L2966 PolarHBondContact NE2-O 3.14Å; Q2947-L2966 VanDerWaalsContact NE2-O 3.16Å
2948F93.2Very high89.7Confident2.25 Ų2.2512.2 Ų12.21%0.016%0.063CC..Hα-helixtrans-53.4-46.5175177.1-102.2000112.7L2897 I2901 C2904 M2923 K2944 L2945 L2946 D2952 T2980 A2982L2897-F2948 HydrophobicContact CD1-CB 4.03Å; L2897-F2948 HydrophobicContact CD1-CD2 4.36Å; I2901-F2948 HydrophobicContact CG1-CD2 3.89Å; I2901-F2948 HydrophobicContact CG1-CE2 4.36Å; C2904-F2948 HydrophobicContact CB-CE2 3.87Å; C2904-F2948 HydrophobicContact CB-CZ 3.8Å; M2923-F2948 HydrophobicContact CB-CD1 4.04Å; M2923-F2948 HydrophobicContact CB-CE1 3.63Å; M2923-F2948 HydrophobicContact CB-CZ 4.27Å; M2923-F2948 HydrophobicContact CE-CD1 4.32Å; M2923-F2948 HydrophobicContact CE-CD2 4.34Å; M2923-F2948 HydrophobicContact CE-CE2 4.48Å; M2923-F2948 HydrophobicContact CE-CG 4.22Å; M2923-F2948 HydrophobicContact CG-CE1 4.05Å; M2923-F2948 HydrophobicContact CG-CZ 4.2Å; K2944-F2948 WeakPolarHBondContact O-CB 3.33Å; K2944-F2948 PolarHBondContact O-N 3.19Å; L2945-F2948 WeakPolarHBondContact O-CB 3.34Å; L2945-F2948 PolarHBondContact O-N 2.91Å; L2946-F2948 VanDerWaalsContact C-N 3.34Å; L2946-F2948 PolarHBondContact O-N 3.18Å; F2948-D2952 PolarHBondContact O-N 3.45Å; F2948-T2980 HydrophobicContact CE2-CG2 3.83Å; F2948-T2980 HydrophobicContact CZ-CG2 4.16Å; F2948-A2982 HydrophobicContact CD1-CB 3.9Å; F2948-A2982 HydrophobicContact CE1-CB 3.52Å; F2948-A2982 HydrophobicContact CZ-CB 4.25Å
2949I93.4Very high89.2Confident1.75 Ų1.7515.9 Ų15.91%0.0099%0.087CC..Hα-helixtrans-72.4-39.8179.4-63.2167.7000111.2V2924 F2927 L2945 L2946 Q2947 D2952 A2953 A2982 M2986 Y3109V2924-I2949 HydrophobicContact CG2-CD1 4.24Å; V2924-I2949 HydrophobicContact CG2-CG1 4.21Å; F2927-I2949 HydrophobicContact CB-CD1 4.09Å; F2927-I2949 HydrophobicContact CD1-CD1 3.27Å; F2927-I2949 HydrophobicContact CE1-CD1 3.85Å; F2927-I2949 HydrophobicContact CG-CD1 3.83Å; L2945-I2949 PolarHBondContact O-N 3.11Å; L2946-I2949 PolarHBondContact O-N 3.13Å; Q2947-I2949 VanDerWaalsContact C-N 3.32Å; Q2947-I2949 PolarHBondContact O-N 3.04Å; I2949-D2952 PolarHBondContact O-N 3.12Å; I2949-A2953 WeakPolarHBondContact O-CB 3.45Å; I2949-A2953 PolarHBondContact O-N 3.34Å; I2949-A2953 VanDerWaalsContact O-N 3.11Å; I2949-A2982 HydrophobicContact CG1-CB 4.22Å; I2949-M2986 HydrophobicContact CD1-CG 4.44Å; I2949-M2986 HydrophobicContact CD1-SD 4.35Å; I2949-M2986 HydrophobicContact CG2-CB 4.15Å; I2949-M2986 HydrophobicContact CG2-CG 4.16Å; I2949-Y3109 HydrophobicContact CG2-CD2 3.85Å; I2949-Y3109 HydrophobicContact CG2-CE2 3.86Å; I2949-Y3109 HydrophobicContact CG2-CG 4.36Å
2950L90.7Very high88.7Confident0 Ų015 Ų150%08%0.082CC..Hα-helixtrans-68.7-39.8-178.2-129.9113.7000112.7L2946 Q2947 D2952 A2953 G2954 G2955 I2957 Q3108 L3112L2946-L2950 HydrophobicContact CD1-CD1 3.84Å; L2946-L2950 HydrophobicContact CD1-CG 4.17Å; L2946-L2950 HydrophobicContact CG-CD1 3.91Å; L2946-L2950 VanDerWaalsContact O-CB 3.24Å; L2946-L2950 WeakPolarHBondContact O-CB 3.35Å; L2946-L2950 PolarHBondContact O-N 3.23Å; Q2947-L2950 PolarHBondContact O-N 3.16Å; L2950-D2952 VanDerWaalsContact C-N 3.32Å; L2950-D2952 PolarHBondContact O-N 2.94Å; L2950-A2953 CarbonylContact O-C 3.23Å; L2950-A2953 WeakPolarHBondContact O-CA 3.49Å; L2950-A2953 WeakPolarHBondContact O-CB 3.33Å; L2950-A2953 PolarHBondContact O-N 3.1Å; L2950-A2953 VanDerWaalsContact O-N 3.13Å; L2950-G2954 PolarHBondContact O-N 3.15Å; L2950-G2954 VanDerWaalsContact O-N 3.1Å; L2950-G2955 CarbonylContact C-O 3.56Å; L2950-G2955 VanDerWaalsContact C-O 3.23Å; L2950-G2955 PolarHBondContact O-N 3Å; L2950-G2955 VanDerWaalsContact O-O 3.13Å; L2950-I2957 HydrophobicContact CD1-CD1 4.36Å; L2950-I2957 HydrophobicContact CD1-CG1 3.43Å; L2950-I2957 VanDerWaalsContact CD1-CG1 3.43Å; L2950-I2957 HydrophobicContact CD2-CB 4.26Å; L2950-I2957 HydrophobicContact CD2-CG1 3.71Å; L2950-Q3108 HydrophobicContact CD1-CB 4.19Å; L2950-Q3108 HydrophobicContact CD1-CG 3.95Å; L2950-Q3108 HydrophobicContact CD2-CB 4.02Å; L2950-Q3108 HydrophobicContact CD2-CG 4.2Å; L2950-L3112 HydrophobicContact CD1-CD1 3.89Å; L2950-L3112 HydrophobicContact CD2-CD1 4.32Å
2951M89.1Confident88Confident20.25 Ų20.2519.2 Ų19.210%0.110%0.102CC..Hα-helixtrans-61.3-41.5176-71.8-178.365.400111.7L2897 I2901 Q2947 A2953 G2954 G2955 L2969 F2970 Y2975L2897-M2951 HydrophobicContact CD2-SD 4.43Å; I2901-M2951 HydrophobicContact CD1-CE 3.89Å; I2901-M2951 HydrophobicContact CD1-SD 3.73Å; Q2947-M2951 HydrophobicContact CG-CG 4.08Å; Q2947-M2951 HydrophobicContact CG-SD 3.84Å; Q2947-M2951 WeakPolarHBondContact O-CB 3.29Å; Q2947-M2951 VanDerWaalsContact O-CG 3.28Å; Q2947-M2951 WeakPolarHBondContact O-CG 3.37Å; Q2947-M2951 PolarHBondContact O-N 3.07Å; M2951-A2953 VanDerWaalsContact C-N 3.28Å; M2951-A2953 PolarHBondContact O-N 3.19Å; M2951-G2954 PolarHBondContact O-N 3.01Å; M2951-G2954 VanDerWaalsContact O-N 3.11Å; M2951-G2955 VanDerWaalsContact CA-O 3.3Å; M2951-G2955 WeakPolarHBondContact CA-O 3.43Å; M2951-G2955 PolarHBondContact N-O 3.42Å; M2951-L2969 HydrophobicContact CE-CB 4.29Å; M2951-L2969 HydrophobicContact CE-CD2 4.4Å; M2951-L2969 HydrophobicContact CE-CG 4.12Å; M2951-L2969 WeakPolarHBondContact CE-O 3.22Å; M2951-L2969 HydrophobicContact SD-CB 4.41Å; M2951-L2969 HydrophobicContact SD-CD2 4.24Å; M2951-L2969 HydrophobicContact SD-CG 4.13Å; M2951-F2970 HydrophobicContact CB-CD2 4.49Å; M2951-F2970 HydrophobicContact CE-CD2 4.43Å; M2951-F2970 HydrophobicContact CG-CD2 4.09Å; M2951-Y2975 VanDerWaalsContact O-CD2 3.26Å; M2951-Y2975 WeakPolarHBondContact O-CD2 3.43Å
2952D88.6Confident87.1Confident31.5 Ų31.520 Ų2017%0.16811%0.107CC..Hα-helixtrans-66.5-30.9175.7-162.278.7000112.6F2948 I2949 L2950 G2954 T2980 G2981 A2982 A2983 R3116F2948-D2952 PolarHBondContact O-N 3.45Å; I2949-D2952 PolarHBondContact O-N 3.12Å; L2950-D2952 VanDerWaalsContact C-N 3.32Å; L2950-D2952 PolarHBondContact O-N 2.94Å; D2952-G2954 VanDerWaalsContact C-N 3.32Å; D2952-G2954 PolarHBondContact O-N 2.66Å; D2952-T2980 WeakPolarHBondContact CB-OG1 3.4Å; D2952-T2980 WeakPolarHBondContact OD1-CA 3.36Å; D2952-T2980 WeakPolarHBondContact OD1-CB 3.37Å; D2952-T2980 PolarHBondContact OD1-N 3.09Å; D2952-T2980 PolarHBondContact OD1-OG1 3.13Å; D2952-G2981 PolarHBondContact OD1-N 3.23Å; D2952-G2981 VanDerWaalsContact OD2-C 3.24Å; D2952-G2981 VanDerWaalsContact OD2-CA 3.27Å; D2952-G2981 WeakPolarHBondContact OD2-CA 3.4Å; D2952-G2981 PolarHBondContact OD2-N 3.32Å; D2952-A2982 HydrophobicContact CB-CB 4.11Å; D2952-A2982 PolarHBondContact OD2-N 3.14Å; D2952-A2983 HydrophobicContact CB-CB 4.41Å; D2952-A2983 WeakPolarHBondContact OD2-CB 3.35Å; D2952-A2983 PolarHBondContact OD2-N 3.28Å; D2952-R3116 PolarHBondContact O-NH1 2.8Å
2953A87.2Confident86.3Confident1.25 Ų1.2520.3 Ų20.31%0.0111%0.109CC..Hα-helixtrans-75.5-20173.400000113.7I2949 L2950 M2951 A2983 Y3109 L3112 R3116I2949-A2953 WeakPolarHBondContact O-CB 3.45Å; I2949-A2953 PolarHBondContact O-N 3.34Å; I2949-A2953 VanDerWaalsContact O-N 3.11Å; L2950-A2953 CarbonylContact O-C 3.23Å; L2950-A2953 WeakPolarHBondContact O-CA 3.49Å; L2950-A2953 WeakPolarHBondContact O-CB 3.33Å; L2950-A2953 PolarHBondContact O-N 3.1Å; L2950-A2953 VanDerWaalsContact O-N 3.13Å; M2951-A2953 VanDerWaalsContact C-N 3.28Å; M2951-A2953 PolarHBondContact O-N 3.19Å; A2953-A2983 HydrophobicContact CB-CB 4.04Å; A2953-Y3109 HydrophobicContact CB-CD2 3.87Å; A2953-Y3109 HydrophobicContact CB-CE2 4.23Å; A2953-L3112 HydrophobicContact CB-CB 4.42Å; A2953-L3112 HydrophobicContact CB-CD1 3.98Å; A2953-R3116 VanDerWaalsContact C-NH1 3.31Å; A2953-R3116 PolarHBondContact O-NH1 3.21Å; A2953-R3116 VanDerWaalsContact O-NH1 3.11Å
2954G84Confident85.3Confident4.75 Ų4.7528.5 Ų28.55%0.04915%0.147CC..THydrogen-bonded Turntrans99.429-176.900000115.2L2950 M2951 D2952 Y2975L2950-G2954 PolarHBondContact O-N 3.15Å; L2950-G2954 VanDerWaalsContact O-N 3.1Å; M2951-G2954 PolarHBondContact O-N 3.01Å; M2951-G2954 VanDerWaalsContact O-N 3.11Å; D2952-G2954 VanDerWaalsContact C-N 3.32Å; D2952-G2954 PolarHBondContact O-N 2.66Å; G2954-Y2975 VanDerWaalsContact CA-CE2 3.47Å
2955G86.1Confident84.3Confident1.5 Ų1.529.9 Ų29.92%0.01517%0.166CC..  trans-132.4178.7175.800000113.5L2950 M2951 F2970 N3382L2950-G2955 CarbonylContact C-O 3.56Å; L2950-G2955 VanDerWaalsContact C-O 3.23Å; L2950-G2955 PolarHBondContact O-N 3Å; L2950-G2955 VanDerWaalsContact O-O 3.13Å; M2951-G2955 VanDerWaalsContact CA-O 3.3Å; M2951-G2955 WeakPolarHBondContact CA-O 3.43Å; M2951-G2955 PolarHBondContact N-O 3.42Å; G2955-F2970 WeakPolarHBondContact O-CD2 3.45Å; G2955-N3382 VanDerWaalsContact CA-OD1 3.25Å; G2955-N3382 WeakPolarHBondContact CA-OD1 3.45Å
2956T89.6Confident83.6Confident10.25 Ų10.2530.5 Ų30.56%0.06317%0.169CC..  trans-145.3145.7173.11790000110.1Q2947 T2967 F2970 Q3108 L3385 T3386Q2947-T2956 PolarHBondContact NE2-OG1 3.32Å; Q2947-T2956 PolarHBondContact OE1-OG1 3.09Å; T2956-T2967 HydrophobicContact CG2-CG2 3.96Å; T2956-F2970 HydrophobicContact CG2-CB 4.04Å; T2956-F2970 HydrophobicContact CG2-CD1 3.92Å; T2956-F2970 HydrophobicContact CG2-CG 4.07Å; T2956-Q3108 PolarHBondContact O-NE2 2.98Å; T2956-Q3108 PolarHBondContact O-OE1 2.87Å; T2956-Q3108 VanDerWaalsContact O-OE1 3.14Å; T2956-L3385 HydrophobicContact CG2-CB 4.1Å; T2956-L3385 HydrophobicContact CG2-CD1 4.37Å; T2956-L3385 VanDerWaalsContact O-CD1 3.24Å; T2956-L3385 WeakPolarHBondContact O-CD1 3.46Å; T2956-T3386 HydrophobicContact CG2-CG2 4.33Å
2957I87.5Confident82.7Confident1 Ų132.5 Ų32.51%0.00518%0.181CC..PPolyproline II helixtrans-64152.8175.2-75.3171000109.9I2943 L2946 Q2947 L2950 L2966 T2967I2943-I2957 HydrophobicContact CD1-CD1 4.03Å; I2943-I2957 HydrophobicContact CG2-CD1 4.03Å; L2946-I2957 HydrophobicContact CB-CD1 3.95Å; L2946-I2957 HydrophobicContact CD2-CD1 4.14Å; L2946-I2957 HydrophobicContact CG-CD1 3.79Å; L2946-I2957 HydrophobicContact CG-CG1 4.25Å; Q2947-I2957 HydrophobicContact CB-CD1 3.94Å; Q2947-I2957 HydrophobicContact CB-CG1 4.48Å; Q2947-I2957 VanDerWaalsContact OE1-CG1 3.31Å; L2950-I2957 HydrophobicContact CD1-CD1 4.36Å; L2950-I2957 HydrophobicContact CD1-CG1 3.43Å; L2950-I2957 VanDerWaalsContact CD1-CG1 3.43Å; L2950-I2957 HydrophobicContact CD2-CB 4.26Å; L2950-I2957 HydrophobicContact CD2-CG1 3.71Å; I2957-L2966 HydrophobicContact CG2-CB 4.33Å; I2957-L2966 HydrophobicContact CG2-CD2 4.47Å; I2957-T2967 VanDerWaalsContact O-CG2 3.28Å; I2957-T2967 WeakPolarHBondContact O-CG2 3.41Å; I2957-T2967 PolarHBondContact O-OG1 3.15Å; I2957-T2967 VanDerWaalsContact O-OG1 3.06Å
2958E82.1Confident81.9Confident47.5 Ų47.537.3 Ų37.322%0.22221%0.211CC..PPolyproline II helixtrans-59.6151.4169.650.4-127.1167.900112.6N2960 H3101 S3104 M3381 L3385 K3688E2958-N2960 PolarHBondContact O-N 3.14Å; E2958-N2960 PolarHBondContact O-ND2 3.44Å; E2958-N2960 VanDerWaalsContact O-ND2 3.13Å; E2958-H3101 IonicContact OE1-CE1 2.67Å; E2958-H3101 IonicContact OE1-CG 3.23Å; E2958-H3101 IonicContact OE1-ND1 3.46Å; E2958-H3101 PolarHBondContact OE1-ND1 3.11Å; E2958-S3104 VanDerWaalsContact CD-OG 3.28Å; E2958-S3104 WeakPolarHBondContact OE1-CB 3.42Å; E2958-S3104 PolarHBondContact OE1-OG 3.29Å; E2958-S3104 WeakPolarHBondContact OE2-CB 3.5Å; E2958-S3104 PolarHBondContact OE2-OG 3.23Å; E2958-M3381 HydrophobicContact CB-CE 3.73Å; E2958-M3381 HydrophobicContact CB-CG 4.39Å; E2958-M3381 HydrophobicContact CB-SD 4.12Å; E2958-M3381 HydrophobicContact CG-CE 4.24Å; E2958-M3381 WeakPolarHBondContact OE2-CE 3.31Å; E2958-L3385 HydrophobicContact CB-CD1 4.45Å; E2958-K3688 HydrophobicContact CB-CD 4.47Å; E2958-K3688 HydrophobicContact CB-CG 4.24Å; E2958-K3688 HydrophobicContact CG-CG 4.11Å
2959P76.1Confident81.1Confident89.5 Ų89.539.4 Ų39.458%0.58122%0.222SC*.PPolyproline II helixtrans-54.4124.4170.6-24.734000110.7T2967 K3688P2959-T2967 HydrophobicContact CB-CG2 4.38Å; P2959-T2967 HydrophobicContact CG-CG2 4.1Å; P2959-K3688 VanDerWaalsContact O-CE 3.3Å; P2959-K3688 WeakPolarHBondContact O-CE 3.44Å; P2959-K3688 PolarHBondContact O-NZ 3.13Å
2960N77.1Confident80.4Confident14.5 Ų14.540.4 Ų40.48%0.07823%0.226CC..  trans-134.2156.7-172.465.186.3000110.5E2958 V2962 V2963 H3101E2958-N2960 PolarHBondContact O-N 3.14Å; E2958-N2960 PolarHBondContact O-ND2 3.44Å; E2958-N2960 VanDerWaalsContact O-ND2 3.13Å; N2960-V2962 VanDerWaalsContact C-N 3.32Å; N2960-V2962 HydrophobicContact CB-CG2 4.11Å; N2960-V2962 PolarHBondContact O-N 3.12Å; N2960-V2962 VanDerWaalsContact OD1-CB 3.26Å; N2960-V2962 WeakPolarHBondContact OD1-CB 3.38Å; N2960-V2962 VanDerWaalsContact OD1-CG2 3.3Å; N2960-V2962 WeakPolarHBondContact OD1-CG2 3.34Å; N2960-V2962 PolarHBondContact OD1-N 3.08Å; N2960-V2963 PolarHBondContact OD1-N 3.09Å; N2960-V2963 VanDerWaalsContact OD1-N 3.09Å; N2960-H3101 VanDerWaalsContact CB-CE1 3.46Å; N2960-H3101 WeakPolarHBondContact CB-CE1 3.49Å; N2960-H3101 WeakPolarHBondContact CB-NE2 3.36Å
2961Q73.8Confident79.7Confident148.25 Ų148.2543.4 Ų43.469%0.69324%0.242SC*.SBendtrans-85.65.7-178.9-62.9174.9-1400112.9H3094Q2961-H3094 WeakPolarHBondContact CB-ND1 3.4Å; Q2961-H3094 PolarHBondContact O-CE1 3.23Å; Q2961-H3094 PolarHBondContact O-ND1 2.89Å; Q2961-H3094 PolarHBondContact O-NE2 3.34Å
2962V72.7Confident78.7Confident16.75 Ų16.7544.8 Ų44.810%0.10225%0.253CS..SBendtrans-88-46.8-178.8-163.10000110.4D2939 E2940 I2943 N2960 H3094 L3098D2939-V2962 HydrophobicContact CB-CG1 4.26Å; E2940-V2962 HydrophobicContact CG-CG1 4.22Å; I2943-V2962 HydrophobicContact CG1-CB 4.4Å; I2943-V2962 HydrophobicContact CG1-CG1 4.23Å; I2943-V2962 HydrophobicContact CG1-CG2 4.22Å; N2960-V2962 VanDerWaalsContact C-N 3.32Å; N2960-V2962 HydrophobicContact CB-CG2 4.11Å; N2960-V2962 PolarHBondContact O-N 3.12Å; N2960-V2962 VanDerWaalsContact OD1-CB 3.26Å; N2960-V2962 WeakPolarHBondContact OD1-CB 3.38Å; N2960-V2962 VanDerWaalsContact OD1-CG2 3.3Å; N2960-V2962 WeakPolarHBondContact OD1-CG2 3.34Å; N2960-V2962 PolarHBondContact OD1-N 3.08Å; V2962-H3094 HydrophobicContact CG1-CB 4.2Å; V2962-H3094 WeakPolarHBondContact CG1-CE1 3.24Å; V2962-H3094 HydrophobicContact CG2-CB 3.84Å; V2962-H3094 WeakPolarHBondContact CG2-CD2 3.18Å; V2962-H3094 WeakPolarHBondContact CG2-NE2 3.33Å; V2962-L3098 HydrophobicContact CG1-CD1 4.32Å; V2962-L3098 HydrophobicContact CG2-CD1 4.3Å
2963V74.8Confident77.7Confident20.75 Ų20.7551.3 Ų51.313%0.12628%0.282CS..SBendtrans-141.7102.1178.7-161.30000108.3E2940 I2943 K2944 N2960 L2966E2940-V2963 HydrophobicContact CB-CG2 3.92Å; E2940-V2963 HydrophobicContact CG-CG2 4.02Å; I2943-V2963 HydrophobicContact CB-CG2 4.34Å; I2943-V2963 HydrophobicContact CG2-CG2 4.26Å; K2944-V2963 HydrophobicContact CG-CG2 4.44Å; N2960-V2963 PolarHBondContact OD1-N 3.09Å; N2960-V2963 VanDerWaalsContact OD1-N 3.09Å; V2963-L2966 HydrophobicContact CB-CB 4.44Å; V2963-L2966 HydrophobicContact CB-CD1 3.87Å; V2963-L2966 HydrophobicContact CB-CD2 4.22Å; V2963-L2966 HydrophobicContact CG1-CB 4.18Å; V2963-L2966 HydrophobicContact CG1-CD1 3.63Å; V2963-L2966 VanDerWaalsContact CG1-CD1 3.47Å; V2963-L2966 HydrophobicContact CG1-CD2 4.36Å; V2963-L2966 HydrophobicContact CG1-CG 4.43Å; V2963-L2966 WeakPolarHBondContact O-CB 3.34Å
2964E72.1Confident77.2Confident171 Ų17153.4 Ų53.480%0.79930%0.295SS*.THydrogen-bonded Turntrans-64.6157.2175.8-60.8-174.9165.200111L2966E2964-L2966 VanDerWaalsContact C-N 3.27Å; E2964-L2966 PolarHBondContact O-N 3.3Å; E2964-L2966 VanDerWaalsContact O-N 3.15Å
2965G72.4Confident76.7Confident43.25 Ų43.2554.8 Ų54.845%0.44630%0.299SS..THydrogen-bonded Turntrans73.1-8.2178.600000116.7T2967 T2968G2965-T2967 PolarHBondContact O-N 2.99Å; G2965-T2967 VanDerWaalsContact O-N 3.11Å; G2965-T2968 VanDerWaalsContact C-OG1 3.32Å; G2965-T2968 WeakPolarHBondContact CA-OG1 3.38Å; G2965-T2968 PolarHBondContact O-N 3.03Å; G2965-T2968 PolarHBondContact O-OG1 3.07Å
2966L78.7Confident76Confident14.5 Ų14.558.9 Ų58.98%0.07632%0.318CS..THydrogen-bonded Turntrans-61-29-177.4-120.963.2000114.3L2897 I2943 K2944 Q2947 I2957 V2963 E2964 T2968 L2969L2897-L2966 HydrophobicContact CB-CD1 4.4Å; L2897-L2966 HydrophobicContact CD2-CD1 3.74Å; L2897-L2966 HydrophobicContact CD2-CG 4.47Å; I2943-L2966 HydrophobicContact CG2-CD2 3.72Å; K2944-L2966 HydrophobicContact CG-CD1 4.44Å; K2944-L2966 HydrophobicContact CG-CD2 4.33Å; Q2947-L2966 HydrophobicContact CB-CD2 3.91Å; Q2947-L2966 HydrophobicContact CB-CG 4.41Å; Q2947-L2966 HydrophobicContact CG-CD1 4.38Å; Q2947-L2966 HydrophobicContact CG-CD2 4.16Å; Q2947-L2966 HydrophobicContact CG-CG 4.11Å; Q2947-L2966 PolarHBondContact NE2-O 3.14Å; Q2947-L2966 VanDerWaalsContact NE2-O 3.16Å; I2957-L2966 HydrophobicContact CG2-CB 4.33Å; I2957-L2966 HydrophobicContact CG2-CD2 4.47Å; V2963-L2966 HydrophobicContact CB-CB 4.44Å; V2963-L2966 HydrophobicContact CB-CD1 3.87Å; V2963-L2966 HydrophobicContact CB-CD2 4.22Å; V2963-L2966 HydrophobicContact CG1-CB 4.18Å; V2963-L2966 HydrophobicContact CG1-CD1 3.63Å; V2963-L2966 VanDerWaalsContact CG1-CD1 3.47Å; V2963-L2966 HydrophobicContact CG1-CD2 4.36Å; V2963-L2966 HydrophobicContact CG1-CG 4.43Å; V2963-L2966 WeakPolarHBondContact O-CB 3.34Å; E2964-L2966 VanDerWaalsContact C-N 3.27Å; E2964-L2966 PolarHBondContact O-N 3.3Å; E2964-L2966 VanDerWaalsContact O-N 3.15Å; L2966-T2968 VanDerWaalsContact C-N 3.28Å; L2966-T2968 PolarHBondContact O-N 3.13Å; L2966-L2969 WeakPolarHBondContact O-CB 3.46Å; L2966-L2969 PolarHBondContact O-N 2.65Å; L2966-L2969 VanDerWaalsContact O-N 3.14Å
2967T75.9Confident75.3Confident41.25 Ų41.2562.9 Ų62.925%0.25334%0.338SS..THydrogen-bonded Turntrans-73.8-31.7177.24.30000113.1T2956 I2957 P2959 G2965 L2969 F2970T2956-T2967 HydrophobicContact CG2-CG2 3.96Å; I2957-T2967 VanDerWaalsContact O-CG2 3.28Å; I2957-T2967 WeakPolarHBondContact O-CG2 3.41Å; I2957-T2967 PolarHBondContact O-OG1 3.15Å; I2957-T2967 VanDerWaalsContact O-OG1 3.06Å; P2959-T2967 HydrophobicContact CB-CG2 4.38Å; P2959-T2967 HydrophobicContact CG-CG2 4.1Å; G2965-T2967 PolarHBondContact O-N 2.99Å; G2965-T2967 VanDerWaalsContact O-N 3.11Å; T2967-L2969 VanDerWaalsContact C-N 3.27Å; T2967-L2969 PolarHBondContact O-N 3.17Å; T2967-F2970 PolarHBondContact O-N 3.19Å
2968T75.1Confident74.9Confident101.75 Ų101.7565.7 Ų65.762%0.62435%0.35SS*.THydrogen-bonded Turntrans-71.1-20.6178.357.20000112.8G2965 L2966 F2970 M3622G2965-T2968 VanDerWaalsContact C-OG1 3.32Å; G2965-T2968 WeakPolarHBondContact CA-OG1 3.38Å; G2965-T2968 PolarHBondContact O-N 3.03Å; G2965-T2968 PolarHBondContact O-OG1 3.07Å; L2966-T2968 VanDerWaalsContact C-N 3.28Å; L2966-T2968 PolarHBondContact O-N 3.13Å; T2968-F2970 VanDerWaalsContact C-N 3.29Å; T2968-F2970 PolarHBondContact O-N 3.11Å; T2968-M3622 HydrophobicContact CG2-CE 3.54Å
2969L76.5Confident74.8Confident46.5 Ų46.566.5 Ų66.524%0.24336%0.36CS..THydrogen-bonded Turntrans-67.8-21.3174-168.460.9000113.2L2897 T2898 I2901 M2951 L2966 T2967 N2971L2897-L2969 HydrophobicContact CB-CD2 4.16Å; L2897-L2969 HydrophobicContact CD2-CD2 3.91Å; L2897-L2969 HydrophobicContact CG-CD2 3.97Å; T2898-L2969 HydrophobicContact CG2-CD1 3.49Å; T2898-L2969 VanDerWaalsContact CG2-CD1 3.47Å; T2898-L2969 HydrophobicContact CG2-CD2 4.11Å; T2898-L2969 HydrophobicContact CG2-CG 4.18Å; I2901-L2969 HydrophobicContact CD1-CD2 4.18Å; M2951-L2969 HydrophobicContact CE-CB 4.29Å; M2951-L2969 HydrophobicContact CE-CD2 4.4Å; M2951-L2969 HydrophobicContact CE-CG 4.12Å; M2951-L2969 WeakPolarHBondContact CE-O 3.22Å; M2951-L2969 HydrophobicContact SD-CB 4.41Å; M2951-L2969 HydrophobicContact SD-CD2 4.24Å; M2951-L2969 HydrophobicContact SD-CG 4.13Å; L2966-L2969 WeakPolarHBondContact O-CB 3.46Å; L2966-L2969 PolarHBondContact O-N 2.65Å; L2966-L2969 VanDerWaalsContact O-N 3.14Å; T2967-L2969 VanDerWaalsContact C-N 3.27Å; T2967-L2969 PolarHBondContact O-N 3.17Å; L2969-N2971 PolarHBondContact O-N 3.08Å; L2969-N2971 VanDerWaalsContact O-N 3.13Å
2970F77.5Confident75.4Confident22 Ų2262.5 Ų62.510%0.09633%0.334CS..  trans-84.989.1176.9-175.6-101.6000111.3M2951 G2955 T2956 T2967 T2968 P2972 Y2975 T3386 T3390M2951-F2970 HydrophobicContact CB-CD2 4.49Å; M2951-F2970 HydrophobicContact CE-CD2 4.43Å; M2951-F2970 HydrophobicContact CG-CD2 4.09Å; G2955-F2970 WeakPolarHBondContact O-CD2 3.45Å; T2956-F2970 HydrophobicContact CG2-CB 4.04Å; T2956-F2970 HydrophobicContact CG2-CD1 3.92Å; T2956-F2970 HydrophobicContact CG2-CG 4.07Å; T2967-F2970 PolarHBondContact O-N 3.19Å; T2968-F2970 VanDerWaalsContact C-N 3.29Å; T2968-F2970 PolarHBondContact O-N 3.11Å; F2970-P2972 HydrophobicContact CE1-CB 4.1Å; F2970-P2972 HydrophobicContact CZ-CB 4.28Å; F2970-P2972 WeakPolarHBondContact O-CD 3.38Å; F2970-Y2975 HydrophobicContact CE2-CD1 4.22Å; F2970-Y2975 HydrophobicContact CE2-CD2 4.12Å; F2970-Y2975 HydrophobicContact CE2-CE2 4.48Å; F2970-Y2975 AromaticContact CE2-CG 3.9Å; F2970-Y2975 HydrophobicContact CE2-CG 3.9Å; F2970-Y2975 HydrophobicContact CZ-CD1 4.25Å; F2970-Y2975 HydrophobicContact CZ-CE1 4.31Å; F2970-Y2975 HydrophobicContact CZ-CG 4.3Å; F2970-T3386 HydrophobicContact CD1-CG2 4.28Å; F2970-T3386 HydrophobicContact CE1-CG2 3.74Å; F2970-T3386 HydrophobicContact CZ-CG2 4.27Å; F2970-T3390 HydrophobicContact CE1-CG2 3.96Å; F2970-T3390 HydrophobicContact CZ-CG2 3.59Å
2971N76.9Confident75.9Confident63.5 Ų63.562.7 Ų62.734%0.3434%0.34SS..  trans-88.7114.3166.9-178.4-25000110.1L2969 Q2973 T2974 Y2975L2969-N2971 PolarHBondContact O-N 3.08Å; L2969-N2971 VanDerWaalsContact O-N 3.13Å; N2971-Q2973 VanDerWaalsContact C-N 3.28Å; N2971-Q2973 PolarHBondContact O-N 3.07Å; N2971-Q2973 VanDerWaalsContact O-N 3.14Å; N2971-Q2973 WeakPolarHBondContact OD1-CB 3.37Å; N2971-Q2973 PolarHBondContact OD1-N 2.97Å; N2971-T2974 WeakPolarHBondContact CB-OG1 3.33Å; N2971-T2974 PolarHBondContact O-N 3.31Å; N2971-T2974 VanDerWaalsContact O-N 3.15Å; N2971-Y2975 PolarHBondContact O-N 2.85Å
2972P68.6Low76.7Confident49.5 Ų49.555.7 Ų55.732%0.32131%0.307SS..THydrogen-bonded Turntrans-68.9-19.1-176.429.2-37.2000114.3F2970 T2974 Y2975 A3389 T3390F2970-P2972 HydrophobicContact CE1-CB 4.1Å; F2970-P2972 HydrophobicContact CZ-CB 4.28Å; F2970-P2972 WeakPolarHBondContact O-CD 3.38Å; P2972-T2974 VanDerWaalsContact C-N 3.33Å; P2972-Y2975 VanDerWaalsContact O-CD1 3.29Å; P2972-Y2975 WeakPolarHBondContact O-CD1 3.36Å; P2972-Y2975 WeakPolarHBondContact O-CE1 3.38Å; P2972-A3389 HydrophobicContact CB-CB 3.5Å; P2972-A3389 VanDerWaalsContact CB-CB 3.45Å; P2972-A3389 VanDerWaalsContact CB-O 3.31Å; P2972-A3389 WeakPolarHBondContact CB-O 3.41Å; P2972-A3389 HydrophobicContact CG-CB 3.57Å; P2972-T3390 HydrophobicContact CB-CG2 4.18Å
2973Q67.6Low77.5Confident167.75 Ų167.7554.9 Ų54.978%0.78430%0.302SS*.THydrogen-bonded Turntrans-80.3-25.9176.9-60.1178.3-9.400111.9N2971N2971-Q2973 VanDerWaalsContact C-N 3.28Å; N2971-Q2973 PolarHBondContact O-N 3.07Å; N2971-Q2973 VanDerWaalsContact O-N 3.14Å; N2971-Q2973 WeakPolarHBondContact OD1-CB 3.37Å; N2971-Q2973 PolarHBondContact OD1-N 2.97Å
2974T76.5Confident78.1Confident46.25 Ų46.2558.9 Ų58.928%0.28432%0.32SS..THydrogen-bonded Turntrans-118.3-11.7-170.463.70000115.1N2971 P2972 H2976 L2977 F2978N2971-T2974 WeakPolarHBondContact CB-OG1 3.33Å; N2971-T2974 PolarHBondContact O-N 3.31Å; N2971-T2974 VanDerWaalsContact O-N 3.15Å; P2972-T2974 VanDerWaalsContact C-N 3.33Å; T2974-H2976 VanDerWaalsContact C-N 3.25Å; T2974-H2976 PolarHBondContact O-N 3.36Å; T2974-H2976 VanDerWaalsContact O-N 3.13Å; T2974-L2977 HydrophobicContact CG2-CD1 4.22Å; T2974-L2977 VanDerWaalsContact O-CB 3.26Å; T2974-L2977 WeakPolarHBondContact O-CB 3.35Å; T2974-L2977 WeakPolarHBondContact O-CG 3.42Å; T2974-L2977 PolarHBondContact O-N 3.06Å; T2974-F2978 WeakPolarHBondContact O-CD2 3.37Å
2975Y72Confident79.1Confident32.75 Ų32.7551.7 Ų51.713%0.12829%0.286CS..G310 helixtrans-57.4-34.5-178.583.9-77.9000113.4M2951 G2954 F2970 N2971 P2972 L2977 F2978 T3390 L3392M2951-Y2975 VanDerWaalsContact O-CD2 3.26Å; M2951-Y2975 WeakPolarHBondContact O-CD2 3.43Å; G2954-Y2975 VanDerWaalsContact CA-CE2 3.47Å; F2970-Y2975 HydrophobicContact CE2-CD1 4.22Å; F2970-Y2975 HydrophobicContact CE2-CD2 4.12Å; F2970-Y2975 HydrophobicContact CE2-CE2 4.48Å; F2970-Y2975 AromaticContact CE2-CG 3.9Å; F2970-Y2975 HydrophobicContact CE2-CG 3.9Å; F2970-Y2975 HydrophobicContact CZ-CD1 4.25Å; F2970-Y2975 HydrophobicContact CZ-CE1 4.31Å; F2970-Y2975 HydrophobicContact CZ-CG 4.3Å; N2971-Y2975 PolarHBondContact O-N 2.85Å; P2972-Y2975 VanDerWaalsContact O-CD1 3.29Å; P2972-Y2975 WeakPolarHBondContact O-CD1 3.36Å; P2972-Y2975 WeakPolarHBondContact O-CE1 3.38Å; Y2975-L2977 PolarHBondContact O-N 3Å; Y2975-L2977 VanDerWaalsContact O-N 3.12Å; Y2975-F2978 PolarHBondContact O-N 3.18Å; Y2975-F2978 VanDerWaalsContact O-N 3.14Å; Y2975-T3390 HydrophobicContact CE1-CG2 3.83Å; Y2975-L3392 WeakPolarHBondContact OH-CD1 3.47Å
2976H72.1Confident80Confident88 Ų8849.7 Ų49.741%0.40727%0.265SS..G310 helixtrans-59.9-20.9174.1-70.1-53.4000114.6T2974 F2978T2974-H2976 VanDerWaalsContact C-N 3.25Å; T2974-H2976 PolarHBondContact O-N 3.36Å; T2974-H2976 VanDerWaalsContact O-N 3.13Å; H2976-F2978 VanDerWaalsContact C-N 3.26Å; H2976-F2978 PolarHBondContact O-N 3.14Å
2977L74.7Confident80.6Confident93.75 Ų93.7552.6 Ų52.649%0.49128%0.275SS..G310 helixtrans-76.2-13.3179.6-55.3177.1000112.8T2974 Y2975 P2979T2974-L2977 HydrophobicContact CG2-CD1 4.22Å; T2974-L2977 VanDerWaalsContact O-CB 3.26Å; T2974-L2977 WeakPolarHBondContact O-CB 3.35Å; T2974-L2977 WeakPolarHBondContact O-CG 3.42Å; T2974-L2977 PolarHBondContact O-N 3.06Å; Y2975-L2977 PolarHBondContact O-N 3Å; Y2975-L2977 VanDerWaalsContact O-N 3.12Å; L2977-P2979 VanDerWaalsContact O-CD 3.28Å; L2977-P2979 WeakPolarHBondContact O-CD 3.38Å
2978F78.8Confident81.3Confident60.25 Ų60.2555 Ų5526%0.26429%0.292SS..SBendtrans-120.157.7-176.6-56.1-82.7000112.9T2443 I2901 S2905 T2974 Y2975 H2976 T2980 L3652T2443-F2978 HydrophobicContact CG2-CZ 4.1Å; I2901-F2978 HydrophobicContact CG2-CB 3.92Å; I2901-F2978 HydrophobicContact CG2-CG 4.42Å; S2905-F2978 WeakPolarHBondContact OG-CA 3.34Å; T2974-F2978 WeakPolarHBondContact O-CD2 3.37Å; Y2975-F2978 PolarHBondContact O-N 3.18Å; Y2975-F2978 VanDerWaalsContact O-N 3.14Å; H2976-F2978 VanDerWaalsContact C-N 3.26Å; H2976-F2978 PolarHBondContact O-N 3.14Å; F2978-T2980 WeakPolarHBondContact O-CG2 3.32Å; F2978-T2980 PolarHBondContact O-N 3.21Å; F2978-T2980 VanDerWaalsContact O-N 3.09Å; F2978-L3652 HydrophobicContact CE1-CB 4.07Å; F2978-L3652 HydrophobicContact CE1-CD1 4.2Å; F2978-L3652 HydrophobicContact CZ-CB 3.68Å; F2978-L3652 HydrophobicContact CZ-CD1 4.09Å
2979P81.8Confident82.1Confident65.25 Ų65.2551.6 Ų51.642%0.42427%0.268SS..  trans-67109.9-17628.3-35.1000111.5S2905 N2908 L2977S2905-P2979 PolarHBondContact OG-O 3.3Å; N2908-P2979 PolarHBondContact ND2-O 3.19Å; L2977-P2979 VanDerWaalsContact O-CD 3.28Å; L2977-P2979 WeakPolarHBondContact O-CD 3.38Å
2980T87.1Confident82.8Confident4.5 Ų4.549.6 Ų49.63%0.02826%0.258CS..  trans-93.4-23.1179.473.70000112.4I2901 C2904 N2908 S2920 F2948 D2952 F2978 A2982I2901-T2980 HydrophobicContact CG2-CG2 4.31Å; C2904-T2980 HydrophobicContact CB-CG2 4.18Å; N2908-T2980 VanDerWaalsContact ND2-CA 3.33Å; N2908-T2980 WeakPolarHBondContact ND2-CA 3.38Å; N2908-T2980 PolarHBondContact ND2-O 3.19Å; S2920-T2980 VanDerWaalsContact CB-O 3.22Å; S2920-T2980 WeakPolarHBondContact CB-O 3.24Å; S2920-T2980 PolarHBondContact OG-O 3.24Å; F2948-T2980 HydrophobicContact CE2-CG2 3.83Å; F2948-T2980 HydrophobicContact CZ-CG2 4.16Å; D2952-T2980 WeakPolarHBondContact CB-OG1 3.4Å; D2952-T2980 WeakPolarHBondContact OD1-CA 3.36Å; D2952-T2980 WeakPolarHBondContact OD1-CB 3.37Å; D2952-T2980 PolarHBondContact OD1-N 3.09Å; D2952-T2980 PolarHBondContact OD1-OG1 3.13Å; F2978-T2980 WeakPolarHBondContact O-CG2 3.32Å; F2978-T2980 PolarHBondContact O-N 3.21Å; F2978-T2980 VanDerWaalsContact O-N 3.09Å; T2980-A2982 VanDerWaalsContact C-N 3.29Å; T2980-A2982 PolarHBondContact O-N 3.19Å; T2980-A2982 WeakPolarHBondContact OG1-CB 3.38Å; T2980-A2982 PolarHBondContact OG1-N 3.06Å
2981G87.5Confident83.4Confident19.5 Ų19.551.9 Ų51.920%0.20128%0.275CS..  trans7013.3-17800000113.8D2952 A2983 E2984 L2985D2952-G2981 PolarHBondContact OD1-N 3.23Å; D2952-G2981 VanDerWaalsContact OD2-C 3.24Å; D2952-G2981 VanDerWaalsContact OD2-CA 3.27Å; D2952-G2981 WeakPolarHBondContact OD2-CA 3.4Å; D2952-G2981 PolarHBondContact OD2-N 3.32Å; G2981-A2983 VanDerWaalsContact C-N 3.32Å; G2981-A2983 PolarHBondContact O-N 3.02Å; G2981-E2984 PolarHBondContact O-N 2.96Å; G2981-L2985 WeakPolarHBondContact O-CD1 3.31Å; G2981-L2985 VanDerWaalsContact O-CG 3.3Å; G2981-L2985 WeakPolarHBondContact O-CG 3.42Å; G2981-L2985 PolarHBondContact O-N 3.02Å; G2981-L2985 VanDerWaalsContact O-N 3.14Å
2982A91.4Very high84.1Confident0 Ų051.2 Ų51.20%027%0.271CS..Hα-helixtrans-61.6-36.2178.700000112.7V2924 F2948 I2949 D2952 T2980 L2985 M2986V2924-A2982 HydrophobicContact CG2-CB 4.1Å; F2948-A2982 HydrophobicContact CD1-CB 3.9Å; F2948-A2982 HydrophobicContact CE1-CB 3.52Å; F2948-A2982 HydrophobicContact CZ-CB 4.25Å; I2949-A2982 HydrophobicContact CG1-CB 4.22Å; D2952-A2982 HydrophobicContact CB-CB 4.11Å; D2952-A2982 PolarHBondContact OD2-N 3.14Å; T2980-A2982 VanDerWaalsContact C-N 3.29Å; T2980-A2982 PolarHBondContact O-N 3.19Å; T2980-A2982 WeakPolarHBondContact OG1-CB 3.38Å; T2980-A2982 PolarHBondContact OG1-N 3.06Å; A2982-L2985 PolarHBondContact O-N 3.23Å; A2982-M2986 VanDerWaalsContact O-CB 3.26Å; A2982-M2986 WeakPolarHBondContact O-CB 3.31Å; A2982-M2986 PolarHBondContact O-N 3.05Å
2983A89.6Confident85.3Confident1 Ų148.9 Ų48.91%0.00826%0.256CS..Hα-helixtrans-66-44.9177.100000111.6D2952 A2953 G2981 L2985 M2986 R2987 Y3109D2952-A2983 HydrophobicContact CB-CB 4.41Å; D2952-A2983 WeakPolarHBondContact OD2-CB 3.35Å; D2952-A2983 PolarHBondContact OD2-N 3.28Å; A2953-A2983 HydrophobicContact CB-CB 4.04Å; G2981-A2983 VanDerWaalsContact C-N 3.32Å; G2981-A2983 PolarHBondContact O-N 3.02Å; A2983-L2985 VanDerWaalsContact C-N 3.28Å; A2983-L2985 PolarHBondContact O-N 2.97Å; A2983-M2986 PolarHBondContact O-N 3.09Å; A2983-M2986 VanDerWaalsContact O-N 3.11Å; A2983-R2987 PolarHBondContact O-N 3.05Å; A2983-R2987 VanDerWaalsContact O-N 3.15Å; A2983-Y3109 HydrophobicContact CB-CE2 4.16Å; A2983-Y3109 PolarHBondContact O-OH 3.2Å
2984E88.3Confident86.5Confident105.25 Ų105.2542 Ų4249%0.49223%0.225SC..Hα-helixtrans-58.3-40175.1-60.4-82122.200112G2981 M2986 R2987 R3116G2981-E2984 PolarHBondContact O-N 2.96Å; E2984-M2986 VanDerWaalsContact C-N 3.32Å; E2984-M2986 PolarHBondContact O-N 3.32Å; E2984-R2987 WeakPolarHBondContact O-CB 3.46Å; E2984-R2987 IonicContact OE1-CZ 3.18Å; E2984-R2987 IonicContact OE1-NH1 3.12Å; E2984-R2987 PolarHBondContact OE1-NH1 3.04Å; E2984-R2987 IonicContact OE1-NH2 3.22Å; E2984-R2987 PolarHBondContact OE1-NH2 3.05Å; E2984-R2987 IonicContact OE2-CZ 3.34Å; E2984-R2987 IonicContact OE2-NH1 3.07Å; E2984-R2987 PolarHBondContact OE2-NH1 3.42Å; E2984-R2987 IonicContact OE2-NH2 3.07Å; E2984-R3116 IonicContact OE1-NH2 3.38Å
2985L91.9Very high87.2Confident19 Ų1942.4 Ų42.410%0.09923%0.233CC..Hα-helixtrans-72.2-27.6178.1-71167000113.4A2917 R2921 V2924 G2981 A2982 A2983 P2988A2917-L2985 HydrophobicContact CB-CD1 4.31Å; A2917-L2985 HydrophobicContact CB-CD2 4.46Å; R2921-L2985 HydrophobicContact CB-CD1 4.23Å; R2921-L2985 HydrophobicContact CB-CD2 4.36Å; R2921-L2985 VanDerWaalsContact NH2-CD2 3.3Å; V2924-L2985 HydrophobicContact CB-CB 4.41Å; V2924-L2985 HydrophobicContact CG1-CB 4.31Å; V2924-L2985 HydrophobicContact CG2-CB 4.09Å; G2981-L2985 WeakPolarHBondContact O-CD1 3.31Å; G2981-L2985 VanDerWaalsContact O-CG 3.3Å; G2981-L2985 WeakPolarHBondContact O-CG 3.42Å; G2981-L2985 PolarHBondContact O-N 3.02Å; G2981-L2985 VanDerWaalsContact O-N 3.14Å; A2982-L2985 PolarHBondContact O-N 3.23Å; A2983-L2985 VanDerWaalsContact C-N 3.28Å; A2983-L2985 PolarHBondContact O-N 2.97Å; L2985-P2988 VanDerWaalsContact O-CD 3.24Å; L2985-P2988 WeakPolarHBondContact O-CD 3.26Å
2986M92.1Very high88.1Confident0.5 Ų0.541.5 Ų41.50%0.00223%0.229CC..Hα-helixtrans-87.7-18.6-179.2-169.665.8175.300112.7V2924 F2927 I2931 I2949 A2982 A2983 E2984 P2988 H2989 L2990 C2993 L3106 Y3109V2924-M2986 HydrophobicContact CG1-CB 4.16Å; V2924-M2986 HydrophobicContact CG1-SD 3.75Å; F2927-M2986 HydrophobicContact CD1-CE 3.76Å; F2927-M2986 HydrophobicContact CD1-SD 4.37Å; F2927-M2986 HydrophobicContact CE1-CE 3.89Å; I2931-M2986 HydrophobicContact CD1-CE 3.97Å; I2949-M2986 HydrophobicContact CD1-CG 4.44Å; I2949-M2986 HydrophobicContact CD1-SD 4.35Å; I2949-M2986 HydrophobicContact CG2-CB 4.15Å; I2949-M2986 HydrophobicContact CG2-CG 4.16Å; A2982-M2986 VanDerWaalsContact O-CB 3.26Å; A2982-M2986 WeakPolarHBondContact O-CB 3.31Å; A2982-M2986 PolarHBondContact O-N 3.05Å; A2983-M2986 PolarHBondContact O-N 3.09Å; A2983-M2986 VanDerWaalsContact O-N 3.11Å; E2984-M2986 VanDerWaalsContact C-N 3.32Å; E2984-M2986 PolarHBondContact O-N 3.32Å; M2986-P2988 VanDerWaalsContact C-CD 3.44Å; M2986-H2989 HydrophobicContact CE-CB 4.28Å; M2986-H2989 WeakPolarHBondContact O-CA 3.37Å; M2986-H2989 WeakPolarHBondContact O-CB 3.44Å; M2986-H2989 PolarHBondContact O-N 3.07Å; M2986-H2989 HydrophobicContact SD-CB 4.08Å; M2986-L2990 PolarHBondContact O-N 2.85Å; M2986-C2993 VanDerWaalsContact CE-SG 3.53Å; M2986-C2993 WeakPolarHBondContact CE-SG 3.47Å; M2986-L3106 HydrophobicContact CE-CD1 4.49Å; M2986-L3106 HydrophobicContact CE-CD2 4.49Å; M2986-Y3109 VanDerWaalsContact C-OH 3.25Å; M2986-Y3109 HydrophobicContact CB-CE1 4.27Å; M2986-Y3109 HydrophobicContact CB-CE2 4.43Å; M2986-Y3109 VanDerWaalsContact CB-OH 3.31Å; M2986-Y3109 WeakPolarHBondContact CB-OH 3.19Å; M2986-Y3109 HydrophobicContact CG-CD1 4.39Å; M2986-Y3109 HydrophobicContact CG-CE1 3.63Å
2987R90.6Very high89.1Confident76.75 Ų76.7537.9 Ų37.929%0.2921%0.213SC..G310 helixtrans-48.9-43.9175.9-123.9-175.1-119.5118.223.5115.2A2983 E2984 H2989 L2990 Y3109 E3113A2983-R2987 PolarHBondContact O-N 3.05Å; A2983-R2987 VanDerWaalsContact O-N 3.15Å; E2984-R2987 WeakPolarHBondContact O-CB 3.46Å; E2984-R2987 IonicContact OE1-CZ 3.18Å; E2984-R2987 IonicContact OE1-NH1 3.12Å; E2984-R2987 PolarHBondContact OE1-NH1 3.04Å; E2984-R2987 IonicContact OE1-NH2 3.22Å; E2984-R2987 PolarHBondContact OE1-NH2 3.05Å; E2984-R2987 IonicContact OE2-CZ 3.34Å; E2984-R2987 IonicContact OE2-NH1 3.07Å; E2984-R2987 PolarHBondContact OE2-NH1 3.42Å; E2984-R2987 IonicContact OE2-NH2 3.07Å; R2987-H2989 PolarHBondContact O-N 3.2Å; R2987-H2989 VanDerWaalsContact O-N 3.1Å; R2987-L2990 HydrophobicContact CB-CD1 4.43Å; R2987-L2990 HydrophobicContact CG-CD1 4.04Å; R2987-L2990 WeakPolarHBondContact O-CB 3.28Å; R2987-L2990 WeakPolarHBondContact O-CD1 3.37Å; R2987-L2990 VanDerWaalsContact O-CG 3.3Å; R2987-L2990 WeakPolarHBondContact O-CG 3.42Å; R2987-L2990 PolarHBondContact O-N 3.11Å; R2987-L2990 VanDerWaalsContact O-N 3.1Å; R2987-Y3109 PolarHBondContact N-OH 3.09Å; R2987-E3113 IonicContact CZ-OE1 3.29Å; R2987-E3113 IonicContact CZ-OE2 3.27Å; R2987-E3113 VanDerWaalsContact CZ-OE2 3.31Å; R2987-E3113 IonicContact NE-OE1 3.31Å; R2987-E3113 IonicContact NE-OE2 3.1Å; R2987-E3113 PolarHBondContact NE-OE2 3.08Å; R2987-E3113 IonicContact NH2-OE1 3.2Å; R2987-E3113 PolarHBondContact NH2-OE1 3.07Å; R2987-E3113 IonicContact NH2-OE2 3.11Å; R2987-E3113 PolarHBondContact NH2-OE2 3.06Å; R2987-E3113 VanDerWaalsContact NH2-OE2 3.09Å
2988P90.6Very high89.9Confident92 Ų9235 Ų3560%0.59720%0.2SC*.G310 helixtrans-62.2-19177.4-22.735.6000114L2985 M2986L2985-P2988 VanDerWaalsContact O-CD 3.24Å; L2985-P2988 WeakPolarHBondContact O-CD 3.26Å; M2986-P2988 VanDerWaalsContact C-CD 3.44Å
2989H91.6Very high90.5Very high29 Ų2933.9 Ų33.913%0.13420%0.198CC..G310 helixtrans-993.5-178.7-56.4-57.7000113.3Y2928 M2986 R2987 P2991 D2992 C2993Y2928-H2989 AromaticContact CD1-CE1 3.96Å; Y2928-H2989 HydrophobicContact CD2-CB 3.95Å; Y2928-H2989 AromaticContact CD2-CG 3.68Å; Y2928-H2989 AromaticContact CD2-ND1 3.65Å; Y2928-H2989 AromaticContact CE1-CE1 3.71Å; Y2928-H2989 AromaticContact CE1-ND1 3.85Å; Y2928-H2989 HydrophobicContact CE2-CB 4.07Å; Y2928-H2989 AromaticContact CE2-CE1 3.9Å; Y2928-H2989 AromaticContact CE2-CG 3.71Å; Y2928-H2989 AromaticContact CE2-ND1 3.22Å; Y2928-H2989 WeakPolarHBondContact CE2-ND1 3.28Å; Y2928-H2989 AromaticContact CZ-CE1 3.6Å; Y2928-H2989 AromaticContact CZ-ND1 3.34Å; Y2928-H2989 VanDerWaalsContact CZ-ND1 3.3Å; M2986-H2989 HydrophobicContact CE-CB 4.28Å; M2986-H2989 WeakPolarHBondContact O-CA 3.37Å; M2986-H2989 WeakPolarHBondContact O-CB 3.44Å; M2986-H2989 PolarHBondContact O-N 3.07Å; M2986-H2989 HydrophobicContact SD-CB 4.08Å; R2987-H2989 PolarHBondContact O-N 3.2Å; R2987-H2989 VanDerWaalsContact O-N 3.1Å; H2989-P2991 VanDerWaalsContact C-CD 3.45Å; H2989-P2991 VanDerWaalsContact C-N 3.33Å; H2989-D2992 WeakPolarHBondContact O-CB 3.28Å; H2989-D2992 PolarHBondContact O-N 3.08Å; H2989-C2993 PolarHBondContact O-N 3.09Å; H2989-C2993 PolarHBondContact O-SG 3.15Å
2990L90.9Very high90.8Very high5.5 Ų5.534.8 Ų34.83%0.02920%0.198CC..Hα-helixtrans-53.1-38.9175.7-93.3149.8000114.3M2986 R2987 D2992 C2993 L2994 Y3109 V3110 E3113 Y3344M2986-L2990 PolarHBondContact O-N 2.85Å; R2987-L2990 HydrophobicContact CB-CD1 4.43Å; R2987-L2990 HydrophobicContact CG-CD1 4.04Å; R2987-L2990 WeakPolarHBondContact O-CB 3.28Å; R2987-L2990 WeakPolarHBondContact O-CD1 3.37Å; R2987-L2990 VanDerWaalsContact O-CG 3.3Å; R2987-L2990 WeakPolarHBondContact O-CG 3.42Å; R2987-L2990 PolarHBondContact O-N 3.11Å; R2987-L2990 VanDerWaalsContact O-N 3.1Å; L2990-D2992 VanDerWaalsContact C-N 3.32Å; L2990-D2992 PolarHBondContact O-N 3.25Å; L2990-C2993 WeakPolarHBondContact O-CB 3.41Å; L2990-C2993 PolarHBondContact O-N 2.86Å; L2990-L2994 PolarHBondContact O-N 3.03Å; L2990-L2994 VanDerWaalsContact O-N 3.11Å; L2990-Y3109 HydrophobicContact CD2-CD1 4.33Å; L2990-Y3109 HydrophobicContact CD2-CE1 3.6Å; L2990-Y3109 HydrophobicContact CG-CE1 4.45Å; L2990-V3110 HydrophobicContact CD2-CB 4.38Å; L2990-V3110 HydrophobicContact CD2-CG1 4.43Å; L2990-V3110 HydrophobicContact CD2-CG2 3.87Å; L2990-E3113 HydrophobicContact CD1-CB 4.1Å; L2990-E3113 HydrophobicContact CD1-CG 4.49Å; L2990-E3113 HydrophobicContact CD2-CB 4.16Å; L2990-E3113 HydrophobicContact CD2-CG 4.43Å; L2990-Y3344 HydrophobicContact CB-CE1 3.92Å; L2990-Y3344 HydrophobicContact CD1-CE1 4.46Å
2991P90.7Very high90.9Very high69.25 Ų69.2539.1 Ų39.145%0.4522%0.217SC..Hα-helixtrans-62.8-36.6174.5-23.535.2000113.4H2989 L2994 A2995 Y3344H2989-P2991 VanDerWaalsContact C-CD 3.45Å; H2989-P2991 VanDerWaalsContact C-N 3.33Å; P2991-L2994 PolarHBondContact O-N 3.02Å; P2991-A2995 WeakPolarHBondContact O-CB 3.47Å; P2991-A2995 PolarHBondContact O-N 3.19Å; P2991-Y3344 HydrophobicContact CG-CD1 4.38Å; P2991-Y3344 HydrophobicContact CG-CE1 4.16Å
2992D92.6Very high91Very high49 Ų4938.3 Ų38.326%0.26221%0.209SC..Hα-helixtrans-71.8-33.6176-70.1-62.2000111.8Y2928 K2932 H2989 L2990 A2995 F2996Y2928-D2992 HydrophobicContact CE2-CB 4.25Å; Y2928-D2992 WeakPolarHBondContact CE2-OD2 3.38Å; Y2928-D2992 PolarHBondContact OH-OD2 3.16Å; K2932-D2992 WeakPolarHBondContact CE-OD1 3.41Å; K2932-D2992 WeakPolarHBondContact CE-OD2 3.37Å; K2932-D2992 IonicContact NZ-OD1 3.4Å; K2932-D2992 PolarHBondContact NZ-OD1 3.06Å; K2932-D2992 IonicContact NZ-OD2 3.76Å; K2932-D2992 PolarHBondContact NZ-OD2 3.11Å; H2989-D2992 WeakPolarHBondContact O-CB 3.28Å; H2989-D2992 PolarHBondContact O-N 3.08Å; L2990-D2992 VanDerWaalsContact C-N 3.32Å; L2990-D2992 PolarHBondContact O-N 3.25Å; D2992-A2995 PolarHBondContact O-N 3.43Å; D2992-F2996 WeakPolarHBondContact O-CB 3.42Å; D2992-F2996 PolarHBondContact O-N 3.07Å
2993C93Very high90.7Very high0.75 Ų0.7539.6 Ų39.61%0.00522%0.217CC..Hα-helixtrans-63-47.1172.9-58.50000111M2986 H2989 L2990 A2995 F2996 I2997 L3106 V3110M2986-C2993 VanDerWaalsContact CE-SG 3.53Å; M2986-C2993 WeakPolarHBondContact CE-SG 3.47Å; H2989-C2993 PolarHBondContact O-N 3.09Å; H2989-C2993 PolarHBondContact O-SG 3.15Å; L2990-C2993 WeakPolarHBondContact O-CB 3.41Å; L2990-C2993 PolarHBondContact O-N 2.86Å; C2993-A2995 VanDerWaalsContact C-N 3.33Å; C2993-A2995 PolarHBondContact O-N 3.15Å; C2993-F2996 PolarHBondContact O-N 3.2Å; C2993-I2997 WeakPolarHBondContact O-CD1 3.32Å; C2993-I2997 VanDerWaalsContact O-CG1 3.28Å; C2993-I2997 WeakPolarHBondContact O-CG1 3.41Å; C2993-I2997 PolarHBondContact O-N 3.14Å; C2993-L3106 HydrophobicContact CB-CD1 4.16Å; C2993-L3106 HydrophobicContact CB-CD2 4.21Å; C2993-L3106 HydrophobicContact CB-CG 4.13Å; C2993-V3110 HydrophobicContact CB-CG2 3.7Å
2994L91.6Very high90.4Very high24.75 Ų24.7543.1 Ų43.113%0.1324%0.235CC..Hα-helixtrans-60.6-41.3175.5-75.4167.7000111.8L2990 P2991 I2997 S2998 V3110 Y3344 L3345 T3371L2990-L2994 PolarHBondContact O-N 3.03Å; L2990-L2994 VanDerWaalsContact O-N 3.11Å; P2991-L2994 PolarHBondContact O-N 3.02Å; L2994-I2997 PolarHBondContact O-N 2.95Å; L2994-S2998 VanDerWaalsContact O-CB 3.29Å; L2994-S2998 WeakPolarHBondContact O-CB 3.31Å; L2994-S2998 PolarHBondContact O-N 3.04Å; L2994-S2998 PolarHBondContact O-OG 3.23Å; L2994-V3110 HydrophobicContact CD2-CG1 3.84Å; L2994-V3110 HydrophobicContact CG-CG1 4.15Å; L2994-Y3344 HydrophobicContact CD1-CD1 4.07Å; L2994-Y3344 HydrophobicContact CD1-CG 4.26Å; L2994-L3345 HydrophobicContact CD1-CD2 4.41Å; L2994-L3345 HydrophobicContact CD2-CD2 4.34Å; L2994-T3371 HydrophobicContact CD2-CG2 4.29Å
2995A91.4Very high90.4Very high53.75 Ų53.7541.8 Ų41.844%0.44423%0.228SC..Hα-helixtrans-63.6-40.5174.400000112.6P2991 D2992 C2993 S2998 D2999P2991-A2995 WeakPolarHBondContact O-CB 3.47Å; P2991-A2995 PolarHBondContact O-N 3.19Å; D2992-A2995 PolarHBondContact O-N 3.43Å; C2993-A2995 VanDerWaalsContact C-N 3.33Å; C2993-A2995 PolarHBondContact O-N 3.15Å; A2995-S2998 WeakPolarHBondContact CA-OG 3.46Å; A2995-S2998 PolarHBondContact O-N 3.34Å; A2995-S2998 PolarHBondContact O-OG 3.26Å; A2995-D2999 WeakPolarHBondContact O-CB 3.33Å; A2995-D2999 PolarHBondContact O-N 3.13Å
2996F92.6Very high90.2Very high13.25 Ų13.2541.2 Ų41.26%0.05823%0.225CC..Hα-helixtrans-66.9-39.3177.8179-85.1000113I2931 F2933 D2992 C2993 T3002 I3006 L3102 K3103 L3106I2931-F2996 HydrophobicContact CB-CD2 4.39Å; I2931-F2996 HydrophobicContact CB-CE2 4.47Å; I2931-F2996 HydrophobicContact CG1-CD2 4.45Å; I2931-F2996 HydrophobicContact CG1-CE2 4.36Å; I2931-F2996 HydrophobicContact CG2-CB 4.15Å; I2931-F2996 HydrophobicContact CG2-CD2 3.77Å; I2931-F2996 HydrophobicContact CG2-CE2 4.39Å; I2931-F2996 HydrophobicContact CG2-CG 4.13Å; I2931-F2996 WeakPolarHBondContact O-CD2 3.3Å; F2933-F2996 HydrophobicContact CE1-CE2 4.46Å; F2933-F2996 HydrophobicContact CE2-CD2 4.45Å; F2933-F2996 HydrophobicContact CE2-CE2 4.31Å; F2933-F2996 HydrophobicContact CZ-CD2 4.33Å; F2933-F2996 AromaticContact CZ-CE2 3.75Å; F2933-F2996 HydrophobicContact CZ-CE2 3.75Å; D2992-F2996 WeakPolarHBondContact O-CB 3.42Å; D2992-F2996 PolarHBondContact O-N 3.07Å; C2993-F2996 PolarHBondContact O-N 3.2Å; F2996-T3002 HydrophobicContact CB-CG2 4.47Å; F2996-T3002 HydrophobicContact CD2-CG2 3.56Å; F2996-T3002 HydrophobicContact CE2-CG2 3.95Å; F2996-T3002 HydrophobicContact CG-CG2 3.95Å; F2996-T3002 WeakPolarHBondContact O-CG2 3.35Å; F2996-T3002 PolarHBondContact O-OG1 3.18Å; F2996-I3006 HydrophobicContact CE1-CD1 4.47Å; F2996-I3006 HydrophobicContact CE2-CD1 4.38Å; F2996-I3006 HydrophobicContact CE2-CG1 4.49Å; F2996-I3006 HydrophobicContact CZ-CD1 3.68Å; F2996-I3006 HydrophobicContact CZ-CG1 4.26Å; F2996-L3102 HydrophobicContact CE1-CB 4.47Å; F2996-K3103 HydrophobicContact CD1-CG 4.35Å; F2996-K3103 HydrophobicContact CE1-CG 4.18Å; F2996-K3103 VanDerWaalsContact O-CE 3.26Å; F2996-K3103 WeakPolarHBondContact O-CE 3.31Å; F2996-K3103 PolarHBondContact O-NZ 3.16Å; F2996-L3106 HydrophobicContact CB-CD2 4.42Å; F2996-L3106 HydrophobicContact CD1-CD1 3.48Å; F2996-L3106 VanDerWaalsContact CD1-CD1 3.48Å; F2996-L3106 HydrophobicContact CD1-CD2 3.61Å; F2996-L3106 HydrophobicContact CE1-CD1 3.54Å; F2996-L3106 HydrophobicContact CE1-CD2 4.13Å; F2996-L3106 HydrophobicContact CG-CD1 4.27Å; F2996-L3106 HydrophobicContact CG-CD2 4.26Å; F2996-L3106 HydrophobicContact CZ-CD1 4.34Å
2997I93Very high89.7Confident12.25 Ų12.2543.2 Ų43.26%0.06323%0.234CC..Hα-helixtrans-66-43.8174.5-67.2162000110.2C2993 L2994 K3103 L3106 S3107 V3110 W3374C2993-I2997 WeakPolarHBondContact O-CD1 3.32Å; C2993-I2997 VanDerWaalsContact O-CG1 3.28Å; C2993-I2997 WeakPolarHBondContact O-CG1 3.41Å; C2993-I2997 PolarHBondContact O-N 3.14Å; L2994-I2997 PolarHBondContact O-N 2.95Å; I2997-K3103 PolarHBondContact O-NZ 3.18Å; I2997-L3106 HydrophobicContact CD1-CB 4.25Å; I2997-L3106 HydrophobicContact CD1-CD2 4.46Å; I2997-L3106 HydrophobicContact CD1-CG 4.26Å; I2997-L3106 HydrophobicContact CG1-CB 4.38Å; I2997-L3106 HydrophobicContact CG1-CD2 4.25Å; I2997-L3106 HydrophobicContact CG1-CG 4.48Å; I2997-S3107 WeakPolarHBondContact CD1-OG 3.26Å; I2997-V3110 HydrophobicContact CD1-CB 4.49Å; I2997-V3110 HydrophobicContact CD1-CG2 4.11Å; I2997-W3374 HydrophobicContact CG2-CB 3.41Å; I2997-W3374 VanDerWaalsContact CG2-CB 3.46Å; I2997-W3374 HydrophobicContact CG2-CD2 4.45Å; I2997-W3374 HydrophobicContact CG2-CG 3.76Å
2998S90.8Very high89.4Confident32.5 Ų32.545.6 Ų45.623%0.22725%0.248CC..Hα-helixtrans-72.8-37.9-176.14.70000114.1L2994 A2995 I3000 E3367 R3370 T3371L2994-S2998 VanDerWaalsContact O-CB 3.29Å; L2994-S2998 WeakPolarHBondContact O-CB 3.31Å; L2994-S2998 PolarHBondContact O-N 3.04Å; L2994-S2998 PolarHBondContact O-OG 3.23Å; A2995-S2998 WeakPolarHBondContact CA-OG 3.46Å; A2995-S2998 PolarHBondContact O-N 3.34Å; A2995-S2998 PolarHBondContact O-OG 3.26Å; S2998-I3000 PolarHBondContact O-N 3.01Å; S2998-E3367 WeakPolarHBondContact CB-OE1 3.31Å; S2998-R3370 VanDerWaalsContact O-CZ 3.25Å; S2998-R3370 PolarHBondContact O-NH1 2.97Å; S2998-R3370 PolarHBondContact O-NH2 3.21Å; S2998-T3371 VanDerWaalsContact CB-OG1 3.26Å; S2998-T3371 WeakPolarHBondContact CB-OG1 3.47Å; S2998-T3371 VanDerWaalsContact OG-CG2 3.25Å; S2998-T3371 WeakPolarHBondContact OG-CG2 3.32Å; S2998-T3371 PolarHBondContact OG-OG1 2.83Å
2999D90.4Very high88.9Confident38.25 Ų38.2542.1 Ų42.121%0.20523%0.226CC..  trans-63.2125.3176.6178.116.7000110.9A2995 H3001 T3002 K3005 K3103A2995-D2999 WeakPolarHBondContact O-CB 3.33Å; A2995-D2999 PolarHBondContact O-N 3.13Å; D2999-H3001 VanDerWaalsContact C-N 3.32Å; D2999-H3001 WeakPolarHBondContact OD1-CB 3.45Å; D2999-H3001 IonicContact OD1-CD2 2.99Å; D2999-H3001 PolarHBondContact OD1-CD2 3.01Å; D2999-H3001 IonicContact OD1-CG 3.49Å; D2999-H3001 PolarHBondContact OD1-N 3.23Å; D2999-T3002 HydrophobicContact CB-CG2 4Å; D2999-T3002 PolarHBondContact O-OG1 3.12Å; D2999-K3005 IonicContact OD2-NZ 3.24Å; D2999-K3005 PolarHBondContact OD2-NZ 3.07Å; D2999-K3103 PolarHBondContact O-NZ 3.24Å
3000I88.2Confident88.4Confident83.5 Ų83.541.4 Ų41.443%0.42822%0.222SC..THydrogen-bonded Turntrans-71.3-26.7176.3-166.6168.2000112S2998 T3002 E3698 H3701S2998-I3000 PolarHBondContact O-N 3.01Å; I3000-T3002 PolarHBondContact O-N 3.28Å; I3000-E3698 HydrophobicContact CG1-CB 3.91Å; I3000-E3698 HydrophobicContact CG1-CG 3.99Å; I3000-H3701 HydrophobicContact CD1-CB 3.62Å; I3000-H3701 HydrophobicContact CG1-CB 4.49Å
3001H89.5Confident87.8Confident95.3333 Ų95.333345.5 Ų45.544%0.44124%0.24SC..THydrogen-bonded Turntrans-84.5-7.7-173.9-57.1-67.9000114D2999 V3003 N3004 K3005 S3702 T3705D2999-H3001 VanDerWaalsContact C-N 3.32Å; D2999-H3001 WeakPolarHBondContact OD1-CB 3.45Å; D2999-H3001 IonicContact OD1-CD2 2.99Å; D2999-H3001 PolarHBondContact OD1-CD2 3.01Å; D2999-H3001 IonicContact OD1-CG 3.49Å; D2999-H3001 PolarHBondContact OD1-N 3.23Å; H3001-V3003 VanDerWaalsContact C-N 3.3Å; H3001-V3003 PolarHBondContact O-N 3.07Å; H3001-N3004 PolarHBondContact O-N 3.25Å; H3001-N3004 VanDerWaalsContact O-N 3.17Å; H3001-K3005 HydrophobicContact CB-CD 4.48Å; H3001-K3005 VanDerWaalsContact O-CG 3.32Å; H3001-K3005 WeakPolarHBondContact O-CG 3.3Å; H3001-K3005 PolarHBondContact O-N 3.2Å; H3001-S3702 PolarHBondContact ND1-OG 3.23Å; H3001-T3705 PolarHBondContact CE1-OG1 3.42Å
3002T89.2Confident86.8Confident3.66667 Ų3.6666745 Ų452%0.02224%0.238CC..Hα-helixtrans-59.8-37.5179.838.30000112.8F2933 F2996 D2999 I3000 N3004 K3005 I3006 K3103F2933-T3002 HydrophobicContact CE2-CG2 4.12Å; F2933-T3002 HydrophobicContact CZ-CG2 4.12Å; F2996-T3002 HydrophobicContact CB-CG2 4.47Å; F2996-T3002 HydrophobicContact CD2-CG2 3.56Å; F2996-T3002 HydrophobicContact CE2-CG2 3.95Å; F2996-T3002 HydrophobicContact CG-CG2 3.95Å; F2996-T3002 WeakPolarHBondContact O-CG2 3.35Å; F2996-T3002 PolarHBondContact O-OG1 3.18Å; D2999-T3002 HydrophobicContact CB-CG2 4Å; D2999-T3002 PolarHBondContact O-OG1 3.12Å; I3000-T3002 PolarHBondContact O-N 3.28Å; T3002-N3004 VanDerWaalsContact C-N 3.34Å; T3002-N3004 PolarHBondContact O-N 3.2Å; T3002-K3005 PolarHBondContact O-N 3.12Å; T3002-K3005 VanDerWaalsContact O-N 3.15Å; T3002-I3006 WeakPolarHBondContact O-CD1 3.43Å; T3002-I3006 VanDerWaalsContact O-CG1 3.23Å; T3002-I3006 WeakPolarHBondContact O-CG1 3.34Å; T3002-I3006 PolarHBondContact O-N 3.25Å; T3002-K3103 WeakPolarHBondContact OG1-CE 3.36Å; T3002-K3103 PolarHBondContact OG1-NZ 3.06Å; T3002-K3103 VanDerWaalsContact OG1-NZ 3.1Å
3003V85.4Confident85.5Confident26.3333 Ų26.333343 Ų4316%0.1623%0.229CC..Hα-helixtrans-57.8-47.1175.4-177.40000111.3H3001 K3005 I3006 K3007 E3698 D3699H3001-V3003 VanDerWaalsContact C-N 3.3Å; H3001-V3003 PolarHBondContact O-N 3.07Å; V3003-K3005 PolarHBondContact O-N 3.12Å; V3003-I3006 PolarHBondContact O-N 2.77Å; V3003-K3007 PolarHBondContact O-N 3.02Å; V3003-K3007 VanDerWaalsContact O-N 3.11Å; V3003-E3698 HydrophobicContact CG2-CB 4.44Å; V3003-D3699 HydrophobicContact CG1-CB 3.84Å
3004N84.8Confident84Confident73.6667 Ų73.666746.9 Ų46.939%0.39425%0.252SS..Hα-helixtrans-67.8-36.3177.5-66.218.3000112.3H3001 T3002 I3006 K3007 Q3008 S3702 T3703H3001-N3004 PolarHBondContact O-N 3.25Å; H3001-N3004 VanDerWaalsContact O-N 3.17Å; T3002-N3004 VanDerWaalsContact C-N 3.34Å; T3002-N3004 PolarHBondContact O-N 3.2Å; N3004-I3006 VanDerWaalsContact C-N 3.33Å; N3004-I3006 PolarHBondContact O-N 3.19Å; N3004-K3007 PolarHBondContact O-N 3.44Å; N3004-Q3008 WeakPolarHBondContact O-CG 3.44Å; N3004-Q3008 PolarHBondContact O-N 3.09Å; N3004-S3702 PolarHBondContact ND2-OG 3.42Å; N3004-S3702 WeakPolarHBondContact OD1-CB 3.29Å; N3004-S3702 PolarHBondContact OD1-OG 2.8Å; N3004-T3703 PolarHBondContact ND2-OG1 2.94Å
3005K87.8Confident82Confident78 Ų7852.3 Ų52.334%0.33928%0.277SS..Hα-helixtrans-65.8-38.4176-67.7166.1-174169.80111.7F2933 D2999 H3001 T3002 V3003 Q3008 S3009F2933-K3005 HydrophobicContact CD1-CB 4.01Å; F2933-K3005 HydrophobicContact CD2-CB 4.18Å; F2933-K3005 HydrophobicContact CD2-CD 4.15Å; F2933-K3005 HydrophobicContact CE1-CB 3.56Å; F2933-K3005 HydrophobicContact CE2-CB 3.75Å; F2933-K3005 HydrophobicContact CE2-CD 3.7Å; F2933-K3005 HydrophobicContact CE2-CG 4.35Å; F2933-K3005 HydrophobicContact CG-CB 4.3Å; F2933-K3005 HydrophobicContact CZ-CB 3.42Å; F2933-K3005 VanDerWaalsContact CZ-CB 3.42Å; F2933-K3005 HydrophobicContact CZ-CD 4.18Å; F2933-K3005 HydrophobicContact CZ-CG 4.44Å; D2999-K3005 IonicContact OD2-NZ 3.24Å; D2999-K3005 PolarHBondContact OD2-NZ 3.07Å; H3001-K3005 HydrophobicContact CB-CD 4.48Å; H3001-K3005 VanDerWaalsContact O-CG 3.32Å; H3001-K3005 WeakPolarHBondContact O-CG 3.3Å; H3001-K3005 PolarHBondContact O-N 3.2Å; T3002-K3005 PolarHBondContact O-N 3.12Å; T3002-K3005 VanDerWaalsContact O-N 3.15Å; V3003-K3005 PolarHBondContact O-N 3.12Å; K3005-Q3008 PolarHBondContact O-N 3.22Å; K3005-S3009 WeakPolarHBondContact O-CB 3.39Å; K3005-S3009 PolarHBondContact O-N 3.13Å
3006I86.5Confident80Confident7.66667 Ų7.6666755.7 Ų55.74%0.03929%0.286CS..Hα-helixtrans-60.9-50.3172.8-64.9158.4000109.7F2933 F2996 T3002 V3003 N3004 Q3008 S3009 Q3010 L3098 L3102F2933-I3006 HydrophobicContact CE1-CB 4.47Å; F2933-I3006 HydrophobicContact CE1-CG1 3.78Å; F2933-I3006 HydrophobicContact CZ-CG1 4.12Å; F2996-I3006 HydrophobicContact CE1-CD1 4.47Å; F2996-I3006 HydrophobicContact CE2-CD1 4.38Å; F2996-I3006 HydrophobicContact CE2-CG1 4.49Å; F2996-I3006 HydrophobicContact CZ-CD1 3.68Å; F2996-I3006 HydrophobicContact CZ-CG1 4.26Å; T3002-I3006 WeakPolarHBondContact O-CD1 3.43Å; T3002-I3006 VanDerWaalsContact O-CG1 3.23Å; T3002-I3006 WeakPolarHBondContact O-CG1 3.34Å; T3002-I3006 PolarHBondContact O-N 3.25Å; V3003-I3006 PolarHBondContact O-N 2.77Å; N3004-I3006 VanDerWaalsContact C-N 3.33Å; N3004-I3006 PolarHBondContact O-N 3.19Å; I3006-Q3008 VanDerWaalsContact C-N 3.25Å; I3006-Q3008 PolarHBondContact O-N 3.31Å; I3006-S3009 WeakPolarHBondContact O-CB 3.46Å; I3006-S3009 PolarHBondContact O-N 3.26Å; I3006-S3009 VanDerWaalsContact O-N 3.16Å; I3006-Q3010 HydrophobicContact CG2-CG 4.47Å; I3006-Q3010 PolarHBondContact O-N 3.15Å; I3006-L3098 HydrophobicContact CG2-CB 4.39Å; I3006-L3098 HydrophobicContact CG2-CD2 3.84Å; I3006-L3098 HydrophobicContact CG2-CG 4.16Å; I3006-L3102 HydrophobicContact CD1-CD1 4.1Å; I3006-L3102 HydrophobicContact CG1-CD1 4.48Å; I3006-L3102 HydrophobicContact CG2-CD1 4.17Å
3007K83.4Confident78Confident43 Ų4358.7 Ų58.719%0.18730%0.303CS..Hα-helixtrans-61.2-30.6178.3-131.1175.2-169.6-175.20113.3V3003 N3004 K3011 E3095 D3096 D3699V3003-K3007 PolarHBondContact O-N 3.02Å; V3003-K3007 VanDerWaalsContact O-N 3.11Å; N3004-K3007 PolarHBondContact O-N 3.44Å; K3007-K3011 WeakPolarHBondContact O-CD 3.22Å; K3007-K3011 WeakPolarHBondContact O-CE 3.29Å; K3007-K3011 WeakPolarHBondContact O-CG 3.25Å; K3007-K3011 PolarHBondContact O-N 2.96Å; K3007-E3095 HydrophobicContact CD-CB 4.29Å; K3007-E3095 VanDerWaalsContact CE-O 3.24Å; K3007-E3095 WeakPolarHBondContact CE-O 3.33Å; K3007-E3095 WeakPolarHBondContact CE-OE2 3.4Å; K3007-E3095 HydrophobicContact CG-CB 4.33Å; K3007-E3095 HydrophobicContact CG-CG 4.28Å; K3007-E3095 IonicContact NZ-OE2 2.68Å; K3007-D3096 IonicContact NZ-OD1 3.02Å; K3007-D3096 PolarHBondContact NZ-OD1 3.3Å; K3007-D3096 IonicContact NZ-OD2 2.77Å; K3007-D3096 PolarHBondContact NZ-OD2 3.03Å; K3007-D3699 WeakPolarHBondContact CE-OD1 3.35Å; K3007-D3699 IonicContact NZ-OD1 2.68Å; K3007-D3699 PolarHBondContact NZ-OD1 3.15Å; K3007-D3699 IonicContact NZ-OD2 3.56Å; K3007-D3699 PolarHBondContact NZ-OD2 3.02Å
3008Q83.3Confident75.4Confident126 Ų12661.3 Ų61.359%0.58932%0.322SS*.Hα-helixtrans-74.1-42.7171.7-72.6171.7-3.200112.3N3004 K3005 I3006 Q3010 K3011 S3012N3004-Q3008 WeakPolarHBondContact O-CG 3.44Å; N3004-Q3008 PolarHBondContact O-N 3.09Å; K3005-Q3008 PolarHBondContact O-N 3.22Å; I3006-Q3008 VanDerWaalsContact C-N 3.25Å; I3006-Q3008 PolarHBondContact O-N 3.31Å; Q3008-Q3010 PolarHBondContact O-N 2.95Å; Q3008-K3011 PolarHBondContact O-N 3.25Å; Q3008-S3012 PolarHBondContact O-N 3.09Å; Q3008-S3012 PolarHBondContact O-OG 3.17Å; Q3008-S3012 VanDerWaalsContact O-OG 3.09Å
3009S81.1Confident72.9Confident18.6667 Ų18.666764.8 Ų64.813%0.13134%0.342CS..Hα-helixtrans-66-39.6-179.7-167.30000112.6C2936 K3005 I3006 K3011 S3012 A3013C2936-S3009 PolarHBondContact SG-OG 3.32Å; C2936-S3009 VanDerWaalsContact SG-OG 3.41Å; K3005-S3009 WeakPolarHBondContact O-CB 3.39Å; K3005-S3009 PolarHBondContact O-N 3.13Å; I3006-S3009 WeakPolarHBondContact O-CB 3.46Å; I3006-S3009 PolarHBondContact O-N 3.26Å; I3006-S3009 VanDerWaalsContact O-N 3.16Å; S3009-K3011 VanDerWaalsContact C-N 3.32Å; S3009-K3011 PolarHBondContact O-N 3.21Å; S3009-S3012 WeakPolarHBondContact O-CB 3.42Å; S3009-S3012 PolarHBondContact O-N 3Å; S3009-S3012 VanDerWaalsContact O-N 3.14Å; S3009-A3013 PolarHBondContact O-N 3.27Å; S3009-A3013 VanDerWaalsContact O-N 3.15Å
3010Q80.9Confident70.4Confident13.3333 Ų13.333365.9 Ų65.96%0.06236%0.363CS..Hα-helixtrans-66.8-35.8177.7-70.9-58.7-18.700112.5I2937 I3006 Q3008 S3012 A3013 V3014 L3098I2937-Q3010 PolarHBondContact O-NE2 3.11Å; I2937-Q3010 PolarHBondContact O-OE1 3.41Å; I3006-Q3010 HydrophobicContact CG2-CG 4.47Å; I3006-Q3010 PolarHBondContact O-N 3.15Å; Q3008-Q3010 PolarHBondContact O-N 2.95Å; Q3010-S3012 VanDerWaalsContact C-N 3.28Å; Q3010-S3012 PolarHBondContact O-N 3.28Å; Q3010-A3013 WeakPolarHBondContact O-CB 3.36Å; Q3010-A3013 PolarHBondContact O-N 2.85Å; Q3010-A3013 VanDerWaalsContact O-N 3.1Å; Q3010-V3014 WeakPolarHBondContact O-CG2 3.42Å; Q3010-V3014 PolarHBondContact O-N 3.12Å; Q3010-L3098 HydrophobicContact CG-CD2 3.71Å
3011K77.2Confident67.8Low92.6667 Ų92.666770.3 Ų70.340%0.40338%0.375SS..Hα-helixtrans-62.1-31.6172.6-72.8172.1-173.6-160.30112.8K3007 Q3008 S3009 Q3015 E3095K3007-K3011 WeakPolarHBondContact O-CD 3.22Å; K3007-K3011 WeakPolarHBondContact O-CE 3.29Å; K3007-K3011 WeakPolarHBondContact O-CG 3.25Å; K3007-K3011 PolarHBondContact O-N 2.96Å; Q3008-K3011 PolarHBondContact O-N 3.25Å; S3009-K3011 VanDerWaalsContact C-N 3.32Å; S3009-K3011 PolarHBondContact O-N 3.21Å; K3011-Q3015 VanDerWaalsContact O-CG 3.3Å; K3011-Q3015 WeakPolarHBondContact O-CG 3.46Å; K3011-Q3015 PolarHBondContact O-N 2.83Å; K3011-E3095 WeakPolarHBondContact CE-OE1 3.43Å; K3011-E3095 VanDerWaalsContact CE-OE2 3.29Å; K3011-E3095 WeakPolarHBondContact CE-OE2 3.38Å; K3011-E3095 WeakPolarHBondContact CG-OE1 3.45Å; K3011-E3095 IonicContact NZ-OE1 3.18Å; K3011-E3095 PolarHBondContact NZ-OE1 2.94Å; K3011-E3095 IonicContact NZ-OE2 3.06Å; K3011-E3095 PolarHBondContact NZ-OE2 3.05Å
3012S69.5Low65Low58.6667 Ų58.666768.9 Ų68.941%0.4139%0.387SS..Hα-helixtrans-71.9-37.6171.7-55.20000112.4Q3008 S3009 Q3010 Q3015 L3016Q3008-S3012 PolarHBondContact O-N 3.09Å; Q3008-S3012 PolarHBondContact O-OG 3.17Å; Q3008-S3012 VanDerWaalsContact O-OG 3.09Å; S3009-S3012 WeakPolarHBondContact O-CB 3.42Å; S3009-S3012 PolarHBondContact O-N 3Å; S3009-S3012 VanDerWaalsContact O-N 3.14Å; Q3010-S3012 VanDerWaalsContact C-N 3.28Å; Q3010-S3012 PolarHBondContact O-N 3.28Å; S3012-Q3015 PolarHBondContact O-N 3.01Å; S3012-L3016 WeakPolarHBondContact O-CG 3.42Å; S3012-L3016 PolarHBondContact O-N 3.2Å; S3012-L3016 VanDerWaalsContact O-N 3.14Å
3013A65.9Low62.2Low7.66667 Ų7.6666776.8 Ų76.86%0.06343%0.428CS..Hα-helixtrans-62.4-49.5176.200000112C2936 S3009 Q3010 Q3015 L3016 N3017C2936-A3013 HydrophobicContact CB-CB 4.02Å; S3009-A3013 PolarHBondContact O-N 3.27Å; S3009-A3013 VanDerWaalsContact O-N 3.15Å; Q3010-A3013 WeakPolarHBondContact O-CB 3.36Å; Q3010-A3013 PolarHBondContact O-N 2.85Å; Q3010-A3013 VanDerWaalsContact O-N 3.1Å; A3013-Q3015 VanDerWaalsContact C-N 3.31Å; A3013-Q3015 PolarHBondContact O-N 3.11Å; A3013-L3016 PolarHBondContact O-N 3.24Å; A3013-N3017 PolarHBondContact O-N 3.2Å
3014V61Low59.4Low81.6667 Ų81.666779.1 Ų79.150%0.49546%0.457SS..Hα-helixtrans-61.2-38.9179.7176.30000111.7Q3010 L3016 N3017 S3018Q3010-V3014 WeakPolarHBondContact O-CG2 3.42Å; Q3010-V3014 PolarHBondContact O-N 3.12Å; V3014-L3016 PolarHBondContact O-N 3.19Å; V3014-N3017 PolarHBondContact O-N 3.13Å; V3014-S3018 WeakPolarHBondContact O-CB 3.45Å; V3014-S3018 PolarHBondContact O-N 3.05Å
3015Q50.1Low56.9Low138.333 Ų138.33381.1 Ų81.165%0.64648%0.477SS*.Hα-helixtrans-66.1-37177.5-75.7-17710.400113.2K3011 S3012 A3013 S3018 V3019K3011-Q3015 VanDerWaalsContact O-CG 3.3Å; K3011-Q3015 WeakPolarHBondContact O-CG 3.46Å; K3011-Q3015 PolarHBondContact O-N 2.83Å; S3012-Q3015 PolarHBondContact O-N 3.01Å; A3013-Q3015 VanDerWaalsContact C-N 3.31Å; A3013-Q3015 PolarHBondContact O-N 3.11Å; Q3015-S3018 PolarHBondContact O-N 3.21Å; Q3015-V3019 VanDerWaalsContact O-CG2 3.26Å; Q3015-V3019 WeakPolarHBondContact O-CG2 3.38Å; Q3015-V3019 PolarHBondContact O-N 3.04Å
3016L50.7Low54.1Low124.667 Ų124.66783.2 Ų83.265%0.65350%0.501SS*.Hα-helixtrans-64.2-44.2175.8-72.4168.3000111.4S3012 A3013 V3014 S3018 V3019S3012-L3016 WeakPolarHBondContact O-CG 3.42Å; S3012-L3016 PolarHBondContact O-N 3.2Å; S3012-L3016 VanDerWaalsContact O-N 3.14Å; A3013-L3016 PolarHBondContact O-N 3.24Å; V3014-L3016 PolarHBondContact O-N 3.19Å; L3016-S3018 VanDerWaalsContact C-N 3.33Å; L3016-S3018 PolarHBondContact O-N 3.11Å; L3016-V3019 PolarHBondContact O-N 3.14Å
3017N49Very low51.4Low77.6667 Ų77.666788.1 Ų88.142%0.41554%0.536SS..Hα-helixtrans-67.4-32.7178.4-70.1-7.3000112.6A3013 V3014 V3019 Y3021A3013-N3017 PolarHBondContact O-N 3.2Å; V3014-N3017 PolarHBondContact O-N 3.13Å; N3017-V3019 PolarHBondContact O-N 3.34Å; N3017-Y3021 WeakPolarHBondContact O-CD2 3.4Å
3018S38.6Very low49Very low65 Ų6594.3 Ų94.346%0.45557%0.568SS.*Hα-helixtrans-70.5-28.3177.4-176.40000114V3014 Q3015 L3016 G3020 Y3021V3014-S3018 WeakPolarHBondContact O-CB 3.45Å; V3014-S3018 PolarHBondContact O-N 3.05Å; Q3015-S3018 PolarHBondContact O-N 3.21Å; L3016-S3018 VanDerWaalsContact C-N 3.33Å; L3016-S3018 PolarHBondContact O-N 3.11Å; S3018-G3020 VanDerWaalsContact C-N 3.3Å; S3018-G3020 PolarHBondContact O-N 3.34Å; S3018-Y3021 PolarHBondContact O-N 3.3Å; S3018-Y3021 VanDerWaalsContact O-N 3.14Å
3019V39.4Very low46.5Very low107 Ų10797.1 Ų97.165%0.64858%0.583SS**Hα-helixtrans-74.5-16.5-175.8169.60000112.8Q3015 L3016 N3017 Y3021Q3015-V3019 VanDerWaalsContact O-CG2 3.26Å; Q3015-V3019 WeakPolarHBondContact O-CG2 3.38Å; Q3015-V3019 PolarHBondContact O-N 3.04Å; L3016-V3019 PolarHBondContact O-N 3.14Å; N3017-V3019 PolarHBondContact O-N 3.34Å; V3019-Y3021 VanDerWaalsContact C-N 3.3Å; V3019-Y3021 PolarHBondContact O-N 3.18Å
3020G37.6Very low44.2Very low61.6667 Ų61.6667102.3 Ų102.364%0.63662%0.619SS**THydrogen-bonded Turntrans-70.4-19.4173.700000115.1S3018S3018-G3020 VanDerWaalsContact C-N 3.3Å; S3018-G3020 PolarHBondContact O-N 3.34Å
3021Y33.3Very low41.8Very low175.333 Ų175.333105.1 Ų105.169%0.68865%0.653SS**SBendtrans-127.867.3-167.9-61.4-80.9000112.5N3017 S3018 V3019N3017-Y3021 WeakPolarHBondContact O-CD2 3.4Å; S3018-Y3021 PolarHBondContact O-N 3.3Å; S3018-Y3021 VanDerWaalsContact O-N 3.14Å; V3019-Y3021 VanDerWaalsContact C-N 3.3Å; V3019-Y3021 PolarHBondContact O-N 3.18Å
3022G29.8Very low39.8Very low66.6667 Ų66.6667106.2 Ų106.269%0.68767%0.672SS**SBendtrans176.99.4174.100000117.5
3023L30.9Very low38.1Very low168.333 Ų168.333110.9 Ų110.988%0.88169%0.692SS**  trans-133.153.3-177.3-71.7159.7000114S3025L3023-S3025 VanDerWaalsContact C-N 3.34Å; L3023-S3025 PolarHBondContact O-N 2.93Å
3024G27.5Very low36.8Very low74.6667 Ų74.6667116.3 Ų116.377%0.7773%0.726SS**  trans-121.443.4177.600000114.6
3025S31.2Very low35.2Very low116.333 Ų116.333118.7 Ų118.781%0.81475%0.745SS**  trans-150.6116.2177.9-77.90000113.9L3023L3023-S3025 VanDerWaalsContact C-N 3.34Å; L3023-S3025 PolarHBondContact O-N 2.93Å
3026S30.3Very low34.3Very low122 Ų122115.6 Ų115.685%0.85375%0.75SS**  trans65.298156.7-24.40000116.6
3027S28.3Very low33.3Very low110 Ų110116.8 Ų116.877%0.76976%0.763SS**  trans-15090.9159.795.90000114.7
3028M33.5Very low32.4Very low173.667 Ų173.667116.8 Ų116.886%0.85678%0.782SS**  trans-154.3124.5133.8-44.3-156.9147.200112.9
3029M31.3Very low32Very low185.667 Ų185.667120.6 Ų120.692%0.91580%0.797SS**  trans39.2124156.9-59.3-173176.400119.3
3030S33.3Very low31.7Very low126.333 Ų126.333121.7 Ų121.788%0.88380%0.799SS**  -147.5136.5111-88.20000109.9
3031G29.2Very low31.3Very low74 Ų74125.1 Ų125.176%0.76380%0.802SS**  trans-129.5101.4-168.500000115.7
3032S35.8Very low31.5Very low114.667 Ų114.667121.7 Ų121.780%0.80280%0.804SS**  trans174.1126.2164.156.10000116.2
3033N32.9Very low31.6Very low158.333 Ų158.333125.2 Ų125.285%0.84781%0.807SS**  trans-77.1151.2158.2-86.4-12.7000114.1
3034P38.6Very low31.8Very low120.333 Ų120.333122.9 Ų122.978%0.78180%0.8SS**  trans-121151.615140.4-29000116.3
3035C28.8Very low32Very low131 Ų131126.1 Ų126.189%0.88580%0.799SS**  trans-144.4157.3157.759.30000114.7
3036G30.3Very low32.2Very low73.6667 Ų73.6667127 Ų12776%0.75980%0.8SS**  trans137.783.9165.500000116.8
3037T30Very low32.3Very low149.667 Ų149.667124.9 Ų124.992%0.91880%0.798SS**  trans-25.1138.6157.349.50000118.3
3038G30.1Very low32.5Very low78.3333 Ų78.3333123.7 Ų123.781%0.80880%0.802SS**  trans133.3124.316000000114.4
3039N30.5Very low32.4Very low145.333 Ų145.333119.4 Ų119.478%0.77780%0.803SS**  -166.7160.352.8-165.726.3000111.5
3040L32.4Very low32.4Very low129.333 Ų129.333114.3 Ų114.368%0.67780%0.797SS**  trans71.2123.9174.3-68.697000118.3
3041D29.5Very low32.3Very low133 Ų133112.4 Ų112.471%0.71179%0.79SS**  76.1134.394.1-70.2-15.4000117.9
3042S37.2Very low32.5Very low105.333 Ų105.333115.1 Ų115.174%0.73779%0.792SS**  151.6143.4118.7-77.50000116.1
3043N32.5Very low32.3Very low139.667 Ų139.667115.3 Ų115.375%0.74779%0.793SS**  trans-71.2157.9142.4-73.7-47.2000115.3
3044T35.3Very low32.2Very low119 Ų119111.2 Ų111.273%0.7379%0.788SS**  15513195.6-53.70000113.7
3045L31.9Very low31.8Very low142.667 Ų142.667112.8 Ų112.875%0.74779%0.79SS**  47.315076.5-92.2129.9000114
3046T34.6Very low31.8Very low134.667 Ų134.667113.9 Ų113.983%0.82679%0.785SS**  161.2155.466.440.20000112.9
3047G33.2Very low31.7Very low78.6667 Ų78.6667113.5 Ų113.581%0.81178%0.781SS**  cis131.3145.314.300000114.9
3048G32.1Very low31.8Very low83.6667 Ų83.6667111.7 Ų111.786%0.86378%0.775SS**  cis142.4149.6-12.600000114.7
3049G31.3Very low31.8Very low84.3333 Ų84.3333112.5 Ų112.587%0.86977%0.768SS**  trans115127.7158.900000117.2
3050G30.8Very low31.8Very low78 Ų78112.2 Ų112.280%0.80477%0.765SS**  trans101.7154.5144.600000114.7
3051A31.5Very low31.5Very low87.6667 Ų87.6667115.4 Ų115.473%0.72577%0.774SS**  cis163.7152.55.700000111.5
3052T32.4Very low31.5Very low130.333 Ų130.333112.8 Ų112.880%0.878%0.778SS**  trans58.6127.5162.958.30000119.4
3053S32.7Very low31.1Very low119 Ų119111.2 Ų111.283%0.83278%0.778SS**  105.7149.576.169.30000115.5
3054G30.5Very low30.9Very low71 Ų71107.6 Ų107.673%0.73278%0.775SS**  trans120.866.314700000121.2
3055N29.4Very low30.7Very low154.333 Ų154.333111.2 Ų111.283%0.82578%0.781SS**  56151.2126.5-133.513.4000122.5
3056I30.3Very low30.5Very low154.333 Ų154.333112.1 Ų112.179%0.79179%0.786SS**  trans80.3114.5159.6-52.6155.4000118.6
3057G27.2Very low30.4Very low64.3333 Ų64.3333110.7 Ų110.766%0.66378%0.782SS**  107.6117.511800000121.5
3058S32.7Very low30.4Very low113.667 Ų113.667112.1 Ų112.180%0.79578%0.779SS**  trans58.1108.1144.1-52.30000120.5
3059S29.8Very low30.2Very low94.3333 Ų94.3333110.7 Ų110.766%0.6676%0.764SS**  71.1148.996.271.70000119.8
3060L29.4Very low30.2Very low138.333 Ų138.333113 Ų11372%0.72476%0.761SS**  trans110.3123.7150.8-112.566.5000118.4
3061F27.3Very low30.1Very low198 Ų198113.7 Ų113.787%0.86875%0.754SS**  trans38.7148.4146.3-58.6-65.5000122.7
3062G28.4Very low30Very low76.6667 Ų76.6667116.9 Ų116.979%0.7976%0.759SS**  cis137.7154.514.900000113.6
3063G30.2Very low30Very low71.6667 Ų71.6667115.8 Ų115.874%0.73976%0.757SS**  trans109.6138.8-166.800000113F3065G3063-F3065 VanDerWaalsContact O-CZ 3.27Å; G3063-F3065 WeakPolarHBondContact O-CZ 3.4Å
3064G27.6Very low29.9Very low65.3333 Ų65.3333114.6 Ų114.667%0.67475%0.754SS**  cis106.7136-4.800000112.5
3065F30.2Very low29.8Very low195 Ų195117.5 Ų117.586%0.85576%0.758SS**  cis-148.6158.622.9-57.2-81.6000111.5G3063G3063-F3065 VanDerWaalsContact O-CZ 3.27Å; G3063-F3065 WeakPolarHBondContact O-CZ 3.4Å
3066N28.6Very low29.8Very low161.333 Ų161.333113.5 Ų113.586%0.86375%0.753SS**  trans-59.6159.9165.6-52.2-18.7000113.8
3067S32.3Very low29.8Very low104.333 Ų104.333110.2 Ų110.273%0.7375%0.748SS**  -167.3153.858-164.80000113.3
3068S32.4Very low29.9Very low109 Ų109113.3 Ų113.376%0.76276%0.755SS**  trans45.3138.2146.564.20000121.9
3069G28.9Very low29.7Very low53.3333 Ų53.3333111.3 Ų111.355%0.5575%0.752SS.*  cis122.4165.91300000114.7K2601K2601-G3069 VanDerWaalsContact CG-C 3.49Å; K2601-G3069 VanDerWaalsContact CG-O 3.29Å; K2601-G3069 WeakPolarHBondContact CG-O 3.46Å
3070V30.9Very low29.6Very low132.333 Ų132.333112.7 Ų112.780%0.80276%0.756SS**  trans63.7169.2173.2-92.20000116.2K2601K2601-V3070 WeakPolarHBondContact CE-O 3.29Å; K2601-V3070 WeakPolarHBondContact CG-O 3.41Å
3071S30.1Very low29.5Very low93 Ų93113.4 Ų113.465%0.6576%0.761SS**  cis-170.2158.7-34.828.30000112.6
3072N29.5Very low29.6Very low155.333 Ų155.333109 Ų10983%0.83175%0.754SS**  trans53.8147.3161.2-63.1-8.8000117.6
3073S31.4Very low29.6Very low107.333 Ų107.333113.3 Ų113.375%0.75176%0.759SS**  cis-177145.811.6490000111.7
3074A29.6Very low29.5Very low93 Ų93115.1 Ų115.177%0.76976%0.755SS**  79127.9125.400000117.2
3075T30.1Very low29.5Very low133 Ų133115 Ų11582%0.81676%0.755SS**  cis-157.8147.829.537.70000109.8
3076G28.8Very low29.4Very low70 Ų70113 Ų11372%0.72275%0.752SS**  105.1111.7103.700000117.6
3077A30.3Very low29.4Very low84 Ų84108.9 Ų108.969%0.69475%0.748SS**  107.3141.5104.300000118.7
3078T28.3Very low29.3Very low130.667 Ų130.667109 Ų10980%0.80274%0.744SS**  trans63.1131.915468.90000118.8
3079G28.4Very low29.2Very low71.6667 Ų71.6667110.4 Ų110.474%0.73974%0.743SS**  trans147.9118-179.800000114.1
3080V28.9Very low29.4Very low123.333 Ų123.333114.5 Ų114.575%0.74775%0.751SS**  trans-72.8156.4151.4-101.60000114.5
3081N26.8Very low29.9Very low153.667 Ų153.667112.2 Ų112.282%0.82274%0.739SS**  trans37.2132158.2-61.4-22.8000118
3082S29.7Very low30.8Very low104.333 Ų104.333109.8 Ų109.873%0.7372%0.722SS**  trans173.5106.2155.153.20000115.5V3084S3082-V3084 PolarHBondContact O-N 3.32Å; S3082-V3084 WeakPolarHBondContact OG-CG2 3.41Å
3083N28Very low31.7Very low167.333 Ų167.333109.4 Ų109.490%0.89572%0.719SS**  trans-101.771.4154.5-111.31.8000109.4G3085N3083-G3085 VanDerWaalsContact C-N 3.35Å; N3083-G3085 PolarHBondContact O-N 3.3Å
3084V28.5Very low33.4Very low109 Ų109106 Ų10666%0.66169%0.691SS**  trans-79.195.9141.6-178.70000109.6S3082 L3086S3082-V3084 PolarHBondContact O-N 3.32Å; S3082-V3084 WeakPolarHBondContact OG-CG2 3.41Å; V3084-L3086 VanDerWaalsContact C-N 3.31Å; V3084-L3086 HydrophobicContact CG1-CD1 3.81Å; V3084-L3086 PolarHBondContact O-N 3.42Å
3085G27.9Very low35.2Very low63.6667 Ų63.6667102.8 Ų102.866%0.65666%0.661SS**  trans-88.5120176.800000111.3N3083 G3087N3083-G3085 VanDerWaalsContact C-N 3.35Å; N3083-G3085 PolarHBondContact O-N 3.3Å; G3085-G3087 PolarHBondContact O-N 3.27Å
3086L27.2Very low37.1Very low153.333 Ų153.333101.1 Ų101.180%0.80365%0.646SS**  trans-99.563167.8-12771.2000110.9V3084 T3088V3084-L3086 VanDerWaalsContact C-N 3.31Å; V3084-L3086 HydrophobicContact CG1-CD1 3.81Å; V3084-L3086 PolarHBondContact O-N 3.42Å; L3086-T3088 VanDerWaalsContact C-N 3.34Å; L3086-T3088 HydrophobicContact CB-CG2 4.48Å; L3086-T3088 PolarHBondContact O-N 3.12Å
3087G30.1Very low39.7Very low75.3333 Ų75.333399.4 Ų99.478%0.77762%0.622SS**  trans-82.370.4-17800000113.3G3085 N3089G3085-G3087 PolarHBondContact O-N 3.27Å; G3087-N3089 PolarHBondContact O-N 3.3Å; G3087-N3089 VanDerWaalsContact O-N 3.08Å
3088T29Very low42.4Very low106.667 Ų106.66795.5 Ų95.565%0.65459%0.59SS**  trans-71.7108.2-176.252.80000113.2L3086 I3090L3086-T3088 VanDerWaalsContact C-N 3.34Å; L3086-T3088 HydrophobicContact CB-CG2 4.48Å; L3086-T3088 PolarHBondContact O-N 3.12Å; T3088-I3090 VanDerWaalsContact C-N 3.31Å; T3088-I3090 PolarHBondContact O-N 3.12Å
3089N30.6Very low45.2Very low138.667 Ų138.66789.4 Ų89.474%0.74255%0.552SS**  trans4442.8156.2-67.5-59.3000116.6G3087 P3091G3087-N3089 PolarHBondContact O-N 3.3Å; G3087-N3089 VanDerWaalsContact O-N 3.08Å; N3089-P3091 WeakPolarHBondContact O-CD 3.32Å
3090I33.7Very low48.1Very low139 Ų13987.3 Ų87.371%0.71353%0.528SS*.PPolyproline II helixtrans-80.3118.7167.8-51.2-179.1000106.9T3088 S3092T3088-I3090 VanDerWaalsContact C-N 3.31Å; T3088-I3090 PolarHBondContact O-N 3.12Å; I3090-S3092 PolarHBondContact O-N 3.33Å; I3090-S3092 VanDerWaalsContact O-N 3.13Å
3091P39.9Very low51Low83 Ų8382.4 Ų82.454%0.53950%0.497SS..PPolyproline II helixtrans-60.7129.1168.812.7-12.6000108N3089 L3093 E3095N3089-P3091 WeakPolarHBondContact O-CD 3.32Å; P3091-L3093 PolarHBondContact O-N 2.99Å; P3091-L3093 VanDerWaalsContact O-N 3.15Å; P3091-E3095 WeakPolarHBondContact CB-OE1 3.37Å
3092S49.6Very low54.1Low43.6667 Ų43.666775.4 Ų75.431%0.30546%0.46SS..PPolyproline II helixtrans-59.1133.6-176.664.30000109.3D2939 I3090 H3094 E3095D2939-S3092 VanDerWaalsContact OD2-CB 3.26Å; D2939-S3092 WeakPolarHBondContact OD2-CB 3.43Å; D2939-S3092 PolarHBondContact OD2-OG 3.02Å; I3090-S3092 PolarHBondContact O-N 3.33Å; I3090-S3092 VanDerWaalsContact O-N 3.13Å; S3092-H3094 PolarHBondContact O-N 3.02Å; S3092-E3095 VanDerWaalsContact O-CB 3.32Å; S3092-E3095 WeakPolarHBondContact O-CB 3.33Å; S3092-E3095 PolarHBondContact O-N 3.21Å
3093L49.5Very low57.1Low147 Ų14770.6 Ų70.677%0.7743%0.425SS*.THydrogen-bonded Turntrans-56.8-20.1-179.2-74164.2000111.9P3091 E3095 D3096P3091-L3093 PolarHBondContact O-N 2.99Å; P3091-L3093 VanDerWaalsContact O-N 3.15Å; L3093-E3095 VanDerWaalsContact C-N 3.28Å; L3093-E3095 PolarHBondContact O-N 2.87Å; L3093-D3096 PolarHBondContact O-N 3.17Å
3094H67.1Low60.1Low36 Ų3662.8 Ų62.817%0.16738%0.384CS..THydrogen-bonded Turntrans-76.8-14.2177.4-67-83.8000114.2D2939 Q2961 V2962 S3092 D3096 V3097 L3098D2939-H3094 IonicContact OD2-CE1 2.61Å; D2939-H3094 PolarHBondContact OD2-CE1 3.02Å; D2939-H3094 IonicContact OD2-CG 2.65Å; D2939-H3094 IonicContact OD2-ND1 2.69Å; D2939-H3094 PolarHBondContact OD2-ND1 3.4Å; Q2961-H3094 WeakPolarHBondContact CB-ND1 3.4Å; Q2961-H3094 PolarHBondContact O-CE1 3.23Å; Q2961-H3094 PolarHBondContact O-ND1 2.89Å; Q2961-H3094 PolarHBondContact O-NE2 3.34Å; V2962-H3094 HydrophobicContact CG1-CB 4.2Å; V2962-H3094 WeakPolarHBondContact CG1-CE1 3.24Å; V2962-H3094 HydrophobicContact CG2-CB 3.84Å; V2962-H3094 WeakPolarHBondContact CG2-CD2 3.18Å; V2962-H3094 WeakPolarHBondContact CG2-NE2 3.33Å; S3092-H3094 PolarHBondContact O-N 3.02Å; H3094-D3096 PolarHBondContact O-N 3.11Å; H3094-D3096 VanDerWaalsContact O-N 3.12Å; H3094-V3097 PolarHBondContact O-N 3.22Å; H3094-L3098 WeakPolarHBondContact NE2-CA 3.39Å; H3094-L3098 WeakPolarHBondContact NE2-CB 3.33Å; H3094-L3098 WeakPolarHBondContact NE2-CD1 3.31Å; H3094-L3098 WeakPolarHBondContact O-CB 3.43Å; H3094-L3098 PolarHBondContact O-N 2.89Å
3095E66.8Low63.2Low26.3333 Ų26.333357.6 Ų57.612%0.12335%0.353CS..Hα-helixtrans-51-34.9178.3-90.7-164.9-170.100113.1K3007 K3011 P3091 S3092 L3093 V3097K3007-E3095 HydrophobicContact CD-CB 4.29Å; K3007-E3095 VanDerWaalsContact CE-O 3.24Å; K3007-E3095 WeakPolarHBondContact CE-O 3.33Å; K3007-E3095 WeakPolarHBondContact CE-OE2 3.4Å; K3007-E3095 HydrophobicContact CG-CB 4.33Å; K3007-E3095 HydrophobicContact CG-CG 4.28Å; K3007-E3095 IonicContact NZ-OE2 2.68Å; K3011-E3095 WeakPolarHBondContact CE-OE1 3.43Å; K3011-E3095 VanDerWaalsContact CE-OE2 3.29Å; K3011-E3095 WeakPolarHBondContact CE-OE2 3.38Å; K3011-E3095 WeakPolarHBondContact CG-OE1 3.45Å; K3011-E3095 IonicContact NZ-OE1 3.18Å; K3011-E3095 PolarHBondContact NZ-OE1 2.94Å; K3011-E3095 IonicContact NZ-OE2 3.06Å; K3011-E3095 PolarHBondContact NZ-OE2 3.05Å; P3091-E3095 WeakPolarHBondContact CB-OE1 3.37Å; S3092-E3095 VanDerWaalsContact O-CB 3.32Å; S3092-E3095 WeakPolarHBondContact O-CB 3.33Å; S3092-E3095 PolarHBondContact O-N 3.21Å; L3093-E3095 VanDerWaalsContact C-N 3.28Å; L3093-E3095 PolarHBondContact O-N 2.87Å; E3095-V3097 VanDerWaalsContact C-N 3.27Å; E3095-V3097 PolarHBondContact O-N 2.65Å
3096D70.8Confident66.3Low96.6667 Ų96.666754.6 Ų54.652%0.51732%0.322SS..Hα-helixtrans-82.3-19.6179.5-83.4-46000114K3007 L3093 H3094K3007-D3096 IonicContact NZ-OD1 3.02Å; K3007-D3096 PolarHBondContact NZ-OD1 3.3Å; K3007-D3096 IonicContact NZ-OD2 2.77Å; K3007-D3096 PolarHBondContact NZ-OD2 3.03Å; L3093-D3096 PolarHBondContact O-N 3.17Å; H3094-D3096 PolarHBondContact O-N 3.11Å; H3094-D3096 VanDerWaalsContact O-N 3.12Å
3097V82.9Confident69.5Low35 Ų3547.3 Ų47.321%0.21228%0.284CS..Hα-helixtrans-107.5-28.6-173.8-157.50000112.6H3094 E3095 G3099 A3100 H3101 F3692H3094-V3097 PolarHBondContact O-N 3.22Å; E3095-V3097 VanDerWaalsContact C-N 3.27Å; E3095-V3097 PolarHBondContact O-N 2.65Å; V3097-G3099 VanDerWaalsContact C-N 3.26Å; V3097-G3099 PolarHBondContact O-N 3.16Å; V3097-G3099 VanDerWaalsContact O-N 3.14Å; V3097-A3100 WeakPolarHBondContact O-CA 3.12Å; V3097-A3100 WeakPolarHBondContact O-CB 3.33Å; V3097-A3100 PolarHBondContact O-N 3.06Å; V3097-H3101 VanDerWaalsContact CG1-NE2 3.35Å; V3097-H3101 WeakPolarHBondContact CG1-NE2 3.34Å; V3097-H3101 PolarHBondContact O-N 3.21Å; V3097-H3101 VanDerWaalsContact O-N 3.11Å; V3097-F3692 HydrophobicContact CG1-CD2 4.02Å; V3097-F3692 HydrophobicContact CG1-CE2 4.45Å; V3097-F3692 HydrophobicContact CG2-CE2 4.18Å
3098L86.7Confident72.5Confident1.66667 Ų1.6666743.7 Ų43.71%0.00925%0.247CC..Hα-helixtrans-50.7-42.7179.5-178.563.7000112.6D2939 I2943 V2962 I3006 Q3010 H3094 A3100 H3101 L3102D2939-L3098 HydrophobicContact CB-CD1 4.02Å; D2939-L3098 HydrophobicContact CB-CD2 3.73Å; D2939-L3098 HydrophobicContact CB-CG 4.43Å; I2943-L3098 HydrophobicContact CD1-CD1 3.87Å; I2943-L3098 HydrophobicContact CG1-CD1 3.74Å; V2962-L3098 HydrophobicContact CG1-CD1 4.32Å; V2962-L3098 HydrophobicContact CG2-CD1 4.3Å; I3006-L3098 HydrophobicContact CG2-CB 4.39Å; I3006-L3098 HydrophobicContact CG2-CD2 3.84Å; I3006-L3098 HydrophobicContact CG2-CG 4.16Å; Q3010-L3098 HydrophobicContact CG-CD2 3.71Å; H3094-L3098 WeakPolarHBondContact NE2-CA 3.39Å; H3094-L3098 WeakPolarHBondContact NE2-CB 3.33Å; H3094-L3098 WeakPolarHBondContact NE2-CD1 3.31Å; H3094-L3098 WeakPolarHBondContact O-CB 3.43Å; H3094-L3098 PolarHBondContact O-N 2.89Å; L3098-A3100 VanDerWaalsContact C-N 3.29Å; L3098-A3100 PolarHBondContact O-N 3.38Å; L3098-H3101 PolarHBondContact O-N 2.92Å; L3098-L3102 HydrophobicContact CD1-CD1 3.98Å; L3098-L3102 HydrophobicContact CD1-CD2 4.38Å; L3098-L3102 HydrophobicContact CD1-CG 4.14Å; L3098-L3102 HydrophobicContact CD2-CD1 4.44Å; L3098-L3102 HydrophobicContact CG-CD1 3.83Å; L3098-L3102 HydrophobicContact CG-CG 4.38Å; L3098-L3102 WeakPolarHBondContact O-CB 3.35Å; L3098-L3102 VanDerWaalsContact O-CG 3.28Å; L3098-L3102 WeakPolarHBondContact O-CG 3.36Å; L3098-L3102 PolarHBondContact O-N 2.91Å
3099G87.9Confident75.6Confident1.33333 Ų1.3333338.7 Ų38.71%0.01422%0.216CC..Hα-helixtrans-67.2-22.9178.700000114.4V3097 K3103V3097-G3099 VanDerWaalsContact C-N 3.26Å; V3097-G3099 PolarHBondContact O-N 3.16Å; V3097-G3099 VanDerWaalsContact O-N 3.14Å; G3099-K3103 WeakPolarHBondContact O-CG 3.43Å; G3099-K3103 PolarHBondContact O-N 3.48Å
3100A88.1Confident78.5Confident29.3333 Ų29.333332.2 Ų32.224%0.24218%0.181CC..Hα-helixtrans-79.9-48.8172.100000111V3097 L3098 L3102 K3103 S3104 I3691V3097-A3100 WeakPolarHBondContact O-CA 3.12Å; V3097-A3100 WeakPolarHBondContact O-CB 3.33Å; V3097-A3100 PolarHBondContact O-N 3.06Å; L3098-A3100 VanDerWaalsContact C-N 3.29Å; L3098-A3100 PolarHBondContact O-N 3.38Å; A3100-L3102 VanDerWaalsContact C-N 3.31Å; A3100-L3102 PolarHBondContact O-N 2.91Å; A3100-K3103 CarbonylContact O-C 3.38Å; A3100-K3103 WeakPolarHBondContact O-CA 3.5Å; A3100-K3103 WeakPolarHBondContact O-CB 3.32Å; A3100-K3103 PolarHBondContact O-N 2.73Å; A3100-K3103 VanDerWaalsContact O-N 3.07Å; A3100-S3104 WeakPolarHBondContact O-CB 3.41Å; A3100-S3104 PolarHBondContact O-N 3.15Å; A3100-S3104 PolarHBondContact O-OG 3.27Å; A3100-I3691 HydrophobicContact CB-CG2 4.08Å
3101H89.5Confident81.2Confident18.6667 Ų18.666725.7 Ų25.79%0.08615%0.148CC..Hα-helixtrans-58.7-41.9177.5-67.7-46.9000112.7I2943 E2958 N2960 V3097 L3098 K3103 S3104 G3105I2943-H3101 HydrophobicContact CD1-CB 4.03Å; E2958-H3101 IonicContact OE1-CE1 2.67Å; E2958-H3101 IonicContact OE1-CG 3.23Å; E2958-H3101 IonicContact OE1-ND1 3.46Å; E2958-H3101 PolarHBondContact OE1-ND1 3.11Å; N2960-H3101 VanDerWaalsContact CB-CE1 3.46Å; N2960-H3101 WeakPolarHBondContact CB-CE1 3.49Å; N2960-H3101 WeakPolarHBondContact CB-NE2 3.36Å; V3097-H3101 VanDerWaalsContact CG1-NE2 3.35Å; V3097-H3101 WeakPolarHBondContact CG1-NE2 3.34Å; V3097-H3101 PolarHBondContact O-N 3.21Å; V3097-H3101 VanDerWaalsContact O-N 3.11Å; L3098-H3101 PolarHBondContact O-N 2.92Å; H3101-K3103 VanDerWaalsContact C-N 3.32Å; H3101-K3103 PolarHBondContact O-N 3.26Å; H3101-S3104 VanDerWaalsContact CA-OG 3.26Å; H3101-S3104 WeakPolarHBondContact CA-OG 3.47Å; H3101-S3104 WeakPolarHBondContact O-CB 3.47Å; H3101-S3104 PolarHBondContact O-N 2.78Å; H3101-S3104 PolarHBondContact O-OG 3.06Å; H3101-G3105 PolarHBondContact O-N 3.06Å
3102L92Very high83.6Confident7 Ų721.8 Ų21.84%0.03712%0.123CC..Hα-helixtrans-65.8-31.8175.9-69.9171.4000112.7F2927 L2942 I2943 L2946 F2996 I3006 L3098 A3100 L3106F2927-L3102 HydrophobicContact CE2-CD2 4.48Å; L2942-L3102 HydrophobicContact CD2-CD1 3.72Å; L2942-L3102 HydrophobicContact CD2-CD2 4.38Å; L2942-L3102 HydrophobicContact CG-CD1 4.26Å; L2942-L3102 HydrophobicContact CG-CD2 4.01Å; I2943-L3102 HydrophobicContact CD1-CD2 3.83Å; I2943-L3102 HydrophobicContact CD1-CG 4.15Å; L2946-L3102 HydrophobicContact CD2-CD2 3.97Å; F2996-L3102 HydrophobicContact CE1-CB 4.47Å; I3006-L3102 HydrophobicContact CD1-CD1 4.1Å; I3006-L3102 HydrophobicContact CG1-CD1 4.48Å; I3006-L3102 HydrophobicContact CG2-CD1 4.17Å; L3098-L3102 HydrophobicContact CD1-CD1 3.98Å; L3098-L3102 HydrophobicContact CD1-CD2 4.38Å; L3098-L3102 HydrophobicContact CD1-CG 4.14Å; L3098-L3102 HydrophobicContact CD2-CD1 4.44Å; L3098-L3102 HydrophobicContact CG-CD1 3.83Å; L3098-L3102 HydrophobicContact CG-CG 4.38Å; L3098-L3102 WeakPolarHBondContact O-CB 3.35Å; L3098-L3102 VanDerWaalsContact O-CG 3.28Å; L3098-L3102 WeakPolarHBondContact O-CG 3.36Å; L3098-L3102 PolarHBondContact O-N 2.91Å; A3100-L3102 VanDerWaalsContact C-N 3.31Å; A3100-L3102 PolarHBondContact O-N 2.91Å; L3102-L3106 WeakPolarHBondContact O-CB 3.41Å; L3102-L3106 WeakPolarHBondContact O-CD1 3.24Å; L3102-L3106 VanDerWaalsContact O-CG 3.27Å; L3102-L3106 WeakPolarHBondContact O-CG 3.35Å; L3102-L3106 PolarHBondContact O-N 2.86Å; L3102-L3106 VanDerWaalsContact O-N 3.13Å
3103K92.9Very high85.4Confident3 Ų319.9 Ų19.91%0.01311%0.109CC..Hα-helixtrans-77.7-39.3173.8-78.8-163.5174.4-158.70112.8F2996 I2997 D2999 T3002 G3099 A3100 H3101 S3107 W3374 E3698F2996-K3103 HydrophobicContact CD1-CG 4.35Å; F2996-K3103 HydrophobicContact CE1-CG 4.18Å; F2996-K3103 VanDerWaalsContact O-CE 3.26Å; F2996-K3103 WeakPolarHBondContact O-CE 3.31Å; F2996-K3103 PolarHBondContact O-NZ 3.16Å; I2997-K3103 PolarHBondContact O-NZ 3.18Å; D2999-K3103 PolarHBondContact O-NZ 3.24Å; T3002-K3103 WeakPolarHBondContact OG1-CE 3.36Å; T3002-K3103 PolarHBondContact OG1-NZ 3.06Å; T3002-K3103 VanDerWaalsContact OG1-NZ 3.1Å; G3099-K3103 WeakPolarHBondContact O-CG 3.43Å; G3099-K3103 PolarHBondContact O-N 3.48Å; A3100-K3103 CarbonylContact O-C 3.38Å; A3100-K3103 WeakPolarHBondContact O-CA 3.5Å; A3100-K3103 WeakPolarHBondContact O-CB 3.32Å; A3100-K3103 PolarHBondContact O-N 2.73Å; A3100-K3103 VanDerWaalsContact O-N 3.07Å; H3101-K3103 VanDerWaalsContact C-N 3.32Å; H3101-K3103 PolarHBondContact O-N 3.26Å; K3103-S3107 VanDerWaalsContact O-CB 3.23Å; K3103-S3107 WeakPolarHBondContact O-CB 3.35Å; K3103-S3107 PolarHBondContact O-N 3.26Å; K3103-S3107 PolarHBondContact O-OG 2.96Å; K3103-W3374 HydrophobicContact CB-CD2 4.24Å; K3103-W3374 HydrophobicContact CB-CE3 3.95Å; K3103-W3374 HydrophobicContact CB-CH2 3.73Å; K3103-W3374 HydrophobicContact CB-CZ2 4Å; K3103-W3374 HydrophobicContact CB-CZ3 3.69Å; K3103-W3374 HydrophobicContact CD-CD2 4.26Å; K3103-W3374 HydrophobicContact CD-CH2 4.36Å; K3103-W3374 HydrophobicContact CD-CZ2 3.78Å; K3103-W3374 HydrophobicContact CG-CZ2 4.43Å; K3103-E3698 IonicContact NZ-OE1 2.97Å; K3103-E3698 IonicContact NZ-OE2 3.81Å; K3103-E3698 PolarHBondContact NZ-OE2 3.42Å
3104S91.9Very high87.1Confident4 Ų413.3 Ų13.33%0.0287%0.074CC..Hα-helixtrans-59.3-59.9176.4164.10000110.7E2958 A3100 H3101 L3106 S3107 Q3108 I3691E2958-S3104 VanDerWaalsContact CD-OG 3.28Å; E2958-S3104 WeakPolarHBondContact OE1-CB 3.42Å; E2958-S3104 PolarHBondContact OE1-OG 3.29Å; E2958-S3104 WeakPolarHBondContact OE2-CB 3.5Å; E2958-S3104 PolarHBondContact OE2-OG 3.23Å; A3100-S3104 WeakPolarHBondContact O-CB 3.41Å; A3100-S3104 PolarHBondContact O-N 3.15Å; A3100-S3104 PolarHBondContact O-OG 3.27Å; H3101-S3104 VanDerWaalsContact CA-OG 3.26Å; H3101-S3104 WeakPolarHBondContact CA-OG 3.47Å; H3101-S3104 WeakPolarHBondContact O-CB 3.47Å; H3101-S3104 PolarHBondContact O-N 2.78Å; H3101-S3104 PolarHBondContact O-OG 3.06Å; S3104-L3106 VanDerWaalsContact C-N 3.3Å; S3104-L3106 PolarHBondContact O-N 3.29Å; S3104-S3107 CarbonylContact O-C 3.35Å; S3104-S3107 WeakPolarHBondContact O-CB 3.35Å; S3104-S3107 PolarHBondContact O-N 2.89Å; S3104-S3107 VanDerWaalsContact O-N 3.13Å; S3104-Q3108 WeakPolarHBondContact O-CB 3.28Å; S3104-Q3108 PolarHBondContact O-N 3.27Å; S3104-I3691 VanDerWaalsContact OG-CD1 3.27Å; S3104-I3691 WeakPolarHBondContact OG-CD1 3.3Å
3105G92.3Very high87.9Confident0 Ų012.5 Ų12.50%07%0.073CC..Hα-helixtrans-65.7-35.3-178.700000113.8H3101 S3107 Q3108 Y3109H3101-G3105 PolarHBondContact O-N 3.06Å; G3105-S3107 VanDerWaalsContact C-N 3.31Å; G3105-S3107 PolarHBondContact O-N 3.42Å; G3105-Q3108 WeakPolarHBondContact O-CB 3.45Å; G3105-Q3108 PolarHBondContact O-N 3.05Å; G3105-Y3109 PolarHBondContact O-N 3.38Å
3106L94.2Very high88.4Confident1.33333 Ų1.3333315.3 Ų15.31%0.0078%0.082CC..Hα-helixtrans-67.2-36.9173.3-143.595.4000111.8F2927 I2931 L2946 M2986 C2993 F2996 I2997 L3102 S3104 Q3108 Y3109 V3110F2927-L3106 HydrophobicContact CE1-CD1 4.07Å; F2927-L3106 HydrophobicContact CE1-CD2 3.81Å; F2927-L3106 HydrophobicContact CZ-CD1 4.39Å; F2927-L3106 HydrophobicContact CZ-CD2 4.01Å; F2927-L3106 HydrophobicContact CZ-CG 4.31Å; I2931-L3106 HydrophobicContact CD1-CD1 3.94Å; I2931-L3106 HydrophobicContact CD1-CD2 3.86Å; I2931-L3106 HydrophobicContact CD1-CG 4.45Å; I2931-L3106 HydrophobicContact CG1-CD1 4.24Å; L2946-L3106 HydrophobicContact CD1-CD2 4.42Å; L2946-L3106 HydrophobicContact CD1-CG 4.36Å; M2986-L3106 HydrophobicContact CE-CD1 4.49Å; M2986-L3106 HydrophobicContact CE-CD2 4.49Å; C2993-L3106 HydrophobicContact CB-CD1 4.16Å; C2993-L3106 HydrophobicContact CB-CD2 4.21Å; C2993-L3106 HydrophobicContact CB-CG 4.13Å; F2996-L3106 HydrophobicContact CB-CD2 4.42Å; F2996-L3106 HydrophobicContact CD1-CD1 3.48Å; F2996-L3106 VanDerWaalsContact CD1-CD1 3.48Å; F2996-L3106 HydrophobicContact CD1-CD2 3.61Å; F2996-L3106 HydrophobicContact CE1-CD1 3.54Å; F2996-L3106 HydrophobicContact CE1-CD2 4.13Å; F2996-L3106 HydrophobicContact CG-CD1 4.27Å; F2996-L3106 HydrophobicContact CG-CD2 4.26Å; F2996-L3106 HydrophobicContact CZ-CD1 4.34Å; I2997-L3106 HydrophobicContact CD1-CB 4.25Å; I2997-L3106 HydrophobicContact CD1-CD2 4.46Å; I2997-L3106 HydrophobicContact CD1-CG 4.26Å; I2997-L3106 HydrophobicContact CG1-CB 4.38Å; I2997-L3106 HydrophobicContact CG1-CD2 4.25Å; I2997-L3106 HydrophobicContact CG1-CG 4.48Å; L3102-L3106 WeakPolarHBondContact O-CB 3.41Å; L3102-L3106 WeakPolarHBondContact O-CD1 3.24Å; L3102-L3106 VanDerWaalsContact O-CG 3.27Å; L3102-L3106 WeakPolarHBondContact O-CG 3.35Å; L3102-L3106 PolarHBondContact O-N 2.86Å; L3102-L3106 VanDerWaalsContact O-N 3.13Å; S3104-L3106 VanDerWaalsContact C-N 3.3Å; S3104-L3106 PolarHBondContact O-N 3.29Å; L3106-Q3108 VanDerWaalsContact C-N 3.31Å; L3106-Y3109 HydrophobicContact CD1-CD1 4.25Å; L3106-Y3109 PolarHBondContact O-N 3.11Å; L3106-V3110 VanDerWaalsContact O-CG2 3.31Å; L3106-V3110 WeakPolarHBondContact O-CG2 3.37Å; L3106-V3110 PolarHBondContact O-N 2.96Å
3107S93.8Very high88.1Confident0.333333 Ų0.33333312.3 Ų12.30%0.0027%0.069CC..Hα-helixtrans-71.1-32.8175.7-126.50000112.4I2997 K3103 S3104 G3105 V3110 S3111 W3374 L3375I2997-S3107 WeakPolarHBondContact CD1-OG 3.26Å; K3103-S3107 VanDerWaalsContact O-CB 3.23Å; K3103-S3107 WeakPolarHBondContact O-CB 3.35Å; K3103-S3107 PolarHBondContact O-N 3.26Å; K3103-S3107 PolarHBondContact O-OG 2.96Å; S3104-S3107 CarbonylContact O-C 3.35Å; S3104-S3107 WeakPolarHBondContact O-CB 3.35Å; S3104-S3107 PolarHBondContact O-N 2.89Å; S3104-S3107 VanDerWaalsContact O-N 3.13Å; G3105-S3107 VanDerWaalsContact C-N 3.31Å; G3105-S3107 PolarHBondContact O-N 3.42Å; S3107-V3110 PolarHBondContact O-N 2.98Å; S3107-S3111 VanDerWaalsContact O-CB 3.28Å; S3107-S3111 WeakPolarHBondContact O-CB 3.33Å; S3107-S3111 PolarHBondContact O-N 2.88Å; S3107-S3111 PolarHBondContact O-OG 3.14Å; S3107-W3374 VanDerWaalsContact CB-O 3.23Å; S3107-W3374 WeakPolarHBondContact CB-O 3.48Å; S3107-W3374 PolarHBondContact OG-O 3.41Å; S3107-L3375 WeakPolarHBondContact OG-CA 3.47Å; S3107-L3375 PolarHBondContact OG-N 3.2Å
3108Q93.3Very high86.8Confident0 Ų013.3 Ų13.30%07%0.073CC..Hα-helixtrans-62.1-47.6170.4-170.6-174.9-100111.2L2950 T2956 S3104 G3105 L3106 S3111 L3112 M3381 N3382L2950-Q3108 HydrophobicContact CD1-CB 4.19Å; L2950-Q3108 HydrophobicContact CD1-CG 3.95Å; L2950-Q3108 HydrophobicContact CD2-CB 4.02Å; L2950-Q3108 HydrophobicContact CD2-CG 4.2Å; T2956-Q3108 PolarHBondContact O-NE2 2.98Å; T2956-Q3108 PolarHBondContact O-OE1 2.87Å; T2956-Q3108 VanDerWaalsContact O-OE1 3.14Å; S3104-Q3108 WeakPolarHBondContact O-CB 3.28Å; S3104-Q3108 PolarHBondContact O-N 3.27Å; G3105-Q3108 WeakPolarHBondContact O-CB 3.45Å; G3105-Q3108 PolarHBondContact O-N 3.05Å; L3106-Q3108 VanDerWaalsContact C-N 3.31Å; Q3108-S3111 WeakPolarHBondContact O-CB 3.38Å; Q3108-S3111 PolarHBondContact O-N 3.19Å; Q3108-L3112 HydrophobicContact CG-CD1 4.34Å; Q3108-L3112 WeakPolarHBondContact O-CB 3.46Å; Q3108-L3112 PolarHBondContact O-N 3.39Å; Q3108-M3381 HydrophobicContact CB-CE 4.19Å; Q3108-M3381 HydrophobicContact CG-CE 4.41Å; Q3108-N3382 HydrophobicContact CG-CB 3.83Å; Q3108-N3382 WeakPolarHBondContact CG-OD1 3.39Å; Q3108-N3382 PolarHBondContact NE2-OD1 3Å
3109Y93Very high85Confident0.666667 Ų0.66666716.3 Ų16.30%0.0039%0.094CC..Hα-helixtrans-59.1-49.1174.4166.8-104000112.3I2949 A2953 A2983 M2986 R2987 L2990 G3105 L3106 S3111 L3112 E3113I2949-Y3109 HydrophobicContact CG2-CD2 3.85Å; I2949-Y3109 HydrophobicContact CG2-CE2 3.86Å; I2949-Y3109 HydrophobicContact CG2-CG 4.36Å; A2953-Y3109 HydrophobicContact CB-CD2 3.87Å; A2953-Y3109 HydrophobicContact CB-CE2 4.23Å; A2983-Y3109 HydrophobicContact CB-CE2 4.16Å; A2983-Y3109 PolarHBondContact O-OH 3.2Å; M2986-Y3109 VanDerWaalsContact C-OH 3.25Å; M2986-Y3109 HydrophobicContact CB-CE1 4.27Å; M2986-Y3109 HydrophobicContact CB-CE2 4.43Å; M2986-Y3109 VanDerWaalsContact CB-OH 3.31Å; M2986-Y3109 WeakPolarHBondContact CB-OH 3.19Å; M2986-Y3109 HydrophobicContact CG-CD1 4.39Å; M2986-Y3109 HydrophobicContact CG-CE1 3.63Å; R2987-Y3109 PolarHBondContact N-OH 3.09Å; L2990-Y3109 HydrophobicContact CD2-CD1 4.33Å; L2990-Y3109 HydrophobicContact CD2-CE1 3.6Å; L2990-Y3109 HydrophobicContact CG-CE1 4.45Å; G3105-Y3109 PolarHBondContact O-N 3.38Å; L3106-Y3109 HydrophobicContact CD1-CD1 4.25Å; L3106-Y3109 PolarHBondContact O-N 3.11Å; Y3109-S3111 VanDerWaalsContact C-N 3.27Å; Y3109-S3111 PolarHBondContact O-N 3.26Å; Y3109-L3112 WeakPolarHBondContact O-CB 3.49Å; Y3109-L3112 PolarHBondContact O-N 3.33Å; Y3109-L3112 VanDerWaalsContact O-N 3.16Å; Y3109-E3113 HydrophobicContact CD2-CG 4.3Å; Y3109-E3113 HydrophobicContact CE1-CG 4.43Å; Y3109-E3113 HydrophobicContact CE2-CG 3.62Å; Y3109-E3113 PolarHBondContact O-N 3.17Å
3110V92.9Very high82.5Confident1.33333 Ų1.3333319.4 Ų19.41%0.00813%0.126CC..Hα-helixtrans-61.8-36.9176.9175.50000111.2L2990 C2993 L2994 I2997 L3106 S3107 E3113 L3114 L3375L2990-V3110 HydrophobicContact CD2-CB 4.38Å; L2990-V3110 HydrophobicContact CD2-CG1 4.43Å; L2990-V3110 HydrophobicContact CD2-CG2 3.87Å; C2993-V3110 HydrophobicContact CB-CG2 3.7Å; L2994-V3110 HydrophobicContact CD2-CG1 3.84Å; L2994-V3110 HydrophobicContact CG-CG1 4.15Å; I2997-V3110 HydrophobicContact CD1-CB 4.49Å; I2997-V3110 HydrophobicContact CD1-CG2 4.11Å; L3106-V3110 VanDerWaalsContact O-CG2 3.31Å; L3106-V3110 WeakPolarHBondContact O-CG2 3.37Å; L3106-V3110 PolarHBondContact O-N 2.96Å; S3107-V3110 PolarHBondContact O-N 2.98Å; V3110-E3113 PolarHBondContact O-N 3.32Å; V3110-L3114 HydrophobicContact CG1-CD1 3.99Å; V3110-L3114 HydrophobicContact CG1-CG 4.39Å; V3110-L3114 WeakPolarHBondContact O-CB 3.38Å; V3110-L3114 VanDerWaalsContact O-CG 3.27Å; V3110-L3114 WeakPolarHBondContact O-CG 3.44Å; V3110-L3114 PolarHBondContact O-N 3.3Å; V3110-L3375 HydrophobicContact CB-CD1 4.28Å; V3110-L3375 HydrophobicContact CG1-CD1 3.77Å
3111S90.8Very high79.9Confident2.33333 Ų2.3333321.8 Ų21.82%0.01614%0.141CC..Hα-helixtrans-67.4-39.5176.7-600000112.6S3107 Q3108 Y3109 S3115 L3375 A3379 C3394S3107-S3111 VanDerWaalsContact O-CB 3.28Å; S3107-S3111 WeakPolarHBondContact O-CB 3.33Å; S3107-S3111 PolarHBondContact O-N 2.88Å; S3107-S3111 PolarHBondContact O-OG 3.14Å; Q3108-S3111 WeakPolarHBondContact O-CB 3.38Å; Q3108-S3111 PolarHBondContact O-N 3.19Å; Y3109-S3111 VanDerWaalsContact C-N 3.27Å; Y3109-S3111 PolarHBondContact O-N 3.26Å; S3111-S3115 WeakPolarHBondContact O-CB 3.35Å; S3111-S3115 PolarHBondContact O-N 3.3Å; S3111-S3115 PolarHBondContact O-OG 3.26Å; S3111-L3375 VanDerWaalsContact OG-CD1 3.27Å; S3111-L3375 WeakPolarHBondContact OG-CD1 3.42Å; S3111-L3375 PolarHBondContact OG-O 3.03Å; S3111-A3379 PolarHBondContact OG-N 3.15Å; S3111-C3394 VanDerWaalsContact CB-SG 3.58Å
3112L88.7Confident77.3Confident2.66667 Ų2.6666724.1 Ų24.11%0.01415%0.154CC..Hα-helixtrans-61.9-49.3173.3-81.4166.6000111.4L2950 A2953 Q3108 Y3109 L3114 S3115 R3116 C3394L2950-L3112 HydrophobicContact CD1-CD1 3.89Å; L2950-L3112 HydrophobicContact CD2-CD1 4.32Å; A2953-L3112 HydrophobicContact CB-CB 4.42Å; A2953-L3112 HydrophobicContact CB-CD1 3.98Å; Q3108-L3112 HydrophobicContact CG-CD1 4.34Å; Q3108-L3112 WeakPolarHBondContact O-CB 3.46Å; Q3108-L3112 PolarHBondContact O-N 3.39Å; Y3109-L3112 WeakPolarHBondContact O-CB 3.49Å; Y3109-L3112 PolarHBondContact O-N 3.33Å; Y3109-L3112 VanDerWaalsContact O-N 3.16Å; L3112-L3114 PolarHBondContact O-N 3.08Å; L3112-S3115 CarbonylContact O-C 3.36Å; L3112-S3115 WeakPolarHBondContact O-CA 3.41Å; L3112-S3115 WeakPolarHBondContact O-CB 3.21Å; L3112-S3115 PolarHBondContact O-N 3.04Å; L3112-S3115 VanDerWaalsContact O-N 3.1Å; L3112-R3116 WeakPolarHBondContact O-CG 3.49Å; L3112-R3116 PolarHBondContact O-N 3.12Å; L3112-C3394 HydrophobicContact CD2-CB 4.43Å
3113E87.7Confident74.8Confident3 Ų332 Ų321%0.01419%0.19CC..Hα-helixtrans-65.3-39.6-179.6-77.7-67.7124.400113.1R2987 L2990 Y3109 V3110 S3115 R3116 S3117R2987-E3113 IonicContact CZ-OE1 3.29Å; R2987-E3113 IonicContact CZ-OE2 3.27Å; R2987-E3113 VanDerWaalsContact CZ-OE2 3.31Å; R2987-E3113 IonicContact NE-OE1 3.31Å; R2987-E3113 IonicContact NE-OE2 3.1Å; R2987-E3113 PolarHBondContact NE-OE2 3.08Å; R2987-E3113 IonicContact NH2-OE1 3.2Å; R2987-E3113 PolarHBondContact NH2-OE1 3.07Å; R2987-E3113 IonicContact NH2-OE2 3.11Å; R2987-E3113 PolarHBondContact NH2-OE2 3.06Å; R2987-E3113 VanDerWaalsContact NH2-OE2 3.09Å; L2990-E3113 HydrophobicContact CD1-CB 4.1Å; L2990-E3113 HydrophobicContact CD1-CG 4.49Å; L2990-E3113 HydrophobicContact CD2-CB 4.16Å; L2990-E3113 HydrophobicContact CD2-CG 4.43Å; Y3109-E3113 HydrophobicContact CD2-CG 4.3Å; Y3109-E3113 HydrophobicContact CE1-CG 4.43Å; Y3109-E3113 HydrophobicContact CE2-CG 3.62Å; Y3109-E3113 PolarHBondContact O-N 3.17Å; V3110-E3113 PolarHBondContact O-N 3.32Å; E3113-S3115 VanDerWaalsContact C-N 3.28Å; E3113-S3115 PolarHBondContact O-N 3.06Å; E3113-R3116 PolarHBondContact O-N 2.66Å; E3113-R3116 WeakPolarHBondContact OE1-CD 3.45Å; E3113-R3116 IonicContact OE1-NE 3.34Å; E3113-R3116 PolarHBondContact OE1-NE 3.25Å; E3113-S3117 WeakPolarHBondContact O-CB 3.44Å; E3113-S3117 PolarHBondContact O-N 3.1Å; E3113-S3117 PolarHBondContact O-OG 2.96Å
3114L86.8Confident72.1Confident7.66667 Ų7.6666737.7 Ų37.74%0.0422%0.221CC..Hα-helixtrans-63.9-33.4170.8-70.3173.9000111.9V3110 L3112 S3117 N3118 Y3344 L3375 P3396V3110-L3114 HydrophobicContact CG1-CD1 3.99Å; V3110-L3114 HydrophobicContact CG1-CG 4.39Å; V3110-L3114 WeakPolarHBondContact O-CB 3.38Å; V3110-L3114 VanDerWaalsContact O-CG 3.27Å; V3110-L3114 WeakPolarHBondContact O-CG 3.44Å; V3110-L3114 PolarHBondContact O-N 3.3Å; L3112-L3114 PolarHBondContact O-N 3.08Å; L3114-S3117 PolarHBondContact O-N 2.93Å; L3114-S3117 PolarHBondContact O-OG 2.91Å; L3114-N3118 PolarHBondContact O-N 3.32Å; L3114-N3118 PolarHBondContact O-ND2 3.12Å; L3114-N3118 PolarHBondContact O-OD1 3.25Å; L3114-Y3344 HydrophobicContact CD2-CD2 3.57Å; L3114-Y3344 HydrophobicContact CD2-CE2 4.09Å; L3114-Y3344 HydrophobicContact CD2-CG 4.25Å; L3114-L3375 HydrophobicContact CD1-CD1 4.1Å; L3114-L3375 HydrophobicContact CD1-CD2 4Å; L3114-P3396 HydrophobicContact CB-CB 3.81Å; L3114-P3396 HydrophobicContact CD1-CB 4.4Å
3115S83.7Confident69.9Low21 Ų2140.8 Ų40.815%0.14724%0.239CC..Hα-helixtrans-71.8-44.8176.5-56.70000112.5S3111 L3112 E3113 S3117 N3118 S3119 C3394 R3395 P3396S3111-S3115 WeakPolarHBondContact O-CB 3.35Å; S3111-S3115 PolarHBondContact O-N 3.3Å; S3111-S3115 PolarHBondContact O-OG 3.26Å; L3112-S3115 CarbonylContact O-C 3.36Å; L3112-S3115 WeakPolarHBondContact O-CA 3.41Å; L3112-S3115 WeakPolarHBondContact O-CB 3.21Å; L3112-S3115 PolarHBondContact O-N 3.04Å; L3112-S3115 VanDerWaalsContact O-N 3.1Å; E3113-S3115 VanDerWaalsContact C-N 3.28Å; E3113-S3115 PolarHBondContact O-N 3.06Å; S3115-S3117 PolarHBondContact O-N 3.2Å; S3115-N3118 WeakPolarHBondContact O-CA 3.33Å; S3115-N3118 WeakPolarHBondContact O-CB 3.33Å; S3115-N3118 PolarHBondContact O-N 3.05Å; S3115-S3119 PolarHBondContact O-N 3.38Å; S3115-C3394 WeakPolarHBondContact OG-CA 3.31Å; S3115-R3395 VanDerWaalsContact OG-C 3.32Å; S3115-R3395 PolarHBondContact OG-N 3.08Å; S3115-P3396 WeakPolarHBondContact OG-CD 3.16Å
3116R76.8Confident67.4Low85 Ų8546 Ų4632%0.32127%0.267SS..Hα-helixtrans-60.8-27.9176.2-69.9170.472.7119.2-1.9112.2D2952 A2953 E2984 L3112 E3113 N3118 S3119D2952-R3116 PolarHBondContact O-NH1 2.8Å; A2953-R3116 VanDerWaalsContact C-NH1 3.31Å; A2953-R3116 PolarHBondContact O-NH1 3.21Å; A2953-R3116 VanDerWaalsContact O-NH1 3.11Å; E2984-R3116 IonicContact OE1-NH2 3.38Å; L3112-R3116 WeakPolarHBondContact O-CG 3.49Å; L3112-R3116 PolarHBondContact O-N 3.12Å; E3113-R3116 PolarHBondContact O-N 2.66Å; E3113-R3116 WeakPolarHBondContact OE1-CD 3.45Å; E3113-R3116 IonicContact OE1-NE 3.34Å; E3113-R3116 PolarHBondContact OE1-NE 3.25Å; R3116-N3118 VanDerWaalsContact C-N 3.32Å; R3116-N3118 PolarHBondContact O-N 3.2Å; R3116-S3119 PolarHBondContact O-OG 2.9Å
3117S63.2Low64.7Low33 Ų3349.4 Ų49.423%0.23129%0.289CS..Hα-helixtrans-70.1-24.5174.5-330000113.9E3113 L3114 S3115 I3340E3113-S3117 WeakPolarHBondContact O-CB 3.44Å; E3113-S3117 PolarHBondContact O-N 3.1Å; E3113-S3117 PolarHBondContact O-OG 2.96Å; L3114-S3117 PolarHBondContact O-N 2.93Å; L3114-S3117 PolarHBondContact O-OG 2.91Å; S3115-S3117 PolarHBondContact O-N 3.2Å; S3117-I3340 WeakPolarHBondContact O-CD1 3.31Å
3118N56.1Low62.1Low55.3333 Ų55.333355.8 Ų55.830%0.29632%0.322SS..Hα-helixtrans-86.3-8.8-177.1-91.79.1000113.1L3114 S3115 R3116 G3120 S3337 R3395 P3396L3114-N3118 PolarHBondContact O-N 3.32Å; L3114-N3118 PolarHBondContact O-ND2 3.12Å; L3114-N3118 PolarHBondContact O-OD1 3.25Å; S3115-N3118 WeakPolarHBondContact O-CA 3.33Å; S3115-N3118 WeakPolarHBondContact O-CB 3.33Å; S3115-N3118 PolarHBondContact O-N 3.05Å; R3116-N3118 VanDerWaalsContact C-N 3.32Å; R3116-N3118 PolarHBondContact O-N 3.2Å; N3118-G3120 PolarHBondContact O-N 3.4Å; N3118-S3337 PolarHBondContact OD1-O 2.98Å; N3118-S3337 VanDerWaalsContact OD1-O 3.11Å; N3118-R3395 PolarHBondContact ND2-O 3.2Å; N3118-R3395 VanDerWaalsContact ND2-O 3.09Å; N3118-P3396 PolarHBondContact ND2-O 3.14Å
3119S48.6Very low59.4Low66.3333 Ų66.333360.7 Ų60.746%0.46435%0.348SS..  trans-8655177.656.60000113.1S3115 R3116 S3121 D3122S3115-S3119 PolarHBondContact O-N 3.38Å; R3116-S3119 PolarHBondContact O-OG 2.9Å; S3119-S3121 PolarHBondContact O-N 3.34Å; S3119-D3122 WeakPolarHBondContact CB-OD2 3.31Å; S3119-D3122 PolarHBondContact O-N 3.37Å; S3119-D3122 PolarHBondContact OG-OD2 2.76Å
3120G36.7Very low56.7Low64.6667 Ų64.666762.5 Ų62.567%0.66736%0.363SS*.THydrogen-bonded Turntrans-76.658.1-179.700000115.3N3118N3118-G3120 PolarHBondContact O-N 3.4Å
3121S32.7Very low53.7Low80.3333 Ų80.333367.9 Ų67.956%0.56240%0.398SS*.THydrogen-bonded Turntrans-143.421.7175.252.70000115.8S3119 H3123 D3124S3119-S3121 PolarHBondContact O-N 3.34Å; S3121-H3123 PolarHBondContact O-N 2.82Å; S3121-D3124 PolarHBondContact O-N 2.68Å
3122D36Very low51.1Low67.3333 Ų67.333371 Ų7136%0.3643%0.431SS..THydrogen-bonded Turntrans-67.22.3-171.8-70.8-23.1000115.8S3119 D3124 V3125S3119-D3122 WeakPolarHBondContact CB-OD2 3.31Å; S3119-D3122 PolarHBondContact O-N 3.37Å; S3119-D3122 PolarHBondContact OG-OD2 2.76Å; D3122-D3124 VanDerWaalsContact C-N 3.3Å; D3122-D3124 PolarHBondContact O-N 3.25Å; D3122-V3125 HydrophobicContact CB-CG2 4.48Å; D3122-V3125 PolarHBondContact O-N 3.34Å
3123H38.9Very low48.6Very low172.333 Ų172.33377.2 Ų77.280%0.79846%0.463SS*.THydrogen-bonded Turntrans-67.7-28.3174.5-92.2-56.4000114S3121 P3127S3121-H3123 PolarHBondContact O-N 2.82Å; H3123-P3127 VanDerWaalsContact O-CD 3.23Å; H3123-P3127 WeakPolarHBondContact O-CD 3.4Å
3124D37.2Very low46Very low123.333 Ų123.33384.6 Ų84.666%0.6650%0.502SS*.THydrogen-bonded Turntrans-92.2-14.5-178.8-65.8-36000113.5S3121 D3122 L3128S3121-D3124 PolarHBondContact O-N 2.68Å; D3122-D3124 VanDerWaalsContact C-N 3.3Å; D3122-D3124 PolarHBondContact O-N 3.25Å; D3124-L3128 WeakPolarHBondContact O-CD1 3.45Å; D3124-L3128 VanDerWaalsContact O-CG 3.31Å; D3124-L3128 WeakPolarHBondContact O-CG 3.35Å
3125V44.7Very low43.4Very low68.3333 Ų68.333388.2 Ų88.241%0.41453%0.532SS..Hα-helixtrans-83.2-38-176.1-177.60000112.1D3122 L3128 L3129D3122-V3125 HydrophobicContact CB-CG2 4.48Å; D3122-V3125 PolarHBondContact O-N 3.34Å; V3125-L3128 PolarHBondContact O-N 3.26Å; V3125-L3128 VanDerWaalsContact O-N 3.1Å; V3125-L3129 HydrophobicContact CG1-CD1 3.99Å; V3125-L3129 HydrophobicContact CG1-CG 3.94Å; V3125-L3129 PolarHBondContact O-N 3.33Å
3126L39.5Very low40.8Very low110.333 Ų110.33394.5 Ų94.558%0.57857%0.565SS**Hα-helixtrans-59.8-42.8179.1-86.6161.8000113.8L3128 A3130L3126-L3128 VanDerWaalsContact C-N 3.32Å; L3126-L3128 PolarHBondContact O-N 3.21Å; L3126-A3130 WeakPolarHBondContact O-CB 3.48Å; L3126-A3130 PolarHBondContact O-N 3.41Å
3127P37.5Very low38.6Very low72 Ų7297.1 Ų97.147%0.46859%0.59SS.*Hα-helixtrans-66.8-29.6172.9-22.634.5000114.1H3123 L3129 A3130H3123-P3127 VanDerWaalsContact O-CD 3.23Å; H3123-P3127 WeakPolarHBondContact O-CD 3.4Å; P3127-L3129 VanDerWaalsContact C-N 3.3Å; P3127-L3129 PolarHBondContact O-N 3.44Å; P3127-A3130 CarbonylContact O-C 3.41Å; P3127-A3130 VanDerWaalsContact O-C 3.3Å; P3127-A3130 PolarHBondContact O-N 3.21Å
3128L38.5Very low37.1Very low134 Ų134104.4 Ų104.470%0.70262%0.617SS**Hα-helixtrans-77.4-26.6-176.5-98.2142.9000113.3D3124 V3125 L3126 P3131D3124-L3128 WeakPolarHBondContact O-CD1 3.45Å; D3124-L3128 VanDerWaalsContact O-CG 3.31Å; D3124-L3128 WeakPolarHBondContact O-CG 3.35Å; V3125-L3128 PolarHBondContact O-N 3.26Å; V3125-L3128 VanDerWaalsContact O-N 3.1Å; L3126-L3128 VanDerWaalsContact C-N 3.32Å; L3126-L3128 PolarHBondContact O-N 3.21Å; L3128-P3131 WeakPolarHBondContact O-CG 3.29Å
3129L37.2Very low35.9Very low102.667 Ų102.667108.4 Ų108.454%0.53864%0.644SS.*THydrogen-bonded Turntrans-86-12.9175.7-65.8174.4000113.4V3125 P3127V3125-L3129 HydrophobicContact CG1-CD1 3.99Å; V3125-L3129 HydrophobicContact CG1-CG 3.94Å; V3125-L3129 PolarHBondContact O-N 3.33Å; P3127-L3129 VanDerWaalsContact C-N 3.3Å; P3127-L3129 PolarHBondContact O-N 3.44Å
3130A35.9Very low35Very low40.3333 Ų40.3333111.9 Ų111.933%0.33366%0.663SS.*  trans-13455.417800000114.8L3126 P3127 G3132 L3133 L3134L3126-A3130 WeakPolarHBondContact O-CB 3.48Å; L3126-A3130 PolarHBondContact O-N 3.41Å; P3127-A3130 CarbonylContact O-C 3.41Å; P3127-A3130 VanDerWaalsContact O-C 3.3Å; P3127-A3130 PolarHBondContact O-N 3.21Å; A3130-G3132 VanDerWaalsContact C-N 3.28Å; A3130-G3132 PolarHBondContact O-N 3.1Å; A3130-L3133 HydrophobicContact CB-CB 4.2Å; A3130-L3133 PolarHBondContact O-N 3.28Å; A3130-L3133 VanDerWaalsContact O-N 3.14Å; A3130-L3134 HydrophobicContact CB-CD1 4.45Å; A3130-L3134 PolarHBondContact O-N 2.97Å
3131P31.3Very low34.7Very low113.667 Ų113.667119.3 Ų119.374%0.73867%0.671SS**THydrogen-bonded Turntrans-66.148.2179.8-3.411.1000113.2L3128L3128-P3131 WeakPolarHBondContact O-CG 3.29Å
3132G34.7Very low34.6Very low68.3333 Ų68.3333122.5 Ų122.570%0.70468%0.681SS**THydrogen-bonded Turntrans-161.4-17.9177.200000116.5A3130A3130-G3132 VanDerWaalsContact C-N 3.28Å; A3130-G3132 PolarHBondContact O-N 3.1Å
3133L36Very low34.3Very low132 Ų132122.7 Ų122.769%0.69170%0.699SS**SBendtrans-104.76.7-171.3-78.8169.1000115.3I2441 A3130I2441-L3133 HydrophobicContact CD1-CD2 4.05Å; A3130-L3133 HydrophobicContact CB-CB 4.2Å; A3130-L3133 PolarHBondContact O-N 3.28Å; A3130-L3133 VanDerWaalsContact O-N 3.14Å
3134L33.3Very low33.9Very low158.667 Ų158.667123.8 Ų123.883%0.83170%0.701SS**  trans-120.153.8174.2-81167.6000112.7A3130A3130-L3134 HydrophobicContact CB-CD1 4.45Å; A3130-L3134 PolarHBondContact O-N 2.97Å
3135A33.5Very low33.6Very low82.3333 Ų82.3333124.5 Ų124.568%0.6871%0.705SS**  trans-111.7144164.600000110.5
3136D28.2Very low33Very low154.333 Ų154.333128.9 Ų128.983%0.82573%0.726SS**  trans50.964171.7-72.5-15.6000119.3
3137V31.7Very low32.7Very low139.333 Ų139.333128 Ų12884%0.84473%0.734SS**  trans-11874.4141.3-170.80000110.2
3138K31.5Very low32.6Very low186 Ų186130.9 Ų130.981%0.80975%0.753SS**  trans-11592.8170.6-117.9175.5-174171.80111.3T3140K3138-T3140 PolarHBondContact O-N 3.41Å; K3138-T3140 PolarHBondContact O-OG1 2.98Å
3139T30.2Very low32.3Very low140.333 Ų140.333127.9 Ų127.986%0.86176%0.755SS**  trans-53.6108.2178.338.50000112.8
3140T30.1Very low32.1Very low139.333 Ų139.333130.6 Ų130.686%0.85577%0.769SS**  trans-114.5113.5171.1-53.90000109.7K3138K3138-T3140 PolarHBondContact O-N 3.41Å; K3138-T3140 PolarHBondContact O-OG1 2.98Å
3141R30.6Very low32.1Very low220.333 Ų220.333133.8 Ų133.883%0.83179%0.786SS**  trans-118.1120.2-178.1-178.9178.6-179-176.71.2111.5
3142N30.4Very low32.2Very low147.333 Ų147.333132.7 Ų132.779%0.78879%0.786SS**  trans59.9124167.6-59.57.3000116.8
3143G28.8Very low32Very low71.3333 Ų71.3333140.2 Ų140.274%0.73579%0.793SS**  157.8107.1123.700000115.7
3144K30.5Very low31.8Very low194.667 Ų194.667138.4 Ų138.485%0.84679%0.792SS**  trans71.4123169.9-60.7-179.7179.1179.60116.9
3145N31.5Very low31.7Very low138.333 Ų138.333140.3 Ų140.374%0.7479%0.793SS**  125.9142.6106.1-74.1-8.2000118.5
3146L32.8Very low31.6Very low162 Ų162140.7 Ų140.785%0.84880%0.797SS**  trans49.9122.4153.8-70.3105.8000119.2
3147A32.9Very low31.8Very low90 Ų90139.6 Ų139.674%0.74480%0.795SS**  cis171156.816.900000114
3148P34.3Very low31.8Very low133.667 Ų133.667138.7 Ų138.787%0.86879%0.79SS**  trans-108.9160.6-162.839.6-33000116.6
3149G32.8Very low31.9Very low71.6667 Ų71.6667136 Ų13674%0.73979%0.789SS**  trans-169.5145.8165.800000113.1
3150L32.6Very low32.1Very low158.667 Ų158.667133.6 Ų133.683%0.83178%0.784SS**  trans-122.5166.5-147-89.8136000110.7T2426T2426-L3150 WeakPolarHBondContact OG1-CD2 3.24Å
3151P36.6Very low32.5Very low107.667 Ų107.667132.7 Ų132.770%0.69978%0.78SS**  trans-112175.1-139.640.7-31.1000114.2P2424P2424-P3151 HydrophobicContact CB-CB 3.84Å; P2424-P3151 HydrophobicContact CG-CB 4.42Å
3152A33.1Very low32.5Very low89.3333 Ų89.3333127.3 Ų127.374%0.73878%0.777SS**  -172.2151.4124.100000114.9K2423 P2424K2423-A3152 CarbonylContact O-C 3.55Å; P2424-A3152 CarbonylContact O-C 3.55Å; P2424-A3152 WeakPolarHBondContact O-CA 3.46Å; P2424-A3152 WeakPolarHBondContact O-CB 3.43Å
3153R30.5Very low32.6Very low227.667 Ų227.667125 Ų12586%0.85977%0.772SS**  92.6113.4125.2-168.3179.9178.7-177.21.3119.6K2423 P2424K2423-R3153 PolarHBondContact O-N 3.49Å; P2424-R3153 PolarHBondContact O-N 3.24Å; P2424-R3153 VanDerWaalsContact O-N 3.14Å
3154S31.3Very low32.6Very low93 Ų93128.9 Ų128.965%0.6578%0.776SS**  trans63.8150.1142.577.90000121.8
3155K32.3Very low32.7Very low198.333 Ų198.333125.2 Ų125.286%0.86277%0.769SS**  152.8147.4104.4-102.1174.4-174.2-177.90115.2
3156A30.7Very low32.7Very low91.3333 Ų91.3333124.6 Ų124.676%0.75577%0.771SS**  trans153.6163.7162.800000112.2
3157V33.1Very low32.7Very low131.333 Ų131.333121.5 Ų121.580%0.79676%0.763SS**  cis-172.1157.219.4149.10000112.2
3158T30.9Very low32.6Very low120 Ų120126.1 Ų126.174%0.73677%0.771SS**  trans-149.6155-170-29.10000111.9
3159T33.5Very low32.5Very low129.667 Ų129.667123.1 Ų123.180%0.79676%0.764SS**  trans174.613516532.80000113.5
3160A35.3Very low32.6Very low89.3333 Ų89.3333126.7 Ų126.774%0.73877%0.766SS**  -157.9-168.1115.600000113.8S3162A3160-S3162 PolarHBondContact O-N 3.5Å
3161P37.2Very low32.7Very low120 Ų120125.8 Ų125.878%0.77977%0.767SS**  trans-119.4146.1-14235.4-21.7000116.6
3162S31.4Very low32.6Very low108.667 Ų108.667123.7 Ų123.776%0.7677%0.765SS**  trans104.6141.8141.366.60000118A3160A3160-S3162 PolarHBondContact O-N 3.5Å
3163S32.5Very low32.7Very low99.3333 Ų99.3333129.4 Ų129.470%0.69577%0.773SS**  trans94.4117.3148.758.70000117.5
3164N29.5Very low32.7Very low152 Ų152123.2 Ų123.281%0.81377%0.765SS**  78.4138.8118.4-64.1-7000119.5
3165V31.3Very low32.6Very low117.333 Ų117.333126 Ų12671%0.71177%0.772SS**  114.9106.3113.9161.80000116.9
3166T31.5Very low32.4Very low125.667 Ų125.667122.7 Ų122.777%0.77176%0.764SS**  trans59150.3144.959.30000122.8
3167S32.8Very low32.3Very low97.3333 Ų97.3333125.1 Ų125.168%0.68176%0.763SS**  cis158.5158.1-2.862.80000114.8
3168M32.5Very low32Very low186.333 Ų186.333126.4 Ų126.492%0.91877%0.765SS**  trans72.3136.7157.1-59.2174.369.400119.3
3169G32.2Very low31.8Very low69.6667 Ų69.6667125.2 Ų125.272%0.71876%0.761SS**  cis-170-173.7-21.300000115.1
3170L34.3Very low31.5Very low147.333 Ų147.333127.4 Ų127.477%0.77176%0.762SS**  107.7136.2124.9-69.7175000118.8L3177L3170-L3177 HydrophobicContact CD2-CD2 4.08Å
3171T34.3Very low31.1Very low139.667 Ų139.667128.7 Ų128.786%0.85777%0.766SS**  trans75.1135.1149.364.60000120
3172G33.8Very low30.6Very low65 Ų65126 Ų12667%0.6776%0.76SS**  cis165.5174.1-10.400000115.4
3173K35.1Very low30.4Very low207.667 Ų207.667129.4 Ų129.490%0.90376%0.764SS**  trans72.9129.1179.3-55.4175.5-177.8176.70115.1
3174S30.7Very low30.1Very low98.6667 Ų98.6667131.2 Ų131.269%0.6977%0.771SS**  cis-176.51398.4-139.90000111.3
3175L30.6Very low30.1Very low151.333 Ų151.333128.1 Ų128.179%0.79277%0.766SS**  101.2114.6116.9-65.5166.5000113.6
3176N27.8Very low29.8Very low129.333 Ų129.333129.6 Ų129.669%0.69277%0.77SS**  39.6151.681.7-60.2-24.8000111.3
3177L28.3Very low29.6Very low141.333 Ų141.333129.2 Ų129.274%0.7477%0.767SS**  cis-153.1161.713.5-89.5142.5000109.4L3170L3170-L3177 HydrophobicContact CD2-CD2 4.08Å
3178L26.2Very low29.3Very low159 Ų159132.6 Ų132.683%0.83277%0.772SS**  trans63.6144.4132.7-82.9151.8000113.8
3179S27.2Very low29.2Very low94 Ų94131.4 Ų131.466%0.65777%0.765SS**  trans-178158.9147.954.50000114.1
3180E26.1Very low29.1Very low176 Ų176133.3 Ų133.382%0.82277%0.766SS**  50.9154.3119.8-95.9164.1136.300118.6
3181S27.8Very low28.8Very low116.333 Ų116.333133.4 Ų133.481%0.81477%0.768SS**  trans38.2160.514162.20000117.4
3182G26.6Very low28.7Very low63.3333 Ų63.3333131.3 Ų131.365%0.65376%0.764SS**  trans12194.7133.800000120.9
3183H27.4Very low28.5Very low181 Ų181136.3 Ų136.384%0.83877%0.771SS**  trans36.4154150.4-65.5-83.1000120.7
3184T27.2Very low28.2Very low137.333 Ų137.333132.6 Ų132.684%0.84376%0.759SS**  trans71.1141.8147.855.40000121.8
3185A28.4Very low28.1Very low86 Ų86136.3 Ų136.371%0.71176%0.763SS**  trans46.5145.5165.100000118.8
3186N25.8Very low28Very low149.667 Ų149.667136.4 Ų136.480%0.876%0.764SS**  75.8132119.6-77.7-2.8000118.1
3187V26.9Very low28.1Very low116.333 Ų116.333135 Ų13571%0.70576%0.763SS**  78128.6124.7168.50000113.9
3188E26.3Very low28.2Very low169 Ų169137.2 Ų137.279%0.7977%0.767SS**  64.6148.7101.1-135158.6-16400116.7
3189Q29.4Very low28.4Very low162 Ų162136.4 Ų136.476%0.75776%0.764SS**  trans-142.4140179.5-94.6173.912.600112.5
3190S30Very low28.5Very low108 Ų108137.2 Ų137.276%0.75577%0.769SS**  trans-144.7103.7155.257.90000114
3191N29.3Very low28.7Very low150.333 Ų150.333132.4 Ų132.480%0.80477%0.767SS**  98.1117.986.7-94.3-42000115.4
3192A31Very low28.7Very low94.6667 Ų94.6667132.3 Ų132.378%0.78277%0.766SS**  trans-141117161.600000110.7
3193Q29.9Very low28.7Very low171.333 Ų171.333135.6 Ų135.680%0.80177%0.773SS**  64.5131.3128.7-89.4-168.2-1900118.1
3194I29Very low28.8Very low129.667 Ų129.667131.5 Ų131.567%0.66576%0.761SS**  107.6131.1117.7-82.3167.3000114.6
3195K29.4Very low28.8Very low176.333 Ų176.333134.4 Ų134.477%0.76776%0.757SS**  trans96.1131.6140.6-88.4173.2-177.1175.20116.9
3196L28.7Very low28.9Very low154 Ų154139.7 Ų139.781%0.80676%0.758SS**  68132.9117.2-71.7161.9000118.6
3197S30Very low29Very low98.3333 Ų98.3333138.5 Ų138.569%0.68875%0.752SS**  cis166158.825.867.20000115.8
3198K30.1Very low29.1Very low188.333 Ų188.333141 Ų14182%0.81976%0.756SS**  trans35.4140.9164.6-62.6173.2177.8-179.50116.9
3199N30.1Very low29.5Very low143.333 Ų143.333137.5 Ų137.577%0.76675%0.748SS**  -167.4149.296.7-103.1-6.1000108.9
3200S29Very low29.5Very low109.667 Ų109.667138.1 Ų138.177%0.76775%0.75SS**  89.7123.650.1-56.20000112.2
3201G31.1Very low29.6Very low75.5 Ų75.5138.1 Ų138.178%0.77875%0.75SS**  trans130.7103.9177.600000111.9
3202S26.5Very low29.4Very low114.5 Ų114.5137.4 Ų137.480%0.80175%0.746SS**  cis92.7147.130.5-162.20000114.3
3203V27.9Very low29.3Very low132 Ų132139.1 Ų139.180%0.875%0.748SS**  trans75.3136.7166.2165.10000116.4
3204V29Very low29.1Very low96 Ų96134.6 Ų134.658%0.58274%0.739SS**  cis-167.8154.3-19.7950000112.7
3205R27.3Very low29Very low197.5 Ų197.5135.7 Ų135.775%0.74575%0.747SS**  trans29.6158.1158.4-59.8162.5-175.9157.1-2.6117.5
3206R29.6Very low28.9Very low197.5 Ų197.5133.3 Ų133.375%0.74575%0.747SS**  cis-162.9154.738.7-115.8-178.7-162109.1-6.9113
3207N29Very low28.8Very low124 Ų124130 Ų13066%0.66374%0.742SS**  trans25.6137135.6-61.256.5000120.2
3208E28.9Very low28.8Very low168.5 Ų168.5132.8 Ų132.879%0.78775%0.748SS**  cis132.116733.1-90-151.2121.700112.1
3209P34.3Very low28.8Very low97 Ų97129.8 Ų129.863%0.6375%0.745SS**  -117.9-164.4-102.339.9-29.2000114.3
3210H28.8Very low28.7Very low173.5 Ų173.5131.3 Ų131.380%0.80375%0.747SS**  trans43.3138.5166.8-72.6-79000119.2D3212H3210-D3212 IonicContact ND1-OD2 2.7Å
3211S31.6Very low29Very low107.5 Ų107.5131.5 Ų131.575%0.75275%0.746SS**  -163.8148.762.650.30000110.5
3212D25.4Very low28.7Very low136 Ų136132.7 Ų132.773%0.72774%0.743SS**  7.8150.2114-56.9-79.8000115H3210H3210-D3212 IonicContact ND1-OD2 2.7Å
3213T29.2Very low28.9Very low131.5 Ų131.5133.9 Ų133.981%0.80775%0.745SS**  trans119.9109.7146.8-51.80000114.2
3214A26.2Very low28.9Very low76 Ų76134.8 Ų134.863%0.62875%0.745SS**  64146.787.400000120
3215N26.4Very low29.1Very low153.5 Ų153.5135.5 Ų135.582%0.82175%0.752SS**  trans70.9155.7168.9-49.5-36.2000115.1
3216T27.3Very low29.3Very low126 Ų126131 Ų13177%0.77375%0.75SS**  cis-145138.417.8-48.40000109.6
3217A26.6Very low29.4Very low84.5 Ų84.5127 Ų12770%0.69875%0.75SS**  trans-0.7168.3135.200000115.3
3218I29.5Very low29.2Very low157 Ų157126 Ų12681%0.80575%0.753SS**  trans132.4119.5156.8-78.8152.9000113.5
3219T31.6Very low29Very low125.5 Ų125.5124.3 Ų124.377%0.7776%0.758SS**  136.2135.862.8-13.40000115.2
3220Q28.5Very low28.6Very low173.5 Ų173.5129.2 Ų129.281%0.81177%0.77SS**  -14.4161.9123.2-84.9-163.67.800114.3
3221P33.5Very low28.6Very low114 Ų114126.2 Ų126.274%0.7477%0.768SS**  cis-120.2-17522.421.31.8000115.3
3222S24.9Very low28.4Very low102 Ų102125.4 Ų125.471%0.71376%0.762SS**  -0.2145.5119.790.80000114.9
3223V31.9Very low28.6Very low138 Ų138127.5 Ų127.584%0.83677%0.768SS**  -159.5141.4108141.90000112.2
3224N26.4Very low28.7Very low151 Ų151126.5 Ų126.581%0.80776%0.762SS**  trans-95.2173.5167.8-99.4-18.3000109.2
3225P33.7Very low28.8Very low111.5 Ų111.5128.4 Ų128.472%0.72476%0.761SS**  cis-143.3-166.71734.2-9.9000115.4
3226S31.1Very low29.1Very low102 Ų102131.2 Ų131.271%0.71376%0.762SS**  trans-55.6164.8154.157.30000113.8
3227P33Very low29.2Very low113.5 Ų113.5130.3 Ų130.374%0.73776%0.756SS**  -152.9-18060.842.9-23000118.6
3228S24.1Very low29.3Very low105 Ų105137.1 Ų137.173%0.73476%0.764SS**  trans-8.4142156.560.40000119.8
3229C24.9Very low29.3Very low131.5 Ų131.5134.2 Ų134.289%0.88976%0.757SS**  -169.7171.3121.6-120.30000113.5
3230K25Very low29.3Very low200.5 Ų200.5132.4 Ų132.487%0.87275%0.747SS**  trans-108.8144-175.1-54.3166.2-179.5173.70112.9
3231S28.9Very low29.5Very low110.5 Ų110.5130.5 Ų130.577%0.77374%0.741SS**  trans176.4162.2135.854.20000111.4
3232S28.1Very low29.6Very low90.5 Ų90.5130.4 Ų130.463%0.63374%0.74SS**  118.1126.159.350.90000114.6
3233E29.1Very low29.9Very low179.5 Ų179.5131.5 Ų131.584%0.83974%0.737SS**  69.1150.1120.1-68.8172.1-164.700116.1
3234T31.3Very low29.9Very low110.5 Ų110.5130.6 Ų130.668%0.67873%0.731SS**  cis-149.3161.14.5-5.80000112.9
3235N29Very low30.1Very low116.5 Ų116.5131 Ų13162%0.62373%0.728SS**  trans17.7152163-58.6-39.4000118.6
3236Y32.1Very low29.9Very low212 Ų212131.2 Ų131.283%0.83173%0.728SS**  cis-130.1127.229.7-70.3-97.9000110.7
3237T30Very low29.8Very low107 Ų107131.6 Ų131.666%0.65673%0.731SS**  50.2140.985.969.30000115
3238R29Very low29.8Very low228.5 Ų228.5131.4 Ų131.486%0.86273%0.732SS**  cis-157.1142.325.3-156.2157.9178.8-168.4-1.6107.6
3239S28.9Very low30.1Very low94.5 Ų94.5132.3 Ų132.366%0.66173%0.733SS**  cis143.1162.248.4-1440000110.4
3240T31Very low30.4Very low89 Ų89135 Ų13555%0.54673%0.729SS.*  cis-173.1129.5-9.6-100.50000108.6
3241I34.3Very low30.6Very low134 Ų134133.2 Ų133.269%0.68772%0.722SS**  61.9154.387-71.6162.5000115.1I3243I3241-I3243 HydrophobicContact CG2-CD1 4.03Å
3242P35.7Very low30.6Very low110.5 Ų110.5133.9 Ų133.972%0.71871%0.713SS**  cis-116.1-167.72.630.7-10.1000113.2
3243I30.5Very low30.6Very low126.5 Ų126.5137 Ų13765%0.64972%0.717SS**  cis139.7153.712.4-97.4167.2000109.8I3241I3241-I3243 HydrophobicContact CG2-CD1 4.03Å
3244T30.8Very low30.6Very low117.5 Ų117.5132.2 Ų132.272%0.72171%0.709SS**  cis-178.1115.10.1-48.80000110.9
3245Q31.1Very low30.6Very low159.5 Ų159.5132.7 Ų132.775%0.74571%0.712SS**  118.6144.9112.5-84.2166.853.500111.7
3246T29Very low30.6Very low116.5 Ų116.5134.1 Ų134.172%0.71572%0.719SS**  cis144147.16.735.80000116.6
3247S30Very low30.5Very low111 Ų111129.8 Ų129.878%0.77672%0.715SS**  121.1158.164.757.70000117.5
3248S32.8Very low30.6Very low109 Ų109133.7 Ų133.776%0.76272%0.723SS**  trans-168.3161.6-130.3590000114.7
3249T30.2Very low30.7Very low123 Ų123129.1 Ų129.176%0.75572%0.715SS**  trans137.5154.1179.461.30000116.7
3250K31Very low30.8Very low188 Ų188132 Ų13282%0.81772%0.721SS**  -178.3162.165.8-109.7164.3-168.91690112.5
3251K29.9Very low30.6Very low164 Ų164132.8 Ų132.871%0.71373%0.73SS**  137.9145.875.7-129-166.5161.5-146.70115.8
3252Q29.2Very low30.3Very low125 Ų125131.7 Ų131.758%0.58473%0.734SS**  trans66.8143.7151.9-77.9174-86.300118.3
3253E27.5Very low30Very low154.5 Ų154.5131.1 Ų131.172%0.72274%0.739SS**  cis-153169.40.2-155.9123.8-117.800112.2
3254A29.5Very low30.1Very low79.5 Ų79.5132 Ų13266%0.65774%0.743SS**  trans41.9133.6153.800000122.7
3255T30.1Very low30Very low121.5 Ų121.5131.9 Ų131.975%0.74575%0.745SS**  131.6148.870.136.90000117.9
3256N29.6Very low29.9Very low144.5 Ų144.5131.3 Ų131.377%0.77375%0.745SS**  trans70125.5156.9-62.9-22.9000120.1
3257T31.2Very low29.9Very low122 Ų122131.1 Ų131.175%0.74875%0.746SS**  -67.4124.57216.60000115.9
3258K31.6Very low29.8Very low190 Ų190131.2 Ų131.283%0.82675%0.747SS**  trans120.4151.6134.7-91.3179.3-179.1179.50117.2
3259L30.5Very low29.8Very low132 Ų132132 Ų13269%0.69175%0.75SS**  -116.7147.2-95-74.2137.8000111
3260I30.9Very low29.6Very low155 Ų155130.8 Ų130.880%0.79575%0.752SS**  trans122.1140.3137.8-83.2167.6000115.1
3261S27.7Very low29.7Very low105 Ų105130.1 Ų130.173%0.73476%0.755SS**  -122.7147-98.9-69.50000112
3262S27.9Very low29.6Very low110.5 Ų110.5127.2 Ų127.277%0.77376%0.755SS**  trans-64.1130.1149.7-59.70000116.2
3263A29.6Very low29.7Very low99 Ų99129.3 Ų129.382%0.81877%0.765SS**  trans-73.1148.6168.800000112.3
3264I31.4Very low29.9Very low144 Ų144128.7 Ų128.774%0.73877%0.767SS**  trans-136.6135.2168.2-80.9163.5000108.8I3266I3264-I3266 HydrophobicContact CG2-CD1 4.3Å; I3264-I3266 HydrophobicContact CG2-CG1 4.08Å; I3264-I3266 PolarHBondContact O-N 2.95Å
3265P29.5Very low29.9Very low116 Ų116132.7 Ų132.775%0.75377%0.772SS**  trans-84.6167.3178.715.7-4.9000111.3
3266I29.7Very low30Very low146.5 Ų146.5134.5 Ų134.575%0.75178%0.776SS**  trans167.6136.3168.5-53.3165.4000110.4I3264I3264-I3266 HydrophobicContact CG2-CD1 4.3Å; I3264-I3266 HydrophobicContact CG2-CG1 4.08Å; I3264-I3266 PolarHBondContact O-N 2.95Å
3267P28.7Very low30Very low113.5 Ų113.5132.5 Ų132.574%0.73777%0.772SS**  -107.7166.2-96.736.1-30.6000114.1
3268S26.5Very low29.8Very low112.5 Ų112.5131.4 Ų131.479%0.78777%0.77SS**  trans-75.6135.1163.2-50.70000111.8A3270S3268-A3270 VanDerWaalsContact C-N 3.33Å; S3268-A3270 PolarHBondContact O-N 3.16Å
3269P33Very low29.8Very low127 Ų127128.4 Ų128.483%0.82577%0.768SS**  trans-90.4110.1164.433.6-30.5000110.9
3270A25.9Very low29.7Very low96.5 Ų96.5128.9 Ų128.980%0.79877%0.771SS**  trans-108.7118.1164.300000108.8S3268S3268-A3270 VanDerWaalsContact C-N 3.33Å; S3268-A3270 PolarHBondContact O-N 3.16Å
3271I33.9Very low29.6Very low173 Ų173127.8 Ų127.889%0.88777%0.771SS**  trans-137.1134.3166.7-82.1164.6000107.2
3272S28.5Very low29.6Very low103 Ų103128.6 Ų128.672%0.7277%0.772SS**  trans-93.4174.5-171.851.20000113.2
3273H31.4Very low29.7Very low169.5 Ų169.5129.6 Ų129.679%0.78577%0.774SS**  trans31.6139.3171.9-77-96.6000113.2
3274D30.5Very low29.7Very low142.5 Ų142.5130 Ų13076%0.76277%0.77SS**  -141.1171.666.6-126.4-39.1000113.7
3275Q29.1Very low29.5Very low164 Ų164128.5 Ų128.577%0.76677%0.768SS**  trans-88.8154.2-168-54.1176.514.800113.8
3276I32.2Very low29.6Very low159.5 Ų159.5129.1 Ų129.182%0.81877%0.77SS**  -179.8124.7120-90.7154.9000111.8
3277S29.7Very low29.4Very low100.5 Ų100.5127.1 Ų127.170%0.70376%0.764SS**  trans4.3129.3154-46.50000119.6
3278S28.6Very low29.5Very low100 Ų100126.2 Ų126.270%0.69976%0.757SS**  135.5158.556.68.70000115.1
3279T31.3Very low29.4Very low127 Ų127125.8 Ų125.878%0.77975%0.754SS**  trans69.1115.2168.963.10000118.7
3280N27.5Very low29.2Very low141.5 Ų141.5125.7 Ų125.776%0.75775%0.751SS**  -82.6137.757.6-78.6-11.5000116.5
3281V29.9Very low29.2Very low133.5 Ų133.5125.7 Ų125.781%0.80975%0.745SS**  trans145.6151.4130.4-178.80000114.1
3282T26.5Very low28.8Very low122 Ų122124.3 Ų124.375%0.74874%0.739SS**  trans154.7115.4174.1-21.10000116
3283T29.9Very low29Very low131.5 Ų131.5126.9 Ų126.981%0.80774%0.744SS**  trans-122.1148.6154.139.10000110.8
3284S30.1Very low29Very low106.5 Ų106.5124.1 Ų124.175%0.74574%0.74SS**  -170.3152.8-122.452.50000109.3
3285T27.7Very low29Very low113 Ų113122.2 Ų122.269%0.69374%0.737SS**  trans-93.8128.9-179.2380000112.3S2407S2407-T3285 WeakPolarHBondContact OG-CB 3.45Å; S2407-T3285 PolarHBondContact OG-OG1 3.24Å
3286T30.3Very low29.3Very low128.5 Ų128.5120.7 Ų120.779%0.78874%0.741SS**  trans-156.8139.7155.218.80000111.2
3287T27.1Very low29.2Very low104 Ų104119.9 Ų119.964%0.63874%0.739SS**  158.297.9123.815.50000113I2409I2409-T3287 HydrophobicContact CG1-CG2 4.23Å; I2409-T3287 HydrophobicContact CG2-CG2 4.23Å
3288T29.2Very low29.3Very low95 Ų95125.1 Ų125.158%0.58375%0.749SS**  trans109128.2159.543.40000112.7I2409I2409-T3288 HydrophobicContact CG2-CG2 4.46Å
3289S25.2Very low29.5Very low103 Ų103125.8 Ų125.872%0.7275%0.749SS**  130.2144.36861.70000115.2
3290V28.6Very low29.5Very low126 Ų126124.7 Ų124.776%0.76475%0.746SS**  trans52.1112.7162.9-1290000121.7
3291S26Very low29.8Very low96 Ų96123.4 Ų123.467%0.67175%0.748SS**  64147120.915.40000124.1
3292N25.8Very low29.9Very low144 Ų144123.1 Ų123.177%0.7775%0.747SS**  trans78132.4160-54.8-20.2000117.9
3293L31.4Very low30.3Very low157 Ų157122.6 Ų122.682%0.82275%0.749SS**  -147.7123.667.4-108.181.8000114.1
3294T32.1Very low30.5Very low112 Ų112122.4 Ų122.469%0.68775%0.747SS**  trans35.6114.3134.962.10000123.6
3295S31Very low30.7Very low102.5 Ų102.5123.6 Ų123.672%0.71775%0.751SS**  47.1142.4118.2-44.90000122.3
3296P35.3Very low31.2Very low131 Ų131123.5 Ų123.585%0.85175%0.751SS**  -130.3154.895.936.3-27.7000115
3297N29.5Very low31.4Very low142.5 Ų142.5125.8 Ų125.876%0.76275%0.753SS**  trans-95.6151.3177.1-67.6-29.2000112
3298F32.4Very low31.4Very low211 Ų211126.4 Ų126.493%0.92576%0.757SS**  trans-135.7165.3153.8-112.5-85.3000110.5
3299V33Very low31.7Very low114.5 Ų114.5129.4 Ų129.469%0.69477%0.768SS**  -133143.7-119.4164.80000113
3300S30.3Very low32.1Very low103.5 Ų103.5129.7 Ų129.772%0.72477%0.77SS**  trans59.6139.8161.3690000118.9
3301S35.3Very low32.1Very low113.5 Ų113.5128.8 Ų128.879%0.79477%0.77SS**  -153.1159.468.6-10.90000108.5
3302T30.9Very low32.5Very low128 Ų128129.3 Ų129.379%0.78577%0.771SS**  -158.2166.3-106.230.80000109.9
3303S34.8Very low32.7Very low112.5 Ų112.5127.4 Ų127.479%0.78777%0.768SS**  trans76.1147.4174.882.40000116.4
3304T34.5Very low32.7Very low126 Ų126125.7 Ų125.777%0.77377%0.769SS**  cis-147.4154.1-5.5280000108.6
3305T35Very low32.8Very low132.5 Ų132.5124.3 Ų124.381%0.81377%0.769SS**  trans147.6164.8136.944.70000115.2
3306P37.5Very low32.8Very low109.5 Ų109.5127.1 Ų127.171%0.71178%0.776SS**  -131.5174.1-106.142.9-31.2000116.2
3307Q33.9Very low32.6Very low178 Ų178125.8 Ų125.883%0.83277%0.77SS**  trans-146.9131149.8-69.4-174.23.900107.7
3308T28.8Very low32.6Very low117 Ų117130.3 Ų130.372%0.71878%0.777SS**  67.2114.550.467.30000115
3309I34.5Very low32.4Very low157 Ų157128.7 Ų128.781%0.80577%0.772SS**  -163138.5106.8-95.7162.2000112.9
3310S32.8Very low32.4Very low110 Ų110128.9 Ų128.977%0.76978%0.775SS**  trans38.1129.1155.9110000125.1
3311S28.8Very low32.5Very low107.5 Ų107.5131 Ų13175%0.75278%0.778SS**  trans-89.8-174.8146.5640000109.9
3312P35.7Very low32.2Very low106.5 Ų106.5136.5 Ų136.569%0.69278%0.783SS**  cis-155.8166.14844.1-22.4000120.8
3313S28.6Very low32.1Very low103 Ų103134.4 Ų134.472%0.7278%0.779SS**  trans61.9139.3137.366.30000125.4
3314S32.7Very low31.9Very low121 Ų121137.6 Ų137.685%0.84678%0.782SS**  trans93.4149.6151.778.60000119
3315A32.9Very low31.7Very low82.5 Ų82.5137.5 Ų137.568%0.68278%0.781SS**  cis-166.5141.8-33.600000110.9
3316N30.9Very low31.5Very low162 Ų162138.1 Ų138.187%0.86678%0.775SS**  trans58.3133.6163-65.4-24.9000119.2
3317S32.2Very low31.1Very low104 Ų104140.1 Ų140.173%0.72778%0.78SS**  cis-166.5130.645.854.70000113.9
3318R29Very low30.7Very low237 Ų237135.9 Ų135.989%0.89478%0.775SS**  trans33.4111.6150.2-63.1173.3178.4176.6-2.4119.6
3319H29.3Very low30.7Very low178 Ų178135.1 Ų135.182%0.82478%0.775SS**  trans-148.3140.2131.7-91.7-87.4000108.8N3321H3319-N3321 PolarHBondContact O-N 3.08Å
3320P33Very low30.5Very low118 Ų118132.7 Ų132.777%0.76677%0.767SS**  trans-91.494.1-179.534.3-31.4000111.7
3321N31.6Very low30.4Very low148 Ų148137.3 Ų137.379%0.79177%0.774SS**  trans-82.3133.8167-74.6-0.1000110H3319 A3323H3319-N3321 PolarHBondContact O-N 3.08Å; N3321-A3323 PolarHBondContact O-N 3.43Å
3322Y29.1Very low30.6Very low227.5 Ų227.5136.5 Ų136.589%0.89277%0.768SS**  trans-63.6110.3174.9-78-98.1000110.6H3324Y3322-H3324 PolarHBondContact O-N 2.71Å; Y3322-H3324 VanDerWaalsContact O-N 3.12Å
3323A28.1Very low30.5Very low85 Ų85136.8 Ų136.870%0.70276%0.76SS**  trans-85.6119.4-176.600000111.9N3321 V3325N3321-A3323 PolarHBondContact O-N 3.43Å; A3323-V3325 PolarHBondContact O-N 3.36Å
3324H31.6Very low31Very low180.5 Ų180.5135.6 Ų135.684%0.83675%0.749SS**  trans-55.8114.8165.5-83.5-88.1000110.5Y3322 M3326Y3322-H3324 PolarHBondContact O-N 2.71Å; Y3322-H3324 VanDerWaalsContact O-N 3.12Å; H3324-M3326 VanDerWaalsContact C-N 3.26Å; H3324-M3326 PolarHBondContact O-N 2.89Å
3325V29.8Very low31.3Very low124 Ų124133.4 Ų133.475%0.75274%0.737SS**  trans-76.875.4172.5-177.60000109.4A3323 L3327A3323-V3325 PolarHBondContact O-N 3.36Å; V3325-L3327 VanDerWaalsContact C-N 3.29Å; V3325-L3327 HydrophobicContact CG1-CG 4.05Å; V3325-L3327 PolarHBondContact O-N 3.16Å
3326M30.2Very low31.9Very low143.5 Ų143.5136.7 Ų136.771%0.70774%0.738SS**  trans-71.887.7165.1-92-167.2-135.700109.6H3324 A3328H3324-M3326 VanDerWaalsContact C-N 3.26Å; H3324-M3326 PolarHBondContact O-N 2.89Å; M3326-A3328 PolarHBondContact O-N 3.33Å; M3326-A3328 VanDerWaalsContact O-N 3.13Å
3327L29.2Very low32.9Very low152 Ų152130.3 Ų130.380%0.79671%0.706SS**  trans-71.5104.2162.8-77.5174.7000109.1V3325 S3329V3325-L3327 VanDerWaalsContact C-N 3.29Å; V3325-L3327 HydrophobicContact CG1-CG 4.05Å; V3325-L3327 PolarHBondContact O-N 3.16Å; L3327-S3329 PolarHBondContact O-N 3.45Å; L3327-S3329 VanDerWaalsContact O-N 3.12Å
3328A26.7Very low34.1Very low90 Ų90127.3 Ų127.374%0.74468%0.681SS**  trans-68.7105.4173.200000109.7M3326 T3330M3326-A3328 PolarHBondContact O-N 3.33Å; M3326-A3328 VanDerWaalsContact O-N 3.13Å; A3328-T3330 PolarHBondContact O-N 3.47Å; A3328-T3330 VanDerWaalsContact O-N 3.1Å
3329S27.1Very low35.7Very low100.5 Ų100.5118.7 Ų118.770%0.70366%0.66SS**  trans-63.9107.3175.134.50000110.5L3327L3327-S3329 PolarHBondContact O-N 3.45Å; L3327-S3329 VanDerWaalsContact O-N 3.12Å
3330T30.3Very low37.8Very low105.5 Ų105.5112.6 Ų112.665%0.64763%0.633SS**  trans-62.3156.7174.646.70000111.4A3328 S3332A3328-T3330 PolarHBondContact O-N 3.47Å; A3328-T3330 VanDerWaalsContact O-N 3.1Å; T3330-S3332 PolarHBondContact O-N 3.4Å
3331F32.2Very low40.1Very low208 Ų208107 Ų10791%0.91260%0.597SS**THydrogen-bonded Turntrans-60.79.1-161.3-122-100.8000118.2
3332S31.6Very low42.5Very low89 Ų89101.5 Ų101.562%0.62257%0.567SS**THydrogen-bonded Turntrans-99.5-18.3-174.450.20000115.5T3330 T3334T3330-S3332 PolarHBondContact O-N 3.4Å; S3332-T3334 PolarHBondContact O-N 3.43Å
3333H34.1Very low45.1Very low114 Ų11497.4 Ų97.453%0.52856%0.556SS.*THydrogen-bonded Turntrans-78.4-12.6-171.3-95.2-94.9000116A3335 H3336H3333-A3335 VanDerWaalsContact C-N 3.31Å; H3333-A3335 PolarHBondContact O-N 3Å; H3333-H3336 PolarHBondContact O-N 2.8Å
3334T38.4Very low47.8Very low78.5 Ų78.596.1 Ų96.148%0.48253%0.534SS..Hα-helixtrans-62-31.2-167.548.90000114.8S3332 H3336 S3337 E3338S3332-T3334 PolarHBondContact O-N 3.43Å; T3334-H3336 VanDerWaalsContact C-N 3.33Å; T3334-H3336 PolarHBondContact O-N 2.99Å; T3334-S3337 PolarHBondContact O-N 3.22Å; T3334-S3337 PolarHBondContact O-OG 2.95Å; T3334-E3338 PolarHBondContact O-N 3.33Å
3335A39.8Very low50.5Low73 Ų7387.8 Ų87.860%0.60350%0.495SS*.Hα-helixtrans-64.7-34.1-17600000113.6H3333H3333-A3335 VanDerWaalsContact C-N 3.31Å; H3333-A3335 PolarHBondContact O-N 3Å
3336H46Very low53.1Low153.5 Ų153.585.5 Ų85.571%0.71148%0.483SS*.Hα-helixtrans-77.3-38.8179.5-82.7-71.8000112.5H3333 T3334 E3338 A3339H3333-H3336 PolarHBondContact O-N 2.8Å; T3334-H3336 VanDerWaalsContact C-N 3.33Å; T3334-H3336 PolarHBondContact O-N 2.99Å; H3336-E3338 VanDerWaalsContact C-N 3.27Å; H3336-E3338 PolarHBondContact O-N 3.34Å; H3336-A3339 WeakPolarHBondContact O-CB 3.35Å; H3336-A3339 PolarHBondContact O-N 2.78Å; H3336-A3339 VanDerWaalsContact O-N 3.12Å
3337S51.5Low55.9Low27.5 Ų27.580.8 Ų80.819%0.19246%0.457CS..Hα-helixtrans-64.3-26.1178.445.70000113.9N3118 T3334 A3339N3118-S3337 PolarHBondContact OD1-O 2.98Å; N3118-S3337 VanDerWaalsContact OD1-O 3.11Å; T3334-S3337 PolarHBondContact O-N 3.22Å; T3334-S3337 PolarHBondContact O-OG 2.95Å; S3337-A3339 VanDerWaalsContact C-N 3.35Å
3338E57.8Low58.6Low40.5 Ų40.573.7 Ų73.719%0.18942%0.42CS..Hα-helixtrans-72.8-31174.1-73.3-175.6-153.400112.9T3334 H3336 I3340 I3341 L3342 K3349 N3400T3334-E3338 PolarHBondContact O-N 3.33Å; H3336-E3338 VanDerWaalsContact C-N 3.27Å; H3336-E3338 PolarHBondContact O-N 3.34Å; E3338-I3340 VanDerWaalsContact C-N 3.33Å; E3338-I3340 PolarHBondContact O-N 2.92Å; E3338-I3341 WeakPolarHBondContact O-CG2 3.33Å; E3338-L3342 HydrophobicContact CB-CD1 4.18Å; E3338-L3342 WeakPolarHBondContact O-CB 3.4Å; E3338-L3342 VanDerWaalsContact O-CD1 3.24Å; E3338-L3342 WeakPolarHBondContact O-CD1 3.11Å; E3338-L3342 WeakPolarHBondContact O-CG 3.33Å; E3338-L3342 PolarHBondContact O-N 3.46Å; E3338-K3349 WeakPolarHBondContact OE2-CE 3.29Å; E3338-K3349 IonicContact OE2-NZ 3.36Å; E3338-K3349 PolarHBondContact OE2-NZ 3.35Å; E3338-N3400 PolarHBondContact OE1-ND2 3.31Å
3339A62Low61.2Low55.5 Ų55.574.8 Ų74.846%0.45941%0.408SS..Hα-helixtrans-63.5-36.8-167.500000113.2H3336 S3337 Q3343H3336-A3339 WeakPolarHBondContact O-CB 3.35Å; H3336-A3339 PolarHBondContact O-N 2.78Å; H3336-A3339 VanDerWaalsContact O-N 3.12Å; S3337-A3339 VanDerWaalsContact C-N 3.35Å; A3339-Q3343 PolarHBondContact O-N 3.28Å; A3339-Q3343 VanDerWaalsContact O-N 3.09Å
3340I73.4Confident63.4Low50 Ų5073.6 Ų73.626%0.25640%0.399SS..Hα-helixtrans-84.5-42.8-169-56170.9000111.8S3117 E3338 L3342 Q3343 Y3344S3117-I3340 WeakPolarHBondContact O-CD1 3.31Å; E3338-I3340 VanDerWaalsContact C-N 3.33Å; E3338-I3340 PolarHBondContact O-N 2.92Å; I3340-L3342 PolarHBondContact O-N 3.05Å; I3340-Q3343 VanDerWaalsContact O-CB 3.31Å; I3340-Q3343 WeakPolarHBondContact O-CB 3.32Å; I3340-Q3343 PolarHBondContact O-N 3.2Å; I3340-Y3344 HydrophobicContact CG2-CD2 4.19Å; I3340-Y3344 HydrophobicContact CG2-CE2 3.87Å; I3340-Y3344 VanDerWaalsContact O-CD2 3.31Å; I3340-Y3344 WeakPolarHBondContact O-CD2 3.45Å; I3340-Y3344 PolarHBondContact O-N 3.19Å
3341I81.8Confident65.5Low0.5 Ų0.570.3 Ų70.30%0.00338%0.379CS..Hα-helixtrans-58.4-35.6170.1-179.6167.7000111.3E3338 Q3343 Y3344 L3345 L3348 P3396 I3397 P3398 L3401E3338-I3341 WeakPolarHBondContact O-CG2 3.33Å; I3341-Q3343 VanDerWaalsContact C-N 3.33Å; I3341-Q3343 PolarHBondContact O-N 2.68Å; I3341-Y3344 PolarHBondContact O-N 3.08Å; I3341-L3345 HydrophobicContact CD1-CD1 4.49Å; I3341-L3345 HydrophobicContact CG1-CD1 4.28Å; I3341-L3345 WeakPolarHBondContact O-CA 3.42Å; I3341-L3345 WeakPolarHBondContact O-CB 3.43Å; I3341-L3345 PolarHBondContact O-N 3.28Å; I3341-L3348 HydrophobicContact CD1-CD2 3.92Å; I3341-L3348 HydrophobicContact CG1-CD2 4.4Å; I3341-P3396 WeakPolarHBondContact CD1-O 3.3Å; I3341-I3397 HydrophobicContact CD1-CB 4.2Å; I3341-I3397 HydrophobicContact CD1-CG1 3.73Å; I3341-I3397 HydrophobicContact CD1-CG2 4.36Å; I3341-P3398 HydrophobicContact CG2-CG 4.48Å; I3341-L3401 HydrophobicContact CD1-CD1 4.45Å; I3341-L3401 HydrophobicContact CG2-CD1 4.19Å
3342L81Confident67.3Low32 Ų3262.3 Ų62.317%0.16835%0.348CS..Hα-helixtrans-74.8-19.4176.9-63.8169.6000113.7E3338 I3340 P3346 L3348 K3349E3338-L3342 HydrophobicContact CB-CD1 4.18Å; E3338-L3342 WeakPolarHBondContact O-CB 3.4Å; E3338-L3342 VanDerWaalsContact O-CD1 3.24Å; E3338-L3342 WeakPolarHBondContact O-CD1 3.11Å; E3338-L3342 WeakPolarHBondContact O-CG 3.33Å; E3338-L3342 PolarHBondContact O-N 3.46Å; I3340-L3342 PolarHBondContact O-N 3.05Å; L3342-P3346 WeakPolarHBondContact O-CA 3.41Å; L3342-P3346 VanDerWaalsContact O-CB 3.32Å; L3342-P3346 WeakPolarHBondContact O-CB 3.36Å; L3342-P3346 WeakPolarHBondContact O-CD 3.28Å; L3342-L3348 HydrophobicContact CD2-CB 4.46Å; L3342-K3349 HydrophobicContact CD1-CD 3.69Å; L3342-K3349 HydrophobicContact CD1-CG 4.47Å; L3342-K3349 HydrophobicContact CD2-CB 4.27Å; L3342-K3349 HydrophobicContact CD2-CD 3.94Å; L3342-K3349 HydrophobicContact CD2-CG 3.81Å; L3342-K3349 HydrophobicContact CG-CD 4.49Å
3343Q84.8Confident69Low142.5 Ų142.561.5 Ų61.567%0.66634%0.341SS*.Hα-helixtrans-68.9-40.6170.7-174.7-178.6-2.800111.2A3339 I3340 I3341A3339-Q3343 PolarHBondContact O-N 3.28Å; A3339-Q3343 VanDerWaalsContact O-N 3.09Å; I3340-Q3343 VanDerWaalsContact O-CB 3.31Å; I3340-Q3343 WeakPolarHBondContact O-CB 3.32Å; I3340-Q3343 PolarHBondContact O-N 3.2Å; I3341-Q3343 VanDerWaalsContact C-N 3.33Å; I3341-Q3343 PolarHBondContact O-N 2.68Å
3344Y84.1Confident70.4Confident58.5 Ų58.558.6 Ų58.623%0.22933%0.333CS..Hα-helixtrans-86.4-36.3179.2-67.2-76.6000113.2L2990 P2991 L2994 L3114 I3340 I3341 P3346L2990-Y3344 HydrophobicContact CB-CE1 3.92Å; L2990-Y3344 HydrophobicContact CD1-CE1 4.46Å; P2991-Y3344 HydrophobicContact CG-CD1 4.38Å; P2991-Y3344 HydrophobicContact CG-CE1 4.16Å; L2994-Y3344 HydrophobicContact CD1-CD1 4.07Å; L2994-Y3344 HydrophobicContact CD1-CG 4.26Å; L3114-Y3344 HydrophobicContact CD2-CD2 3.57Å; L3114-Y3344 HydrophobicContact CD2-CE2 4.09Å; L3114-Y3344 HydrophobicContact CD2-CG 4.25Å; I3340-Y3344 HydrophobicContact CG2-CD2 4.19Å; I3340-Y3344 HydrophobicContact CG2-CE2 3.87Å; I3340-Y3344 VanDerWaalsContact O-CD2 3.31Å; I3340-Y3344 WeakPolarHBondContact O-CD2 3.45Å; I3340-Y3344 PolarHBondContact O-N 3.19Å; I3341-Y3344 PolarHBondContact O-N 3.08Å; Y3344-P3346 VanDerWaalsContact C-CD 3.4Å; Y3344-P3346 WeakPolarHBondContact O-CD 3.35Å
3345L88.2Confident71.5Confident5.5 Ų5.560.2 Ų60.23%0.02935%0.347CS..  trans-125.158.3-176.1-53.7178.9000111.7L2994 I3341 W3347 L3348 L3375L2994-L3345 HydrophobicContact CD1-CD2 4.41Å; L2994-L3345 HydrophobicContact CD2-CD2 4.34Å; I3341-L3345 HydrophobicContact CD1-CD1 4.49Å; I3341-L3345 HydrophobicContact CG1-CD1 4.28Å; I3341-L3345 WeakPolarHBondContact O-CA 3.42Å; I3341-L3345 WeakPolarHBondContact O-CB 3.43Å; I3341-L3345 PolarHBondContact O-N 3.28Å; L3345-W3347 HydrophobicContact CB-CZ2 4.36Å; L3345-W3347 HydrophobicContact CD1-CZ2 4.49Å; L3345-W3347 HydrophobicContact CD2-CZ2 3.81Å; L3345-W3347 HydrophobicContact CG-CZ2 4.45Å; L3345-W3347 PolarHBondContact O-N 3.28Å; L3345-W3347 VanDerWaalsContact O-N 3.1Å; L3345-L3348 VanDerWaalsContact O-CB 3.27Å; L3345-L3348 WeakPolarHBondContact O-CB 3.38Å; L3345-L3348 PolarHBondContact O-N 2.86Å; L3345-L3375 HydrophobicContact CD1-CD2 4.24Å
3346P85.4Confident72.5Confident76 Ų7664 Ų6449%0.49435%0.353SS..G310 helixtrans-61-26.1-174.824.1-34.9000113.5L3342 Y3344 L3348 K3349 S3350L3342-P3346 WeakPolarHBondContact O-CA 3.41Å; L3342-P3346 VanDerWaalsContact O-CB 3.32Å; L3342-P3346 WeakPolarHBondContact O-CB 3.36Å; L3342-P3346 WeakPolarHBondContact O-CD 3.28Å; Y3344-P3346 VanDerWaalsContact C-CD 3.4Å; Y3344-P3346 WeakPolarHBondContact O-CD 3.35Å; P3346-L3348 PolarHBondContact O-N 2.67Å; P3346-L3348 VanDerWaalsContact O-N 3.16Å; P3346-K3349 PolarHBondContact O-N 3.43Å; P3346-S3350 PolarHBondContact O-OG 3.25Å
3347W88.8Confident73.7Confident45 Ų4557.6 Ų57.617%0.1732%0.324CS..G310 helixtrans-63.2-15.4175.953.9-105.2000114L3345 K3349 S3350 R3368 L3372 L3408L3345-W3347 HydrophobicContact CB-CZ2 4.36Å; L3345-W3347 HydrophobicContact CD1-CZ2 4.49Å; L3345-W3347 HydrophobicContact CD2-CZ2 3.81Å; L3345-W3347 HydrophobicContact CG-CZ2 4.45Å; L3345-W3347 PolarHBondContact O-N 3.28Å; L3345-W3347 VanDerWaalsContact O-N 3.1Å; W3347-K3349 VanDerWaalsContact C-N 3.27Å; W3347-K3349 PolarHBondContact O-N 3.08Å; W3347-S3350 WeakPolarHBondContact CA-OG 3.44Å; W3347-S3350 CarbonylContact O-C 3.48Å; W3347-S3350 PolarHBondContact O-N 3.16Å; W3347-R3368 VanDerWaalsContact CB-CZ 3.5Å; W3347-R3368 HydrophobicContact CD2-CB 4.35Å; W3347-R3368 HydrophobicContact CD2-CG 3.7Å; W3347-R3368 HydrophobicContact CE3-CB 4.03Å; W3347-R3368 HydrophobicContact CE3-CG 3.8Å; W3347-R3368 HydrophobicContact CG-CG 4.25Å; W3347-R3368 HydrophobicContact CH2-CB 3.68Å; W3347-R3368 HydrophobicContact CH2-CG 4.05Å; W3347-R3368 HydrophobicContact CZ2-CB 3.99Å; W3347-R3368 HydrophobicContact CZ2-CG 3.93Å; W3347-R3368 HydrophobicContact CZ3-CB 3.71Å; W3347-R3368 HydrophobicContact CZ3-CG 3.99Å; W3347-L3372 HydrophobicContact CH2-CD1 4.44Å; W3347-L3408 HydrophobicContact CZ3-CD2 4.15Å
3348L85.5Confident75Confident1.5 Ų1.557.3 Ų57.31%0.00833%0.325CS..G310 helixtrans-67.3-25.9-179.5-17056.5000112.1I3341 L3342 L3345 P3346 L3401 S3404 V3405I3341-L3348 HydrophobicContact CD1-CD2 3.92Å; I3341-L3348 HydrophobicContact CG1-CD2 4.4Å; L3342-L3348 HydrophobicContact CD2-CB 4.46Å; L3345-L3348 VanDerWaalsContact O-CB 3.27Å; L3345-L3348 WeakPolarHBondContact O-CB 3.38Å; L3345-L3348 PolarHBondContact O-N 2.86Å; P3346-L3348 PolarHBondContact O-N 2.67Å; P3346-L3348 VanDerWaalsContact O-N 3.16Å; L3348-L3401 HydrophobicContact CD2-CD1 3.74Å; L3348-L3401 HydrophobicContact CG-CD1 4.49Å; L3348-S3404 WeakPolarHBondContact O-CB 3.3Å; L3348-S3404 PolarHBondContact O-OG 3.47Å; L3348-V3405 HydrophobicContact CD1-CG2 4.17Å
3349K80.3Confident76.1Confident114.5 Ų114.558.4 Ų58.450%0.49834%0.336SS..G310 helixtrans-93.5-0.9169.7-82.6-176.6179.3175.20114.4E3338 L3342 P3346 W3347E3338-K3349 WeakPolarHBondContact OE2-CE 3.29Å; E3338-K3349 IonicContact OE2-NZ 3.36Å; E3338-K3349 PolarHBondContact OE2-NZ 3.35Å; L3342-K3349 HydrophobicContact CD1-CD 3.69Å; L3342-K3349 HydrophobicContact CD1-CG 4.47Å; L3342-K3349 HydrophobicContact CD2-CB 4.27Å; L3342-K3349 HydrophobicContact CD2-CD 3.94Å; L3342-K3349 HydrophobicContact CD2-CG 3.81Å; L3342-K3349 HydrophobicContact CG-CD 4.49Å; P3346-K3349 PolarHBondContact O-N 3.43Å; W3347-K3349 VanDerWaalsContact C-N 3.27Å; W3347-K3349 PolarHBondContact O-N 3.08Å
3350S74.4Confident77.2Confident74 Ų7463.8 Ų63.852%0.51735%0.349SS..  trans-133.869.8-17548.30000112.3P3346 W3347 P3352 R3368P3346-S3350 PolarHBondContact O-OG 3.25Å; W3347-S3350 WeakPolarHBondContact CA-OG 3.44Å; W3347-S3350 CarbonylContact O-C 3.48Å; W3347-S3350 PolarHBondContact O-N 3.16Å; S3350-P3352 WeakPolarHBondContact O-CD 3.36Å; S3350-R3368 PolarHBondContact O-NH1 3.35Å
3351T75.1Confident77.8Confident37.5 Ų37.564.8 Ų64.823%0.2336%0.355CS..PPolyproline II helixtrans-74.7124.6168.7-56.10000109.9M3365 A3411T3351-M3365 HydrophobicContact CG2-SD 4.15Å; T3351-A3411 HydrophobicContact CG2-CB 3.97Å
3352P68.8Low78Confident38.5 Ų38.564.7 Ų64.725%0.2536%0.355CS..PPolyproline II helixtrans-59.1139.5173.5-24.134000112.2S3350 S3354 L3357 M3365S3350-P3352 WeakPolarHBondContact O-CD 3.36Å; P3352-S3354 PolarHBondContact O-N 2.9Å; P3352-L3357 HydrophobicContact CB-CD1 4.41Å; P3352-M3365 HydrophobicContact CG-SD 4.34Å
3353P67.2Low78.3Confident72.5 Ų72.566.7 Ų66.747%0.47137%0.365SS..PPolyproline II helixtrans-67.4133.9176.228.3-33.9000110.7S3355 Q3356P3353-S3355 PolarHBondContact O-N 3Å; P3353-Q3356 PolarHBondContact O-N 3.19Å
3354S64Low78.5Confident53 Ų5363.3 Ų63.337%0.37135%0.35SS..G310 helixtrans-50.7-33.1-174.6-49.20000114.5P3352 Q3356 L3357 S3414P3352-S3354 PolarHBondContact O-N 2.9Å; S3354-Q3356 PolarHBondContact O-N 3.43Å; S3354-L3357 WeakPolarHBondContact O-CB 3.36Å; S3354-L3357 PolarHBondContact O-N 2.95Å; S3354-S3414 WeakPolarHBondContact CB-OG 3.28Å; S3354-S3414 PolarHBondContact OG-OG 2.81Å
3355S62Low78.7Confident112 Ų11260.5 Ų60.578%0.78334%0.34SS*.G310 helixtrans-69.8-5.7-177.654.10000115.2P3353P3353-S3355 PolarHBondContact O-N 3Å
3356Q60.8Low78.8Confident154.5 Ų154.560.5 Ų60.572%0.72234%0.34SS*.G310 helixtrans-120.910.8177.9-66-176.5-18.500112.7P3353 S3354 G3358P3353-Q3356 PolarHBondContact O-N 3.19Å; S3354-Q3356 PolarHBondContact O-N 3.43Å; Q3356-G3358 PolarHBondContact O-N 3.19Å; Q3356-G3358 VanDerWaalsContact O-N 3.08Å
3357L70.3Confident79.1Confident17.5 Ų17.560.6 Ų60.69%0.09233%0.334CS..  trans-80.594.3-165.6-166.474.1000112.8P3352 S3354 D3361 F3362 M3365P3352-L3357 HydrophobicContact CB-CD1 4.41Å; S3354-L3357 WeakPolarHBondContact O-CB 3.36Å; S3354-L3357 PolarHBondContact O-N 2.95Å; L3357-D3361 HydrophobicContact CD1-CB 3.68Å; L3357-D3361 HydrophobicContact CG-CB 4.47Å; L3357-F3362 HydrophobicContact CD2-CB 4.11Å; L3357-F3362 HydrophobicContact CD2-CD2 3.66Å; L3357-F3362 HydrophobicContact CD2-CG 4.34Å; L3357-F3362 HydrophobicContact CG-CB 4.19Å; L3357-M3365 HydrophobicContact CD1-CE 3.37Å; L3357-M3365 HydrophobicContact CD1-SD 4.06Å; L3357-M3365 HydrophobicContact CD2-CE 3.4Å; L3357-M3365 VanDerWaalsContact CD2-CE 3.4Å; L3357-M3365 HydrophobicContact CG-CE 4.03Å
3358G78.8Confident79.2Confident22 Ų2260.7 Ų60.723%0.22733%0.334CS..  trans-67.8163.9172.500000112.9Q3356 K3360 D3361 F3362Q3356-G3358 PolarHBondContact O-N 3.19Å; Q3356-G3358 VanDerWaalsContact O-N 3.08Å; G3358-K3360 PolarHBondContact O-N 2.69Å; G3358-K3360 VanDerWaalsContact O-N 3.13Å; G3358-D3361 PolarHBondContact N-OD2 3.23Å; G3358-D3361 PolarHBondContact O-N 3.02Å; G3358-D3361 VanDerWaalsContact O-N 3.1Å; G3358-F3362 PolarHBondContact O-N 3.34Å
3359P82.2Confident79.6Confident63 Ų6360.6 Ų60.641%0.40933%0.333SS..Hα-helixtrans-58.2-29.7-179.9-22.730.6000113.9L3363P3359-L3363 WeakPolarHBondContact O-CG 3.41Å; P3359-L3363 PolarHBondContact O-N 3.33Å
3360K83.9Confident80.2Confident169 Ų16956.1 Ų56.174%0.73531%0.313SS*.Hα-helixtrans-70-47.8175.5-66.3-177.1178.9-1800111.3G3358 F3362 L3363 I3364G3358-K3360 PolarHBondContact O-N 2.69Å; G3358-K3360 VanDerWaalsContact O-N 3.13Å; K3360-F3362 VanDerWaalsContact C-N 3.32Å; K3360-F3362 PolarHBondContact O-N 3.02Å; K3360-L3363 PolarHBondContact O-N 3.24Å; K3360-I3364 WeakPolarHBondContact O-CG1 3.36Å; K3360-I3364 PolarHBondContact O-N 2.91Å
3361D85.4Confident81.1Confident70.5 Ų70.552.9 Ų52.938%0.37729%0.291SS..Hα-helixtrans-66.9-35.8-179.4-49.8-75.2000111.4L3357 G3358 I3364 M3365L3357-D3361 HydrophobicContact CD1-CB 3.68Å; L3357-D3361 HydrophobicContact CG-CB 4.47Å; G3358-D3361 PolarHBondContact N-OD2 3.23Å; G3358-D3361 PolarHBondContact O-N 3.02Å; G3358-D3361 VanDerWaalsContact O-N 3.1Å; D3361-I3364 PolarHBondContact O-N 3.33Å; D3361-M3365 WeakPolarHBondContact O-CG 3.46Å; D3361-M3365 PolarHBondContact O-N 3.31Å
3362F87.4Confident82Confident0 Ų051.2 Ų51.20%028%0.28CS..Hα-helixtrans-56.6-52.7169.4-172.6-78.8000111.1L3357 G3358 K3360 I3364 M3365 V3366 L3412 F3416 Q3419 V3426 S3429L3357-F3362 HydrophobicContact CD2-CB 4.11Å; L3357-F3362 HydrophobicContact CD2-CD2 3.66Å; L3357-F3362 HydrophobicContact CD2-CG 4.34Å; L3357-F3362 HydrophobicContact CG-CB 4.19Å; G3358-F3362 PolarHBondContact O-N 3.34Å; K3360-F3362 VanDerWaalsContact C-N 3.32Å; K3360-F3362 PolarHBondContact O-N 3.02Å; F3362-I3364 VanDerWaalsContact C-N 3.33Å; F3362-I3364 PolarHBondContact O-N 3Å; F3362-M3365 PolarHBondContact O-N 3.04Å; F3362-M3365 VanDerWaalsContact O-N 3.11Å; F3362-V3366 HydrophobicContact CD1-CG2 3.85Å; F3362-V3366 HydrophobicContact CE1-CG2 3.51Å; F3362-V3366 VanDerWaalsContact CE1-CG2 3.48Å; F3362-V3366 HydrophobicContact CZ-CG2 4.33Å; F3362-V3366 WeakPolarHBondContact O-CG2 3.29Å; F3362-V3366 PolarHBondContact O-N 2.96Å; F3362-L3412 HydrophobicContact CD1-CD2 4.24Å; F3362-L3412 HydrophobicContact CD2-CD2 3.99Å; F3362-L3412 HydrophobicContact CE1-CD2 4.02Å; F3362-L3412 HydrophobicContact CE2-CD2 3.77Å; F3362-L3412 HydrophobicContact CG-CD2 4.21Å; F3362-L3412 HydrophobicContact CZ-CD2 3.78Å; F3362-F3416 HydrophobicContact CZ-CD2 4.45Å; F3362-Q3419 HydrophobicContact CB-CG 4.36Å; F3362-Q3419 HydrophobicContact CD2-CB 4.16Å; F3362-Q3419 HydrophobicContact CD2-CG 3.79Å; F3362-Q3419 HydrophobicContact CE2-CB 4.33Å; F3362-Q3419 HydrophobicContact CE2-CG 4.35Å; F3362-Q3419 HydrophobicContact CG-CB 4.38Å; F3362-Q3419 HydrophobicContact CG-CG 4.09Å; F3362-V3426 HydrophobicContact CD1-CG1 4.27Å; F3362-V3426 HydrophobicContact CD1-CG2 4.16Å; F3362-V3426 HydrophobicContact CE1-CB 4.36Å; F3362-V3426 HydrophobicContact CE1-CG1 3.66Å; F3362-V3426 HydrophobicContact CE1-CG2 4.2Å; F3362-V3426 HydrophobicContact CZ-CG1 3.96Å; F3362-S3429 WeakPolarHBondContact CZ-OG 3.47Å
3363L87.6Confident83.2Confident73 Ų7349.5 Ų49.538%0.38227%0.269SS..Hα-helixtrans-62.2-37.7179.1-71.4172.5000112.7P3359 K3360 M3365 V3366 E3367 T3425 V3426P3359-L3363 WeakPolarHBondContact O-CG 3.41Å; P3359-L3363 PolarHBondContact O-N 3.33Å; K3360-L3363 PolarHBondContact O-N 3.24Å; L3363-M3365 VanDerWaalsContact C-N 3.32Å; L3363-M3365 PolarHBondContact O-N 2.96Å; L3363-V3366 PolarHBondContact O-N 3.08Å; L3363-E3367 PolarHBondContact O-N 3.1Å; L3363-T3425 HydrophobicContact CD2-CG2 3.94Å; L3363-V3426 HydrophobicContact CD2-CG2 4.24Å
3364I88.8Confident84.6Confident71.5 Ų71.547 Ų4737%0.36725%0.251SS..Hα-helixtrans-62.2-39.2173.3-69.2165000110.9K3360 D3361 F3362 E3367 R3368K3360-I3364 WeakPolarHBondContact O-CG1 3.36Å; K3360-I3364 PolarHBondContact O-N 2.91Å; D3361-I3364 PolarHBondContact O-N 3.33Å; F3362-I3364 VanDerWaalsContact C-N 3.33Å; F3362-I3364 PolarHBondContact O-N 3Å; I3364-E3367 PolarHBondContact O-N 2.84Å; I3364-R3368 VanDerWaalsContact O-CG 3.31Å; I3364-R3368 WeakPolarHBondContact O-CG 3.26Å; I3364-R3368 PolarHBondContact O-N 3.11Å
3365M88.5Confident86Confident0 Ų044.7 Ų44.70%023%0.234CC..Hα-helixtrans-69.9-33.6174.2-69.3-160.5-45.700113T3351 P3352 L3357 D3361 F3362 L3363 E3367 R3368 V3369 L3408 A3411 L3412T3351-M3365 HydrophobicContact CG2-SD 4.15Å; P3352-M3365 HydrophobicContact CG-SD 4.34Å; L3357-M3365 HydrophobicContact CD1-CE 3.37Å; L3357-M3365 HydrophobicContact CD1-SD 4.06Å; L3357-M3365 HydrophobicContact CD2-CE 3.4Å; L3357-M3365 VanDerWaalsContact CD2-CE 3.4Å; L3357-M3365 HydrophobicContact CG-CE 4.03Å; D3361-M3365 WeakPolarHBondContact O-CG 3.46Å; D3361-M3365 PolarHBondContact O-N 3.31Å; F3362-M3365 PolarHBondContact O-N 3.04Å; F3362-M3365 VanDerWaalsContact O-N 3.11Å; L3363-M3365 VanDerWaalsContact C-N 3.32Å; L3363-M3365 PolarHBondContact O-N 2.96Å; M3365-E3367 VanDerWaalsContact C-N 3.34Å; M3365-R3368 PolarHBondContact O-N 3.03Å; M3365-V3369 PolarHBondContact O-N 3.37Å; M3365-L3408 HydrophobicContact CB-CD1 3.83Å; M3365-L3408 HydrophobicContact CG-CD1 3.87Å; M3365-L3408 HydrophobicContact SD-CD1 3.9Å; M3365-A3411 HydrophobicContact CE-CB 3.54Å; M3365-A3411 HydrophobicContact SD-CB 3.89Å; M3365-L3412 HydrophobicContact CB-CD1 4.22Å; M3365-L3412 HydrophobicContact CB-CD2 3.7Å; M3365-L3412 HydrophobicContact CB-CG 3.95Å; M3365-L3412 HydrophobicContact CE-CD2 3.9Å; M3365-L3412 HydrophobicContact CE-CG 3.97Å
3366V90.1Very high87.6Confident5.5 Ų5.539.3 Ų39.33%0.03320%0.196CC..Hα-helixtrans-64.2-39.9172178.40000111F3362 L3363 V3369 R3370 L3412F3362-V3366 HydrophobicContact CD1-CG2 3.85Å; F3362-V3366 HydrophobicContact CE1-CG2 3.51Å; F3362-V3366 VanDerWaalsContact CE1-CG2 3.48Å; F3362-V3366 HydrophobicContact CZ-CG2 4.33Å; F3362-V3366 WeakPolarHBondContact O-CG2 3.29Å; F3362-V3366 PolarHBondContact O-N 2.96Å; L3363-V3366 PolarHBondContact O-N 3.08Å; V3366-V3369 PolarHBondContact O-N 3.35Å; V3366-R3370 WeakPolarHBondContact O-CG 3.41Å; V3366-R3370 PolarHBondContact O-N 3.32Å; V3366-L3412 HydrophobicContact CG2-CD1 4.44Å; V3366-L3412 HydrophobicContact CG2-CD2 3.74Å
3367E90.4Very high89.1Confident77.5 Ų77.533.5 Ų33.536%0.36217%0.17SC..Hα-helixtrans-59.5-52.1171.1177169.9-155.600111.6S2998 L3363 I3364 M3365 V3369 R3370 T3371S2998-E3367 WeakPolarHBondContact CB-OE1 3.31Å; L3363-E3367 PolarHBondContact O-N 3.1Å; I3364-E3367 PolarHBondContact O-N 2.84Å; M3365-E3367 VanDerWaalsContact C-N 3.34Å; E3367-V3369 VanDerWaalsContact C-N 3.26Å; E3367-V3369 PolarHBondContact O-N 3.19Å; E3367-R3370 WeakPolarHBondContact O-CA 3.17Å; E3367-R3370 WeakPolarHBondContact O-CB 3.44Å; E3367-R3370 PolarHBondContact O-N 3.24Å; E3367-T3371 PolarHBondContact O-N 3.03Å; E3367-T3371 PolarHBondContact O-OG1 3.19Å; E3367-T3371 VanDerWaalsContact O-OG1 3.1Å
3368R92.1Very high90.2Very high46.5 Ų46.532.7 Ų32.718%0.17517%0.166CC..Hα-helixtrans-52-42.4175.7-69.1172.3-169.1-169.92.7112.5W3347 S3350 I3364 M3365 T3371 L3372 L3408W3347-R3368 VanDerWaalsContact CB-CZ 3.5Å; W3347-R3368 HydrophobicContact CD2-CB 4.35Å; W3347-R3368 HydrophobicContact CD2-CG 3.7Å; W3347-R3368 HydrophobicContact CE3-CB 4.03Å; W3347-R3368 HydrophobicContact CE3-CG 3.8Å; W3347-R3368 HydrophobicContact CG-CG 4.25Å; W3347-R3368 HydrophobicContact CH2-CB 3.68Å; W3347-R3368 HydrophobicContact CH2-CG 4.05Å; W3347-R3368 HydrophobicContact CZ2-CB 3.99Å; W3347-R3368 HydrophobicContact CZ2-CG 3.93Å; W3347-R3368 HydrophobicContact CZ3-CB 3.71Å; W3347-R3368 HydrophobicContact CZ3-CG 3.99Å; S3350-R3368 PolarHBondContact O-NH1 3.35Å; I3364-R3368 VanDerWaalsContact O-CG 3.31Å; I3364-R3368 WeakPolarHBondContact O-CG 3.26Å; I3364-R3368 PolarHBondContact O-N 3.11Å; M3365-R3368 PolarHBondContact O-N 3.03Å; R3368-T3371 PolarHBondContact O-N 3.26Å; R3368-L3372 WeakPolarHBondContact O-CB 3.3Å; R3368-L3372 PolarHBondContact O-N 3.3Å; R3368-L3408 HydrophobicContact CB-CD1 4.38Å; R3368-L3408 HydrophobicContact CB-CD2 4.07Å
3369V92.7Very high90.8Very high0 Ų031.6 Ų31.60%016%0.155CC..Hα-helixtrans-65.8-40.2176.1161.20000112.5M3365 V3366 E3367 L3372 S3373 L3408 L3412 H3432 V3433 L3436M3365-V3369 PolarHBondContact O-N 3.37Å; V3366-V3369 PolarHBondContact O-N 3.35Å; E3367-V3369 VanDerWaalsContact C-N 3.26Å; E3367-V3369 PolarHBondContact O-N 3.19Å; V3369-L3372 PolarHBondContact O-N 3.22Å; V3369-S3373 WeakPolarHBondContact O-CB 3.23Å; V3369-S3373 PolarHBondContact O-N 2.71Å; V3369-S3373 PolarHBondContact O-OG 3.08Å; V3369-L3408 HydrophobicContact CG2-CD1 4.42Å; V3369-L3408 HydrophobicContact CG2-CD2 3.68Å; V3369-L3408 HydrophobicContact CG2-CG 3.76Å; V3369-L3412 HydrophobicContact CB-CD1 4.2Å; V3369-L3412 HydrophobicContact CG2-CD1 3.48Å; V3369-L3412 VanDerWaalsContact CG2-CD1 3.48Å; V3369-H3432 HydrophobicContact CG1-CB 4.07Å; V3369-H3432 WeakPolarHBondContact CG1-O 3.08Å; V3369-V3433 HydrophobicContact CG1-CG2 4.45Å; V3369-L3436 HydrophobicContact CB-CD2 4.27Å; V3369-L3436 HydrophobicContact CG1-CB 3.99Å; V3369-L3436 HydrophobicContact CG1-CD2 3.9Å; V3369-L3436 HydrophobicContact CG2-CD2 3.86Å
3370R92.9Very high91.2Very high20.5 Ų20.529.1 Ų29.18%0.07714%0.138CC..Hα-helixtrans-65.6-45.2174.4-69.2-176.1-55.793.64.9111.5S2998 V3366 E3367 L3372 S3373 W3374 H3432 E3698S2998-R3370 VanDerWaalsContact O-CZ 3.25Å; S2998-R3370 PolarHBondContact O-NH1 2.97Å; S2998-R3370 PolarHBondContact O-NH2 3.21Å; V3366-R3370 WeakPolarHBondContact O-CG 3.41Å; V3366-R3370 PolarHBondContact O-N 3.32Å; E3367-R3370 WeakPolarHBondContact O-CA 3.17Å; E3367-R3370 WeakPolarHBondContact O-CB 3.44Å; E3367-R3370 PolarHBondContact O-N 3.24Å; R3370-L3372 VanDerWaalsContact C-N 3.31Å; R3370-L3372 PolarHBondContact O-N 3.04Å; R3370-S3373 WeakPolarHBondContact O-CB 3.28Å; R3370-S3373 PolarHBondContact O-N 3.28Å; R3370-W3374 VanDerWaalsContact O-CD1 3.25Å; R3370-W3374 PolarHBondContact O-N 3.01Å; R3370-H3432 HydrophobicContact CG-CB 4.24Å; R3370-E3698 WeakPolarHBondContact CD-OE1 3.43Å; R3370-E3698 IonicContact CZ-OE1 2.72Å; R3370-E3698 IonicContact NE-OE1 3.44Å; R3370-E3698 IonicContact NH1-OE1 2.66Å; R3370-E3698 PolarHBondContact NH1-OE1 3.22Å
3371T93.7Very high91.5Very high7 Ų721.7 Ų21.74%0.04311%0.107CC..Hα-helixtrans-56.4-46175.2-490000111.2L2994 S2998 E3367 R3368 W3374 L3375L2994-T3371 HydrophobicContact CD2-CG2 4.29Å; S2998-T3371 VanDerWaalsContact CB-OG1 3.26Å; S2998-T3371 WeakPolarHBondContact CB-OG1 3.47Å; S2998-T3371 VanDerWaalsContact OG-CG2 3.25Å; S2998-T3371 WeakPolarHBondContact OG-CG2 3.32Å; S2998-T3371 PolarHBondContact OG-OG1 2.83Å; E3367-T3371 PolarHBondContact O-N 3.03Å; E3367-T3371 PolarHBondContact O-OG1 3.19Å; E3367-T3371 VanDerWaalsContact O-OG1 3.1Å; R3368-T3371 PolarHBondContact O-N 3.26Å; T3371-W3374 PolarHBondContact O-N 3.15Å; T3371-L3375 WeakPolarHBondContact O-CB 3.31Å; T3371-L3375 PolarHBondContact O-N 2.87Å
3372L94.3Very high91.7Very high1 Ų118.3 Ų18.31%0.0059%0.089CC..Hα-helixtrans-67-39.2179.1-159.670.7000112W3347 R3368 V3369 R3370 L3375 L3376 I3397 V3405 L3436W3347-L3372 HydrophobicContact CH2-CD1 4.44Å; R3368-L3372 WeakPolarHBondContact O-CB 3.3Å; R3368-L3372 PolarHBondContact O-N 3.3Å; V3369-L3372 PolarHBondContact O-N 3.22Å; R3370-L3372 VanDerWaalsContact C-N 3.31Å; R3370-L3372 PolarHBondContact O-N 3.04Å; L3372-L3375 PolarHBondContact O-N 3.42Å; L3372-L3376 HydrophobicContact CG-CD1 4.09Å; L3372-L3376 WeakPolarHBondContact O-CB 3.47Å; L3372-L3376 WeakPolarHBondContact O-CD1 3.32Å; L3372-L3376 VanDerWaalsContact O-CG 3.24Å; L3372-L3376 WeakPolarHBondContact O-CG 3.5Å; L3372-L3376 PolarHBondContact O-N 3.19Å; L3372-I3397 HydrophobicContact CD1-CD1 3.55Å; L3372-I3397 HydrophobicContact CD1-CG1 4.37Å; L3372-I3397 HydrophobicContact CG-CD1 4.29Å; L3372-V3405 HydrophobicContact CD2-CB 4.48Å; L3372-V3405 HydrophobicContact CD2-CG1 3.84Å; L3372-V3405 HydrophobicContact CD2-CG2 3.93Å; L3372-L3436 HydrophobicContact CB-CD1 4.25Å; L3372-L3436 HydrophobicContact CD2-CD1 3.98Å; L3372-L3436 HydrophobicContact CD2-CD2 4.03Å; L3372-L3436 HydrophobicContact CG-CD1 4.21Å
3373S94.8Very high91.7Very high3.5 Ų3.518.6 Ų18.62%0.0249%0.09CC..Hα-helixtrans-62.7-46.9176.4-56.50000111.8V3369 R3370 L3376 L3377V3369-S3373 WeakPolarHBondContact O-CB 3.23Å; V3369-S3373 PolarHBondContact O-N 2.71Å; V3369-S3373 PolarHBondContact O-OG 3.08Å; R3370-S3373 WeakPolarHBondContact O-CB 3.28Å; R3370-S3373 PolarHBondContact O-N 3.28Å; S3373-L3376 PolarHBondContact O-N 3.25Å; S3373-L3377 WeakPolarHBondContact O-CB 3.37Å; S3373-L3377 WeakPolarHBondContact O-CG 3.43Å; S3373-L3377 PolarHBondContact O-N 2.99Å
3374W95.2Very high91.6Very high20.5 Ų20.517.2 Ų17.28%0.0789%0.088CC..Hα-helixtrans-61.6-44.3175.2-82.9114.7000111.9I2997 K3103 S3107 R3370 T3371 L3376 L3377 G3378 I3691 L3694 E3698I2997-W3374 HydrophobicContact CG2-CB 3.41Å; I2997-W3374 VanDerWaalsContact CG2-CB 3.46Å; I2997-W3374 HydrophobicContact CG2-CD2 4.45Å; I2997-W3374 HydrophobicContact CG2-CG 3.76Å; K3103-W3374 HydrophobicContact CB-CD2 4.24Å; K3103-W3374 HydrophobicContact CB-CE3 3.95Å; K3103-W3374 HydrophobicContact CB-CH2 3.73Å; K3103-W3374 HydrophobicContact CB-CZ2 4Å; K3103-W3374 HydrophobicContact CB-CZ3 3.69Å; K3103-W3374 HydrophobicContact CD-CD2 4.26Å; K3103-W3374 HydrophobicContact CD-CH2 4.36Å; K3103-W3374 HydrophobicContact CD-CZ2 3.78Å; K3103-W3374 HydrophobicContact CG-CZ2 4.43Å; S3107-W3374 VanDerWaalsContact CB-O 3.23Å; S3107-W3374 WeakPolarHBondContact CB-O 3.48Å; S3107-W3374 PolarHBondContact OG-O 3.41Å; R3370-W3374 VanDerWaalsContact O-CD1 3.25Å; R3370-W3374 PolarHBondContact O-N 3.01Å; T3371-W3374 PolarHBondContact O-N 3.15Å; W3374-L3376 PolarHBondContact O-N 3.28Å; W3374-L3377 HydrophobicContact CE3-CD2 4.15Å; W3374-L3377 HydrophobicContact CZ3-CD2 4.12Å; W3374-L3377 PolarHBondContact O-N 3.25Å; W3374-G3378 PolarHBondContact O-N 3.14Å; W3374-I3691 HydrophobicContact CZ3-CG1 4.47Å; W3374-I3691 HydrophobicContact CZ3-CG2 4.29Å; W3374-L3694 HydrophobicContact CD2-CD2 3.63Å; W3374-L3694 HydrophobicContact CD2-CG 4.38Å; W3374-L3694 VanDerWaalsContact CE2-CD2 3.43Å; W3374-L3694 HydrophobicContact CE3-CD2 4.16Å; W3374-L3694 HydrophobicContact CG-CD2 3.97Å; W3374-L3694 HydrophobicContact CH2-CB 4.39Å; W3374-L3694 HydrophobicContact CH2-CD2 4.31Å; W3374-L3694 HydrophobicContact CH2-CG 4.28Å; W3374-L3694 HydrophobicContact CZ2-CB 4.18Å; W3374-L3694 HydrophobicContact CZ2-CD2 3.81Å; W3374-L3694 HydrophobicContact CZ2-CG 3.64Å; W3374-L3694 HydrophobicContact CZ3-CD2 4.47Å; W3374-E3698 PolarHBondContact NE1-OE1 3.29Å; W3374-E3698 VanDerWaalsContact NE1-OE1 3.14Å; W3374-E3698 PolarHBondContact NE1-OE2 3.3Å; W3374-E3698 VanDerWaalsContact NE1-OE2 3.11Å
3375L94.5Very high91.4Very high3 Ų316.1 Ų16.12%0.0168%0.083CC..Hα-helixtrans-61.7-45.1178.4-168.770.6000111.8S3107 V3110 S3111 L3114 L3345 T3371 L3372 L3377 G3378 A3379 P3396 I3397S3107-L3375 WeakPolarHBondContact OG-CA 3.47Å; S3107-L3375 PolarHBondContact OG-N 3.2Å; V3110-L3375 HydrophobicContact CB-CD1 4.28Å; V3110-L3375 HydrophobicContact CG1-CD1 3.77Å; S3111-L3375 VanDerWaalsContact OG-CD1 3.27Å; S3111-L3375 WeakPolarHBondContact OG-CD1 3.42Å; S3111-L3375 PolarHBondContact OG-O 3.03Å; L3114-L3375 HydrophobicContact CD1-CD1 4.1Å; L3114-L3375 HydrophobicContact CD1-CD2 4Å; L3345-L3375 HydrophobicContact CD1-CD2 4.24Å; T3371-L3375 WeakPolarHBondContact O-CB 3.31Å; T3371-L3375 PolarHBondContact O-N 2.87Å; L3372-L3375 PolarHBondContact O-N 3.42Å; L3375-L3377 PolarHBondContact O-N 3.46Å; L3375-G3378 PolarHBondContact O-N 3.37Å; L3375-A3379 WeakPolarHBondContact O-CB 3.34Å; L3375-A3379 PolarHBondContact O-N 3.27Å; L3375-P3396 HydrophobicContact CD2-CB 4.43Å; L3375-P3396 HydrophobicContact CG-CB 4.47Å; L3375-P3396 HydrophobicContact CG-CG 4.4Å; L3375-I3397 HydrophobicContact CD2-CD1 4.19Å; L3375-I3397 HydrophobicContact CD2-CG1 4.26Å
3376L94.3Very high91Very high0 Ų016.3 Ų16.30%08%0.084CC..Hα-helixtrans-66-37.4176.3-68.8159.1000112.3L3372 S3373 W3374 A3379 T3380 I3397 L3436 V3439 W3440 Y3443L3372-L3376 HydrophobicContact CG-CD1 4.09Å; L3372-L3376 WeakPolarHBondContact O-CB 3.47Å; L3372-L3376 WeakPolarHBondContact O-CD1 3.32Å; L3372-L3376 VanDerWaalsContact O-CG 3.24Å; L3372-L3376 WeakPolarHBondContact O-CG 3.5Å; L3372-L3376 PolarHBondContact O-N 3.19Å; S3373-L3376 PolarHBondContact O-N 3.25Å; W3374-L3376 PolarHBondContact O-N 3.28Å; L3376-A3379 PolarHBondContact O-N 3.08Å; L3376-T3380 VanDerWaalsContact O-CB 3.29Å; L3376-T3380 WeakPolarHBondContact O-CB 3.42Å; L3376-T3380 WeakPolarHBondContact O-CG2 3.28Å; L3376-T3380 PolarHBondContact O-N 3.32Å; L3376-T3380 PolarHBondContact O-OG1 3.43Å; L3376-I3397 HydrophobicContact CD1-CD1 4.4Å; L3376-I3397 HydrophobicContact CD2-CD1 3.61Å; L3376-I3397 VanDerWaalsContact CD2-CD1 3.48Å; L3376-I3397 HydrophobicContact CG-CD1 3.83Å; L3376-L3436 HydrophobicContact CD1-CD1 3.49Å; L3376-L3436 VanDerWaalsContact CD1-CD1 3.49Å; L3376-V3439 HydrophobicContact CB-CG1 3.58Å; L3376-W3440 HydrophobicContact CD1-CE3 3.77Å; L3376-W3440 HydrophobicContact CD1-CZ3 4.42Å; L3376-W3440 HydrophobicContact CD2-CE3 4.01Å; L3376-W3440 HydrophobicContact CD2-CZ3 4.17Å; L3376-Y3443 HydrophobicContact CD2-CD1 3.48Å; L3376-Y3443 VanDerWaalsContact CD2-CD1 3.48Å; L3376-Y3443 HydrophobicContact CD2-CD2 3.79Å; L3376-Y3443 HydrophobicContact CD2-CE1 3.88Å; L3376-Y3443 HydrophobicContact CD2-CE2 4.18Å; L3376-Y3443 HydrophobicContact CD2-CG 3.42Å; L3376-Y3443 VanDerWaalsContact CD2-CG 3.42Å
3377L93.7Very high90.1Very high32 Ų3219.3 Ų19.317%0.16810%0.095CC..Hα-helixtrans-62.7-45.8174.2-126.7117000111.1S3373 W3374 L3375 A3379 T3380 M3381 V3439 L3687 H3690 I3691 L3694S3373-L3377 WeakPolarHBondContact O-CB 3.37Å; S3373-L3377 WeakPolarHBondContact O-CG 3.43Å; S3373-L3377 PolarHBondContact O-N 2.99Å; W3374-L3377 HydrophobicContact CE3-CD2 4.15Å; W3374-L3377 HydrophobicContact CZ3-CD2 4.12Å; W3374-L3377 PolarHBondContact O-N 3.25Å; L3375-L3377 PolarHBondContact O-N 3.46Å; L3377-A3379 VanDerWaalsContact C-N 3.34Å; L3377-A3379 PolarHBondContact O-N 3.45Å; L3377-T3380 WeakPolarHBondContact CA-OG1 3.41Å; L3377-T3380 PolarHBondContact O-N 3.1Å; L3377-T3380 PolarHBondContact O-OG1 3.18Å; L3377-M3381 VanDerWaalsContact O-CB 3.22Å; L3377-M3381 WeakPolarHBondContact O-CB 3.45Å; L3377-M3381 PolarHBondContact O-N 3.12Å; L3377-V3439 HydrophobicContact CD2-CG1 3.95Å; L3377-V3439 HydrophobicContact CD2-CG2 3.8Å; L3377-V3439 HydrophobicContact CG-CG1 3.97Å; L3377-V3439 HydrophobicContact CG-CG2 4.07Å; L3377-L3687 HydrophobicContact CD2-CD2 3.71Å; L3377-H3690 HydrophobicContact CD2-CB 3.97Å; L3377-I3691 HydrophobicContact CD1-CG1 4.45Å; L3377-L3694 HydrophobicContact CD1-CD2 3.87Å
3378G92.5Very high88.7Confident0.5 Ų0.522.6 Ų22.61%0.00511%0.11CC..Hα-helixtrans-60.7-44175.400000113W3374 L3375 T3380 M3381 N3382W3374-G3378 PolarHBondContact O-N 3.14Å; L3375-G3378 PolarHBondContact O-N 3.37Å; G3378-T3380 PolarHBondContact O-N 3.05Å; G3378-M3381 PolarHBondContact O-N 3.07Å; G3378-N3382 PolarHBondContact O-N 3.14Å
3379A91.9Very high87.2Confident0 Ų022.5 Ų22.50%012%0.12CC..Hα-helixtrans-63.2-45.3176.100000112.6S3111 L3375 L3376 L3377 N3382 M3383 P3396 Y3443S3111-A3379 PolarHBondContact OG-N 3.15Å; L3375-A3379 WeakPolarHBondContact O-CB 3.34Å; L3375-A3379 PolarHBondContact O-N 3.27Å; L3376-A3379 PolarHBondContact O-N 3.08Å; L3377-A3379 VanDerWaalsContact C-N 3.34Å; L3377-A3379 PolarHBondContact O-N 3.45Å; A3379-N3382 PolarHBondContact O-N 3.43Å; A3379-M3383 HydrophobicContact CB-CE 4.5Å; A3379-M3383 WeakPolarHBondContact O-CE 3.46Å; A3379-M3383 WeakPolarHBondContact O-CG 3.39Å; A3379-M3383 PolarHBondContact O-N 3.32Å; A3379-P3396 HydrophobicContact CB-CG 3.77Å; A3379-Y3443 HydrophobicContact CB-CD2 4.42Å; A3379-Y3443 HydrophobicContact CB-CE2 4.11Å
3380T91Very high85.9Confident9 Ų923.4 Ų23.46%0.05513%0.125CC..Hα-helixtrans-67.7-36.7178.6-0.70000111.7L3376 L3377 G3378 M3383 A3384 I3442 T3446 L3683 L3687L3376-T3380 VanDerWaalsContact O-CB 3.29Å; L3376-T3380 WeakPolarHBondContact O-CB 3.42Å; L3376-T3380 WeakPolarHBondContact O-CG2 3.28Å; L3376-T3380 PolarHBondContact O-N 3.32Å; L3376-T3380 PolarHBondContact O-OG1 3.43Å; L3377-T3380 WeakPolarHBondContact CA-OG1 3.41Å; L3377-T3380 PolarHBondContact O-N 3.1Å; L3377-T3380 PolarHBondContact O-OG1 3.18Å; G3378-T3380 PolarHBondContact O-N 3.05Å; T3380-M3383 HydrophobicContact CG2-CE 4.25Å; T3380-M3383 CarbonylContact O-C 3.6Å; T3380-M3383 PolarHBondContact O-N 3.19Å; T3380-A3384 WeakPolarHBondContact O-CB 3.49Å; T3380-A3384 PolarHBondContact O-N 3.13Å; T3380-I3442 HydrophobicContact CG2-CG2 4.13Å; T3380-T3446 HydrophobicContact CG2-CG2 4.01Å; T3380-L3683 HydrophobicContact CG2-CD1 4.2Å; T3380-L3687 HydrophobicContact CG2-CD1 4.03Å; T3380-L3687 HydrophobicContact CG2-CD2 3.97Å
3381M90.1Very high84.5Confident14 Ų1425.8 Ų25.87%0.06916%0.157CC..Hα-helixtrans-63.5-41.9173-168.4117.385.600111.7E2958 Q3108 L3377 G3378 M3383 A3384 L3385 V3684 L3687 K3688 I3691E2958-M3381 HydrophobicContact CB-CE 3.73Å; E2958-M3381 HydrophobicContact CB-CG 4.39Å; E2958-M3381 HydrophobicContact CB-SD 4.12Å; E2958-M3381 HydrophobicContact CG-CE 4.24Å; E2958-M3381 WeakPolarHBondContact OE2-CE 3.31Å; Q3108-M3381 HydrophobicContact CB-CE 4.19Å; Q3108-M3381 HydrophobicContact CG-CE 4.41Å; L3377-M3381 VanDerWaalsContact O-CB 3.22Å; L3377-M3381 WeakPolarHBondContact O-CB 3.45Å; L3377-M3381 PolarHBondContact O-N 3.12Å; G3378-M3381 PolarHBondContact O-N 3.07Å; M3381-M3383 VanDerWaalsContact C-N 3.33Å; M3381-M3383 PolarHBondContact O-N 2.95Å; M3381-A3384 PolarHBondContact O-N 3.39Å; M3381-L3385 HydrophobicContact CG-CD1 3.81Å; M3381-L3385 HydrophobicContact CG-CG 4.24Å; M3381-L3385 WeakPolarHBondContact O-CB 3.44Å; M3381-L3385 WeakPolarHBondContact O-CG 3.39Å; M3381-L3385 PolarHBondContact O-N 2.9Å; M3381-L3385 HydrophobicContact SD-CD1 3.73Å; M3381-L3385 HydrophobicContact SD-CD2 4.45Å; M3381-L3385 HydrophobicContact SD-CG 3.91Å; M3381-V3684 HydrophobicContact SD-CG1 4.43Å; M3381-V3684 HydrophobicContact SD-CG2 4.45Å; M3381-L3687 HydrophobicContact CB-CD1 4.28Å; M3381-L3687 HydrophobicContact CE-CB 3.47Å; M3381-L3687 VanDerWaalsContact CE-CB 3.47Å; M3381-L3687 HydrophobicContact CE-CD1 4.28Å; M3381-L3687 HydrophobicContact SD-CB 4.37Å; M3381-L3687 HydrophobicContact SD-CD1 4.15Å; M3381-K3688 HydrophobicContact CE-CG 4.13Å; M3381-I3691 HydrophobicContact CE-CD1 3.39Å
3382N89.4Confident83.5Confident0 Ų028 Ų280%017%0.168CC..Hα-helixtrans-63.2-42.9173.7-152.280.6000112.2G2955 Q3108 G3378 A3379 A3384 L3385 T3386 C3394G2955-N3382 VanDerWaalsContact CA-OD1 3.25Å; G2955-N3382 WeakPolarHBondContact CA-OD1 3.45Å; Q3108-N3382 HydrophobicContact CG-CB 3.83Å; Q3108-N3382 WeakPolarHBondContact CG-OD1 3.39Å; Q3108-N3382 PolarHBondContact NE2-OD1 3Å; G3378-N3382 PolarHBondContact O-N 3.14Å; A3379-N3382 PolarHBondContact O-N 3.43Å; N3382-A3384 VanDerWaalsContact C-N 3.27Å; N3382-A3384 PolarHBondContact O-N 3.42Å; N3382-L3385 PolarHBondContact O-N 2.9Å; N3382-T3386 PolarHBondContact ND2-OG1 3.14Å; N3382-T3386 PolarHBondContact O-N 3.11Å; N3382-T3386 PolarHBondContact O-OG1 3.12Å; N3382-C3394 HydrophobicContact CB-CB 4.06Å
3383M87.3Confident82.5Confident6.5 Ų6.530.9 Ų30.93%0.03219%0.188CC..Hα-helixtrans-69.2-16.3176.4-70.2-173-66.700113.5A3379 T3380 M3381 R3387 C3394 Y3443 T3446 V3447 L3450A3379-M3383 HydrophobicContact CB-CE 4.5Å; A3379-M3383 WeakPolarHBondContact O-CE 3.46Å; A3379-M3383 WeakPolarHBondContact O-CG 3.39Å; A3379-M3383 PolarHBondContact O-N 3.32Å; T3380-M3383 HydrophobicContact CG2-CE 4.25Å; T3380-M3383 CarbonylContact O-C 3.6Å; T3380-M3383 PolarHBondContact O-N 3.19Å; M3381-M3383 VanDerWaalsContact C-N 3.33Å; M3381-M3383 PolarHBondContact O-N 2.95Å; M3383-R3387 WeakPolarHBondContact O-CA 3.5Å; M3383-R3387 WeakPolarHBondContact O-CB 3.36Å; M3383-R3387 VanDerWaalsContact O-CD 3.27Å; M3383-R3387 WeakPolarHBondContact O-CD 3.38Å; M3383-R3387 WeakPolarHBondContact O-CG 3.36Å; M3383-C3394 HydrophobicContact CG-CB 4.06Å; M3383-Y3443 HydrophobicContact CE-CD2 3.57Å; M3383-Y3443 HydrophobicContact CE-CE2 3.72Å; M3383-T3446 WeakPolarHBondContact CE-OG1 3.33Å; M3383-V3447 HydrophobicContact CE-CG2 3.92Å; M3383-V3447 HydrophobicContact SD-CG2 3.89Å; M3383-L3450 HydrophobicContact CG-CD1 4.29Å; M3383-L3450 HydrophobicContact SD-CD1 3.72Å
3384A85Confident82Confident42 Ų4230.7 Ų30.735%0.34719%0.187SC..Hα-helixtrans-83-53.1168.500000110.7T3380 M3381 N3382 T3386 T3680 L3683 V3684 L3687T3380-A3384 WeakPolarHBondContact O-CB 3.49Å; T3380-A3384 PolarHBondContact O-N 3.13Å; M3381-A3384 PolarHBondContact O-N 3.39Å; N3382-A3384 VanDerWaalsContact C-N 3.27Å; N3382-A3384 PolarHBondContact O-N 3.42Å; A3384-T3386 PolarHBondContact O-N 3.09Å; A3384-T3680 VanDerWaalsContact O-CG2 3.25Å; A3384-T3680 WeakPolarHBondContact O-CG2 3.42Å; A3384-L3683 HydrophobicContact CB-CD2 3.73Å; A3384-L3683 HydrophobicContact CB-CG 4.05Å; A3384-V3684 HydrophobicContact CB-CG2 3.73Å; A3384-L3687 HydrophobicContact CB-CD1 4.17Å
3385L84.7Confident81.6Confident49 Ų4932.9 Ų32.926%0.25720%0.195SC..Hα-helixtrans-75.6-20.3-171.2-63.7173.5000114.9T2956 E2958 M3381 N3382 V3684T2956-L3385 HydrophobicContact CG2-CB 4.1Å; T2956-L3385 HydrophobicContact CG2-CD1 4.37Å; T2956-L3385 VanDerWaalsContact O-CD1 3.24Å; T2956-L3385 WeakPolarHBondContact O-CD1 3.46Å; E2958-L3385 HydrophobicContact CB-CD1 4.45Å; M3381-L3385 HydrophobicContact CG-CD1 3.81Å; M3381-L3385 HydrophobicContact CG-CG 4.24Å; M3381-L3385 WeakPolarHBondContact O-CB 3.44Å; M3381-L3385 WeakPolarHBondContact O-CG 3.39Å; M3381-L3385 PolarHBondContact O-N 2.9Å; M3381-L3385 HydrophobicContact SD-CD1 3.73Å; M3381-L3385 HydrophobicContact SD-CD2 4.45Å; M3381-L3385 HydrophobicContact SD-CG 3.91Å; N3382-L3385 PolarHBondContact O-N 2.9Å; L3385-V3684 HydrophobicContact CD2-CG1 4.28Å; L3385-V3684 HydrophobicContact CD2-CG2 3.77Å; L3385-V3684 HydrophobicContact CG-CG2 4.4Å
3386T80.4Confident81.2Confident3.5 Ų3.532.8 Ų32.82%0.02119%0.194CC..SBendtrans-130.76.3-172.868.20000115.3T2956 F2970 N3382 A3384 E3388 A3389 T3390T2956-T3386 HydrophobicContact CG2-CG2 4.33Å; F2970-T3386 HydrophobicContact CD1-CG2 4.28Å; F2970-T3386 HydrophobicContact CE1-CG2 3.74Å; F2970-T3386 HydrophobicContact CZ-CG2 4.27Å; N3382-T3386 PolarHBondContact ND2-OG1 3.14Å; N3382-T3386 PolarHBondContact O-N 3.11Å; N3382-T3386 PolarHBondContact O-OG1 3.12Å; A3384-T3386 PolarHBondContact O-N 3.09Å; T3386-E3388 VanDerWaalsContact C-N 3.26Å; T3386-E3388 PolarHBondContact O-N 2.97Å; T3386-A3389 WeakPolarHBondContact O-CA 3.14Å; T3386-A3389 VanDerWaalsContact O-CB 3.28Å; T3386-A3389 WeakPolarHBondContact O-CB 3.42Å; T3386-A3389 PolarHBondContact O-N 3.16Å; T3386-T3390 HydrophobicContact CG2-CG2 4.41Å; T3386-T3390 PolarHBondContact O-N 3.49Å; T3386-T3390 PolarHBondContact O-OG1 3.34Å
3387R70.5Confident80.9Confident70 Ų7032.8 Ų32.826%0.26420%0.195SC..THydrogen-bonded Turntrans-52.2-39-162.6177.8165.1167-93.9-10116.1M3383 A3389 S3449 L3450M3383-R3387 WeakPolarHBondContact O-CA 3.5Å; M3383-R3387 WeakPolarHBondContact O-CB 3.36Å; M3383-R3387 VanDerWaalsContact O-CD 3.27Å; M3383-R3387 WeakPolarHBondContact O-CD 3.38Å; M3383-R3387 WeakPolarHBondContact O-CG 3.36Å; R3387-A3389 VanDerWaalsContact C-N 3.32Å; R3387-S3449 PolarHBondContact NE-OG 3.16Å; R3387-S3449 PolarHBondContact NH2-O 3.09Å; R3387-S3449 PolarHBondContact NH2-OG 3.39Å; R3387-L3450 HydrophobicContact CG-CD2 3.97Å
3388E61Low80.5Confident146 Ų14632.3 Ų32.368%0.68219%0.193SC*.THydrogen-bonded Turntrans-104.3-6.2-176.9-59.8-178.7-178.200112.3T3386T3386-E3388 VanDerWaalsContact C-N 3.26Å; T3386-E3388 PolarHBondContact O-N 2.97Å
3389A61.5Low80.2Confident44.5 Ų44.534.5 Ų34.537%0.36820%0.204SC..THydrogen-bonded Turntrans-104.7-42.1-161.200000113.6P2972 T3386 R3387P2972-A3389 HydrophobicContact CB-CB 3.5Å; P2972-A3389 VanDerWaalsContact CB-CB 3.45Å; P2972-A3389 VanDerWaalsContact CB-O 3.31Å; P2972-A3389 WeakPolarHBondContact CB-O 3.41Å; P2972-A3389 HydrophobicContact CG-CB 3.57Å; T3386-A3389 WeakPolarHBondContact O-CA 3.14Å; T3386-A3389 VanDerWaalsContact O-CB 3.28Å; T3386-A3389 WeakPolarHBondContact O-CB 3.42Å; T3386-A3389 PolarHBondContact O-N 3.16Å; R3387-A3389 VanDerWaalsContact C-N 3.32Å
3390T65.2Low79.9Confident19 Ų1938.2 Ų38.212%0.11722%0.224CC..THydrogen-bonded Turntrans-100.5-15-179.461.10000113.7F2970 P2972 Y2975 T3386 L3392F2970-T3390 HydrophobicContact CE1-CG2 3.96Å; F2970-T3390 HydrophobicContact CZ-CG2 3.59Å; P2972-T3390 HydrophobicContact CB-CG2 4.18Å; Y2975-T3390 HydrophobicContact CE1-CG2 3.83Å; T3386-T3390 HydrophobicContact CG2-CG2 4.41Å; T3386-T3390 PolarHBondContact O-N 3.49Å; T3386-T3390 PolarHBondContact O-OG1 3.34Å; T3390-L3392 PolarHBondContact O-N 3.43Å; T3390-L3392 VanDerWaalsContact O-N 3.11Å; T3390-L3392 WeakPolarHBondContact OG1-CB 3.33Å; T3390-L3392 PolarHBondContact OG1-N 3.17Å
3391G64.2Low79.6Confident71.5 Ų71.538.1 Ų38.174%0.73722%0.223SC*.  trans67.2-3.4-168.600000115.2S3393G3391-S3393 PolarHBondContact O-N 3.47Å
3392L70.9Confident79.5Confident53.5 Ų53.537.5 Ų37.528%0.2822%0.221SC..  trans-78.2111.1-175.2-64.3175.4000111.6Y2975 T3390 C3394Y2975-L3392 WeakPolarHBondContact OH-CD1 3.47Å; T3390-L3392 PolarHBondContact O-N 3.43Å; T3390-L3392 VanDerWaalsContact O-N 3.11Å; T3390-L3392 WeakPolarHBondContact OG1-CB 3.33Å; T3390-L3392 PolarHBondContact OG1-N 3.17Å; L3392-C3394 PolarHBondContact O-N 3.09Å; L3392-C3394 VanDerWaalsContact O-N 3.15Å
3393S75.2Confident79.5Confident60.5 Ų60.539.6 Ų39.642%0.42323%0.234SC..  trans-76.8102176.369.20000111.6G3391 R3395G3391-S3393 PolarHBondContact O-N 3.47Å; S3393-R3395 VanDerWaalsContact C-N 3.3Å; S3393-R3395 PolarHBondContact O-N 3.1Å
3394C83.6Confident79.6Confident0.5 Ų0.540.2 Ų40.20%0.00324%0.239CC..  trans-73.486.6175.2-160.20000111S3111 L3112 S3115 N3382 M3383 L3392 P3396S3111-C3394 VanDerWaalsContact CB-SG 3.58Å; L3112-C3394 HydrophobicContact CD2-CB 4.43Å; S3115-C3394 WeakPolarHBondContact OG-CA 3.31Å; N3382-C3394 HydrophobicContact CB-CB 4.06Å; M3383-C3394 HydrophobicContact CG-CB 4.06Å; L3392-C3394 PolarHBondContact O-N 3.09Å; L3392-C3394 VanDerWaalsContact O-N 3.15Å; C3394-P3396 VanDerWaalsContact C-CD 3.46Å; C3394-P3396 WeakPolarHBondContact O-CD 3.5Å
3395R85.9Confident79.9Confident66.5 Ų66.538.2 Ų38.225%0.25122%0.222SC..  trans-122.469.4-177.4-68.2174.1170.3-177.3-8.8110.2S3115 N3118 S3393 I3397 Y3443 V3447S3115-R3395 VanDerWaalsContact OG-C 3.32Å; S3115-R3395 PolarHBondContact OG-N 3.08Å; N3118-R3395 PolarHBondContact ND2-O 3.2Å; N3118-R3395 VanDerWaalsContact ND2-O 3.09Å; S3393-R3395 VanDerWaalsContact C-N 3.3Å; S3393-R3395 PolarHBondContact O-N 3.1Å; R3395-I3397 VanDerWaalsContact C-N 3.34Å; R3395-I3397 PolarHBondContact O-N 2.93Å; R3395-Y3443 WeakPolarHBondContact CA-OH 3.41Å; R3395-V3447 HydrophobicContact CG-CG2 4.16Å; R3395-V3447 PolarHBondContact NH2-O 2.65Å
3396P87.5Confident80.3Confident0 Ų035.9 Ų35.90%021%0.21CC..  trans-69.4-32.3-174.627.6-36000113L3114 S3115 N3118 I3341 L3375 A3379 C3394 P3398L3114-P3396 HydrophobicContact CB-CB 3.81Å; L3114-P3396 HydrophobicContact CD1-CB 4.4Å; S3115-P3396 WeakPolarHBondContact OG-CD 3.16Å; N3118-P3396 PolarHBondContact ND2-O 3.14Å; I3341-P3396 WeakPolarHBondContact CD1-O 3.3Å; L3375-P3396 HydrophobicContact CD2-CB 4.43Å; L3375-P3396 HydrophobicContact CG-CB 4.47Å; L3375-P3396 HydrophobicContact CG-CG 4.4Å; A3379-P3396 HydrophobicContact CB-CG 3.77Å; C3394-P3396 VanDerWaalsContact C-CD 3.46Å; C3394-P3396 WeakPolarHBondContact O-CD 3.5Å; P3396-P3398 WeakPolarHBondContact O-CD 3.37Å
3397I88.2Confident80.8Confident1 Ų138.6 Ų38.61%0.00523%0.225CC..SBendtrans-107.8111.6-179-59.4154000108.9I3341 L3372 L3375 L3376 R3395 L3399 L3401 W3440 Y3443I3341-I3397 HydrophobicContact CD1-CB 4.2Å; I3341-I3397 HydrophobicContact CD1-CG1 3.73Å; I3341-I3397 HydrophobicContact CD1-CG2 4.36Å; L3372-I3397 HydrophobicContact CD1-CD1 3.55Å; L3372-I3397 HydrophobicContact CD1-CG1 4.37Å; L3372-I3397 HydrophobicContact CG-CD1 4.29Å; L3375-I3397 HydrophobicContact CD2-CD1 4.19Å; L3375-I3397 HydrophobicContact CD2-CG1 4.26Å; L3376-I3397 HydrophobicContact CD1-CD1 4.4Å; L3376-I3397 HydrophobicContact CD2-CD1 3.61Å; L3376-I3397 VanDerWaalsContact CD2-CD1 3.48Å; L3376-I3397 HydrophobicContact CG-CD1 3.83Å; R3395-I3397 VanDerWaalsContact C-N 3.34Å; R3395-I3397 PolarHBondContact O-N 2.93Å; I3397-L3399 PolarHBondContact O-N 3.15Å; I3397-L3401 HydrophobicContact CG2-CB 4.35Å; I3397-L3401 HydrophobicContact CG2-CD1 4.49Å; I3397-W3440 HydrophobicContact CD1-CZ3 4.29Å; I3397-W3440 HydrophobicContact CG2-CH2 4.01Å; I3397-W3440 HydrophobicContact CG2-CZ3 4Å; I3397-Y3443 PolarHBondContact O-OH 2.88Å
3398P85Confident81.8Confident21.5 Ų21.535.4 Ų35.414%0.1421%0.212CC..  trans-56.4135.4172.2-29.637.8000113.1I3341 P3396 N3400 L3401I3341-P3398 HydrophobicContact CG2-CG 4.48Å; P3396-P3398 WeakPolarHBondContact O-CD 3.37Å; P3398-N3400 VanDerWaalsContact CB-OD1 3.28Å; P3398-N3400 WeakPolarHBondContact CB-OD1 3.24Å; P3398-N3400 PolarHBondContact O-N 3.19Å; P3398-L3401 WeakPolarHBondContact O-CB 3.4Å; P3398-L3401 PolarHBondContact O-N 3.07Å
3399L86.3Confident83.3Confident46 Ų4628.4 Ų28.424%0.24118%0.18CC..G310 helixtrans-66.3-8.9-176-62.3-178.6000114.5I3397 L3401 V3402 Y3443 V3447 A3461 T3464I3397-L3399 PolarHBondContact O-N 3.15Å; L3399-L3401 VanDerWaalsContact C-N 3.3Å; L3399-V3402 VanDerWaalsContact O-CG2 3.23Å; L3399-V3402 WeakPolarHBondContact O-CG2 3.32Å; L3399-Y3443 HydrophobicContact CD2-CE1 4.17Å; L3399-V3447 HydrophobicContact CD1-CG1 3.91Å; L3399-V3447 HydrophobicContact CD2-CG1 4.28Å; L3399-V3447 HydrophobicContact CG-CG1 4.46Å; L3399-A3461 HydrophobicContact CD1-CB 3.81Å; L3399-T3464 HydrophobicContact CB-CG2 4.22Å; L3399-T3464 HydrophobicContact CD2-CG2 4.03Å; L3399-T3464 PolarHBondContact O-OG1 3.37Å
3400N84.6Confident84.8Confident77 Ų7728.8 Ų28.841%0.41217%0.173SC..G310 helixtrans-80.6-10.2172.767.3-12.7000113.2E3338 P3398 V3402 P3403E3338-N3400 PolarHBondContact OE1-ND2 3.31Å; P3398-N3400 VanDerWaalsContact CB-OD1 3.28Å; P3398-N3400 WeakPolarHBondContact CB-OD1 3.24Å; P3398-N3400 PolarHBondContact O-N 3.19Å; N3400-V3402 VanDerWaalsContact C-N 3.26Å; N3400-V3402 PolarHBondContact O-N 3.42Å; N3400-P3403 WeakPolarHBondContact O-CD 3.23Å
3401L86Confident85.9Confident7 Ų728 Ų284%0.03717%0.169CC..G310 helixtrans-84.911.2173.7-58.5178000113.4I3341 L3348 I3397 P3398 L3399 P3403 S3404 V3405I3341-L3401 HydrophobicContact CD1-CD1 4.45Å; I3341-L3401 HydrophobicContact CG2-CD1 4.19Å; L3348-L3401 HydrophobicContact CD2-CD1 3.74Å; L3348-L3401 HydrophobicContact CG-CD1 4.49Å; I3397-L3401 HydrophobicContact CG2-CB 4.35Å; I3397-L3401 HydrophobicContact CG2-CD1 4.49Å; P3398-L3401 WeakPolarHBondContact O-CB 3.4Å; P3398-L3401 PolarHBondContact O-N 3.07Å; L3399-L3401 VanDerWaalsContact C-N 3.3Å; L3401-P3403 VanDerWaalsContact C-N 3.33Å; L3401-S3404 WeakPolarHBondContact O-CB 3.29Å; L3401-S3404 PolarHBondContact O-N 3.29Å; L3401-V3405 PolarHBondContact O-N 2.92Å
3402V87.6Confident87.1Confident3 Ų324.7 Ų24.72%0.01813%0.134CC..Hα-helixtrans-47.1-45.8169165.80000113.5L3399 N3400 S3404 V3405 A3406 W3440 T3464 D3467 F3468L3399-V3402 VanDerWaalsContact O-CG2 3.23Å; L3399-V3402 WeakPolarHBondContact O-CG2 3.32Å; N3400-V3402 VanDerWaalsContact C-N 3.26Å; N3400-V3402 PolarHBondContact O-N 3.42Å; V3402-S3404 PolarHBondContact O-N 3.25Å; V3402-V3405 PolarHBondContact O-N 3.03Å; V3402-A3406 WeakPolarHBondContact O-CB 3.15Å; V3402-A3406 PolarHBondContact O-N 2.92Å; V3402-W3440 HydrophobicContact CG2-CZ2 3.7Å; V3402-T3464 HydrophobicContact CG2-CG2 3.4Å; V3402-T3464 VanDerWaalsContact CG2-CG2 3.4Å; V3402-D3467 HydrophobicContact CG1-CB 4.42Å; V3402-F3468 HydrophobicContact CG1-CB 4.09Å
3403P89.5Confident88Confident43 Ų4322.2 Ų22.228%0.27912%0.121SC..Hα-helixtrans-59.4-47.3-179.4-2435.9000111.6N3400 L3401 V3405 A3406 D3407N3400-P3403 WeakPolarHBondContact O-CD 3.23Å; L3401-P3403 VanDerWaalsContact C-N 3.33Å; P3403-V3405 PolarHBondContact O-N 2.84Å; P3403-A3406 CarbonylContact O-C 3.43Å; P3403-A3406 PolarHBondContact O-N 3.04Å; P3403-D3407 WeakPolarHBondContact O-CB 3.35Å; P3403-D3407 PolarHBondContact O-N 3.46Å
3404S89.1Confident88.6Confident19 Ų1921.5 Ų21.513%0.13312%0.116CC..Hα-helixtrans-55-47.3176.1-76.90000113.6L3348 L3401 V3402 D3407 L3408L3348-S3404 WeakPolarHBondContact O-CB 3.3Å; L3348-S3404 PolarHBondContact O-OG 3.47Å; L3401-S3404 WeakPolarHBondContact O-CB 3.29Å; L3401-S3404 PolarHBondContact O-N 3.29Å; V3402-S3404 PolarHBondContact O-N 3.25Å; S3404-D3407 PolarHBondContact O-N 2.96Å; S3404-L3408 PolarHBondContact O-N 3.36Å
3405V91.6Very high88.7Confident0 Ų021.7 Ų21.70%012%0.119CC..Hα-helixtrans-69.3-40.2-179.6-178.50000110.7L3348 L3372 L3401 V3402 P3403 D3407 V3409 L3436 W3440 F3468L3348-V3405 HydrophobicContact CD1-CG2 4.17Å; L3372-V3405 HydrophobicContact CD2-CB 4.48Å; L3372-V3405 HydrophobicContact CD2-CG1 3.84Å; L3372-V3405 HydrophobicContact CD2-CG2 3.93Å; L3401-V3405 PolarHBondContact O-N 2.92Å; V3402-V3405 PolarHBondContact O-N 3.03Å; P3403-V3405 PolarHBondContact O-N 2.84Å; V3405-D3407 VanDerWaalsContact C-N 3.35Å; V3405-V3409 WeakPolarHBondContact O-CG2 3.33Å; V3405-V3409 PolarHBondContact O-N 3.26Å; V3405-V3409 VanDerWaalsContact O-N 3.13Å; V3405-L3436 HydrophobicContact CG1-CD2 4.41Å; V3405-W3440 HydrophobicContact CB-CZ3 4.49Å; V3405-W3440 HydrophobicContact CG1-CD2 4.21Å; V3405-W3440 HydrophobicContact CG1-CE3 4.01Å; V3405-W3440 HydrophobicContact CG1-CZ3 4.33Å; V3405-W3440 HydrophobicContact CG2-CE3 4.4Å; V3405-W3440 HydrophobicContact CG2-CH2 4.09Å; V3405-W3440 HydrophobicContact CG2-CZ3 3.9Å; V3405-F3468 HydrophobicContact CG1-CE2 4.07Å
3406A92.8Very high88.7Confident0 Ų018.6 Ų18.60%011%0.107CC..Hα-helixtrans-65.7-35.2173.600000112.4V3402 P3403 V3409 K3410 F3468 R3471 I3472V3402-A3406 WeakPolarHBondContact O-CB 3.15Å; V3402-A3406 PolarHBondContact O-N 2.92Å; P3403-A3406 CarbonylContact O-C 3.43Å; P3403-A3406 PolarHBondContact O-N 3.04Å; A3406-V3409 PolarHBondContact O-N 2.98Å; A3406-K3410 WeakPolarHBondContact O-CB 3.35Å; A3406-K3410 WeakPolarHBondContact O-CE 3.48Å; A3406-K3410 VanDerWaalsContact O-CG 3.26Å; A3406-K3410 WeakPolarHBondContact O-CG 3.36Å; A3406-K3410 PolarHBondContact O-N 3.24Å; A3406-F3468 HydrophobicContact CB-CD2 4.01Å; A3406-F3468 HydrophobicContact CB-CE2 4.39Å; A3406-R3471 HydrophobicContact CB-CB 3.85Å; A3406-I3472 HydrophobicContact CB-CG2 4.07Å
3407D91.3Very high88.4Confident61 Ų6120.5 Ų20.533%0.32612%0.119SC..Hα-helixtrans-67.6-43.9177.2-71.4-26.7000111.5P3403 S3404 V3405 V3409 K3410 A3411P3403-D3407 WeakPolarHBondContact O-CB 3.35Å; P3403-D3407 PolarHBondContact O-N 3.46Å; S3404-D3407 PolarHBondContact O-N 2.96Å; V3405-D3407 VanDerWaalsContact C-N 3.35Å; D3407-V3409 PolarHBondContact O-N 3.06Å; D3407-K3410 PolarHBondContact O-N 2.94Å; D3407-K3410 WeakPolarHBondContact OD1-CE 3.31Å; D3407-K3410 IonicContact OD1-NZ 2.74Å; D3407-K3410 PolarHBondContact OD1-NZ 2.7Å; D3407-A3411 WeakPolarHBondContact O-CB 3.16Å; D3407-A3411 PolarHBondContact O-N 3.41Å
3408L91.2Very high88Confident2 Ų226.9 Ų26.91%0.0115%0.154CC..Hα-helixtrans-59.6-44.2173.6-179.863.2000112.1W3347 M3365 R3368 V3369 S3404 A3411 L3412W3347-L3408 HydrophobicContact CZ3-CD2 4.15Å; M3365-L3408 HydrophobicContact CB-CD1 3.83Å; M3365-L3408 HydrophobicContact CG-CD1 3.87Å; M3365-L3408 HydrophobicContact SD-CD1 3.9Å; R3368-L3408 HydrophobicContact CB-CD1 4.38Å; R3368-L3408 HydrophobicContact CB-CD2 4.07Å; V3369-L3408 HydrophobicContact CG2-CD1 4.42Å; V3369-L3408 HydrophobicContact CG2-CD2 3.68Å; V3369-L3408 HydrophobicContact CG2-CG 3.76Å; S3404-L3408 PolarHBondContact O-N 3.36Å; L3408-A3411 PolarHBondContact O-N 3.06Å; L3408-L3412 PolarHBondContact O-N 3.11Å
3409V93.3Very high87.8Confident0 Ų027.1 Ų27.10%015%0.153CC..Hα-helixtrans-64.6-46.1175.8167.10000111.4V3405 A3406 D3407 A3411 L3413 V3433 L3436 F3468 I3472V3405-V3409 WeakPolarHBondContact O-CG2 3.33Å; V3405-V3409 PolarHBondContact O-N 3.26Å; V3405-V3409 VanDerWaalsContact O-N 3.13Å; A3406-V3409 PolarHBondContact O-N 2.98Å; D3407-V3409 PolarHBondContact O-N 3.06Å; V3409-A3411 VanDerWaalsContact C-N 3.34Å; V3409-A3411 PolarHBondContact O-N 3.34Å; V3409-L3413 HydrophobicContact CG1-CD1 3.7Å; V3409-L3413 HydrophobicContact CG1-CG 4.36Å; V3409-L3413 WeakPolarHBondContact O-CB 3.33Å; V3409-L3413 VanDerWaalsContact O-CG 3.28Å; V3409-L3413 WeakPolarHBondContact O-CG 3.28Å; V3409-L3413 PolarHBondContact O-N 2.56Å; V3409-V3433 HydrophobicContact CG1-CG1 3.89Å; V3409-V3433 HydrophobicContact CG2-CG1 4.46Å; V3409-L3436 HydrophobicContact CG2-CD2 3.9Å; V3409-F3468 HydrophobicContact CG2-CE2 4.28Å; V3409-F3468 HydrophobicContact CG2-CZ 4.29Å; V3409-I3472 HydrophobicContact CB-CG2 4.16Å; V3409-I3472 HydrophobicContact CG1-CB 4.21Å; V3409-I3472 HydrophobicContact CG1-CD1 4.17Å; V3409-I3472 HydrophobicContact CG1-CG2 3.71Å
3410K91.9Very high87.3Confident53 Ų5326.2 Ų26.223%0.2315%0.147CC..Hα-helixtrans-59.6-43.6176-78-179.4-64.8-179.90111.7A3406 D3407 L3413 S3414 R3471 I3472A3406-K3410 WeakPolarHBondContact O-CB 3.35Å; A3406-K3410 WeakPolarHBondContact O-CE 3.48Å; A3406-K3410 VanDerWaalsContact O-CG 3.26Å; A3406-K3410 WeakPolarHBondContact O-CG 3.36Å; A3406-K3410 PolarHBondContact O-N 3.24Å; D3407-K3410 PolarHBondContact O-N 2.94Å; D3407-K3410 WeakPolarHBondContact OD1-CE 3.31Å; D3407-K3410 IonicContact OD1-NZ 2.74Å; D3407-K3410 PolarHBondContact OD1-NZ 2.7Å; K3410-L3413 PolarHBondContact O-N 3.38Å; K3410-S3414 VanDerWaalsContact O-CB 3.28Å; K3410-S3414 WeakPolarHBondContact O-CB 3.35Å; K3410-S3414 PolarHBondContact O-N 3.43Å; K3410-S3414 PolarHBondContact O-OG 3.08Å; K3410-R3471 WeakPolarHBondContact CD-O 3.18Å; K3410-I3472 HydrophobicContact CG-CG2 4.27Å
3411A88.9Confident86.7Confident3 Ų330.9 Ų30.93%0.02516%0.164CC..Hα-helixtrans-59-52.5-17800000111T3351 M3365 D3407 L3408 V3409 S3414 G3415T3351-A3411 HydrophobicContact CG2-CB 3.97Å; M3365-A3411 HydrophobicContact CE-CB 3.54Å; M3365-A3411 HydrophobicContact SD-CB 3.89Å; D3407-A3411 WeakPolarHBondContact O-CB 3.16Å; D3407-A3411 PolarHBondContact O-N 3.41Å; L3408-A3411 PolarHBondContact O-N 3.06Å; V3409-A3411 VanDerWaalsContact C-N 3.34Å; V3409-A3411 PolarHBondContact O-N 3.34Å; A3411-S3414 PolarHBondContact O-N 2.97Å; A3411-S3414 PolarHBondContact O-OG 2.84Å; A3411-G3415 PolarHBondContact O-N 3.37Å
3412L89.7Confident86.2Confident2 Ų236.9 Ų36.91%0.0119%0.192CC..Hα-helixtrans-61-46.4176.2-74.5171.8000113.2F3362 M3365 V3366 V3369 L3408 S3414 G3415 F3416 V3433F3362-L3412 HydrophobicContact CD1-CD2 4.24Å; F3362-L3412 HydrophobicContact CD2-CD2 3.99Å; F3362-L3412 HydrophobicContact CE1-CD2 4.02Å; F3362-L3412 HydrophobicContact CE2-CD2 3.77Å; F3362-L3412 HydrophobicContact CG-CD2 4.21Å; F3362-L3412 HydrophobicContact CZ-CD2 3.78Å; M3365-L3412 HydrophobicContact CB-CD1 4.22Å; M3365-L3412 HydrophobicContact CB-CD2 3.7Å; M3365-L3412 HydrophobicContact CB-CG 3.95Å; M3365-L3412 HydrophobicContact CE-CD2 3.9Å; M3365-L3412 HydrophobicContact CE-CG 3.97Å; V3366-L3412 HydrophobicContact CG2-CD1 4.44Å; V3366-L3412 HydrophobicContact CG2-CD2 3.74Å; V3369-L3412 HydrophobicContact CB-CD1 4.2Å; V3369-L3412 HydrophobicContact CG2-CD1 3.48Å; V3369-L3412 VanDerWaalsContact CG2-CD1 3.48Å; L3408-L3412 PolarHBondContact O-N 3.11Å; L3412-S3414 VanDerWaalsContact C-N 3.26Å; L3412-S3414 PolarHBondContact O-N 2.62Å; L3412-G3415 PolarHBondContact O-N 2.7Å; L3412-F3416 WeakPolarHBondContact O-CB 3.4Å; L3412-F3416 PolarHBondContact O-N 3.48Å; L3412-V3433 HydrophobicContact CB-CG2 3.84Å; L3412-V3433 HydrophobicContact CD1-CG2 3.55Å; L3412-V3433 HydrophobicContact CG-CG2 4.33Å
3413L89.5Confident85.4Confident1 Ų138.7 Ų38.71%0.00521%0.205CC..Hα-helixtrans-62.5-33.6178.1-70.3172.8000112.6V3409 K3410 L3430 V3433 F3434 T3475 I3476 L3479V3409-L3413 HydrophobicContact CG1-CD1 3.7Å; V3409-L3413 HydrophobicContact CG1-CG 4.36Å; V3409-L3413 WeakPolarHBondContact O-CB 3.33Å; V3409-L3413 VanDerWaalsContact O-CG 3.28Å; V3409-L3413 WeakPolarHBondContact O-CG 3.28Å; V3409-L3413 PolarHBondContact O-N 2.56Å; K3410-L3413 PolarHBondContact O-N 3.38Å; L3413-L3430 HydrophobicContact CD2-CD2 3.79Å; L3413-V3433 HydrophobicContact CD1-CG1 4.39Å; L3413-V3433 HydrophobicContact CD2-CG1 3.89Å; L3413-V3433 HydrophobicContact CG-CG1 3.91Å; L3413-F3434 HydrophobicContact CD2-CE2 4.29Å; L3413-F3434 HydrophobicContact CD2-CZ 4.32Å; L3413-T3475 HydrophobicContact CB-CG2 3.7Å; L3413-I3476 HydrophobicContact CD1-CD1 4.19Å; L3413-I3476 HydrophobicContact CD1-CG1 3.66Å; L3413-L3479 HydrophobicContact CB-CD2 4.46Å; L3413-L3479 HydrophobicContact CD2-CD2 3.93Å
3414S87.6Confident84.6Confident44 Ų4441.1 Ų41.131%0.30822%0.218SC..Hα-helixtrans-77.3-34.9179.264.10000113.9S3354 K3410 A3411 L3412 P3417S3354-S3414 WeakPolarHBondContact CB-OG 3.28Å; S3354-S3414 PolarHBondContact OG-OG 2.81Å; K3410-S3414 VanDerWaalsContact O-CB 3.28Å; K3410-S3414 WeakPolarHBondContact O-CB 3.35Å; K3410-S3414 PolarHBondContact O-N 3.43Å; K3410-S3414 PolarHBondContact O-OG 3.08Å; A3411-S3414 PolarHBondContact O-N 2.97Å; A3411-S3414 PolarHBondContact O-OG 2.84Å; L3412-S3414 VanDerWaalsContact C-N 3.26Å; L3412-S3414 PolarHBondContact O-N 2.62Å; S3414-P3417 WeakPolarHBondContact O-CD 3.3Å
3415G85.1Confident83.9Confident6 Ų641.8 Ų41.86%0.06222%0.222CC..Hα-helixtrans-87.9-10178.200000114.8A3411 L3412 D3418 Q3419A3411-G3415 PolarHBondContact O-N 3.37Å; L3412-G3415 PolarHBondContact O-N 2.7Å; G3415-D3418 PolarHBondContact O-N 2.74Å; G3415-Q3419 WeakPolarHBondContact O-CG 3.38Å; G3415-Q3419 PolarHBondContact O-N 3.45Å
3416F86.1Confident83.2Confident2 Ų241.9 Ų41.91%0.00922%0.222CC..Hα-helixtrans-57.1-43.9-179.2177-96.7000114.5F3362 L3412 D3418 Q3419 Q3420 V3426 L3430 L3479F3362-F3416 HydrophobicContact CZ-CD2 4.45Å; L3412-F3416 WeakPolarHBondContact O-CB 3.4Å; L3412-F3416 PolarHBondContact O-N 3.48Å; F3416-D3418 VanDerWaalsContact C-N 3.27Å; F3416-D3418 PolarHBondContact O-N 2.64Å; F3416-Q3419 PolarHBondContact O-N 2.96Å; F3416-Q3420 HydrophobicContact CD1-CB 4.38Å; F3416-Q3420 HydrophobicContact CD2-CB 4.26Å; F3416-Q3420 HydrophobicContact CE1-CB 3.87Å; F3416-Q3420 HydrophobicContact CE1-CG 4.32Å; F3416-Q3420 HydrophobicContact CE2-CB 3.73Å; F3416-Q3420 HydrophobicContact CZ-CB 3.52Å; F3416-Q3420 HydrophobicContact CZ-CG 4.4Å; F3416-Q3420 VanDerWaalsContact CZ-OE1 3.32Å; F3416-Q3420 WeakPolarHBondContact O-CB 3.37Å; F3416-Q3420 PolarHBondContact O-N 3.46Å; F3416-V3426 HydrophobicContact CD2-CG1 4.39Å; F3416-V3426 HydrophobicContact CE2-CG1 4.5Å; F3416-V3426 WeakPolarHBondContact CE2-O 3.33Å; F3416-L3430 HydrophobicContact CB-CD2 4.34Å; F3416-L3430 HydrophobicContact CD1-CD1 3.89Å; F3416-L3430 HydrophobicContact CD1-CD2 4.17Å; F3416-L3430 HydrophobicContact CD1-CG 4.1Å; F3416-L3430 HydrophobicContact CD2-CD1 4.29Å; F3416-L3430 HydrophobicContact CD2-CD2 4.08Å; F3416-L3430 HydrophobicContact CD2-CG 3.74Å; F3416-L3430 HydrophobicContact CE1-CD1 3.48Å; F3416-L3430 VanDerWaalsContact CE1-CD1 3.48Å; F3416-L3430 HydrophobicContact CE1-CG 4.03Å; F3416-L3430 HydrophobicContact CE2-CD1 3.93Å; F3416-L3430 HydrophobicContact CE2-CD2 4.48Å; F3416-L3430 HydrophobicContact CE2-CG 3.66Å; F3416-L3430 HydrophobicContact CG-CD1 4.27Å; F3416-L3430 HydrophobicContact CG-CD2 3.91Å; F3416-L3430 HydrophobicContact CG-CG 3.96Å; F3416-L3430 HydrophobicContact CZ-CD1 3.51Å; F3416-L3430 HydrophobicContact CZ-CG 3.81Å; F3416-L3479 HydrophobicContact CD1-CD1 4.45Å
3417P82.3Confident82.5Confident39 Ų3947 Ų4725%0.25325%0.247SC..Hα-helixtrans-57.9-36.2-178.7-26.736.7000114.4S3414 L3479S3414-P3417 WeakPolarHBondContact O-CD 3.3Å; P3417-L3479 HydrophobicContact CG-CD1 3.56Å
3418D79.8Confident82.1Confident136 Ų13644.7 Ų44.773%0.72724%0.236SC*.Hα-helixtrans-78.8-33.3-178.6-54.6-49.4000111.8G3415 F3416G3415-D3418 PolarHBondContact O-N 2.74Å; F3416-D3418 VanDerWaalsContact C-N 3.27Å; F3416-D3418 PolarHBondContact O-N 2.64Å
3419Q79.4Confident82Confident26 Ų2644.6 Ų44.612%0.12124%0.236CC..Hα-helixtrans-92.7-21.1-173.1-60.7-62.4-35.100113.8F3362 G3415 F3416 K3421 Q3422 V3426F3362-Q3419 HydrophobicContact CB-CG 4.36Å; F3362-Q3419 HydrophobicContact CD2-CB 4.16Å; F3362-Q3419 HydrophobicContact CD2-CG 3.79Å; F3362-Q3419 HydrophobicContact CE2-CB 4.33Å; F3362-Q3419 HydrophobicContact CE2-CG 4.35Å; F3362-Q3419 HydrophobicContact CG-CB 4.38Å; F3362-Q3419 HydrophobicContact CG-CG 4.09Å; G3415-Q3419 WeakPolarHBondContact O-CG 3.38Å; G3415-Q3419 PolarHBondContact O-N 3.45Å; F3416-Q3419 PolarHBondContact O-N 2.96Å; Q3419-K3421 PolarHBondContact O-N 3.1Å; Q3419-Q3422 WeakPolarHBondContact O-CB 3.47Å; Q3419-Q3422 PolarHBondContact O-N 2.99Å; Q3419-V3426 HydrophobicContact CB-CG1 3.75Å; Q3419-V3426 WeakPolarHBondContact O-CG1 3.46Å
3420Q75.8Confident81.7Confident27 Ų2744.7 Ų44.713%0.12624%0.236CC..THydrogen-bonded Turntrans-59-23.6-165.959.4165.7-0.700116.2F3416 Q3422 D3485F3416-Q3420 HydrophobicContact CD1-CB 4.38Å; F3416-Q3420 HydrophobicContact CD2-CB 4.26Å; F3416-Q3420 HydrophobicContact CE1-CB 3.87Å; F3416-Q3420 HydrophobicContact CE1-CG 4.32Å; F3416-Q3420 HydrophobicContact CE2-CB 3.73Å; F3416-Q3420 HydrophobicContact CZ-CB 3.52Å; F3416-Q3420 HydrophobicContact CZ-CG 4.4Å; F3416-Q3420 VanDerWaalsContact CZ-OE1 3.32Å; F3416-Q3420 WeakPolarHBondContact O-CB 3.37Å; F3416-Q3420 PolarHBondContact O-N 3.46Å; Q3420-Q3422 VanDerWaalsContact C-N 3.31Å; Q3420-D3485 PolarHBondContact NE2-OD2 3.22Å; Q3420-D3485 PolarHBondContact OE1-OD2 3.08Å
3421K73.4Confident81.6Confident175 Ų17543.4 Ų43.476%0.76123%0.23SC*.THydrogen-bonded Turntrans-82.6-5.1178.6-66.4172.8-177169.80113.3Q3419 E3484Q3419-K3421 PolarHBondContact O-N 3.1Å; K3421-E3484 IonicContact NZ-OE2 2.65Å
3422Q73.6Confident81.7Confident132 Ų13243.4 Ų43.462%0.61723%0.23SC*.SBendtrans-83.5-34.6-170.4-169.360.737.300115Q3419 Q3420Q3419-Q3422 WeakPolarHBondContact O-CB 3.47Å; Q3419-Q3422 PolarHBondContact O-N 2.99Å; Q3420-Q3422 VanDerWaalsContact C-N 3.31Å
3423S71.8Confident81.9Confident42 Ų4243.4 Ų43.429%0.29423%0.23SC..  trans-166162.7176690000113.3T3425 V3426 M3427S3423-T3425 PolarHBondContact O-N 3.43Å; S3423-T3425 PolarHBondContact OG-N 3.27Å; S3423-V3426 PolarHBondContact O-N 2.96Å; S3423-V3426 PolarHBondContact OG-N 3.35Å; S3423-M3427 PolarHBondContact O-N 3.45Å
3424V73.5Confident82.1Confident94 Ų9443.5 Ų43.557%0.5723%0.23SC*.Hα-helixtrans-58.1-34.3171.7-1780000111.7V3426 M3427 S3428V3424-V3426 VanDerWaalsContact C-N 3.32Å; V3424-V3426 PolarHBondContact O-N 3.17Å; V3424-M3427 PolarHBondContact O-N 2.95Å; V3424-S3428 PolarHBondContact O-N 2.93Å; V3424-S3428 PolarHBondContact O-OG 3.5Å
3425T73.4Confident82.3Confident32 Ų3241.5 Ų41.520%0.19622%0.216CC..Hα-helixtrans-66.6-31.9176.3-44.50000112.5L3363 S3423 S3428 S3429L3363-T3425 HydrophobicContact CD2-CG2 3.94Å; S3423-T3425 PolarHBondContact O-N 3.43Å; S3423-T3425 PolarHBondContact OG-N 3.27Å; T3425-S3428 PolarHBondContact O-OG 2.71Å; T3425-S3429 PolarHBondContact O-N 3.31Å
3426V77.8Confident82.8Confident3 Ų341.2 Ų41.22%0.01821%0.213CC..Hα-helixtrans-75.2-43169.9-177.90000110.3F3362 L3363 F3416 Q3419 S3423 V3424 S3428 S3429F3362-V3426 HydrophobicContact CD1-CG1 4.27Å; F3362-V3426 HydrophobicContact CD1-CG2 4.16Å; F3362-V3426 HydrophobicContact CE1-CB 4.36Å; F3362-V3426 HydrophobicContact CE1-CG1 3.66Å; F3362-V3426 HydrophobicContact CE1-CG2 4.2Å; F3362-V3426 HydrophobicContact CZ-CG1 3.96Å; L3363-V3426 HydrophobicContact CD2-CG2 4.24Å; F3416-V3426 HydrophobicContact CD2-CG1 4.39Å; F3416-V3426 HydrophobicContact CE2-CG1 4.5Å; F3416-V3426 WeakPolarHBondContact CE2-O 3.33Å; Q3419-V3426 HydrophobicContact CB-CG1 3.75Å; Q3419-V3426 WeakPolarHBondContact O-CG1 3.46Å; S3423-V3426 PolarHBondContact O-N 2.96Å; S3423-V3426 PolarHBondContact OG-N 3.35Å; V3424-V3426 VanDerWaalsContact C-N 3.32Å; V3424-V3426 PolarHBondContact O-N 3.17Å; V3426-S3428 PolarHBondContact O-N 3.39Å; V3426-S3429 VanDerWaalsContact O-CB 3.22Å; V3426-S3429 WeakPolarHBondContact O-CB 3.28Å; V3426-S3429 PolarHBondContact O-N 3.11Å; V3426-S3429 PolarHBondContact O-OG 3.19Å
3427M77.9Confident83.2Confident106 Ų10641.1 Ų41.152%0.52221%0.212SC..Hα-helixtrans-57.2-33.3176.8-165.2-170.7-171.700112.6S3423 V3424 I3488S3423-M3427 PolarHBondContact O-N 3.45Å; V3424-M3427 PolarHBondContact O-N 2.95Å; M3427-I3488 HydrophobicContact CE-CD1 4.15Å
3428S82.9Confident83.8Confident13 Ų1339.5 Ų39.59%0.09120%0.201CC..Hα-helixtrans-84.9-11.5174.862.50000115.1V3424 T3425 V3426 L3430 Y3431 H3701V3424-S3428 PolarHBondContact O-N 2.93Å; V3424-S3428 PolarHBondContact O-OG 3.5Å; T3425-S3428 PolarHBondContact O-OG 2.71Å; V3426-S3428 PolarHBondContact O-N 3.39Å; S3428-L3430 VanDerWaalsContact C-N 3.25Å; S3428-L3430 PolarHBondContact O-N 3.06Å; S3428-Y3431 VanDerWaalsContact O-CB 3.28Å; S3428-Y3431 WeakPolarHBondContact O-CB 3.25Å; S3428-Y3431 PolarHBondContact O-N 2.77Å; S3428-H3701 WeakPolarHBondContact CB-CE1 3.43Å; S3428-H3701 WeakPolarHBondContact CB-NE2 3.43Å; S3428-H3701 PolarHBondContact OG-CE1 3.19Å; S3428-H3701 PolarHBondContact OG-NE2 3.26Å
3429S87.5Confident84.4Confident1 Ų133 Ų331%0.00717%0.167CC..Hα-helixtrans-53.9-39.2179.866.10000113.4F3362 T3425 V3426 Y3431 H3432 V3433F3362-S3429 WeakPolarHBondContact CZ-OG 3.47Å; T3425-S3429 PolarHBondContact O-N 3.31Å; V3426-S3429 VanDerWaalsContact O-CB 3.22Å; V3426-S3429 WeakPolarHBondContact O-CB 3.28Å; V3426-S3429 PolarHBondContact O-N 3.11Å; V3426-S3429 PolarHBondContact O-OG 3.19Å; S3429-Y3431 PolarHBondContact O-N 3.49Å; S3429-H3432 PolarHBondContact O-N 3.17Å; S3429-H3432 VanDerWaalsContact O-N 3.09Å; S3429-V3433 WeakPolarHBondContact O-CG2 3.39Å; S3429-V3433 PolarHBondContact O-N 2.86Å
3430L88.5Confident85.1Confident2 Ų231.8 Ų31.81%0.0116%0.161CC..Hα-helixtrans-56.9-35174.4-73.2-175.8000112.8L3413 F3416 S3428 V3433 F3434 L3479 I3488 V3489L3413-L3430 HydrophobicContact CD2-CD2 3.79Å; F3416-L3430 HydrophobicContact CB-CD2 4.34Å; F3416-L3430 HydrophobicContact CD1-CD1 3.89Å; F3416-L3430 HydrophobicContact CD1-CD2 4.17Å; F3416-L3430 HydrophobicContact CD1-CG 4.1Å; F3416-L3430 HydrophobicContact CD2-CD1 4.29Å; F3416-L3430 HydrophobicContact CD2-CD2 4.08Å; F3416-L3430 HydrophobicContact CD2-CG 3.74Å; F3416-L3430 HydrophobicContact CE1-CD1 3.48Å; F3416-L3430 VanDerWaalsContact CE1-CD1 3.48Å; F3416-L3430 HydrophobicContact CE1-CG 4.03Å; F3416-L3430 HydrophobicContact CE2-CD1 3.93Å; F3416-L3430 HydrophobicContact CE2-CD2 4.48Å; F3416-L3430 HydrophobicContact CE2-CG 3.66Å; F3416-L3430 HydrophobicContact CG-CD1 4.27Å; F3416-L3430 HydrophobicContact CG-CD2 3.91Å; F3416-L3430 HydrophobicContact CG-CG 3.96Å; F3416-L3430 HydrophobicContact CZ-CD1 3.51Å; F3416-L3430 HydrophobicContact CZ-CG 3.81Å; S3428-L3430 VanDerWaalsContact C-N 3.25Å; S3428-L3430 PolarHBondContact O-N 3.06Å; L3430-V3433 PolarHBondContact O-N 2.94Å; L3430-F3434 HydrophobicContact CB-CD2 4.37Å; L3430-F3434 HydrophobicContact CD2-CE2 4.27Å; L3430-F3434 WeakPolarHBondContact O-CB 3.4Å; L3430-F3434 VanDerWaalsContact O-CD2 3.24Å; L3430-F3434 WeakPolarHBondContact O-CD2 3.44Å; L3430-F3434 PolarHBondContact O-N 2.89Å; L3430-L3479 HydrophobicContact CD2-CD2 4.43Å; L3430-I3488 HydrophobicContact CD1-CG2 4.27Å; L3430-V3489 HydrophobicContact CD1-CG2 4.1Å
3431Y89.2Confident85.9Confident26 Ų2630.5 Ų30.510%0.10216%0.155CC..Hα-helixtrans-61.1-49175.6169.7-97.4000110.7S3428 S3429 V3433 F3434 L3435 V3693 N3697S3428-Y3431 VanDerWaalsContact O-CB 3.28Å; S3428-Y3431 WeakPolarHBondContact O-CB 3.25Å; S3428-Y3431 PolarHBondContact O-N 2.77Å; S3429-Y3431 PolarHBondContact O-N 3.49Å; Y3431-V3433 VanDerWaalsContact C-N 3.33Å; Y3431-V3433 PolarHBondContact O-N 2.85Å; Y3431-F3434 PolarHBondContact O-N 3.39Å; Y3431-L3435 HydrophobicContact CE1-CD2 3.91Å; Y3431-L3435 WeakPolarHBondContact O-CB 3.38Å; Y3431-L3435 PolarHBondContact O-N 3.15Å; Y3431-V3693 WeakPolarHBondContact OH-CG1 3.28Å; Y3431-N3697 WeakPolarHBondContact CE1-ND2 3.33Å
3432H90.8Very high86.8Confident3 Ų322.5 Ų22.51%0.01412%0.12CC..Hα-helixtrans-65.1-36.3179.6-61.7-68.2000112.3V3369 R3370 S3429 L3436 H3701V3369-H3432 HydrophobicContact CG1-CB 4.07Å; V3369-H3432 WeakPolarHBondContact CG1-O 3.08Å; R3370-H3432 HydrophobicContact CG-CB 4.24Å; S3429-H3432 PolarHBondContact O-N 3.17Å; S3429-H3432 VanDerWaalsContact O-N 3.09Å; H3432-L3436 WeakPolarHBondContact O-CB 3.46Å; H3432-L3436 PolarHBondContact O-N 2.71Å; H3432-H3701 AromaticContact NE2-CD2 3.93Å
3433V93.3Very high87.6Confident1 Ų116.2 Ų16.21%0.0069%0.091CC..Hα-helixtrans-66.6-47.3176.1175.60000112.1V3369 V3409 L3412 L3413 S3429 L3430 Y3431 L3436 C3437V3369-V3433 HydrophobicContact CG1-CG2 4.45Å; V3409-V3433 HydrophobicContact CG1-CG1 3.89Å; V3409-V3433 HydrophobicContact CG2-CG1 4.46Å; L3412-V3433 HydrophobicContact CB-CG2 3.84Å; L3412-V3433 HydrophobicContact CD1-CG2 3.55Å; L3412-V3433 HydrophobicContact CG-CG2 4.33Å; L3413-V3433 HydrophobicContact CD1-CG1 4.39Å; L3413-V3433 HydrophobicContact CD2-CG1 3.89Å; L3413-V3433 HydrophobicContact CG-CG1 3.91Å; S3429-V3433 WeakPolarHBondContact O-CG2 3.39Å; S3429-V3433 PolarHBondContact O-N 2.86Å; L3430-V3433 PolarHBondContact O-N 2.94Å; Y3431-V3433 VanDerWaalsContact C-N 3.33Å; Y3431-V3433 PolarHBondContact O-N 2.85Å; V3433-L3436 PolarHBondContact O-N 2.87Å; V3433-C3437 PolarHBondContact O-N 3.19Å; V3433-C3437 VanDerWaalsContact O-N 3.13Å; V3433-C3437 PolarHBondContact O-SG 3.33Å
3434F93.5Very high88.5Confident3 Ų314.2 Ų14.21%0.0138%0.077CC..Hα-helixtrans-72-30.1178.3-78.1-69000112.5L3413 L3430 Y3431 C3437 Q3438 I3476 V3489 R3492 L3493 V3496L3413-F3434 HydrophobicContact CD2-CE2 4.29Å; L3413-F3434 HydrophobicContact CD2-CZ 4.32Å; L3430-F3434 HydrophobicContact CB-CD2 4.37Å; L3430-F3434 HydrophobicContact CD2-CE2 4.27Å; L3430-F3434 WeakPolarHBondContact O-CB 3.4Å; L3430-F3434 VanDerWaalsContact O-CD2 3.24Å; L3430-F3434 WeakPolarHBondContact O-CD2 3.44Å; L3430-F3434 PolarHBondContact O-N 2.89Å; Y3431-F3434 PolarHBondContact O-N 3.39Å; F3434-C3437 WeakPolarHBondContact O-CB 3.49Å; F3434-C3437 PolarHBondContact O-N 3.49Å; F3434-Q3438 WeakPolarHBondContact O-CG 3.17Å; F3434-Q3438 PolarHBondContact O-N 3.38Å; F3434-Q3438 VanDerWaalsContact O-N 3.1Å; F3434-I3476 HydrophobicContact CE1-CD1 4.04Å; F3434-V3489 HydrophobicContact CE2-CG1 4.48Å; F3434-V3489 HydrophobicContact CZ-CG1 4.23Å; F3434-R3492 HydrophobicContact CB-CB 4.22Å; F3434-R3492 HydrophobicContact CD2-CB 3.26Å; F3434-R3492 HydrophobicContact CD2-CG 3.99Å; F3434-R3492 HydrophobicContact CE2-CB 3.67Å; F3434-R3492 HydrophobicContact CE2-CG 4.43Å; F3434-R3492 HydrophobicContact CG-CB 3.8Å; F3434-R3492 HydrophobicContact CZ-CB 4.47Å; F3434-L3493 HydrophobicContact CE1-CB 4.38Å; F3434-L3493 HydrophobicContact CE1-CD1 4.45Å; F3434-V3496 HydrophobicContact CB-CG2 3.89Å; F3434-V3496 HydrophobicContact CD1-CG2 3.73Å; F3434-V3496 HydrophobicContact CG-CG2 4.21Å
3435L93.3Very high89.1Confident2 Ų211.3 Ų11.31%0.016%0.058CC..Hα-helixtrans-61.6-47.8168.4176.564.5000111.2Y3431 C3437 Q3438 V3439 H3690 L3694Y3431-L3435 HydrophobicContact CE1-CD2 3.91Å; Y3431-L3435 WeakPolarHBondContact O-CB 3.38Å; Y3431-L3435 PolarHBondContact O-N 3.15Å; L3435-C3437 PolarHBondContact O-N 3.26Å; L3435-Q3438 WeakPolarHBondContact O-CB 3.44Å; L3435-Q3438 PolarHBondContact O-N 3.35Å; L3435-V3439 HydrophobicContact CD1-CG2 3.92Å; L3435-V3439 HydrophobicContact CG-CG2 4.27Å; L3435-V3439 WeakPolarHBondContact O-CG2 3.41Å; L3435-V3439 PolarHBondContact O-N 3.38Å; L3435-H3690 WeakPolarHBondContact CD1-ND1 3.28Å; L3435-L3694 HydrophobicContact CD2-CB 4.31Å; L3435-L3694 HydrophobicContact CD2-CD1 3.84Å; L3435-L3694 HydrophobicContact CD2-CD2 4.08Å; L3435-L3694 HydrophobicContact CD2-CG 4.3Å
3436L94.9Very high89.8Confident0 Ų010.3 Ų10.30%05%0.051CC..Hα-helixtrans-57.1-38.2175.217760.4000111.4V3369 L3372 L3376 V3405 V3409 H3432 V3433 Q3438 W3440V3369-L3436 HydrophobicContact CB-CD2 4.27Å; V3369-L3436 HydrophobicContact CG1-CB 3.99Å; V3369-L3436 HydrophobicContact CG1-CD2 3.9Å; V3369-L3436 HydrophobicContact CG2-CD2 3.86Å; L3372-L3436 HydrophobicContact CB-CD1 4.25Å; L3372-L3436 HydrophobicContact CD2-CD1 3.98Å; L3372-L3436 HydrophobicContact CD2-CD2 4.03Å; L3372-L3436 HydrophobicContact CG-CD1 4.21Å; L3376-L3436 HydrophobicContact CD1-CD1 3.49Å; L3376-L3436 VanDerWaalsContact CD1-CD1 3.49Å; V3405-L3436 HydrophobicContact CG1-CD2 4.41Å; V3409-L3436 HydrophobicContact CG2-CD2 3.9Å; H3432-L3436 WeakPolarHBondContact O-CB 3.46Å; H3432-L3436 PolarHBondContact O-N 2.71Å; V3433-L3436 PolarHBondContact O-N 2.87Å; L3436-Q3438 PolarHBondContact O-N 3.5Å; L3436-W3440 WeakPolarHBondContact O-CB 3.3Å; L3436-W3440 PolarHBondContact O-N 3.43Å
3437C94.9Very high90.1Very high0 Ų010.2 Ų10.20%05%0.051CC..Hα-helixtrans-63.8-38.7175.2-60.10000112.7V3433 F3434 L3435 T3441 F3468 W3469V3433-C3437 PolarHBondContact O-N 3.19Å; V3433-C3437 VanDerWaalsContact O-N 3.13Å; V3433-C3437 PolarHBondContact O-SG 3.33Å; F3434-C3437 WeakPolarHBondContact O-CB 3.49Å; F3434-C3437 PolarHBondContact O-N 3.49Å; L3435-C3437 PolarHBondContact O-N 3.26Å; C3437-T3441 WeakPolarHBondContact O-CB 3.37Å; C3437-T3441 PolarHBondContact O-N 3.33Å; C3437-T3441 PolarHBondContact O-OG1 3.28Å; C3437-F3468 HydrophobicContact CB-CE1 4.18Å; C3437-F3468 HydrophobicContact CB-CZ 4.38Å; C3437-W3469 HydrophobicContact CB-CH2 3.84Å; C3437-W3469 HydrophobicContact CB-CZ2 3.84Å
3438Q93.7Very high90.5Very high5 Ų55.2 Ų5.22%0.0233%0.026CC..Hα-helixtrans-64.4-56.4174.2-66.11620.800110.7F3434 L3435 L3436 W3440 T3441 I3442 T3495 V3496 E3499 W3686 H3690F3434-Q3438 WeakPolarHBondContact O-CG 3.17Å; F3434-Q3438 PolarHBondContact O-N 3.38Å; F3434-Q3438 VanDerWaalsContact O-N 3.1Å; L3435-Q3438 WeakPolarHBondContact O-CB 3.44Å; L3435-Q3438 PolarHBondContact O-N 3.35Å; L3436-Q3438 PolarHBondContact O-N 3.5Å; Q3438-W3440 PolarHBondContact O-N 3.34Å; Q3438-T3441 WeakPolarHBondContact O-CB 3.31Å; Q3438-T3441 PolarHBondContact O-N 3.38Å; Q3438-T3441 VanDerWaalsContact O-N 3.14Å; Q3438-I3442 PolarHBondContact O-N 3.23Å; Q3438-T3495 PolarHBondContact NE2-O 3.05Å; Q3438-V3496 HydrophobicContact CG-CB 4.16Å; Q3438-V3496 HydrophobicContact CG-CG1 3.88Å; Q3438-V3496 HydrophobicContact CG-CG2 3.98Å; Q3438-E3499 HydrophobicContact CG-CB 4.27Å; Q3438-W3686 HydrophobicContact CB-CH2 4.31Å; Q3438-W3686 HydrophobicContact CB-CZ2 4.21Å; Q3438-H3690 PolarHBondContact OE1-CE1 3.04Å; Q3438-H3690 VanDerWaalsContact OE1-CE1 3.25Å
3439V93.7Very high90.4Very high0 Ų06.5 Ų6.50%04%0.035CC..Hα-helixtrans-65.7-37.6-175-172.70000111.2L3376 L3377 L3435 T3441 I3442 Y3443 W3686L3376-V3439 HydrophobicContact CB-CG1 3.58Å; L3377-V3439 HydrophobicContact CD2-CG1 3.95Å; L3377-V3439 HydrophobicContact CD2-CG2 3.8Å; L3377-V3439 HydrophobicContact CG-CG1 3.97Å; L3377-V3439 HydrophobicContact CG-CG2 4.07Å; L3435-V3439 HydrophobicContact CD1-CG2 3.92Å; L3435-V3439 HydrophobicContact CG-CG2 4.27Å; L3435-V3439 WeakPolarHBondContact O-CG2 3.41Å; L3435-V3439 PolarHBondContact O-N 3.38Å; V3439-T3441 VanDerWaalsContact C-N 3.34Å; V3439-T3441 PolarHBondContact O-N 2.91Å; V3439-I3442 PolarHBondContact O-N 3.27Å; V3439-Y3443 WeakPolarHBondContact O-CB 3.31Å; V3439-Y3443 PolarHBondContact O-N 2.85Å; V3439-W3686 HydrophobicContact CG2-CH2 4.25Å
3440W94Very high89.9Confident0 Ų09 Ų90%05%0.048CC..Hα-helixtrans-61-41.2173.2-177.2-94.7000112.4L3376 I3397 V3402 V3405 L3436 Q3438 Y3443 C3444 F3468L3376-W3440 HydrophobicContact CD1-CE3 3.77Å; L3376-W3440 HydrophobicContact CD1-CZ3 4.42Å; L3376-W3440 HydrophobicContact CD2-CE3 4.01Å; L3376-W3440 HydrophobicContact CD2-CZ3 4.17Å; I3397-W3440 HydrophobicContact CD1-CZ3 4.29Å; I3397-W3440 HydrophobicContact CG2-CH2 4.01Å; I3397-W3440 HydrophobicContact CG2-CZ3 4Å; V3402-W3440 HydrophobicContact CG2-CZ2 3.7Å; V3405-W3440 HydrophobicContact CB-CZ3 4.49Å; V3405-W3440 HydrophobicContact CG1-CD2 4.21Å; V3405-W3440 HydrophobicContact CG1-CE3 4.01Å; V3405-W3440 HydrophobicContact CG1-CZ3 4.33Å; V3405-W3440 HydrophobicContact CG2-CE3 4.4Å; V3405-W3440 HydrophobicContact CG2-CH2 4.09Å; V3405-W3440 HydrophobicContact CG2-CZ3 3.9Å; L3436-W3440 WeakPolarHBondContact O-CB 3.3Å; L3436-W3440 PolarHBondContact O-N 3.43Å; Q3438-W3440 PolarHBondContact O-N 3.34Å; W3440-Y3443 HydrophobicContact CE3-CD1 4.49Å; W3440-Y3443 HydrophobicContact CZ3-CD1 4.42Å; W3440-Y3443 PolarHBondContact O-N 2.73Å; W3440-C3444 PolarHBondContact NE1-SG 3.33Å; W3440-C3444 VanDerWaalsContact NE1-SG 3.44Å; W3440-C3444 PolarHBondContact O-N 2.85Å; W3440-C3444 PolarHBondContact O-SG 2.66Å; W3440-F3468 AromaticContact CD1-CD1 3.61Å; W3440-F3468 AromaticContact CD1-CD2 3.86Å; W3440-F3468 AromaticContact CD1-CE1 4Å; W3440-F3468 AromaticContact CD1-CG 3.53Å; W3440-F3468 HydrophobicContact CG-CD2 4.5Å; W3440-F3468 AromaticContact NE1-CD2 3.9Å; W3440-F3468 AromaticContact NE1-CG 3.66Å
3441T92.6Very high89.4Confident0 Ų09.5 Ų9.50%05%0.052CC..Hα-helixtrans-64.7-47.2178.6-57.20000110.9C3437 Q3438 V3439 C3444 E3445 W3469 L3500 L3507C3437-T3441 WeakPolarHBondContact O-CB 3.37Å; C3437-T3441 PolarHBondContact O-N 3.33Å; C3437-T3441 PolarHBondContact O-OG1 3.28Å; Q3438-T3441 WeakPolarHBondContact O-CB 3.31Å; Q3438-T3441 PolarHBondContact O-N 3.38Å; Q3438-T3441 VanDerWaalsContact O-N 3.14Å; V3439-T3441 VanDerWaalsContact C-N 3.34Å; V3439-T3441 PolarHBondContact O-N 2.91Å; T3441-C3444 PolarHBondContact O-N 3.39Å; T3441-E3445 PolarHBondContact O-N 3.17Å; T3441-W3469 PolarHBondContact OG1-NE1 3.17Å; T3441-L3500 HydrophobicContact CG2-CD1 4.14Å; T3441-L3500 HydrophobicContact CG2-CD2 3.86Å; T3441-L3507 HydrophobicContact CG2-CB 4.14Å; T3441-L3507 HydrophobicContact CG2-CD1 3.63Å
3442I91.2Very high88.8Confident7 Ų712.3 Ų12.34%0.0367%0.073CC..Hα-helixtrans-69.6-33.9177.8-59.7-57.4000112T3380 Q3438 V3439 E3445 T3446 L3500 C3503 L3683 W3686T3380-I3442 HydrophobicContact CG2-CG2 4.13Å; Q3438-I3442 PolarHBondContact O-N 3.23Å; V3439-I3442 PolarHBondContact O-N 3.27Å; I3442-E3445 PolarHBondContact O-N 3.43Å; I3442-T3446 HydrophobicContact CG2-CG2 4.3Å; I3442-T3446 WeakPolarHBondContact O-CB 3.33Å; I3442-T3446 WeakPolarHBondContact O-CG2 3.44Å; I3442-T3446 PolarHBondContact O-N 3.26Å; I3442-T3446 PolarHBondContact O-OG1 3.01Å; I3442-L3500 HydrophobicContact CD1-CD2 3.64Å; I3442-L3500 HydrophobicContact CG1-CD2 3.85Å; I3442-C3503 HydrophobicContact CD1-CB 3.65Å; I3442-C3503 HydrophobicContact CG1-CB 4.47Å; I3442-L3683 HydrophobicContact CG2-CD1 3.63Å; I3442-W3686 HydrophobicContact CB-CH2 4.35Å; I3442-W3686 HydrophobicContact CB-CZ3 4.22Å; I3442-W3686 HydrophobicContact CG1-CH2 3.85Å; I3442-W3686 HydrophobicContact CG1-CZ2 4.31Å; I3442-W3686 HydrophobicContact CG1-CZ3 4.06Å; I3442-W3686 HydrophobicContact CG2-CZ3 4.19Å
3443Y91.5Very high88Confident1 Ų116.1 Ų16.10%0.00410%0.097CC..Hα-helixtrans-61-47.6171.2173.2-106.5000111.4L3376 A3379 M3383 R3395 I3397 L3399 V3439 W3440 E3445 T3446 V3447L3376-Y3443 HydrophobicContact CD2-CD1 3.48Å; L3376-Y3443 VanDerWaalsContact CD2-CD1 3.48Å; L3376-Y3443 HydrophobicContact CD2-CD2 3.79Å; L3376-Y3443 HydrophobicContact CD2-CE1 3.88Å; L3376-Y3443 HydrophobicContact CD2-CE2 4.18Å; L3376-Y3443 HydrophobicContact CD2-CG 3.42Å; L3376-Y3443 VanDerWaalsContact CD2-CG 3.42Å; A3379-Y3443 HydrophobicContact CB-CD2 4.42Å; A3379-Y3443 HydrophobicContact CB-CE2 4.11Å; M3383-Y3443 HydrophobicContact CE-CD2 3.57Å; M3383-Y3443 HydrophobicContact CE-CE2 3.72Å; R3395-Y3443 WeakPolarHBondContact CA-OH 3.41Å; I3397-Y3443 PolarHBondContact O-OH 2.88Å; L3399-Y3443 HydrophobicContact CD2-CE1 4.17Å; V3439-Y3443 WeakPolarHBondContact O-CB 3.31Å; V3439-Y3443 PolarHBondContact O-N 2.85Å; W3440-Y3443 HydrophobicContact CE3-CD1 4.49Å; W3440-Y3443 HydrophobicContact CZ3-CD1 4.42Å; W3440-Y3443 PolarHBondContact O-N 2.73Å; Y3443-E3445 VanDerWaalsContact C-N 3.31Å; Y3443-E3445 PolarHBondContact O-N 3.21Å; Y3443-T3446 WeakPolarHBondContact CA-OG1 3.39Å; Y3443-T3446 PolarHBondContact O-N 3.35Å; Y3443-T3446 PolarHBondContact O-OG1 2.84Å; Y3443-V3447 HydrophobicContact CD1-CG2 4.4Å; Y3443-V3447 HydrophobicContact CD2-CG2 4.02Å; Y3443-V3447 HydrophobicContact CE1-CG2 4.09Å; Y3443-V3447 HydrophobicContact CE2-CG2 3.65Å; Y3443-V3447 HydrophobicContact CG-CG2 4.38Å; Y3443-V3447 VanDerWaalsContact O-CB 3.27Å; Y3443-V3447 WeakPolarHBondContact O-CB 3.08Å; Y3443-V3447 VanDerWaalsContact O-CG2 3.23Å; Y3443-V3447 WeakPolarHBondContact O-CG2 3.48Å; Y3443-V3447 PolarHBondContact O-N 3.38Å
3444C89.8Confident87.2Confident0 Ų022.7 Ų22.70%013%0.132CC..Hα-helixtrans-63.5-37.7176.9-64.20000112.1W3440 T3441 A3448 A3465W3440-C3444 PolarHBondContact NE1-SG 3.33Å; W3440-C3444 VanDerWaalsContact NE1-SG 3.44Å; W3440-C3444 PolarHBondContact O-N 2.85Å; W3440-C3444 PolarHBondContact O-SG 2.66Å; T3441-C3444 PolarHBondContact O-N 3.39Å; C3444-A3448 WeakPolarHBondContact O-CB 3.31Å; C3444-A3448 PolarHBondContact O-N 3.4Å; C3444-A3465 HydrophobicContact CB-CB 3.78Å
3445E87.8Confident86.8Confident33 Ų3324 Ų2415%0.15414%0.141CC..Hα-helixtrans-70-38.1177.8-179.1151.6-14400113.3T3441 I3442 Y3443 A3448 S3449 M3462 S3505 S3506 L3507T3441-E3445 PolarHBondContact O-N 3.17Å; I3442-E3445 PolarHBondContact O-N 3.43Å; Y3443-E3445 VanDerWaalsContact C-N 3.31Å; Y3443-E3445 PolarHBondContact O-N 3.21Å; E3445-A3448 PolarHBondContact O-N 3.34Å; E3445-S3449 WeakPolarHBondContact O-CB 3.42Å; E3445-S3449 PolarHBondContact O-N 3.42Å; E3445-M3462 HydrophobicContact CB-CE 4.08Å; E3445-M3462 HydrophobicContact CG-CE 3.92Å; E3445-S3505 VanDerWaalsContact OE2-CA 3.27Å; E3445-S3505 WeakPolarHBondContact OE2-CA 3.44Å; E3445-S3505 WeakPolarHBondContact OE2-CB 3.38Å; E3445-S3505 PolarHBondContact OE2-OG 3.37Å; E3445-S3506 VanDerWaalsContact OE1-CB 3.24Å; E3445-S3506 WeakPolarHBondContact OE1-CB 3.36Å; E3445-S3506 PolarHBondContact OE1-N 3.49Å; E3445-S3506 PolarHBondContact OE1-OG 3.02Å; E3445-S3506 PolarHBondContact OE2-N 2.86Å; E3445-L3507 HydrophobicContact CB-CD1 4.23Å
3446T86.7Confident86.4Confident11 Ų1130.1 Ų30.17%0.06717%0.174CC..Hα-helixtrans-73-39.917449.20000112.3T3380 M3383 I3442 Y3443 A3448 S3449 L3450 L3683T3380-T3446 HydrophobicContact CG2-CG2 4.01Å; M3383-T3446 WeakPolarHBondContact CE-OG1 3.33Å; I3442-T3446 HydrophobicContact CG2-CG2 4.3Å; I3442-T3446 WeakPolarHBondContact O-CB 3.33Å; I3442-T3446 WeakPolarHBondContact O-CG2 3.44Å; I3442-T3446 PolarHBondContact O-N 3.26Å; I3442-T3446 PolarHBondContact O-OG1 3.01Å; Y3443-T3446 WeakPolarHBondContact CA-OG1 3.39Å; Y3443-T3446 PolarHBondContact O-N 3.35Å; Y3443-T3446 PolarHBondContact O-OG1 2.84Å; T3446-A3448 VanDerWaalsContact C-N 3.26Å; T3446-A3448 PolarHBondContact O-N 2.88Å; T3446-S3449 PolarHBondContact O-N 2.97Å; T3446-S3449 VanDerWaalsContact O-N 3.08Å; T3446-S3449 PolarHBondContact O-OG 3.45Å; T3446-S3449 VanDerWaalsContact O-OG 3.12Å; T3446-L3450 PolarHBondContact O-N 3.23Å; T3446-L3683 HydrophobicContact CG2-CD1 4.46Å; T3446-L3683 HydrophobicContact CG2-CD2 3.57Å
3447V85Confident85.8Confident1 Ų135 Ų351%0.00620%0.197CC..Hα-helixtrans-59.4-37.8171.3165.40000111.6M3383 R3395 L3399 Y3443 A3461M3383-V3447 HydrophobicContact CE-CG2 3.92Å; M3383-V3447 HydrophobicContact SD-CG2 3.89Å; R3395-V3447 HydrophobicContact CG-CG2 4.16Å; R3395-V3447 PolarHBondContact NH2-O 2.65Å; L3399-V3447 HydrophobicContact CD1-CG1 3.91Å; L3399-V3447 HydrophobicContact CD2-CG1 4.28Å; L3399-V3447 HydrophobicContact CG-CG1 4.46Å; Y3443-V3447 HydrophobicContact CD1-CG2 4.4Å; Y3443-V3447 HydrophobicContact CD2-CG2 4.02Å; Y3443-V3447 HydrophobicContact CE1-CG2 4.09Å; Y3443-V3447 HydrophobicContact CE2-CG2 3.65Å; Y3443-V3447 HydrophobicContact CG-CG2 4.38Å; Y3443-V3447 VanDerWaalsContact O-CB 3.27Å; Y3443-V3447 WeakPolarHBondContact O-CB 3.08Å; Y3443-V3447 VanDerWaalsContact O-CG2 3.23Å; Y3443-V3447 WeakPolarHBondContact O-CG2 3.48Å; Y3443-V3447 PolarHBondContact O-N 3.38Å; V3447-A3461 HydrophobicContact CG1-CB 4.27Å
3448A84.6Confident85.3Confident0 Ų037.1 Ų37.10%021%0.205CC..Hα-helixtrans-67.6-41.7172.300000111.9C3444 E3445 T3446 L3450 S3451 Y3458 A3461 M3462C3444-A3448 WeakPolarHBondContact O-CB 3.31Å; C3444-A3448 PolarHBondContact O-N 3.4Å; E3445-A3448 PolarHBondContact O-N 3.34Å; T3446-A3448 VanDerWaalsContact C-N 3.26Å; T3446-A3448 PolarHBondContact O-N 2.88Å; A3448-L3450 PolarHBondContact O-N 3.39Å; A3448-S3451 PolarHBondContact O-N 2.91Å; A3448-S3451 VanDerWaalsContact O-O 3.09Å; A3448-Y3458 HydrophobicContact CB-CD2 3.71Å; A3448-Y3458 HydrophobicContact CB-CE2 4.01Å; A3448-Y3458 HydrophobicContact CB-CG 4.36Å; A3448-Y3458 WeakPolarHBondContact O-CD2 3.41Å; A3448-A3461 HydrophobicContact CB-CB 3.72Å; A3448-M3462 HydrophobicContact CB-CE 3.65Å; A3448-M3462 HydrophobicContact CB-CG 4.33Å
3449S81.5Confident85Confident40 Ų4042.3 Ų42.328%0.2823%0.228SC..Hα-helixtrans-73-2.7-177.184.70000115.2R3387 E3445 T3446R3387-S3449 PolarHBondContact NE-OG 3.16Å; R3387-S3449 PolarHBondContact NH2-O 3.09Å; R3387-S3449 PolarHBondContact NH2-OG 3.39Å; E3445-S3449 WeakPolarHBondContact O-CB 3.42Å; E3445-S3449 PolarHBondContact O-N 3.42Å; T3446-S3449 PolarHBondContact O-N 2.97Å; T3446-S3449 VanDerWaalsContact O-N 3.08Å; T3446-S3449 PolarHBondContact O-OG 3.45Å; T3446-S3449 VanDerWaalsContact O-OG 3.12Å
3450L78Confident84.7Confident53 Ų5344.9 Ų44.928%0.27725%0.249SC..THydrogen-bonded Turntrans-80.72.6162.9-64.6175.8000113.1M3383 R3387 T3446 A3448M3383-L3450 HydrophobicContact CG-CD1 4.29Å; M3383-L3450 HydrophobicContact SD-CD1 3.72Å; R3387-L3450 HydrophobicContact CG-CD2 3.97Å; T3446-L3450 PolarHBondContact O-N 3.23Å; A3448-L3450 PolarHBondContact O-N 3.39Å
3451S77.1Confident84.3Confident14 Ų1445 Ų4510%0.09825%0.249CC..SBendtrans-137.4144.4-178.7-61.20000110.5A3448 V3453A3448-S3451 PolarHBondContact O-N 2.91Å; A3448-S3451 VanDerWaalsContact O-O 3.09Å; S3451-V3453 PolarHBondContact O-N 3.45Å
3452P76.3Confident84.1Confident85 Ų8545.6 Ų45.655%0.55225%0.252SS*.  trans-61.5141.4-179.223.3-31.6000110.5N3454 S3455P3452-N3454 PolarHBondContact O-N 3.32Å; P3452-S3455 WeakPolarHBondContact O-CB 3.47Å; P3452-S3455 PolarHBondContact O-N 2.95Å; P3452-S3455 PolarHBondContact O-OG 2.88Å
3453V75.7Confident84.1Confident83 Ų8347.9 Ų47.950%0.50327%0.273SS..THydrogen-bonded Turntrans-54.3-31.4-169179.30000113.4S3451 S3455 Y3458S3451-V3453 PolarHBondContact O-N 3.45Å; V3453-S3455 VanDerWaalsContact C-N 3.3Å; V3453-S3455 PolarHBondContact O-N 3.27Å; V3453-Y3458 HydrophobicContact CG1-CD1 4.12Å; V3453-Y3458 HydrophobicContact CG1-CE1 3.78Å; V3453-Y3458 HydrophobicContact CG2-CD2 4.48Å; V3453-Y3458 HydrophobicContact CG2-CE2 4.27Å; V3453-Y3458 WeakPolarHBondContact O-CD1 3.37Å
3454N76.3Confident84.1Confident138 Ų13849 Ų4974%0.73828%0.279SS*.THydrogen-bonded Turntrans-76.2-15.7-179.5-64.7-16.9000113.7P3452 K3459P3452-N3454 PolarHBondContact O-N 3.32Å; N3454-K3459 WeakPolarHBondContact O-CE 3.48Å; N3454-K3459 PolarHBondContact O-NZ 2.96Å
3455S84.9Confident84.1Confident30 Ų3049 Ų4921%0.2128%0.28CS..SBendtrans-69154.3-174.7700000113.8P3452 V3453 Q3457 Y3458 K3459P3452-S3455 WeakPolarHBondContact O-CB 3.47Å; P3452-S3455 PolarHBondContact O-N 2.95Å; P3452-S3455 PolarHBondContact O-OG 2.88Å; V3453-S3455 VanDerWaalsContact C-N 3.3Å; V3453-S3455 PolarHBondContact O-N 3.27Å; S3455-Q3457 VanDerWaalsContact C-N 3.25Å; S3455-Q3457 PolarHBondContact O-N 3.07Å; S3455-Y3458 PolarHBondContact O-N 3.24Å; S3455-Y3458 WeakPolarHBondContact OG-CB 3.25Å; S3455-Y3458 PolarHBondContact OG-N 2.86Å; S3455-Y3458 VanDerWaalsContact OG-N 3.12Å; S3455-K3459 WeakPolarHBondContact O-CG 3.33Å; S3455-K3459 PolarHBondContact O-N 3.46Å
3456N84.2Confident84.2Confident132 Ų13249.7 Ų49.771%0.70628%0.282SS*.Hα-helixtrans-66.7-27.1172.7-67.4-15.4000112.1A3460N3456-A3460 WeakPolarHBondContact O-CB 3.47Å; N3456-A3460 PolarHBondContact O-N 3.46Å
3457Q82.1Confident84.5Confident102 Ų10251.8 Ų51.848%0.47729%0.293SS..Hα-helixtrans-67-47.2174.8-66.3-164.932.800111.9S3455 K3459 A3460 A3461S3455-Q3457 VanDerWaalsContact C-N 3.25Å; S3455-Q3457 PolarHBondContact O-N 3.07Å; Q3457-K3459 PolarHBondContact O-N 3.36Å; Q3457-A3460 PolarHBondContact O-N 3.31Å; Q3457-A3461 WeakPolarHBondContact O-CB 3.4Å; Q3457-A3461 PolarHBondContact O-N 3.41Å
3458Y85.6Confident85Confident44 Ų4451.7 Ų51.717%0.17329%0.293CS..Hα-helixtrans-57.9-48.5174.9176.5-86.8000111.1A3448 V3453 S3455 A3460 A3461 M3462A3448-Y3458 HydrophobicContact CB-CD2 3.71Å; A3448-Y3458 HydrophobicContact CB-CE2 4.01Å; A3448-Y3458 HydrophobicContact CB-CG 4.36Å; A3448-Y3458 WeakPolarHBondContact O-CD2 3.41Å; V3453-Y3458 HydrophobicContact CG1-CD1 4.12Å; V3453-Y3458 HydrophobicContact CG1-CE1 3.78Å; V3453-Y3458 HydrophobicContact CG2-CD2 4.48Å; V3453-Y3458 HydrophobicContact CG2-CE2 4.27Å; V3453-Y3458 WeakPolarHBondContact O-CD1 3.37Å; S3455-Y3458 PolarHBondContact O-N 3.24Å; S3455-Y3458 WeakPolarHBondContact OG-CB 3.25Å; S3455-Y3458 PolarHBondContact OG-N 2.86Å; S3455-Y3458 VanDerWaalsContact OG-N 3.12Å; Y3458-A3460 PolarHBondContact O-N 3.31Å; Y3458-A3461 PolarHBondContact O-N 3.07Å; Y3458-M3462 HydrophobicContact CD1-CG 4.18Å; Y3458-M3462 HydrophobicContact CE1-CG 3.73Å; Y3458-M3462 HydrophobicContact CE2-CE 4.05Å; Y3458-M3462 HydrophobicContact CE2-CG 4.33Å; Y3458-M3462 WeakPolarHBondContact O-CB 3.32Å; Y3458-M3462 VanDerWaalsContact O-CG 3.3Å; Y3458-M3462 WeakPolarHBondContact O-CG 3.48Å; Y3458-M3462 PolarHBondContact O-N 3.02Å
3459K87.3Confident85.4Confident115 Ų11551.8 Ų51.850%0.529%0.293SS..Hα-helixtrans-61.7-42.2178.9-70166.6-179.9160.10112.4N3454 S3455 Q3457 A3463N3454-K3459 WeakPolarHBondContact O-CE 3.48Å; N3454-K3459 PolarHBondContact O-NZ 2.96Å; S3455-K3459 WeakPolarHBondContact O-CG 3.33Å; S3455-K3459 PolarHBondContact O-N 3.46Å; Q3457-K3459 PolarHBondContact O-N 3.36Å; K3459-A3463 VanDerWaalsContact O-CB 3.32Å; K3459-A3463 WeakPolarHBondContact O-CB 3.35Å; K3459-A3463 PolarHBondContact O-N 3.12Å
3460A87.3Confident85.9Confident54 Ų5455 Ų5545%0.44631%0.306SS..Hα-helixtrans-65-47.5177.600000112N3456 Q3457 Y3458 M3462 A3463 T3464N3456-A3460 WeakPolarHBondContact O-CB 3.47Å; N3456-A3460 PolarHBondContact O-N 3.46Å; Q3457-A3460 PolarHBondContact O-N 3.31Å; Y3458-A3460 PolarHBondContact O-N 3.31Å; A3460-M3462 VanDerWaalsContact C-N 3.35Å; A3460-M3462 PolarHBondContact O-N 3.08Å; A3460-A3463 PolarHBondContact O-N 3.15Å; A3460-T3464 WeakPolarHBondContact O-CB 3.41Å; A3460-T3464 PolarHBondContact O-N 3.33Å
3461A85.7Confident86.6Confident1 Ų156.7 Ų56.71%0.00831%0.308CS..Hα-helixtrans-63.2-39178.700000112.7L3399 V3447 A3448 Q3457 Y3458 T3464 A3465L3399-A3461 HydrophobicContact CD1-CB 3.81Å; V3447-A3461 HydrophobicContact CG1-CB 4.27Å; A3448-A3461 HydrophobicContact CB-CB 3.72Å; Q3457-A3461 WeakPolarHBondContact O-CB 3.4Å; Q3457-A3461 PolarHBondContact O-N 3.41Å; Y3458-A3461 PolarHBondContact O-N 3.07Å; A3461-T3464 WeakPolarHBondContact O-CB 3.48Å; A3461-T3464 PolarHBondContact O-N 3.37Å; A3461-A3465 PolarHBondContact O-N 3.5Å
3462M87.7Confident87.3Confident13 Ų1356 Ų566%0.06430%0.304CS..Hα-helixtrans-63.4-46.4171.4-73.4-75.5143.200112.2E3445 A3448 Y3458 A3460 T3464 A3465 F3466 L3507E3445-M3462 HydrophobicContact CB-CE 4.08Å; E3445-M3462 HydrophobicContact CG-CE 3.92Å; A3448-M3462 HydrophobicContact CB-CE 3.65Å; A3448-M3462 HydrophobicContact CB-CG 4.33Å; Y3458-M3462 HydrophobicContact CD1-CG 4.18Å; Y3458-M3462 HydrophobicContact CE1-CG 3.73Å; Y3458-M3462 HydrophobicContact CE2-CE 4.05Å; Y3458-M3462 HydrophobicContact CE2-CG 4.33Å; Y3458-M3462 WeakPolarHBondContact O-CB 3.32Å; Y3458-M3462 VanDerWaalsContact O-CG 3.3Å; Y3458-M3462 WeakPolarHBondContact O-CG 3.48Å; Y3458-M3462 PolarHBondContact O-N 3.02Å; A3460-M3462 VanDerWaalsContact C-N 3.35Å; A3460-M3462 PolarHBondContact O-N 3.08Å; M3462-T3464 VanDerWaalsContact C-N 3.33Å; M3462-T3464 PolarHBondContact O-N 2.99Å; M3462-A3465 WeakPolarHBondContact O-CB 3.4Å; M3462-A3465 PolarHBondContact O-N 3.36Å; M3462-A3465 VanDerWaalsContact O-N 3.16Å; M3462-F3466 WeakPolarHBondContact O-CD2 3.14Å; M3462-F3466 PolarHBondContact O-N 3.16Å; M3462-L3507 HydrophobicContact SD-CD1 4.45Å; M3462-L3507 HydrophobicContact SD-CD2 3.62Å; M3462-L3507 HydrophobicContact SD-CG 4Å
3463A91Very high88Confident56 Ų5652.9 Ų52.946%0.46328%0.282SS..Hα-helixtrans-62.8-39177.500000112.3K3459 A3460 A3465 F3466 D3467K3459-A3463 VanDerWaalsContact O-CB 3.32Å; K3459-A3463 WeakPolarHBondContact O-CB 3.35Å; K3459-A3463 PolarHBondContact O-N 3.12Å; A3460-A3463 PolarHBondContact O-N 3.15Å; A3463-A3465 VanDerWaalsContact C-N 3.3Å; A3463-A3465 PolarHBondContact O-N 2.94Å; A3463-F3466 PolarHBondContact O-N 3.38Å; A3463-F3466 VanDerWaalsContact O-N 3.17Å; A3463-D3467 PolarHBondContact O-N 3.13Å
3464T91.2Very high88.7Confident23 Ų2352.4 Ų52.414%0.14128%0.28CS..Hα-helixtrans-55.3-41.6171.4-94.70000112.1L3399 V3402 A3460 A3461 M3462 F3468L3399-T3464 HydrophobicContact CB-CG2 4.22Å; L3399-T3464 HydrophobicContact CD2-CG2 4.03Å; L3399-T3464 PolarHBondContact O-OG1 3.37Å; V3402-T3464 HydrophobicContact CG2-CG2 3.4Å; V3402-T3464 VanDerWaalsContact CG2-CG2 3.4Å; A3460-T3464 WeakPolarHBondContact O-CB 3.41Å; A3460-T3464 PolarHBondContact O-N 3.33Å; A3461-T3464 WeakPolarHBondContact O-CB 3.48Å; A3461-T3464 PolarHBondContact O-N 3.37Å; M3462-T3464 VanDerWaalsContact C-N 3.33Å; M3462-T3464 PolarHBondContact O-N 2.99Å; T3464-F3468 PolarHBondContact O-N 2.68Å; T3464-F3468 VanDerWaalsContact O-N 3.09Å
3465A89.8Confident89.3Confident1 Ų146.6 Ų46.61%0.00825%0.25CS..Hα-helixtrans-67.9-39.1176.500000112.4C3444 A3461 M3462 A3463 W3469 L3507C3444-A3465 HydrophobicContact CB-CB 3.78Å; A3461-A3465 PolarHBondContact O-N 3.5Å; M3462-A3465 WeakPolarHBondContact O-CB 3.4Å; M3462-A3465 PolarHBondContact O-N 3.36Å; M3462-A3465 VanDerWaalsContact O-N 3.16Å; A3463-A3465 VanDerWaalsContact C-N 3.3Å; A3463-A3465 PolarHBondContact O-N 2.94Å; A3465-W3469 VanDerWaalsContact O-CD1 3.31Å; A3465-W3469 PolarHBondContact O-N 3.28Å; A3465-L3507 HydrophobicContact CB-CD1 3.54Å; A3465-L3507 HydrophobicContact CB-CD2 4.17Å
3466F91.3Very high89.6Confident48 Ų4845.2 Ų45.221%0.21124%0.24CC..Hα-helixtrans-66.8-43.2174.1-76-70.3000112.6M3462 A3463 F3468 W3469 I3470 L3507 K3510 L3511M3462-F3466 WeakPolarHBondContact O-CD2 3.14Å; M3462-F3466 PolarHBondContact O-N 3.16Å; A3463-F3466 PolarHBondContact O-N 3.38Å; A3463-F3466 VanDerWaalsContact O-N 3.17Å; F3466-F3468 VanDerWaalsContact C-N 3.33Å; F3466-F3468 PolarHBondContact O-N 3Å; F3466-W3469 PolarHBondContact O-N 3.4Å; F3466-W3469 VanDerWaalsContact O-N 3.16Å; F3466-I3470 HydrophobicContact CB-CD1 4.39Å; F3466-I3470 WeakPolarHBondContact O-CB 3.48Å; F3466-I3470 WeakPolarHBondContact O-CD1 3.37Å; F3466-I3470 VanDerWaalsContact O-CG1 3.23Å; F3466-I3470 WeakPolarHBondContact O-CG1 3.41Å; F3466-I3470 PolarHBondContact O-N 2.91Å; F3466-L3507 HydrophobicContact CD2-CD2 4.06Å; F3466-L3507 HydrophobicContact CE1-CD2 4.4Å; F3466-L3507 HydrophobicContact CE2-CD2 3.34Å; F3466-L3507 HydrophobicContact CZ-CD2 3.53Å; F3466-K3510 HydrophobicContact CE1-CB 3.88Å; F3466-K3510 HydrophobicContact CE2-CD 4.21Å; F3466-K3510 HydrophobicContact CZ-CB 3.66Å; F3466-K3510 HydrophobicContact CZ-CD 3.61Å; F3466-K3510 HydrophobicContact CZ-CG 4.27Å; F3466-L3511 HydrophobicContact CD1-CD2 3.79Å; F3466-L3511 HydrophobicContact CD1-CG 4.42Å; F3466-L3511 HydrophobicContact CE1-CD2 3.72Å; F3466-L3511 HydrophobicContact CE1-CG 3.9Å
3467D92.8Very high89.7Confident54 Ų5442.9 Ų42.929%0.28923%0.227SC..Hα-helixtrans-61-41.3178-17736.9000111.7V3402 A3463 W3469 I3470 R3471V3402-D3467 HydrophobicContact CG1-CB 4.42Å; A3463-D3467 PolarHBondContact O-N 3.13Å; D3467-W3469 PolarHBondContact O-N 3.18Å; D3467-I3470 PolarHBondContact O-N 3Å; D3467-R3471 WeakPolarHBondContact O-CB 3.49Å; D3467-R3471 WeakPolarHBondContact O-CG 3.19Å; D3467-R3471 PolarHBondContact O-N 3.01Å; D3467-R3471 IonicContact OD1-CZ 3.96Å; D3467-R3471 IonicContact OD1-NE 3.16Å; D3467-R3471 PolarHBondContact OD1-NE 3.23Å; D3467-R3471 IonicContact OD1-NH2 3.27Å; D3467-R3471 PolarHBondContact OD1-NH2 2.96Å; D3467-R3471 IonicContact OD2-CZ 3.22Å; D3467-R3471 VanDerWaalsContact OD2-CZ 3.24Å; D3467-R3471 IonicContact OD2-NE 3.54Å; D3467-R3471 PolarHBondContact OD2-NE 3.34Å; D3467-R3471 IonicContact OD2-NH2 2.82Å; D3467-R3471 PolarHBondContact OD2-NH2 3.11Å
3468F94.3Very high89.9Confident0 Ų045.7 Ų45.70%023%0.234CC..Hα-helixtrans-54.4-52.5170.6172.9-99.8000111.9V3402 V3405 A3406 V3409 C3437 W3440 T3464 F3466 R3471 I3472V3402-F3468 HydrophobicContact CG1-CB 4.09Å; V3405-F3468 HydrophobicContact CG1-CE2 4.07Å; A3406-F3468 HydrophobicContact CB-CD2 4.01Å; A3406-F3468 HydrophobicContact CB-CE2 4.39Å; V3409-F3468 HydrophobicContact CG2-CE2 4.28Å; V3409-F3468 HydrophobicContact CG2-CZ 4.29Å; C3437-F3468 HydrophobicContact CB-CE1 4.18Å; C3437-F3468 HydrophobicContact CB-CZ 4.38Å; W3440-F3468 AromaticContact CD1-CD1 3.61Å; W3440-F3468 AromaticContact CD1-CD2 3.86Å; W3440-F3468 AromaticContact CD1-CE1 4Å; W3440-F3468 AromaticContact CD1-CG 3.53Å; W3440-F3468 HydrophobicContact CG-CD2 4.5Å; W3440-F3468 AromaticContact NE1-CD2 3.9Å; W3440-F3468 AromaticContact NE1-CG 3.66Å; T3464-F3468 PolarHBondContact O-N 2.68Å; T3464-F3468 VanDerWaalsContact O-N 3.09Å; F3466-F3468 VanDerWaalsContact C-N 3.33Å; F3466-F3468 PolarHBondContact O-N 3Å; F3468-R3471 PolarHBondContact O-N 3.38Å; F3468-I3472 HydrophobicContact CD1-CD1 4.31Å; F3468-I3472 HydrophobicContact CE1-CD1 3.61Å; F3468-I3472 HydrophobicContact CE2-CG2 4.28Å; F3468-I3472 HydrophobicContact CZ-CD1 3.78Å; F3468-I3472 HydrophobicContact CZ-CG2 4.44Å; F3468-I3472 PolarHBondContact O-N 2.98Å
3469W93.6Very high89.9Confident1 Ų143.9 Ų43.90%0.00423%0.227CC..Hα-helixtrans-64.7-43.1-179.5-83.1106.6000112.9C3437 T3441 A3465 F3466 D3467 R3471 I3472 M3473 I3476 V3496 L3511 W3515C3437-W3469 HydrophobicContact CB-CH2 3.84Å; C3437-W3469 HydrophobicContact CB-CZ2 3.84Å; T3441-W3469 PolarHBondContact OG1-NE1 3.17Å; A3465-W3469 VanDerWaalsContact O-CD1 3.31Å; A3465-W3469 PolarHBondContact O-N 3.28Å; F3466-W3469 PolarHBondContact O-N 3.4Å; F3466-W3469 VanDerWaalsContact O-N 3.16Å; D3467-W3469 PolarHBondContact O-N 3.18Å; W3469-R3471 VanDerWaalsContact C-N 3.27Å; W3469-R3471 PolarHBondContact O-N 2.92Å; W3469-I3472 HydrophobicContact CD2-CD1 4.27Å; W3469-I3472 HydrophobicContact CE3-CD1 3.7Å; W3469-I3472 HydrophobicContact CE3-CG1 3.92Å; W3469-I3472 HydrophobicContact CH2-CD1 4.24Å; W3469-I3472 HydrophobicContact CZ3-CD1 3.69Å; W3469-I3472 HydrophobicContact CZ3-CG1 4.29Å; W3469-I3472 PolarHBondContact O-N 3.19Å; W3469-M3473 HydrophobicContact CE3-CE 3.84Å; W3469-M3473 HydrophobicContact CZ3-CE 3.76Å; W3469-M3473 WeakPolarHBondContact O-CB 3.49Å; W3469-M3473 WeakPolarHBondContact O-CG 3.39Å; W3469-M3473 PolarHBondContact O-N 2.79Å; W3469-I3476 HydrophobicContact CZ3-CD1 4.25Å; W3469-V3496 HydrophobicContact CH2-CG1 3.89Å; W3469-V3496 HydrophobicContact CZ2-CG1 3.94Å; W3469-L3511 HydrophobicContact CB-CD2 3.92Å; W3469-L3511 HydrophobicContact CD2-CD1 4.44Å; W3469-L3511 HydrophobicContact CG-CD1 3.98Å; W3469-L3511 HydrophobicContact CG-CD2 4.08Å; W3469-W3515 AromaticContact CD2-CZ2 3.76Å; W3469-W3515 HydrophobicContact CD2-CZ2 3.76Å; W3469-W3515 AromaticContact CE2-CZ2 3.72Å; W3469-W3515 AromaticContact CE3-CZ2 3.79Å; W3469-W3515 HydrophobicContact CE3-CZ2 3.79Å; W3469-W3515 AromaticContact CE3-NE1 3.81Å; W3469-W3515 AromaticContact CH2-CZ2 3.8Å; W3469-W3515 HydrophobicContact CH2-CZ2 3.8Å; W3469-W3515 HydrophobicContact CZ2-CH2 4.31Å; W3469-W3515 AromaticContact CZ2-CZ2 3.75Å; W3469-W3515 HydrophobicContact CZ2-CZ2 3.75Å; W3469-W3515 AromaticContact CZ3-CZ2 3.81Å; W3469-W3515 HydrophobicContact CZ3-CZ2 3.81Å; W3469-W3515 AromaticContact CZ3-NE1 3.89Å
3470I92.5Very high89.7Confident107 Ų10739.2 Ų39.255%0.54921%0.207SC..Hα-helixtrans-59.1-38.3176.5-70.3164000111F3466 D3467 P3474F3466-I3470 HydrophobicContact CB-CD1 4.39Å; F3466-I3470 WeakPolarHBondContact O-CB 3.48Å; F3466-I3470 WeakPolarHBondContact O-CD1 3.37Å; F3466-I3470 VanDerWaalsContact O-CG1 3.23Å; F3466-I3470 WeakPolarHBondContact O-CG1 3.41Å; F3466-I3470 PolarHBondContact O-N 2.91Å; D3467-I3470 PolarHBondContact O-N 3Å; I3470-P3474 WeakPolarHBondContact O-CD 3.34Å
3471R92.2Very high89.4Confident89 Ų8939.8 Ų39.834%0.33621%0.208SC..Hα-helixtrans-68.8-39.7176.9-71.9170.2-166.3-106.62.3113.3A3406 K3410 D3467 F3468 W3469A3406-R3471 HydrophobicContact CB-CB 3.85Å; K3410-R3471 WeakPolarHBondContact CD-O 3.18Å; D3467-R3471 WeakPolarHBondContact O-CB 3.49Å; D3467-R3471 WeakPolarHBondContact O-CG 3.19Å; D3467-R3471 PolarHBondContact O-N 3.01Å; D3467-R3471 IonicContact OD1-CZ 3.96Å; D3467-R3471 IonicContact OD1-NE 3.16Å; D3467-R3471 PolarHBondContact OD1-NE 3.23Å; D3467-R3471 IonicContact OD1-NH2 3.27Å; D3467-R3471 PolarHBondContact OD1-NH2 2.96Å; D3467-R3471 IonicContact OD2-CZ 3.22Å; D3467-R3471 VanDerWaalsContact OD2-CZ 3.24Å; D3467-R3471 IonicContact OD2-NE 3.54Å; D3467-R3471 PolarHBondContact OD2-NE 3.34Å; D3467-R3471 IonicContact OD2-NH2 2.82Å; D3467-R3471 PolarHBondContact OD2-NH2 3.11Å; F3468-R3471 PolarHBondContact O-N 3.38Å; W3469-R3471 VanDerWaalsContact C-N 3.27Å; W3469-R3471 PolarHBondContact O-N 2.92Å
3472I92.6Very high89Confident0 Ų045.2 Ų45.20%024%0.236CC..Hα-helixtrans-88.1-24.8-17568.9169.6000113.8A3406 V3409 K3410 F3468 W3469 T3475 I3476A3406-I3472 HydrophobicContact CB-CG2 4.07Å; V3409-I3472 HydrophobicContact CB-CG2 4.16Å; V3409-I3472 HydrophobicContact CG1-CB 4.21Å; V3409-I3472 HydrophobicContact CG1-CD1 4.17Å; V3409-I3472 HydrophobicContact CG1-CG2 3.71Å; K3410-I3472 HydrophobicContact CG-CG2 4.27Å; F3468-I3472 HydrophobicContact CD1-CD1 4.31Å; F3468-I3472 HydrophobicContact CE1-CD1 3.61Å; F3468-I3472 HydrophobicContact CE2-CG2 4.28Å; F3468-I3472 HydrophobicContact CZ-CD1 3.78Å; F3468-I3472 HydrophobicContact CZ-CG2 4.44Å; F3468-I3472 PolarHBondContact O-N 2.98Å; W3469-I3472 HydrophobicContact CD2-CD1 4.27Å; W3469-I3472 HydrophobicContact CE3-CD1 3.7Å; W3469-I3472 HydrophobicContact CE3-CG1 3.92Å; W3469-I3472 HydrophobicContact CH2-CD1 4.24Å; W3469-I3472 HydrophobicContact CZ3-CD1 3.69Å; W3469-I3472 HydrophobicContact CZ3-CG1 4.29Å; W3469-I3472 PolarHBondContact O-N 3.19Å; I3472-T3475 PolarHBondContact O-N 3.01Å; I3472-T3475 VanDerWaalsContact O-N 3.08Å; I3472-I3476 HydrophobicContact CD1-CD1 4.04Å; I3472-I3476 HydrophobicContact CG1-CD1 4.15Å; I3472-I3476 PolarHBondContact O-N 3.45Å; I3472-I3476 VanDerWaalsContact O-N 3.07Å
3473M90.3Very high88.2Confident19 Ų1945 Ų459%0.09424%0.235CC..Hα-helixtrans-54.4-44.5-179.3-81.6-75.793.400114.4W3469 T3475 I3476 L3477 L3518W3469-M3473 HydrophobicContact CE3-CE 3.84Å; W3469-M3473 HydrophobicContact CZ3-CE 3.76Å; W3469-M3473 WeakPolarHBondContact O-CB 3.49Å; W3469-M3473 WeakPolarHBondContact O-CG 3.39Å; W3469-M3473 PolarHBondContact O-N 2.79Å; M3473-T3475 VanDerWaalsContact C-N 3.27Å; M3473-T3475 PolarHBondContact O-N 2.89Å; M3473-I3476 HydrophobicContact CE-CB 4.04Å; M3473-I3476 HydrophobicContact CE-CD1 3.49Å; M3473-I3476 VanDerWaalsContact CE-CD1 3.49Å; M3473-I3476 HydrophobicContact CE-CG1 4.32Å; M3473-I3476 HydrophobicContact CE-CG2 4.09Å; M3473-I3476 PolarHBondContact O-N 3.18Å; M3473-L3477 WeakPolarHBondContact O-CB 3.32Å; M3473-L3477 PolarHBondContact O-N 3.17Å; M3473-L3518 HydrophobicContact SD-CD1 3.86Å
3474P90.3Very high87.2Confident73 Ų7349.8 Ų49.847%0.47425%0.248SC..Hα-helixtrans-59.8-32.9176.2-26.635.8000114I3470 R3478I3470-P3474 WeakPolarHBondContact O-CD 3.34Å; P3474-R3478 WeakPolarHBondContact O-CB 3.42Å; P3474-R3478 PolarHBondContact O-N 3.39Å
3475T89.7Confident86.2Confident17 Ų1751.1 Ų51.110%0.10425%0.254CS..Hα-helixtrans-76.3-38.3176.8-570000111.4L3413 I3472 M3473 R3478 L3479L3413-T3475 HydrophobicContact CB-CG2 3.7Å; I3472-T3475 PolarHBondContact O-N 3.01Å; I3472-T3475 VanDerWaalsContact O-N 3.08Å; M3473-T3475 VanDerWaalsContact C-N 3.27Å; M3473-T3475 PolarHBondContact O-N 2.89Å; T3475-R3478 PolarHBondContact O-N 3.26Å; T3475-L3479 VanDerWaalsContact O-CB 3.3Å; T3475-L3479 WeakPolarHBondContact O-CB 3.12Å; T3475-L3479 PolarHBondContact O-N 3.36Å
3476I89.5Confident85.7Confident0 Ų051.8 Ų51.80%026%0.257CS..Hα-helixtrans-64.7-42.2173.5-67169.3000110.6L3413 F3434 W3469 I3472 M3473 L3479 L3480 L3493L3413-I3476 HydrophobicContact CD1-CD1 4.19Å; L3413-I3476 HydrophobicContact CD1-CG1 3.66Å; F3434-I3476 HydrophobicContact CE1-CD1 4.04Å; W3469-I3476 HydrophobicContact CZ3-CD1 4.25Å; I3472-I3476 HydrophobicContact CD1-CD1 4.04Å; I3472-I3476 HydrophobicContact CG1-CD1 4.15Å; I3472-I3476 PolarHBondContact O-N 3.45Å; I3472-I3476 VanDerWaalsContact O-N 3.07Å; M3473-I3476 HydrophobicContact CE-CB 4.04Å; M3473-I3476 HydrophobicContact CE-CD1 3.49Å; M3473-I3476 VanDerWaalsContact CE-CD1 3.49Å; M3473-I3476 HydrophobicContact CE-CG1 4.32Å; M3473-I3476 HydrophobicContact CE-CG2 4.09Å; M3473-I3476 PolarHBondContact O-N 3.18Å; I3476-L3479 PolarHBondContact O-N 3.48Å; I3476-L3480 HydrophobicContact CG2-CD1 3.95Å; I3476-L3480 HydrophobicContact CG2-CG 4.41Å; I3476-L3480 WeakPolarHBondContact O-CB 3.29Å; I3476-L3480 VanDerWaalsContact O-CG 3.31Å; I3476-L3480 WeakPolarHBondContact O-CG 3.18Å; I3476-L3480 PolarHBondContact O-N 3.33Å; I3476-L3493 HydrophobicContact CG2-CD2 4.33Å
3477L87.2Confident85.3Confident83 Ų8352 Ų5244%0.43526%0.262SS..Hα-helixtrans-56.5-50.3171.3-88.7166.4000112M3473 L3479 L3480 S3481 L3518M3473-L3477 WeakPolarHBondContact O-CB 3.32Å; M3473-L3477 PolarHBondContact O-N 3.17Å; L3477-L3479 PolarHBondContact O-N 3.26Å; L3477-L3480 PolarHBondContact O-N 3.02Å; L3477-S3481 WeakPolarHBondContact O-CB 3.47Å; L3477-S3481 PolarHBondContact O-N 3.4Å; L3477-S3481 PolarHBondContact O-OG 3.31Å; L3477-L3518 HydrophobicContact CD2-CD1 4.33Å; L3477-L3518 HydrophobicContact CD2-CD2 3.63Å; L3477-L3518 HydrophobicContact CD2-CG 4.48Å; L3477-L3518 HydrophobicContact CG-CD1 4.32Å; L3477-L3518 HydrophobicContact CG-CD2 4.32Å
3478R86.5Confident84.8Confident162 Ų16251.9 Ų51.961%0.61126%0.261SS*.Hα-helixtrans-59.3-46.7176.7-180172.6-71.4140.2-0.8111.2P3474 T3475 S3481 I3482P3474-R3478 WeakPolarHBondContact O-CB 3.42Å; P3474-R3478 PolarHBondContact O-N 3.39Å; T3475-R3478 PolarHBondContact O-N 3.26Å; R3478-S3481 PolarHBondContact O-N 3.46Å; R3478-S3481 VanDerWaalsContact O-N 3.12Å; R3478-S3481 PolarHBondContact O-OG 2.82Å; R3478-I3482 HydrophobicContact CG-CD1 3.6Å; R3478-I3482 HydrophobicContact CG-CG1 4.41Å; R3478-I3482 WeakPolarHBondContact O-CG1 3.49Å; R3478-I3482 PolarHBondContact O-N 2.58Å
3479L85.7Confident84.4Confident6 Ų651.9 Ų51.93%0.03126%0.261CS..Hα-helixtrans-60.9-45.5178.6-178.562.1000111.9L3413 F3416 P3417 L3430 T3475 I3476 L3477 S3481 I3482 S3483 V3489L3413-L3479 HydrophobicContact CB-CD2 4.46Å; L3413-L3479 HydrophobicContact CD2-CD2 3.93Å; F3416-L3479 HydrophobicContact CD1-CD1 4.45Å; P3417-L3479 HydrophobicContact CG-CD1 3.56Å; L3430-L3479 HydrophobicContact CD2-CD2 4.43Å; T3475-L3479 VanDerWaalsContact O-CB 3.3Å; T3475-L3479 WeakPolarHBondContact O-CB 3.12Å; T3475-L3479 PolarHBondContact O-N 3.36Å; I3476-L3479 PolarHBondContact O-N 3.48Å; L3477-L3479 PolarHBondContact O-N 3.26Å; L3479-S3481 VanDerWaalsContact C-N 3.27Å; L3479-S3481 PolarHBondContact O-N 3.09Å; L3479-I3482 PolarHBondContact O-N 3.06Å; L3479-S3483 WeakPolarHBondContact O-CB 3.44Å; L3479-S3483 PolarHBondContact O-N 3.17Å; L3479-V3489 HydrophobicContact CD2-CG1 3.78Å; L3479-V3489 HydrophobicContact CD2-CG2 3.89Å; L3479-V3489 HydrophobicContact CG-CG1 4.07Å; L3479-V3489 HydrophobicContact CG-CG2 3.94Å
3480L83.4Confident84Confident16 Ų1652 Ų528%0.08426%0.262CS..Hα-helixtrans-63.8-29.4174.3-73.8170000113.1I3476 L3477 V3489 S3490 L3493 R3522I3476-L3480 HydrophobicContact CG2-CD1 3.95Å; I3476-L3480 HydrophobicContact CG2-CG 4.41Å; I3476-L3480 WeakPolarHBondContact O-CB 3.29Å; I3476-L3480 VanDerWaalsContact O-CG 3.31Å; I3476-L3480 WeakPolarHBondContact O-CG 3.18Å; I3476-L3480 PolarHBondContact O-N 3.33Å; L3477-L3480 PolarHBondContact O-N 3.02Å; L3480-V3489 HydrophobicContact CD2-CB 3.9Å; L3480-V3489 HydrophobicContact CD2-CG1 3.7Å; L3480-V3489 HydrophobicContact CG-CG1 4.01Å; L3480-S3490 VanDerWaalsContact CD2-OG 3.3Å; L3480-S3490 WeakPolarHBondContact CD2-OG 3.44Å; L3480-L3493 HydrophobicContact CD1-CD2 4.47Å; L3480-R3522 PolarHBondContact O-NH1 2.89Å
3481S81Confident83.7Confident66 Ų6647.5 Ų47.546%0.46224%0.242SC..Hα-helixtrans-77.4-38.8178.273.40000113.2L3477 R3478 L3479 R3522L3477-S3481 WeakPolarHBondContact O-CB 3.47Å; L3477-S3481 PolarHBondContact O-N 3.4Å; L3477-S3481 PolarHBondContact O-OG 3.31Å; R3478-S3481 PolarHBondContact O-N 3.46Å; R3478-S3481 VanDerWaalsContact O-N 3.12Å; R3478-S3481 PolarHBondContact O-OG 2.82Å; L3479-S3481 VanDerWaalsContact C-N 3.27Å; L3479-S3481 PolarHBondContact O-N 3.09Å; S3481-R3522 PolarHBondContact O-NH2 3.34Å
3482I76.3Confident83.5Confident115 Ų11547.5 Ų47.559%0.5924%0.242SC*.Hα-helixtrans-92-38.4-172.7-65.4175.8000112.9R3478 L3479 E3484R3478-I3482 HydrophobicContact CG-CD1 3.6Å; R3478-I3482 HydrophobicContact CG-CG1 4.41Å; R3478-I3482 WeakPolarHBondContact O-CG1 3.49Å; R3478-I3482 PolarHBondContact O-N 2.58Å; L3479-I3482 PolarHBondContact O-N 3.06Å; I3482-E3484 PolarHBondContact O-N 3.33Å
3483S71.4Confident83.3Confident8 Ų847.5 Ų47.56%0.05624%0.242CC..  trans-70.5128.8-169.6-174.60000112.6L3479 D3485 F3486L3479-S3483 WeakPolarHBondContact O-CB 3.44Å; L3479-S3483 PolarHBondContact O-N 3.17Å; S3483-D3485 PolarHBondContact O-N 3.44Å; S3483-D3485 PolarHBondContact OG-N 3.42Å; S3483-F3486 PolarHBondContact O-N 2.95Å
3484E69.4Low83.3Confident157 Ų15746.8 Ų46.873%0.73424%0.239SC*.THydrogen-bonded Turntrans-55.8-40.6165.5-57.1-177.8131.400109.9K3421 I3482 F3486K3421-E3484 IonicContact NZ-OE2 2.65Å; I3482-E3484 PolarHBondContact O-N 3.33Å; E3484-F3486 PolarHBondContact O-N 3.05Å
3485D71.3Confident83.3Confident51 Ų5144.9 Ų44.927%0.27323%0.226SC..THydrogen-bonded Turntrans-78.532.7178.1-57-85.3000114Q3420 S3483 V3487 I3488 V3489Q3420-D3485 PolarHBondContact NE2-OD2 3.22Å; Q3420-D3485 PolarHBondContact OE1-OD2 3.08Å; S3483-D3485 PolarHBondContact O-N 3.44Å; S3483-D3485 PolarHBondContact OG-N 3.42Å; D3485-V3487 PolarHBondContact O-N 3.36Å; D3485-I3488 HydrophobicContact CB-CB 4.34Å; D3485-I3488 HydrophobicContact CB-CD1 3.99Å; D3485-I3488 HydrophobicContact CB-CG1 4.14Å; D3485-I3488 WeakPolarHBondContact O-CB 3.45Å; D3485-I3488 PolarHBondContact O-N 3.46Å; D3485-V3489 PolarHBondContact O-N 2.84Å
3486F78.4Confident83.4Confident16 Ų1644.1 Ų44.17%0.0722%0.221CC..Hα-helixtrans-51.4-31.5178.6107.3-85000112.3S3483 E3484 S3490 R3522 Q3525 L3526S3483-F3486 PolarHBondContact O-N 2.95Å; E3484-F3486 PolarHBondContact O-N 3.05Å; F3486-S3490 WeakPolarHBondContact CD2-OG 3.35Å; F3486-S3490 WeakPolarHBondContact O-CB 3.32Å; F3486-S3490 PolarHBondContact O-N 3.45Å; F3486-S3490 PolarHBondContact O-OG 2.74Å; F3486-R3522 HydrophobicContact CE2-CB 4.12Å; F3486-Q3525 HydrophobicContact CE1-CB 3.6Å; F3486-Q3525 HydrophobicContact CZ-CB 3.53Å; F3486-Q3525 WeakPolarHBondContact CZ-O 3.39Å; F3486-L3526 HydrophobicContact CE2-CD2 3.62Å; F3486-L3526 HydrophobicContact CE2-CG 4.1Å; F3486-L3526 HydrophobicContact CZ-CD2 3.78Å; F3486-L3526 HydrophobicContact CZ-CG 4.12Å
3487V82.7Confident83.4Confident52 Ų5244.1 Ų44.132%0.31522%0.221SC..Hα-helixtrans-60.8-43.2175.4179.30000111.7D3485 G3491 P3527 M3530D3485-V3487 PolarHBondContact O-N 3.36Å; V3487-G3491 WeakPolarHBondContact O-CA 3.29Å; V3487-G3491 PolarHBondContact O-N 3Å; V3487-P3527 HydrophobicContact CG1-CG 3.74Å; V3487-P3527 HydrophobicContact CG2-CG 4.32Å; V3487-M3530 HydrophobicContact CG1-SD 3.78Å
3488I82.6Confident83.5Confident51 Ų5142.8 Ų42.826%0.26221%0.213SC..Hα-helixtrans-68-48.2-179.1-57.1-175.3000109.4M3427 L3430 D3485 G3491 R3492M3427-I3488 HydrophobicContact CE-CD1 4.15Å; L3430-I3488 HydrophobicContact CD1-CG2 4.27Å; D3485-I3488 HydrophobicContact CB-CB 4.34Å; D3485-I3488 HydrophobicContact CB-CD1 3.99Å; D3485-I3488 HydrophobicContact CB-CG1 4.14Å; D3485-I3488 WeakPolarHBondContact O-CB 3.45Å; D3485-I3488 PolarHBondContact O-N 3.46Å; I3488-G3491 PolarHBondContact O-N 3.03Å; I3488-G3491 VanDerWaalsContact O-N 3.14Å; I3488-R3492 WeakPolarHBondContact O-CG 3.25Å; I3488-R3492 PolarHBondContact O-N 2.87Å
3489V85Confident83.7Confident0 Ų036.1 Ų36.10%019%0.188CC..Hα-helixtrans-63.3-47-179.5-176.50000110.8L3430 F3434 L3479 L3480 D3485 G3491 R3492 L3493L3430-V3489 HydrophobicContact CD1-CG2 4.1Å; F3434-V3489 HydrophobicContact CE2-CG1 4.48Å; F3434-V3489 HydrophobicContact CZ-CG1 4.23Å; L3479-V3489 HydrophobicContact CD2-CG1 3.78Å; L3479-V3489 HydrophobicContact CD2-CG2 3.89Å; L3479-V3489 HydrophobicContact CG-CG1 4.07Å; L3479-V3489 HydrophobicContact CG-CG2 3.94Å; L3480-V3489 HydrophobicContact CD2-CB 3.9Å; L3480-V3489 HydrophobicContact CD2-CG1 3.7Å; L3480-V3489 HydrophobicContact CG-CG1 4.01Å; D3485-V3489 PolarHBondContact O-N 2.84Å; V3489-G3491 VanDerWaalsContact C-N 3.26Å; V3489-G3491 PolarHBondContact O-N 2.94Å; V3489-R3492 PolarHBondContact O-N 3.04Å; V3489-L3493 PolarHBondContact O-N 3.06Å
3490S85.4Confident83.9Confident4 Ų435.8 Ų35.83%0.02819%0.187CC..Hα-helixtrans-61.2-36173.8-56.40000111.8L3480 F3486 L3493 L3494L3480-S3490 VanDerWaalsContact CD2-OG 3.3Å; L3480-S3490 WeakPolarHBondContact CD2-OG 3.44Å; F3486-S3490 WeakPolarHBondContact CD2-OG 3.35Å; F3486-S3490 WeakPolarHBondContact O-CB 3.32Å; F3486-S3490 PolarHBondContact O-N 3.45Å; F3486-S3490 PolarHBondContact O-OG 2.74Å; S3490-L3493 PolarHBondContact O-N 3.43Å; S3490-L3494 VanDerWaalsContact O-CB 3.24Å; S3490-L3494 WeakPolarHBondContact O-CB 3.49Å; S3490-L3494 PolarHBondContact O-N 3.17Å
3491G87.4Confident84Confident13 Ų1335.7 Ų35.713%0.13419%0.186CC..Hα-helixtrans-68.5-34.3179.300000113.6V3487 I3488 V3489 T3495 M3530 R3533V3487-G3491 WeakPolarHBondContact O-CA 3.29Å; V3487-G3491 PolarHBondContact O-N 3Å; I3488-G3491 PolarHBondContact O-N 3.03Å; I3488-G3491 VanDerWaalsContact O-N 3.14Å; V3489-G3491 VanDerWaalsContact C-N 3.26Å; V3489-G3491 PolarHBondContact O-N 2.94Å; G3491-T3495 PolarHBondContact O-N 2.67Å; G3491-T3495 PolarHBondContact O-OG1 3.02Å; G3491-M3530 VanDerWaalsContact CA-CE 3.42Å; G3491-M3530 VanDerWaalsContact N-CE 3.32Å; G3491-R3533 PolarHBondContact O-NH2 2.9Å
3492R87.5Confident84.3Confident89 Ų8936.6 Ų36.634%0.33618%0.183SC..Hα-helixtrans-76.2-42.7172.4-61.6-57.3-176-179.32.9112F3434 I3488 V3489 L3494 T3495 V3496F3434-R3492 HydrophobicContact CB-CB 4.22Å; F3434-R3492 HydrophobicContact CD2-CB 3.26Å; F3434-R3492 HydrophobicContact CD2-CG 3.99Å; F3434-R3492 HydrophobicContact CE2-CB 3.67Å; F3434-R3492 HydrophobicContact CE2-CG 4.43Å; F3434-R3492 HydrophobicContact CG-CB 3.8Å; F3434-R3492 HydrophobicContact CZ-CB 4.47Å; I3488-R3492 WeakPolarHBondContact O-CG 3.25Å; I3488-R3492 PolarHBondContact O-N 2.87Å; V3489-R3492 PolarHBondContact O-N 3.04Å; R3492-L3494 VanDerWaalsContact C-N 3.3Å; R3492-L3494 PolarHBondContact O-N 3.46Å; R3492-T3495 CarbonylContact O-C 3.34Å; R3492-T3495 WeakPolarHBondContact O-CA 3.34Å; R3492-T3495 WeakPolarHBondContact O-CB 3.45Å; R3492-T3495 PolarHBondContact O-N 3.43Å; R3492-T3495 VanDerWaalsContact O-N 3.08Å; R3492-V3496 PolarHBondContact O-N 2.96Å
3493L89.3Confident84.5Confident0 Ų031.9 Ų31.90%016%0.16CC..Hα-helixtrans-59.4-41.8174.4-17960.4000111.6F3434 I3476 L3480 V3489 S3490 T3495 V3496 I3497 L3519F3434-L3493 HydrophobicContact CE1-CB 4.38Å; F3434-L3493 HydrophobicContact CE1-CD1 4.45Å; I3476-L3493 HydrophobicContact CG2-CD2 4.33Å; L3480-L3493 HydrophobicContact CD1-CD2 4.47Å; V3489-L3493 PolarHBondContact O-N 3.06Å; S3490-L3493 PolarHBondContact O-N 3.43Å; L3493-T3495 VanDerWaalsContact C-N 3.31Å; L3493-T3495 PolarHBondContact O-N 3.44Å; L3493-V3496 WeakPolarHBondContact O-CB 3.43Å; L3493-V3496 PolarHBondContact O-N 3.11Å; L3493-I3497 WeakPolarHBondContact O-CG1 3.38Å; L3493-I3497 PolarHBondContact O-N 3.43Å; L3493-I3497 VanDerWaalsContact O-N 3.08Å; L3493-L3519 HydrophobicContact CD2-CD2 4.18Å; L3493-L3519 HydrophobicContact CD2-CG 4.45Å
3494L89.1Confident85.1Confident3 Ų334.6 Ų34.62%0.01617%0.172CC..Hα-helixtrans-63.4-34.8174.5-175.154.9000112.5S3490 R3492 I3497 E3498 M3530 R3533 L3534S3490-L3494 VanDerWaalsContact O-CB 3.24Å; S3490-L3494 WeakPolarHBondContact O-CB 3.49Å; S3490-L3494 PolarHBondContact O-N 3.17Å; R3492-L3494 VanDerWaalsContact C-N 3.3Å; R3492-L3494 PolarHBondContact O-N 3.46Å; L3494-I3497 WeakPolarHBondContact O-CB 3.23Å; L3494-I3497 PolarHBondContact O-N 3.43Å; L3494-E3498 WeakPolarHBondContact O-CG 3.4Å; L3494-E3498 PolarHBondContact O-N 2.58Å; L3494-M3530 HydrophobicContact CD2-CB 4.39Å; L3494-M3530 HydrophobicContact CD2-CE 4.4Å; L3494-R3533 HydrophobicContact CD2-CB 3.6Å; L3494-R3533 HydrophobicContact CG-CB 4.26Å; L3494-L3534 HydrophobicContact CD1-CB 4.44Å; L3494-L3534 HydrophobicContact CD1-CD1 3.95Å; L3494-L3534 HydrophobicContact CD2-CB 4.43Å
3495T90.6Very high85.8Confident34 Ų3427.3 Ų27.321%0.20914%0.138CC..Hα-helixtrans-68.5-33170.3-650000112.3Q3438 G3491 R3492 L3493 I3497 E3498 E3499 R3533Q3438-T3495 PolarHBondContact NE2-O 3.05Å; G3491-T3495 PolarHBondContact O-N 2.67Å; G3491-T3495 PolarHBondContact O-OG1 3.02Å; R3492-T3495 CarbonylContact O-C 3.34Å; R3492-T3495 WeakPolarHBondContact O-CA 3.34Å; R3492-T3495 WeakPolarHBondContact O-CB 3.45Å; R3492-T3495 PolarHBondContact O-N 3.43Å; R3492-T3495 VanDerWaalsContact O-N 3.08Å; L3493-T3495 VanDerWaalsContact C-N 3.31Å; L3493-T3495 PolarHBondContact O-N 3.44Å; T3495-I3497 VanDerWaalsContact C-N 3.31Å; T3495-I3497 PolarHBondContact O-N 3.27Å; T3495-E3498 PolarHBondContact O-N 3.17Å; T3495-E3499 HydrophobicContact CG2-CG 3.89Å; T3495-E3499 VanDerWaalsContact O-CB 3.31Å; T3495-E3499 WeakPolarHBondContact O-CB 3.11Å; T3495-E3499 WeakPolarHBondContact O-CG 3.3Å; T3495-E3499 PolarHBondContact O-N 2.99Å; T3495-R3533 PolarHBondContact OG1-NH2 3.24Å
3496V91.4Very high86.3Confident0 Ų026.8 Ų26.80%014%0.138CC..Hα-helixtrans-60.8-43.2170.3-178.60000111.4F3434 Q3438 W3469 R3492 L3493 L3500F3434-V3496 HydrophobicContact CB-CG2 3.89Å; F3434-V3496 HydrophobicContact CD1-CG2 3.73Å; F3434-V3496 HydrophobicContact CG-CG2 4.21Å; Q3438-V3496 HydrophobicContact CG-CB 4.16Å; Q3438-V3496 HydrophobicContact CG-CG1 3.88Å; Q3438-V3496 HydrophobicContact CG-CG2 3.98Å; W3469-V3496 HydrophobicContact CH2-CG1 3.89Å; W3469-V3496 HydrophobicContact CZ2-CG1 3.94Å; R3492-V3496 PolarHBondContact O-N 2.96Å; L3493-V3496 WeakPolarHBondContact O-CB 3.43Å; L3493-V3496 PolarHBondContact O-N 3.11Å; V3496-L3500 HydrophobicContact CG1-CD1 3.72Å; V3496-L3500 HydrophobicContact CG1-CG 4.22Å; V3496-L3500 WeakPolarHBondContact O-CB 3.44Å; V3496-L3500 VanDerWaalsContact O-CG 3.25Å; V3496-L3500 WeakPolarHBondContact O-CG 3.46Å; V3496-L3500 PolarHBondContact O-N 3Å
3497I89.8Confident86.6Confident1 Ų126 Ų261%0.00514%0.135CC..Hα-helixtrans-60.9-53.4177.3-66.7170.9000110.2L3493 L3494 T3495 E3499 L3500 M3501 F3512 W3515 L3519 C3537L3493-I3497 WeakPolarHBondContact O-CG1 3.38Å; L3493-I3497 PolarHBondContact O-N 3.43Å; L3493-I3497 VanDerWaalsContact O-N 3.08Å; L3494-I3497 WeakPolarHBondContact O-CB 3.23Å; L3494-I3497 PolarHBondContact O-N 3.43Å; T3495-I3497 VanDerWaalsContact C-N 3.31Å; T3495-I3497 PolarHBondContact O-N 3.27Å; I3497-E3499 PolarHBondContact O-N 3.07Å; I3497-L3500 PolarHBondContact O-N 3.11Å; I3497-M3501 HydrophobicContact CG2-SD 3.35Å; I3497-M3501 WeakPolarHBondContact CG2-SD 3.37Å; I3497-M3501 WeakPolarHBondContact O-CB 3.46Å; I3497-M3501 VanDerWaalsContact O-CG 3.25Å; I3497-M3501 WeakPolarHBondContact O-CG 3.25Å; I3497-M3501 PolarHBondContact O-N 2.73Å; I3497-M3501 VanDerWaalsContact O-SD 3.38Å; I3497-F3512 HydrophobicContact CG2-CD2 4.38Å; I3497-F3512 HydrophobicContact CG2-CE2 4.2Å; I3497-W3515 HydrophobicContact CD1-CB 4.03Å; I3497-W3515 HydrophobicContact CD1-CD2 4.48Å; I3497-W3515 HydrophobicContact CD1-CE3 4.15Å; I3497-W3515 HydrophobicContact CG1-CD2 4.26Å; I3497-W3515 HydrophobicContact CG1-CE3 3.62Å; I3497-W3515 HydrophobicContact CG1-CZ3 4.04Å; I3497-L3519 HydrophobicContact CD1-CD1 3.58Å; I3497-C3537 HydrophobicContact CG2-CB 3.96Å
3498E90.3Very high86.6Confident54 Ų5423.6 Ų23.625%0.25212%0.121SC..Hα-helixtrans-56-47.4177.3-71.4167.415900112.8L3494 T3495 M3501 E3502 R3533L3494-E3498 WeakPolarHBondContact O-CG 3.4Å; L3494-E3498 PolarHBondContact O-N 2.58Å; T3495-E3498 PolarHBondContact O-N 3.17Å; E3498-M3501 PolarHBondContact O-N 3.11Å; E3498-E3502 WeakPolarHBondContact O-CB 3.23Å; E3498-E3502 PolarHBondContact O-N 3.38Å; E3498-R3533 WeakPolarHBondContact OE1-CB 3.46Å; E3498-R3533 WeakPolarHBondContact OE1-CG 3.29Å; E3498-R3533 IonicContact OE1-CZ 2.81Å; E3498-R3533 IonicContact OE1-NE 2.68Å; E3498-R3533 PolarHBondContact OE1-NE 3.2Å; E3498-R3533 IonicContact OE1-NH2 3.64Å; E3498-R3533 PolarHBondContact OE1-NH2 3.13Å; E3498-R3533 IonicContact OE2-CZ 3.38Å; E3498-R3533 IonicContact OE2-NE 3.76Å; E3498-R3533 PolarHBondContact OE2-NE 2.83Å; E3498-R3533 IonicContact OE2-NH2 3.43Å; E3498-R3533 PolarHBondContact OE2-NH2 3.4Å
3499E90.2Very high86.5Confident22 Ų2223.6 Ų23.610%0.10313%0.125CC..Hα-helixtrans-68.8-37.4-177.3-68-67.415800112.8Q3438 T3495 I3497 M3501 E3502 C3503 W3686 K3689 H3690Q3438-E3499 HydrophobicContact CG-CB 4.27Å; T3495-E3499 HydrophobicContact CG2-CG 3.89Å; T3495-E3499 VanDerWaalsContact O-CB 3.31Å; T3495-E3499 WeakPolarHBondContact O-CB 3.11Å; T3495-E3499 WeakPolarHBondContact O-CG 3.3Å; T3495-E3499 PolarHBondContact O-N 2.99Å; I3497-E3499 PolarHBondContact O-N 3.07Å; E3499-M3501 VanDerWaalsContact C-N 3.34Å; E3499-E3502 PolarHBondContact O-N 2.97Å; E3499-C3503 PolarHBondContact O-N 3.04Å; E3499-W3686 HydrophobicContact CB-CZ2 4.39Å; E3499-W3686 PolarHBondContact O-NE1 3.16Å; E3499-W3686 PolarHBondContact OE2-NE1 2.84Å; E3499-K3689 WeakPolarHBondContact OE1-CE 3.2Å; E3499-K3689 IonicContact OE1-NZ 3.72Å; E3499-K3689 PolarHBondContact OE1-NZ 2.82Å; E3499-K3689 IonicContact OE2-NZ 3.34Å; E3499-K3689 PolarHBondContact OE2-NZ 3.24Å; E3499-H3690 IonicContact OE2-CD2 2.64Å; E3499-H3690 IonicContact OE2-CE1 3.36Å; E3499-H3690 IonicContact OE2-NE2 2.72Å; E3499-H3690 PolarHBondContact OE2-NE2 3.49Å
3500L89.1Confident86.4Confident0 Ų029 Ų290%015%0.149CC..Hα-helixtrans-71.1-31.8175.8-67.6175.7000112T3441 I3442 V3496 I3497 C3503 Q3504 S3505 A3508 W3515T3441-L3500 HydrophobicContact CG2-CD1 4.14Å; T3441-L3500 HydrophobicContact CG2-CD2 3.86Å; I3442-L3500 HydrophobicContact CD1-CD2 3.64Å; I3442-L3500 HydrophobicContact CG1-CD2 3.85Å; V3496-L3500 HydrophobicContact CG1-CD1 3.72Å; V3496-L3500 HydrophobicContact CG1-CG 4.22Å; V3496-L3500 WeakPolarHBondContact O-CB 3.44Å; V3496-L3500 VanDerWaalsContact O-CG 3.25Å; V3496-L3500 WeakPolarHBondContact O-CG 3.46Å; V3496-L3500 PolarHBondContact O-N 3Å; I3497-L3500 PolarHBondContact O-N 3.11Å; L3500-C3503 CarbonylContact O-C 3.43Å; L3500-C3503 WeakPolarHBondContact O-CB 3.28Å; L3500-C3503 PolarHBondContact O-N 3.3Å; L3500-Q3504 PolarHBondContact O-N 2.87Å; L3500-S3505 VanDerWaalsContact O-CB 3.29Å; L3500-S3505 WeakPolarHBondContact O-CB 3.12Å; L3500-S3505 PolarHBondContact O-N 3.13Å; L3500-A3508 HydrophobicContact CB-CB 4.02Å; L3500-W3515 HydrophobicContact CD1-CH2 3.7Å; L3500-W3515 HydrophobicContact CD1-CZ3 4.27Å
3501M86.5Confident86.5Confident13 Ų1328.9 Ų28.96%0.06415%0.148CC..Hα-helixtrans-75-33.9172.9-70.4160.653.800112I3497 E3498 E3499 C3503 Q3504 A3508 F3512 C3537 W3540I3497-M3501 HydrophobicContact CG2-SD 3.35Å; I3497-M3501 WeakPolarHBondContact CG2-SD 3.37Å; I3497-M3501 WeakPolarHBondContact O-CB 3.46Å; I3497-M3501 VanDerWaalsContact O-CG 3.25Å; I3497-M3501 WeakPolarHBondContact O-CG 3.25Å; I3497-M3501 PolarHBondContact O-N 2.73Å; I3497-M3501 VanDerWaalsContact O-SD 3.38Å; E3498-M3501 PolarHBondContact O-N 3.11Å; E3499-M3501 VanDerWaalsContact C-N 3.34Å; M3501-C3503 PolarHBondContact O-N 3.37Å; M3501-Q3504 PolarHBondContact O-N 3.29Å; M3501-A3508 HydrophobicContact CG-CB 4.39Å; M3501-F3512 HydrophobicContact SD-CE2 4.48Å; M3501-C3537 HydrophobicContact CE-CB 3.94Å; M3501-C3537 HydrophobicContact SD-CB 4.27Å; M3501-W3540 HydrophobicContact CB-CD2 4.37Å; M3501-W3540 HydrophobicContact CB-CZ2 4.18Å; M3501-W3540 HydrophobicContact CE-CB 3.28Å; M3501-W3540 HydrophobicContact CE-CD2 3.62Å; M3501-W3540 HydrophobicContact CE-CE3 3.99Å; M3501-W3540 HydrophobicContact CE-CG 3.34Å; M3501-W3540 HydrophobicContact CG-CD2 4.09Å; M3501-W3540 HydrophobicContact CG-CE3 4.09Å; M3501-W3540 HydrophobicContact CG-CH2 4.18Å; M3501-W3540 HydrophobicContact CG-CZ2 4.19Å; M3501-W3540 HydrophobicContact CG-CZ3 4.13Å; M3501-W3540 HydrophobicContact SD-CE3 4.43Å
3502E85.8Confident86.3Confident86 Ų8630.7 Ų30.740%0.40215%0.152SC..Hα-helixtrans-62.6-31.3168.3-165.7177.5127.900111.2E3498 E3499 R3682 K3689E3498-E3502 WeakPolarHBondContact O-CB 3.23Å; E3498-E3502 PolarHBondContact O-N 3.38Å; E3499-E3502 PolarHBondContact O-N 2.97Å; E3502-R3682 PolarHBondContact O-NE 2.91Å; E3502-R3682 PolarHBondContact O-NH2 3.44Å; E3502-K3689 WeakPolarHBondContact OE1-CD 3.3Å; E3502-K3689 IonicContact OE1-NZ 2.65Å; E3502-K3689 PolarHBondContact OE1-NZ 3.43Å; E3502-K3689 IonicContact OE2-NZ 3.68Å; E3502-K3689 PolarHBondContact OE2-NZ 2.95Å
3503C82Confident86.1Confident16 Ų1631.2 Ų31.211%0.10817%0.165CC..THydrogen-bonded Turntrans-79.1-7168.6-105.40000115.4I3442 E3499 L3500 M3501 S3505I3442-C3503 HydrophobicContact CD1-CB 3.65Å; I3442-C3503 HydrophobicContact CG1-CB 4.47Å; E3499-C3503 PolarHBondContact O-N 3.04Å; L3500-C3503 CarbonylContact O-C 3.43Å; L3500-C3503 WeakPolarHBondContact O-CB 3.28Å; L3500-C3503 PolarHBondContact O-N 3.3Å; M3501-C3503 PolarHBondContact O-N 3.37Å; C3503-S3505 PolarHBondContact O-N 3.26Å
3504Q83.6Confident85.7Confident65 Ų6535.5 Ų35.530%0.30419%0.188SC..THydrogen-bonded Turntrans53.134-168.9-92.4177.5-1800113.8L3500 M3501 S3506 W3540 P3543L3500-Q3504 PolarHBondContact O-N 2.87Å; M3501-Q3504 PolarHBondContact O-N 3.29Å; Q3504-S3506 PolarHBondContact O-N 2.85Å; Q3504-W3540 HydrophobicContact CG-CZ2 4.27Å; Q3504-P3543 HydrophobicContact CB-CG 4.34Å; Q3504-P3543 HydrophobicContact CG-CB 4.46Å; Q3504-P3543 HydrophobicContact CG-CG 3.98Å
3505S83.7Confident85.5Confident3 Ų335.4 Ų35.42%0.02119%0.187CC..  trans-57.1126.6-178.7175.90000112.3E3445 L3500 C3503 L3507 A3508E3445-S3505 VanDerWaalsContact OE2-CA 3.27Å; E3445-S3505 WeakPolarHBondContact OE2-CA 3.44Å; E3445-S3505 WeakPolarHBondContact OE2-CB 3.38Å; E3445-S3505 PolarHBondContact OE2-OG 3.37Å; L3500-S3505 VanDerWaalsContact O-CB 3.29Å; L3500-S3505 WeakPolarHBondContact O-CB 3.12Å; L3500-S3505 PolarHBondContact O-N 3.13Å; C3503-S3505 PolarHBondContact O-N 3.26Å; S3505-L3507 PolarHBondContact O-N 2.89Å; S3505-L3507 PolarHBondContact OG-N 3.42Å; S3505-A3508 WeakPolarHBondContact O-CB 3.45Å; S3505-A3508 PolarHBondContact O-N 3.31Å; S3505-A3508 VanDerWaalsContact O-N 3.15Å
3506S81.7Confident85.1Confident40 Ų4034.5 Ų34.528%0.2818%0.181SC..Hα-helixtrans-67.6-26.1176.669.40000111.9E3445 Q3504 S3509E3445-S3506 VanDerWaalsContact OE1-CB 3.24Å; E3445-S3506 WeakPolarHBondContact OE1-CB 3.36Å; E3445-S3506 PolarHBondContact OE1-N 3.49Å; E3445-S3506 PolarHBondContact OE1-OG 3.02Å; E3445-S3506 PolarHBondContact OE2-N 2.86Å; Q3504-S3506 PolarHBondContact O-N 2.85Å; S3506-S3509 PolarHBondContact O-OG 2.83Å
3507L84Confident84.6Confident0 Ų038.1 Ų38.10%021%0.205CC..Hα-helixtrans-67.7-35.7173.6-66168.6000111.8T3441 E3445 M3462 A3465 F3466 S3505 S3509 K3510 L3511T3441-L3507 HydrophobicContact CG2-CB 4.14Å; T3441-L3507 HydrophobicContact CG2-CD1 3.63Å; E3445-L3507 HydrophobicContact CB-CD1 4.23Å; M3462-L3507 HydrophobicContact SD-CD1 4.45Å; M3462-L3507 HydrophobicContact SD-CD2 3.62Å; M3462-L3507 HydrophobicContact SD-CG 4Å; A3465-L3507 HydrophobicContact CB-CD1 3.54Å; A3465-L3507 HydrophobicContact CB-CD2 4.17Å; F3466-L3507 HydrophobicContact CD2-CD2 4.06Å; F3466-L3507 HydrophobicContact CE1-CD2 4.4Å; F3466-L3507 HydrophobicContact CE2-CD2 3.34Å; F3466-L3507 HydrophobicContact CZ-CD2 3.53Å; S3505-L3507 PolarHBondContact O-N 2.89Å; S3505-L3507 PolarHBondContact OG-N 3.42Å; L3507-S3509 VanDerWaalsContact C-N 3.34Å; L3507-S3509 PolarHBondContact O-N 3.43Å; L3507-K3510 PolarHBondContact O-N 2.88Å; L3507-K3510 VanDerWaalsContact O-N 3.17Å; L3507-L3511 HydrophobicContact CB-CD1 4.21Å; L3507-L3511 WeakPolarHBondContact O-CB 3.1Å; L3507-L3511 WeakPolarHBondContact O-CG 3.48Å; L3507-L3511 PolarHBondContact O-N 3.07Å
3508A84.3Confident84Confident2 Ų240.1 Ų40.12%0.01722%0.215CC..Hα-helixtrans-55.9-47.817900000111.6L3500 M3501 S3505 K3510 L3511 F3512L3500-A3508 HydrophobicContact CB-CB 4.02Å; M3501-A3508 HydrophobicContact CG-CB 4.39Å; S3505-A3508 WeakPolarHBondContact O-CB 3.45Å; S3505-A3508 PolarHBondContact O-N 3.31Å; S3505-A3508 VanDerWaalsContact O-N 3.15Å; A3508-K3510 PolarHBondContact O-N 2.91Å; A3508-L3511 PolarHBondContact O-N 3.5Å; A3508-F3512 VanDerWaalsContact O-CB 3.32Å; A3508-F3512 WeakPolarHBondContact O-CB 3.42Å; A3508-F3512 PolarHBondContact O-N 3.19Å
3509S80.1Confident83.3Confident51 Ų5137.8 Ų37.836%0.35720%0.204SC..Hα-helixtrans-54.4-37.2179.470.30000113.8S3506 L3507S3506-S3509 PolarHBondContact O-OG 2.83Å; L3507-S3509 VanDerWaalsContact C-N 3.34Å; L3507-S3509 PolarHBondContact O-N 3.43Å
3510K83.4Confident82.6Confident113 Ų11340.5 Ų40.549%0.49122%0.217SC..Hα-helixtrans-82.2-38.6-178.5-68.5168.5-179.9170.90111.9F3466 L3507 A3508 T3513F3466-K3510 HydrophobicContact CE1-CB 3.88Å; F3466-K3510 HydrophobicContact CE2-CD 4.21Å; F3466-K3510 HydrophobicContact CZ-CB 3.66Å; F3466-K3510 HydrophobicContact CZ-CD 3.61Å; F3466-K3510 HydrophobicContact CZ-CG 4.27Å; L3507-K3510 PolarHBondContact O-N 2.88Å; L3507-K3510 VanDerWaalsContact O-N 3.17Å; A3508-K3510 PolarHBondContact O-N 2.91Å; K3510-T3513 PolarHBondContact O-OG1 2.84Å
3511L85.9Confident81.5Confident2 Ų243.7 Ų43.71%0.0125%0.249CC..Hα-helixtrans-75.5-23.8178.3-65.9168.1000112.7F3466 W3469 L3507 A3508 T3513 L3514 W3515F3466-L3511 HydrophobicContact CD1-CD2 3.79Å; F3466-L3511 HydrophobicContact CD1-CG 4.42Å; F3466-L3511 HydrophobicContact CE1-CD2 3.72Å; F3466-L3511 HydrophobicContact CE1-CG 3.9Å; W3469-L3511 HydrophobicContact CB-CD2 3.92Å; W3469-L3511 HydrophobicContact CD2-CD1 4.44Å; W3469-L3511 HydrophobicContact CG-CD1 3.98Å; W3469-L3511 HydrophobicContact CG-CD2 4.08Å; L3507-L3511 HydrophobicContact CB-CD1 4.21Å; L3507-L3511 WeakPolarHBondContact O-CB 3.1Å; L3507-L3511 WeakPolarHBondContact O-CG 3.48Å; L3507-L3511 PolarHBondContact O-N 3.07Å; A3508-L3511 PolarHBondContact O-N 3.5Å; L3511-T3513 VanDerWaalsContact C-N 3.27Å; L3511-T3513 PolarHBondContact O-N 2.89Å; L3511-L3514 HydrophobicContact CD2-CD1 4.32Å; L3511-L3514 WeakPolarHBondContact O-CB 3.37Å; L3511-L3514 PolarHBondContact O-N 3.5Å; L3511-W3515 HydrophobicContact CB-CD2 3.99Å; L3511-W3515 HydrophobicContact CB-CE3 3.84Å; L3511-W3515 HydrophobicContact CB-CH2 3.5Å; L3511-W3515 VanDerWaalsContact CB-CH2 3.5Å; L3511-W3515 HydrophobicContact CB-CZ2 3.61Å; L3511-W3515 HydrophobicContact CB-CZ3 3.61Å; L3511-W3515 HydrophobicContact CD1-CH2 3.57Å; L3511-W3515 HydrophobicContact CD1-CZ2 3.67Å; L3511-W3515 HydrophobicContact CD1-CZ3 4.44Å; L3511-W3515 HydrophobicContact CG-CH2 4.14Å; L3511-W3515 HydrophobicContact CG-CZ2 4.13Å; L3511-W3515 PolarHBondContact O-N 3.49Å
3512F84.3Confident80.6Confident50 Ų5047.7 Ų47.722%0.21926%0.264CS..Hα-helixtrans-54.1-42.1178-162.8-109.3000112.6I3497 M3501 A3508 L3514 W3515 M3516 C3537 V3538I3497-F3512 HydrophobicContact CG2-CD2 4.38Å; I3497-F3512 HydrophobicContact CG2-CE2 4.2Å; M3501-F3512 HydrophobicContact SD-CE2 4.48Å; A3508-F3512 VanDerWaalsContact O-CB 3.32Å; A3508-F3512 WeakPolarHBondContact O-CB 3.42Å; A3508-F3512 PolarHBondContact O-N 3.19Å; F3512-L3514 PolarHBondContact O-N 3.37Å; F3512-W3515 PolarHBondContact O-N 3.08Å; F3512-M3516 HydrophobicContact CD1-CG 3.67Å; F3512-M3516 HydrophobicContact CD2-CG 3.86Å; F3512-M3516 HydrophobicContact CD2-SD 4.09Å; F3512-M3516 HydrophobicContact CE1-CG 3.47Å; F3512-M3516 VanDerWaalsContact CE1-CG 3.47Å; F3512-M3516 HydrophobicContact CE1-SD 4.17Å; F3512-M3516 HydrophobicContact CE2-CG 3.66Å; F3512-M3516 HydrophobicContact CE2-SD 3.46Å; F3512-M3516 WeakPolarHBondContact CE2-SD 3.49Å; F3512-M3516 HydrophobicContact CG-CG 3.85Å; F3512-M3516 HydrophobicContact CZ-CE 4.23Å; F3512-M3516 HydrophobicContact CZ-CG 3.44Å; F3512-M3516 VanDerWaalsContact CZ-CG 3.44Å; F3512-M3516 HydrophobicContact CZ-SD 3.5Å; F3512-M3516 WeakPolarHBondContact CZ-SD 3.17Å; F3512-M3516 WeakPolarHBondContact O-CB 3.26Å; F3512-M3516 VanDerWaalsContact O-CG 3.27Å; F3512-M3516 WeakPolarHBondContact O-CG 3.39Å; F3512-M3516 PolarHBondContact O-N 2.94Å; F3512-C3537 HydrophobicContact CE2-CB 4.22Å; F3512-C3537 WeakPolarHBondContact CE2-O 3.4Å; F3512-C3537 WeakPolarHBondContact CZ-O 3.3Å; F3512-V3538 HydrophobicContact CZ-CG2 4.14Å
3513T82.4Confident79.5Confident100 Ų10047.5 Ų47.561%0.61326%0.263SS*.Hα-helixtrans-61.9-27.6177.864.70000113.2K3510 L3511 P3517K3510-T3513 PolarHBondContact O-OG1 2.84Å; L3511-T3513 VanDerWaalsContact C-N 3.27Å; L3511-T3513 PolarHBondContact O-N 2.89Å; T3513-P3517 WeakPolarHBondContact O-CD 3.33Å; T3513-P3517 WeakPolarHBondContact O-CG 3.28Å
3514L82.3Confident78.6Confident90 Ų9057 Ų5747%0.47130%0.302SS..Hα-helixtrans-85.3-38.1176.3-58.7176.3000112.1L3511 F3512 L3518L3511-L3514 HydrophobicContact CD2-CD1 4.32Å; L3511-L3514 WeakPolarHBondContact O-CB 3.37Å; L3511-L3514 PolarHBondContact O-N 3.5Å; F3512-L3514 PolarHBondContact O-N 3.37Å; L3514-L3518 WeakPolarHBondContact O-CG 3.47Å
3515W85.2Confident77.9Confident1 Ų159.4 Ų59.40%0.00431%0.314CS..Hα-helixtrans-79.6-37.4-175.9-64.3-32.2000114.2W3469 I3497 L3500 L3511 F3512 L3518 L3519W3469-W3515 AromaticContact CD2-CZ2 3.76Å; W3469-W3515 HydrophobicContact CD2-CZ2 3.76Å; W3469-W3515 AromaticContact CE2-CZ2 3.72Å; W3469-W3515 AromaticContact CE3-CZ2 3.79Å; W3469-W3515 HydrophobicContact CE3-CZ2 3.79Å; W3469-W3515 AromaticContact CE3-NE1 3.81Å; W3469-W3515 AromaticContact CH2-CZ2 3.8Å; W3469-W3515 HydrophobicContact CH2-CZ2 3.8Å; W3469-W3515 HydrophobicContact CZ2-CH2 4.31Å; W3469-W3515 AromaticContact CZ2-CZ2 3.75Å; W3469-W3515 HydrophobicContact CZ2-CZ2 3.75Å; W3469-W3515 AromaticContact CZ3-CZ2 3.81Å; W3469-W3515 HydrophobicContact CZ3-CZ2 3.81Å; W3469-W3515 AromaticContact CZ3-NE1 3.89Å; I3497-W3515 HydrophobicContact CD1-CB 4.03Å; I3497-W3515 HydrophobicContact CD1-CD2 4.48Å; I3497-W3515 HydrophobicContact CD1-CE3 4.15Å; I3497-W3515 HydrophobicContact CG1-CD2 4.26Å; I3497-W3515 HydrophobicContact CG1-CE3 3.62Å; I3497-W3515 HydrophobicContact CG1-CZ3 4.04Å; L3500-W3515 HydrophobicContact CD1-CH2 3.7Å; L3500-W3515 HydrophobicContact CD1-CZ3 4.27Å; L3511-W3515 HydrophobicContact CB-CD2 3.99Å; L3511-W3515 HydrophobicContact CB-CE3 3.84Å; L3511-W3515 HydrophobicContact CB-CH2 3.5Å; L3511-W3515 VanDerWaalsContact CB-CH2 3.5Å; L3511-W3515 HydrophobicContact CB-CZ2 3.61Å; L3511-W3515 HydrophobicContact CB-CZ3 3.61Å; L3511-W3515 HydrophobicContact CD1-CH2 3.57Å; L3511-W3515 HydrophobicContact CD1-CZ2 3.67Å; L3511-W3515 HydrophobicContact CD1-CZ3 4.44Å; L3511-W3515 HydrophobicContact CG-CH2 4.14Å; L3511-W3515 HydrophobicContact CG-CZ2 4.13Å; L3511-W3515 PolarHBondContact O-N 3.49Å; F3512-W3515 PolarHBondContact O-N 3.08Å; W3515-L3518 WeakPolarHBondContact O-CB 3.38Å; W3515-L3518 PolarHBondContact O-N 2.71Å; W3515-L3519 PolarHBondContact O-N 3.36Å
3516M81.7Confident77.4Confident15 Ų1560.2 Ų60.27%0.07432%0.318CS..Hα-helixtrans-63.6-37.1-174.4-69.7-52.5-5800114.4F3512 L3518 L3519 H3520 L3534 V3538F3512-M3516 HydrophobicContact CD1-CG 3.67Å; F3512-M3516 HydrophobicContact CD2-CG 3.86Å; F3512-M3516 HydrophobicContact CD2-SD 4.09Å; F3512-M3516 HydrophobicContact CE1-CG 3.47Å; F3512-M3516 VanDerWaalsContact CE1-CG 3.47Å; F3512-M3516 HydrophobicContact CE1-SD 4.17Å; F3512-M3516 HydrophobicContact CE2-CG 3.66Å; F3512-M3516 HydrophobicContact CE2-SD 3.46Å; F3512-M3516 WeakPolarHBondContact CE2-SD 3.49Å; F3512-M3516 HydrophobicContact CG-CG 3.85Å; F3512-M3516 HydrophobicContact CZ-CE 4.23Å; F3512-M3516 HydrophobicContact CZ-CG 3.44Å; F3512-M3516 VanDerWaalsContact CZ-CG 3.44Å; F3512-M3516 HydrophobicContact CZ-SD 3.5Å; F3512-M3516 WeakPolarHBondContact CZ-SD 3.17Å; F3512-M3516 WeakPolarHBondContact O-CB 3.26Å; F3512-M3516 VanDerWaalsContact O-CG 3.27Å; F3512-M3516 WeakPolarHBondContact O-CG 3.39Å; F3512-M3516 PolarHBondContact O-N 2.94Å; M3516-L3518 VanDerWaalsContact C-N 3.26Å; M3516-L3518 PolarHBondContact O-N 3.03Å; M3516-L3519 PolarHBondContact O-N 3.15Å; M3516-H3520 VanDerWaalsContact CE-CE1 3.4Å; M3516-H3520 WeakPolarHBondContact CE-CE1 3.24Å; M3516-H3520 WeakPolarHBondContact O-CB 3.34Å; M3516-H3520 PolarHBondContact O-N 2.98Å; M3516-H3520 PolarHBondContact O-ND1 2.94Å; M3516-L3534 HydrophobicContact CE-CD1 3.45Å; M3516-L3534 VanDerWaalsContact CE-CD1 3.45Å; M3516-L3534 HydrophobicContact CE-CD2 4.4Å; M3516-L3534 HydrophobicContact CE-CG 3.87Å; M3516-L3534 HydrophobicContact SD-CD1 3.9Å; M3516-V3538 HydrophobicContact CE-CG2 3.32Å; M3516-V3538 HydrophobicContact SD-CG2 4.45Å
3517P80.3Confident77.4Confident77 Ų7760.7 Ų60.750%0.532%0.319SS..Hα-helixtrans-59.2-34.1169.7-26.536.2000113.4T3513 H3520 G3521T3513-P3517 WeakPolarHBondContact O-CD 3.33Å; T3513-P3517 WeakPolarHBondContact O-CG 3.28Å; P3517-H3520 PolarHBondContact O-N 3.49Å; P3517-G3521 PolarHBondContact O-N 2.93Å
3518L77.2Confident77.2Confident42 Ų4263.1 Ų63.122%0.2235%0.345CS..Hα-helixtrans-68.6-41.9-177.5-44.4-169.6000111.4M3473 L3477 L3514 W3515 M3516M3473-L3518 HydrophobicContact SD-CD1 3.86Å; L3477-L3518 HydrophobicContact CD2-CD1 4.33Å; L3477-L3518 HydrophobicContact CD2-CD2 3.63Å; L3477-L3518 HydrophobicContact CD2-CG 4.48Å; L3477-L3518 HydrophobicContact CG-CD1 4.32Å; L3477-L3518 HydrophobicContact CG-CD2 4.32Å; L3514-L3518 WeakPolarHBondContact O-CG 3.47Å; W3515-L3518 WeakPolarHBondContact O-CB 3.38Å; W3515-L3518 PolarHBondContact O-N 2.71Å; M3516-L3518 VanDerWaalsContact C-N 3.26Å; M3516-L3518 PolarHBondContact O-N 3.03Å
3519L76.4Confident77.2Confident6 Ų668.2 Ų68.23%0.03137%0.372CS..Hα-helixtrans-75.2-31.9178.6-64.2172.3000111.8L3493 I3497 W3515 M3516 L3534L3493-L3519 HydrophobicContact CD2-CD2 4.18Å; L3493-L3519 HydrophobicContact CD2-CG 4.45Å; I3497-L3519 HydrophobicContact CD1-CD1 3.58Å; W3515-L3519 PolarHBondContact O-N 3.36Å; M3516-L3519 PolarHBondContact O-N 3.15Å; L3519-L3534 HydrophobicContact CB-CD1 3.98Å; L3519-L3534 HydrophobicContact CB-CD2 4.22Å; L3519-L3534 HydrophobicContact CD1-CD1 3.6Å; L3519-L3534 HydrophobicContact CG-CD1 4.4Å
3520H73.8Confident77.3Confident79 Ų7966.2 Ų66.237%0.36636%0.357SS..Hα-helixtrans-74.2-29.4173.6-77.896.1000113.8M3516 P3517 R3522 Q3523M3516-H3520 VanDerWaalsContact CE-CE1 3.4Å; M3516-H3520 WeakPolarHBondContact CE-CE1 3.24Å; M3516-H3520 WeakPolarHBondContact O-CB 3.34Å; M3516-H3520 PolarHBondContact O-N 2.98Å; M3516-H3520 PolarHBondContact O-ND1 2.94Å; P3517-H3520 PolarHBondContact O-N 3.49Å; H3520-R3522 PolarHBondContact O-N 2.66Å; H3520-Q3523 PolarHBondContact CD2-NE2 3.46Å; H3520-Q3523 PolarHBondContact NE2-NE2 3.41Å; H3520-Q3523 WeakPolarHBondContact O-CB 3.31Å; H3520-Q3523 PolarHBondContact O-N 3.09Å
3521G67.4Low77.3Confident66 Ų6664.1 Ų64.168%0.6835%0.351SS*.THydrogen-bonded Turntrans-56.9-22.9-176.400000115.6P3517P3517-G3521 PolarHBondContact O-N 2.93Å
3522R67Low77.2Confident97 Ų9771.1 Ų71.137%0.36638%0.381SS..THydrogen-bonded Turntrans-126.529.9171-69.4-176.2176.7178.94.8113L3480 S3481 F3486 H3520 K3524 Q3525L3480-R3522 PolarHBondContact O-NH1 2.89Å; S3481-R3522 PolarHBondContact O-NH2 3.34Å; F3486-R3522 HydrophobicContact CE2-CB 4.12Å; H3520-R3522 PolarHBondContact O-N 2.66Å; R3522-K3524 PolarHBondContact O-N 3.41Å; R3522-Q3525 PolarHBondContact O-N 3.08Å
3523Q63.5Low77.4Confident82 Ų8272 Ų7238%0.38338%0.383SS..G310 helixtrans-51.3-36.7-173.4-165.4-178.930.600114.1H3520 Q3525 L3526 L3531H3520-Q3523 PolarHBondContact CD2-NE2 3.46Å; H3520-Q3523 PolarHBondContact NE2-NE2 3.41Å; H3520-Q3523 WeakPolarHBondContact O-CB 3.31Å; H3520-Q3523 PolarHBondContact O-N 3.09Å; Q3523-Q3525 PolarHBondContact O-N 2.97Å; Q3523-Q3525 VanDerWaalsContact O-N 3.16Å; Q3523-L3526 PolarHBondContact O-N 3.22Å; Q3523-L3531 HydrophobicContact CG-CD1 3.91Å
3524K62Low77.5Confident216 Ų21667.4 Ų67.494%0.93936%0.355SS*.G310 helixtrans-63.9-14.6177.9-67-173.9178.6-179.20114.9R3522R3522-K3524 PolarHBondContact O-N 3.41Å
3525Q69.6Low77.6Confident116 Ų11668 Ų6854%0.54236%0.355SS..G310 helixtrans-102.6-6.9179.3-63.1178.4-20.400112.7F3486 R3522 Q3523F3486-Q3525 HydrophobicContact CE1-CB 3.6Å; F3486-Q3525 HydrophobicContact CZ-CB 3.53Å; F3486-Q3525 WeakPolarHBondContact CZ-O 3.39Å; R3522-Q3525 PolarHBondContact O-N 3.08Å; Q3523-Q3525 PolarHBondContact O-N 2.97Å; Q3523-Q3525 VanDerWaalsContact O-N 3.16Å
3526L74.1Confident77.6Confident20 Ų2075.3 Ų75.311%0.10539%0.387CS..SBendtrans-77.6131.2-176.5-77.8175.1000111.9F3486 Q3523 M3530 L3534F3486-L3526 HydrophobicContact CE2-CD2 3.62Å; F3486-L3526 HydrophobicContact CE2-CG 4.1Å; F3486-L3526 HydrophobicContact CZ-CD2 3.78Å; F3486-L3526 HydrophobicContact CZ-CG 4.12Å; Q3523-L3526 PolarHBondContact O-N 3.22Å; L3526-M3530 HydrophobicContact CD2-CE 3.72Å; L3526-M3530 HydrophobicContact CD2-SD 4.28Å; L3526-L3534 HydrophobicContact CD1-CD2 4.37Å
3527P79.8Confident77.7Confident49 Ų4974.7 Ų74.732%0.31838%0.384SS..  trans-55.6141.3172.4-29.537.9000113.2V3487 N3529 M3530 L3531V3487-P3527 HydrophobicContact CG1-CG 3.74Å; V3487-P3527 HydrophobicContact CG2-CG 4.32Å; P3527-N3529 VanDerWaalsContact CB-OD1 3.25Å; P3527-N3529 WeakPolarHBondContact CB-OD1 3.44Å; P3527-N3529 PolarHBondContact O-N 3.1Å; P3527-N3529 VanDerWaalsContact O-N 3.07Å; P3527-M3530 HydrophobicContact CG-SD 4.44Å; P3527-M3530 WeakPolarHBondContact O-CA 3.47Å; P3527-M3530 WeakPolarHBondContact O-CB 3.23Å; P3527-M3530 PolarHBondContact O-N 3.34Å; P3527-L3531 PolarHBondContact O-N 3.46Å
3528G80.3Confident77.8Confident52 Ų5275 Ų7554%0.53638%0.384SS..Hα-helixtrans-61.5-21.9-172.300000115.7K3532G3528-K3532 WeakPolarHBondContact O-CG 3.36Å; G3528-K3532 PolarHBondContact O-N 3Å
3529N84Confident78.1Confident108 Ų10878.8 Ų78.858%0.57840%0.401SS*.Hα-helixtrans-72.8-34.8170.564.1-34.3000112.3P3527 R3533P3527-N3529 VanDerWaalsContact CB-OD1 3.25Å; P3527-N3529 WeakPolarHBondContact CB-OD1 3.44Å; P3527-N3529 PolarHBondContact O-N 3.1Å; P3527-N3529 VanDerWaalsContact O-N 3.07Å; N3529-R3533 WeakPolarHBondContact O-CG 3.45Å; N3529-R3533 PolarHBondContact O-N 3.43Å
3530M82.6Confident78.1Confident10 Ų1081.7 Ų81.75%0.04941%0.411CS..Hα-helixtrans-72-37.7172.1-67.2-175.859.200111.7V3487 G3491 L3494 L3526 P3527 K3532 R3533 L3534V3487-M3530 HydrophobicContact CG1-SD 3.78Å; G3491-M3530 VanDerWaalsContact CA-CE 3.42Å; G3491-M3530 VanDerWaalsContact N-CE 3.32Å; L3494-M3530 HydrophobicContact CD2-CB 4.39Å; L3494-M3530 HydrophobicContact CD2-CE 4.4Å; L3526-M3530 HydrophobicContact CD2-CE 3.72Å; L3526-M3530 HydrophobicContact CD2-SD 4.28Å; P3527-M3530 HydrophobicContact CG-SD 4.44Å; P3527-M3530 WeakPolarHBondContact O-CA 3.47Å; P3527-M3530 WeakPolarHBondContact O-CB 3.23Å; P3527-M3530 PolarHBondContact O-N 3.34Å; M3530-K3532 VanDerWaalsContact C-N 3.29Å; M3530-K3532 PolarHBondContact O-N 2.97Å; M3530-R3533 PolarHBondContact O-N 3.32Å; M3530-R3533 VanDerWaalsContact O-N 3.14Å; M3530-L3534 WeakPolarHBondContact O-CB 3.5Å; M3530-L3534 PolarHBondContact O-N 2.8Å
3531L82.9Confident77.9Confident68 Ų6885.6 Ų85.636%0.35643%0.43SS..Hα-helixtrans-60.1-40.3175-172.662.9000111.5Q3523 P3527 L3534 Q3535Q3523-L3531 HydrophobicContact CG-CD1 3.91Å; P3527-L3531 PolarHBondContact O-N 3.46Å; L3531-L3534 PolarHBondContact O-N 2.99Å; L3531-Q3535 WeakPolarHBondContact O-CB 3.41Å; L3531-Q3535 PolarHBondContact O-N 3.24Å
3532K85.4Confident77.6Confident150 Ų15085.7 Ų85.765%0.65242%0.418SS*.Hα-helixtrans-66.6-35.4173.1-73.3-174.9176.7-166.80113.9G3528 M3530 K3536G3528-K3532 WeakPolarHBondContact O-CG 3.36Å; G3528-K3532 PolarHBondContact O-N 3Å; M3530-K3532 VanDerWaalsContact C-N 3.29Å; M3530-K3532 PolarHBondContact O-N 2.97Å; K3532-K3536 PolarHBondContact O-N 3.38Å; K3532-K3536 VanDerWaalsContact O-N 3.13Å
3533R88.2Confident77.3Confident67 Ų6783.9 Ų83.925%0.25342%0.419SS..Hα-helixtrans-67-43.6172.9-77.2171.562.4-154.3-4.7111.3G3491 L3494 T3495 E3498 N3529 M3530 K3536 C3537G3491-R3533 PolarHBondContact O-NH2 2.9Å; L3494-R3533 HydrophobicContact CD2-CB 3.6Å; L3494-R3533 HydrophobicContact CG-CB 4.26Å; T3495-R3533 PolarHBondContact OG1-NH2 3.24Å; E3498-R3533 WeakPolarHBondContact OE1-CB 3.46Å; E3498-R3533 WeakPolarHBondContact OE1-CG 3.29Å; E3498-R3533 IonicContact OE1-CZ 2.81Å; E3498-R3533 IonicContact OE1-NE 2.68Å; E3498-R3533 PolarHBondContact OE1-NE 3.2Å; E3498-R3533 IonicContact OE1-NH2 3.64Å; E3498-R3533 PolarHBondContact OE1-NH2 3.13Å; E3498-R3533 IonicContact OE2-CZ 3.38Å; E3498-R3533 IonicContact OE2-NE 3.76Å; E3498-R3533 PolarHBondContact OE2-NE 2.83Å; E3498-R3533 IonicContact OE2-NH2 3.43Å; E3498-R3533 PolarHBondContact OE2-NH2 3.4Å; N3529-R3533 WeakPolarHBondContact O-CG 3.45Å; N3529-R3533 PolarHBondContact O-N 3.43Å; M3530-R3533 PolarHBondContact O-N 3.32Å; M3530-R3533 VanDerWaalsContact O-N 3.14Å; R3533-K3536 PolarHBondContact O-N 2.98Å; R3533-C3537 PolarHBondContact O-N 3.02Å; R3533-C3537 VanDerWaalsContact O-N 3.12Å; R3533-C3537 PolarHBondContact O-SG 3.36Å
3534L84.7Confident76.6Confident4 Ų484.8 Ų84.82%0.02142%0.423CS..Hα-helixtrans-62.5-43175.7-170.567.5000111.6L3494 M3516 L3519 L3526 M3530 L3531 C3537 V3538L3494-L3534 HydrophobicContact CD1-CB 4.44Å; L3494-L3534 HydrophobicContact CD1-CD1 3.95Å; L3494-L3534 HydrophobicContact CD2-CB 4.43Å; M3516-L3534 HydrophobicContact CE-CD1 3.45Å; M3516-L3534 VanDerWaalsContact CE-CD1 3.45Å; M3516-L3534 HydrophobicContact CE-CD2 4.4Å; M3516-L3534 HydrophobicContact CE-CG 3.87Å; M3516-L3534 HydrophobicContact SD-CD1 3.9Å; L3519-L3534 HydrophobicContact CB-CD1 3.98Å; L3519-L3534 HydrophobicContact CB-CD2 4.22Å; L3519-L3534 HydrophobicContact CD1-CD1 3.6Å; L3519-L3534 HydrophobicContact CG-CD1 4.4Å; L3526-L3534 HydrophobicContact CD1-CD2 4.37Å; M3530-L3534 WeakPolarHBondContact O-CB 3.5Å; M3530-L3534 PolarHBondContact O-N 2.8Å; L3531-L3534 PolarHBondContact O-N 2.99Å; L3534-C3537 WeakPolarHBondContact O-CA 3.38Å; L3534-C3537 WeakPolarHBondContact O-CB 3.46Å; L3534-C3537 PolarHBondContact O-N 3.07Å; L3534-V3538 WeakPolarHBondContact O-CG2 3.37Å; L3534-V3538 PolarHBondContact O-N 3.06Å
3535Q84.7Confident75.9Confident102 Ų10279 Ų7948%0.47741%0.408SS..Hα-helixtrans-56.6-49.9173.9176.3175.5-200111.2L3531 C3537 V3538 E3539L3531-Q3535 WeakPolarHBondContact O-CB 3.41Å; L3531-Q3535 PolarHBondContact O-N 3.24Å; Q3535-C3537 PolarHBondContact O-N 2.69Å; Q3535-C3537 VanDerWaalsContact O-N 3.16Å; Q3535-V3538 WeakPolarHBondContact O-CA 3.4Å; Q3535-V3538 PolarHBondContact O-N 3.38Å; Q3535-E3539 VanDerWaalsContact CG-CD 3.47Å; Q3535-E3539 HydrophobicContact CG-CG 4.23Å; Q3535-E3539 VanDerWaalsContact CG-OE1 3.23Å; Q3535-E3539 WeakPolarHBondContact CG-OE1 3.41Å; Q3535-E3539 PolarHBondContact NE2-OE1 3.24Å; Q3535-E3539 WeakPolarHBondContact O-CB 3.34Å; Q3535-E3539 WeakPolarHBondContact O-CG 3.27Å; Q3535-E3539 PolarHBondContact O-N 3.09Å
3536K84.6Confident74.3Confident155 Ų15580.2 Ų80.267%0.67441%0.408SS*.Hα-helixtrans-57.8-28.8173.7-75.7-172.6171.4-159.40114.1K3532 R3533 W3540K3532-K3536 PolarHBondContact O-N 3.38Å; K3532-K3536 VanDerWaalsContact O-N 3.13Å; R3533-K3536 PolarHBondContact O-N 2.98Å; K3536-W3540 PolarHBondContact O-N 2.94Å
3537C83.6Confident72.7Confident3 Ų384.1 Ų84.12%0.0243%0.429CS..Hα-helixtrans-77.1-28.7175.7-60.10000112.4I3497 M3501 F3512 R3533 L3534 Q3535I3497-C3537 HydrophobicContact CG2-CB 3.96Å; M3501-C3537 HydrophobicContact CE-CB 3.94Å; M3501-C3537 HydrophobicContact SD-CB 4.27Å; F3512-C3537 HydrophobicContact CE2-CB 4.22Å; F3512-C3537 WeakPolarHBondContact CE2-O 3.4Å; F3512-C3537 WeakPolarHBondContact CZ-O 3.3Å; R3533-C3537 PolarHBondContact O-N 3.02Å; R3533-C3537 VanDerWaalsContact O-N 3.12Å; R3533-C3537 PolarHBondContact O-SG 3.36Å; L3534-C3537 WeakPolarHBondContact O-CA 3.38Å; L3534-C3537 WeakPolarHBondContact O-CB 3.46Å; L3534-C3537 PolarHBondContact O-N 3.07Å; Q3535-C3537 PolarHBondContact O-N 2.69Å; Q3535-C3537 VanDerWaalsContact O-N 3.16Å
3538V82.8Confident70.9Confident82 Ų8288.9 Ų88.950%0.49744%0.441SS..Hα-helixtrans-80.1-33.6174.3175.30000112F3512 M3516 L3534 Q3535 W3540F3512-V3538 HydrophobicContact CZ-CG2 4.14Å; M3516-V3538 HydrophobicContact CE-CG2 3.32Å; M3516-V3538 HydrophobicContact SD-CG2 4.45Å; L3534-V3538 WeakPolarHBondContact O-CG2 3.37Å; L3534-V3538 PolarHBondContact O-N 3.06Å; Q3535-V3538 WeakPolarHBondContact O-CA 3.4Å; Q3535-V3538 PolarHBondContact O-N 3.38Å; V3538-W3540 PolarHBondContact O-N 3.33Å
3539E82.8Confident68.7Low123 Ų12390.1 Ų90.158%0.57544%0.435SS*.SBendtrans-76.2-1.9174.5-67.9168.2165.500113.1Q3535 E3541Q3535-E3539 VanDerWaalsContact CG-CD 3.47Å; Q3535-E3539 HydrophobicContact CG-CG 4.23Å; Q3535-E3539 VanDerWaalsContact CG-OE1 3.23Å; Q3535-E3539 WeakPolarHBondContact CG-OE1 3.41Å; Q3535-E3539 PolarHBondContact NE2-OE1 3.24Å; Q3535-E3539 WeakPolarHBondContact O-CB 3.34Å; Q3535-E3539 WeakPolarHBondContact O-CG 3.27Å; Q3535-E3539 PolarHBondContact O-N 3.09Å; E3539-E3541 PolarHBondContact O-N 3.3Å
3540W75.5Confident66.4Low67 Ų6790 Ų9025%0.25443%0.434SS..  trans-79.6111177.6-178.680.4000111M3501 Q3504 K3536 V3538 P3542M3501-W3540 HydrophobicContact CB-CD2 4.37Å; M3501-W3540 HydrophobicContact CB-CZ2 4.18Å; M3501-W3540 HydrophobicContact CE-CB 3.28Å; M3501-W3540 HydrophobicContact CE-CD2 3.62Å; M3501-W3540 HydrophobicContact CE-CE3 3.99Å; M3501-W3540 HydrophobicContact CE-CG 3.34Å; M3501-W3540 HydrophobicContact CG-CD2 4.09Å; M3501-W3540 HydrophobicContact CG-CE3 4.09Å; M3501-W3540 HydrophobicContact CG-CH2 4.18Å; M3501-W3540 HydrophobicContact CG-CZ2 4.19Å; M3501-W3540 HydrophobicContact CG-CZ3 4.13Å; M3501-W3540 HydrophobicContact SD-CE3 4.43Å; Q3504-W3540 HydrophobicContact CG-CZ2 4.27Å; K3536-W3540 PolarHBondContact O-N 2.94Å; V3538-W3540 PolarHBondContact O-N 3.33Å; W3540-P3542 HydrophobicContact CE3-CB 4.29Å; W3540-P3542 HydrophobicContact CH2-CB 4.2Å; W3540-P3542 HydrophobicContact CZ3-CB 3.75Å
3541E70.2Confident64.2Low161 Ų16194.8 Ų94.875%0.75246%0.459SS*.PPolyproline II helixtrans-69.1121.4167.9-169.4157.5-129.800109.6E3539E3539-E3541 PolarHBondContact O-N 3.3Å
3542P62.4Low62Low68 Ų6897.2 Ų97.244%0.44247%0.472SS..PPolyproline II helixtrans-63.8142.8175.127.8-33.9000109.4W3540 E3544W3540-P3542 HydrophobicContact CE3-CB 4.29Å; W3540-P3542 HydrophobicContact CH2-CB 4.2Å; W3540-P3542 HydrophobicContact CZ3-CB 3.75Å; P3542-E3544 PolarHBondContact O-N 3.41Å
3543P59.9Low59.7Low58 Ų5896 Ų9638%0.37747%0.472SS..PPolyproline II helixtrans-58.4116.8178.625.6-34.4000109.2Q3504Q3504-P3543 HydrophobicContact CB-CG 4.34Å; Q3504-P3543 HydrophobicContact CG-CB 4.46Å; Q3504-P3543 HydrophobicContact CG-CG 3.98Å
3544E49Very low57.3Low102 Ų10297 Ų9748%0.47749%0.489SS..PPolyproline II helixtrans-53.4139.8-176.5-71.6-159.5122.500111P3542 Y3546 N3547P3542-E3544 PolarHBondContact O-N 3.41Å; E3544-Y3546 PolarHBondContact O-N 3.37Å; E3544-Y3546 VanDerWaalsContact O-N 3.08Å; E3544-N3547 PolarHBondContact O-N 3.15Å
3545P47.8Very low54.9Low94 Ų94100.1 Ų100.161%0.6151%0.505SS*.Hα-helixtrans-57.1-26.8169.226.9-34.5000110.8R3548 L3549P3545-R3548 PolarHBondContact O-N 2.93Å; P3545-L3549 PolarHBondContact O-N 3.22Å
3546Y36Very low52.3Low141 Ų141100.8 Ų100.855%0.55352%0.518SS*.Hα-helixtrans-65.3-30.9174.7-68.2-67.8000114.4E3544 R3548 L3549 L3550E3544-Y3546 PolarHBondContact O-N 3.37Å; E3544-Y3546 VanDerWaalsContact O-N 3.08Å; Y3546-R3548 VanDerWaalsContact C-N 3.27Å; Y3546-R3548 PolarHBondContact O-N 3.13Å; Y3546-L3549 CarbonylContact O-C 3.58Å; Y3546-L3549 PolarHBondContact O-N 3.47Å; Y3546-L3549 VanDerWaalsContact O-N 3.09Å; Y3546-L3550 WeakPolarHBondContact O-CB 3.29Å; Y3546-L3550 PolarHBondContact O-N 3.39Å
3547N40.2Very low49.7Very low102 Ų10298.9 Ų98.955%0.54552%0.516SS..Hα-helixtrans-66.9-30.9177.3-101.6-61.1000112.6E3544E3544-N3547 PolarHBondContact O-N 3.15Å
3548R41.1Very low47.2Very low149 Ų149104 Ų10456%0.56255%0.548SS*.Hα-helixtrans-75.3-32.8170.7-115.3179.7171-172.4-5.3112.8P3545 Y3546 L3552P3545-R3548 PolarHBondContact O-N 2.93Å; Y3546-R3548 VanDerWaalsContact C-N 3.27Å; Y3546-R3548 PolarHBondContact O-N 3.13Å; R3548-L3552 WeakPolarHBondContact O-CD1 3.34Å; R3548-L3552 WeakPolarHBondContact O-CG 3.25Å
3549L33.7Very low44.8Very low79 Ų79107.7 Ų107.741%0.41457%0.565SS.*Hα-helixtrans-79.1-38.6178.3-82.1162000113P3545 Y3546 L3552 L3553P3545-L3549 PolarHBondContact O-N 3.22Å; Y3546-L3549 CarbonylContact O-C 3.58Å; Y3546-L3549 PolarHBondContact O-N 3.47Å; Y3546-L3549 VanDerWaalsContact O-N 3.09Å; L3549-L3552 CarbonylContact O-C 3.59Å; L3549-L3552 WeakPolarHBondContact O-CA 3.22Å; L3549-L3552 PolarHBondContact O-N 3.1Å; L3549-L3553 HydrophobicContact CB-CD1 4.14Å; L3549-L3553 HydrophobicContact CD2-CD1 4.48Å; L3549-L3553 VanDerWaalsContact O-CB 3.25Å; L3549-L3553 WeakPolarHBondContact O-CB 3.29Å; L3549-L3553 WeakPolarHBondContact O-CG 3.3Å; L3549-L3553 PolarHBondContact O-N 2.79Å
3550L35.8Very low42.4Very low105 Ų105106.2 Ų106.255%0.5556%0.564SS.*Hα-helixtrans-68.2-36.6178.8-109.8149.7000111.8Y3546 L3552 L3553 S3554Y3546-L3550 WeakPolarHBondContact O-CB 3.29Å; Y3546-L3550 PolarHBondContact O-N 3.39Å; L3550-L3552 PolarHBondContact O-N 3.38Å; L3550-L3553 PolarHBondContact O-N 2.7Å; L3550-S3554 WeakPolarHBondContact O-CB 3.4Å; L3550-S3554 PolarHBondContact O-N 2.94Å; L3550-S3554 PolarHBondContact O-OG 2.86Å
3551L37.8Very low40.1Very low111 Ų111110.8 Ų110.858%0.58159%0.594SS**Hα-helixtrans-69.2-15.3169.6-82.8167.1000113.7L3555L3551-L3555 WeakPolarHBondContact O-CD1 3.34Å
3552L35.4Very low38.2Very low118 Ų118108.3 Ų108.362%0.61859%0.594SS**Hα-helixtrans-99.7-23.6173-71.8172.4000113.5R3548 L3549 L3550R3548-L3552 WeakPolarHBondContact O-CD1 3.34Å; R3548-L3552 WeakPolarHBondContact O-CG 3.25Å; L3549-L3552 CarbonylContact O-C 3.59Å; L3549-L3552 WeakPolarHBondContact O-CA 3.22Å; L3549-L3552 PolarHBondContact O-N 3.1Å; L3550-L3552 PolarHBondContact O-N 3.38Å
3553L37.2Very low36.6Very low125 Ų125115.7 Ų115.765%0.65461%0.613SS**Hα-helixtrans-95.8-9.8178.5-68.4166.8000112.7L3549 L3550 L3555L3549-L3553 HydrophobicContact CB-CD1 4.14Å; L3549-L3553 HydrophobicContact CD2-CD1 4.48Å; L3549-L3553 VanDerWaalsContact O-CB 3.25Å; L3549-L3553 WeakPolarHBondContact O-CB 3.29Å; L3549-L3553 WeakPolarHBondContact O-CG 3.3Å; L3549-L3553 PolarHBondContact O-N 2.79Å; L3550-L3553 PolarHBondContact O-N 2.7Å; L3553-L3555 VanDerWaalsContact C-N 3.35Å
3554S38.2Very low35.1Very low88 Ų88120.4 Ų120.462%0.61564%0.635SS**SBendtrans-88.6-3.7166.5-52.30000112.4L3550L3550-S3554 WeakPolarHBondContact O-CB 3.4Å; L3550-S3554 PolarHBondContact O-N 2.94Å; L3550-S3554 PolarHBondContact O-OG 2.86Å
3555L34.1Very low34.3Very low70 Ų70121.8 Ų121.837%0.36665%0.652SS.*SBendtrans-70.2139.8159.2-89.771.8000108.2L3551 L3553 D3557 A3671L3551-L3555 WeakPolarHBondContact O-CD1 3.34Å; L3553-L3555 VanDerWaalsContact C-N 3.35Å; L3555-D3557 PolarHBondContact O-N 3.01Å; L3555-A3671 HydrophobicContact CD2-CB 4.04Å
3556P30.3Very low33.4Very low115 Ų115122.4 Ų122.475%0.74766%0.659SS**  trans-64.4121.3167.4-15.429.3000109.5P3558P3556-P3558 WeakPolarHBondContact O-CD 3.42Å; P3556-P3558 VanDerWaalsContact O-N 3.15Å
3557D29.7Very low33.1Very low116 Ų116119.3 Ų119.362%0.6267%0.67SS**  trans-55115.6170.6-98.6-30.9000109.7L3555 L3559 T3560L3555-D3557 PolarHBondContact O-N 3.01Å; D3557-L3559 PolarHBondContact O-N 2.93Å; D3557-T3560 WeakPolarHBondContact CB-OG1 3.38Å; D3557-T3560 PolarHBondContact OD2-OG1 2.95Å
3558P32Very low32.9Very low109 Ų109120.2 Ų120.271%0.70868%0.681SS**THydrogen-bonded Turntrans-72.15.5-175-2135.1000114.9P3556P3556-P3558 WeakPolarHBondContact O-CD 3.42Å; P3556-P3558 VanDerWaalsContact O-N 3.15Å
3559L32.6Very low32.5Very low161 Ų161119.3 Ų119.384%0.84369%0.693SS**THydrogen-bonded Turntrans-134.90.6-165.3-66.4175000115.2D3557D3557-L3559 PolarHBondContact O-N 2.93Å
3560T30.9Very low32.4Very low92 Ų92122.3 Ų122.356%0.56471%0.714SS**SBendtrans-122.334.1-17053.30000115.5D3557D3557-T3560 WeakPolarHBondContact CB-OG1 3.38Å; D3557-T3560 PolarHBondContact OD2-OG1 2.95Å
3561N28.9Very low32.2Very low163 Ų163120.6 Ų120.687%0.87272%0.722SS**  trans-133.844.3165-106.2-37.9000114.6R3563N3561-R3563 PolarHBondContact O-N 3.11Å
3562S28.7Very low31.9Very low109 Ų109124.4 Ų124.476%0.76274%0.736SS**  trans-94.372.2167.3-173.30000111.7
3563R29.7Very low31.4Very low223 Ų223123.9 Ų123.984%0.84274%0.742SS**  trans-176.2144.8153.3-103153.3-127.2-122.10.9111.6N3561N3561-R3563 PolarHBondContact O-N 3.11Å
3564L27.2Very low30.9Very low157 Ų157125.9 Ų125.982%0.82275%0.748SS**  trans-71.2163.7178.5-65.774.1000111.1
3565P31.8Very low30.3Very low130 Ų130128.2 Ų128.284%0.84475%0.754SS**  -129.1135.2105.625.3-11.1000114.8
3566S30.4Very low30.1Very low108 Ų108132.4 Ų132.476%0.75578%0.776SS**  trans-43.2143.5174.9500000118.8
3567G29.2Very low30.1Very low76 Ų76131.9 Ų131.978%0.78478%0.775SS**  trans-143.7119.6155.400000109.5
3568P36.4Very low29.9Very low121 Ų121135.7 Ų135.779%0.78679%0.786SS**  trans-118.7159-156.840.9-32.9000116.7
3569T32.2Very low29.6Very low130 Ų130136.8 Ų136.880%0.79879%0.791SS**  trans-139.4123.2157.729.90000112.4
3570T32.7Very low29.5Very low142 Ų142133.4 Ų133.487%0.87179%0.787SS**  trans45.4116148.8570000120.8
3571G30.8Very low29.4Very low68 Ų68136.3 Ų136.370%0.70180%0.797SS**  trans-177.918.6169.500000120.3
3572H31.1Very low29.3Very low192 Ų192135.4 Ų135.489%0.88980%0.798SS**  trans60.7132.4-176.8-54.1-89.1000114.9
3573S24.9Very low29.3Very low107 Ų107133.1 Ų133.175%0.74879%0.791SS**  cis-148.3159.337.6-55.60000112.8
3574E26.2Very low29.3Very low167 Ų167128.8 Ų128.878%0.7879%0.79SS**  trans59.7107.9161.5-66-177.4-161.900119.6
3575N26.2Very low29.5Very low136 Ų136125.4 Ų125.473%0.72778%0.784SS**  trans65.2122.3132.2-55.7-31.1000118.6
3576L29.8Very low29.5Very low159 Ų159125.8 Ų125.883%0.83278%0.779SS**  cis-149.6170.214.5-105.6148.7000112.6
3577S30.4Very low29.5Very low104 Ų104125 Ų12573%0.72777%0.77SS**  trans-56.4154-173.749.20000117.5
3578F25.2Very low29.6Very low195 Ų195130.7 Ų130.786%0.85577%0.774SS**  trans-63178.9162.6-124.4-105.2000113.1
3579T25.7Very low29.5Very low132 Ų132130 Ų13081%0.8177%0.769SS**  trans6789.8162.3440000120.2
3580A30.4Very low29.6Very low91 Ų91129.4 Ų129.475%0.75277%0.771SS**  trans-164.7114.6142.600000108.8
3581I28.8Very low29.8Very low153 Ų153127.1 Ų127.179%0.78576%0.76SS**  78.4102.292-68.4168000115.2
3582T27.8Very low30Very low143 Ų143131.2 Ų131.288%0.87776%0.761SS**  trans62.9155.6152.3600000122.5
3583G29.4Very low30.1Very low61 Ų61131.1 Ų131.163%0.62975%0.754SS**  trans120.966159.700000116.2
3584T29.4Very low30.5Very low133 Ų133131.8 Ų131.882%0.81675%0.745SS**  64.6134.886.4660000117.8
3585A31.3Very low30.8Very low85 Ų85131.4 Ų131.470%0.70274%0.741SS**  trans70.2151.2156.700000118.3
3586N32.1Very low31.1Very low138 Ų138129.9 Ų129.974%0.73874%0.738SS**  cis-156.5138.2-15.3-105.7-9.1000110.8
3587T29.8Very low31Very low93 Ų93128.9 Ų128.957%0.57173%0.733SS**  42.8123.7117.3-34.10000120.5
3588F30.4Very low31Very low194 Ų194132.1 Ų132.185%0.85174%0.741SS**  -177.9154.5102-94.5-72.9000112.5
3589P35.4Very low31Very low107 Ų107130 Ų13070%0.69573%0.733SS**  trans-129.3-154.2-165.145.9-30.7000115.1
3590S33.7Very low31Very low118 Ų118128.1 Ų128.183%0.82573%0.725SS**  trans90.9152.5172.7840000115.8
3591S36.2Very low30.8Very low94 Ų94130.3 Ų130.366%0.65773%0.73SS**  cis-152.513911.760.30000114.7
3592H35.4Very low30.9Very low153 Ų153128.2 Ų128.271%0.70873%0.729SS**  trans57.1152.4139.9-73.6-102.5000120.8
3593Y34.4Very low31Very low191 Ų191126.1 Ų126.175%0.74972%0.72SS**  cis-154.9170.74.8-96.6-56.1000105.9
3594E32.9Very low31Very low121 Ų121128 Ų12857%0.56572%0.723SS**  cis-162123.2-31.5-164.9140.9-153.900103.9
3595K31.9Very low31Very low158 Ų158129.8 Ų129.869%0.68773%0.727SS**  60.616591.7-160-161.7-175.3-174.20113.6
3596P32.8Very low30.9Very low104 Ų104131.3 Ų131.368%0.67573%0.73SS**  cis-106.6169.5-21.13.921.6000111.6
3597L26.8Very low30.6Very low138 Ų138127.9 Ų127.972%0.72373%0.727SS**  cis70.5122.239.9-105.3152.3000116.2
3598I30.8Very low30.7Very low172 Ų172134.6 Ų134.688%0.88274%0.742SS**  trans-172.2154.9138.8-99.9155.1000109.5
3599H25.4Very low30.9Very low152 Ų152129.6 Ų129.670%0.70473%0.728SS**  trans-125.5143.5-159.8-107.1-80.5000114.3
3600S26.1Very low30.8Very low92 Ų92132.5 Ų132.564%0.64373%0.732SS**  trans76155.1137.5-58.20000122.6
3601T26.1Very low30.7Very low137 Ų137130.6 Ų130.684%0.8472%0.719SS**  trans77.9106.8163.667.20000119.9
3602S31Very low30.6Very low109 Ų109129 Ų12976%0.76271%0.707SS**  -179.1135.8109.462.40000114.7
3603S30.5Very low30.5Very low99 Ų99128.6 Ų128.669%0.69271%0.71SS**  trans53.7112.1145.563.10000123.2
3604S29.5Very low30.4Very low101 Ų101124 Ų12471%0.70670%0.698SS**  57110.7129.766.80000121.9
3605L29Very low30.3Very low169 Ų169122.1 Ų122.189%0.88570%0.703SS**  -173.515993.5-89.6165.6000109.4
3606P28.5Very low30.2Very low118 Ų118119.8 Ų119.877%0.76671%0.705SS**  trans-115.5168.5-151.941.1-34000116.3
3607G26.6Very low30Very low66 Ų66121.2 Ų121.268%0.6870%0.703SS**  trans107.157.9142.700000118.3
3608W32.1Very low30Very low233 Ų233118.7 Ų118.788%0.88370%0.702SS**  trans-116105.2155-7364.3000107.5
3609T32.9Very low29.9Very low90 Ų90117.5 Ų117.555%0.55270%0.697SS**  trans-84.5162.1179.453.30000110.9S3611 S3612T3609-S3611 PolarHBondContact O-N 3.27Å; T3609-S3611 WeakPolarHBondContact OG1-CB 3.38Å; T3609-S3611 PolarHBondContact OG1-OG 3.37Å; T3609-S3611 VanDerWaalsContact OG1-OG 3.06Å; T3609-S3612 WeakPolarHBondContact O-CB 3.26Å; T3609-S3612 PolarHBondContact O-N 3.16Å; T3609-S3612 PolarHBondContact O-OG 3.36Å
3610E33.2Very low30Very low167 Ų167115.6 Ų115.678%0.7870%0.701SS**G310 helixtrans-52.3-26.5174.1-160.4169.3-17400113S3612 L3613 L3614E3610-S3612 PolarHBondContact O-N 3.23Å; E3610-S3612 VanDerWaalsContact O-N 3.11Å; E3610-L3613 PolarHBondContact O-N 3.05Å; E3610-L3614 PolarHBondContact O-N 3.39Å
3611S32.7Very low30.1Very low79 Ų79119.1 Ų119.155%0.55271%0.712SS**G310 helixtrans-50.9-27.8168.2-36.20000114.5T3609 L3614T3609-S3611 PolarHBondContact O-N 3.27Å; T3609-S3611 WeakPolarHBondContact OG1-CB 3.38Å; T3609-S3611 PolarHBondContact OG1-OG 3.37Å; T3609-S3611 VanDerWaalsContact OG1-OG 3.06Å; S3611-L3614 PolarHBondContact O-N 2.87Å
3612S33.9Very low30.3Very low59 Ų59119.4 Ų119.441%0.41371%0.705SS.*G310 helixtrans-72.4-27.5177.6-59.40000113.1T3609 E3610 A3615T3609-S3612 WeakPolarHBondContact O-CB 3.26Å; T3609-S3612 PolarHBondContact O-N 3.16Å; T3609-S3612 PolarHBondContact O-OG 3.36Å; E3610-S3612 PolarHBondContact O-N 3.23Å; E3610-S3612 VanDerWaalsContact O-N 3.11Å; S3612-A3615 WeakPolarHBondContact O-CB 3.31Å
3613L33.2Very low30Very low145 Ų145118.1 Ų118.176%0.75971%0.71SS**G310 helixtrans-79.8-27.3173.3-78.2162.9000111.8E3610 A3615 C3616E3610-L3613 PolarHBondContact O-N 3.05Å; L3613-A3615 PolarHBondContact O-N 3.39Å; L3613-A3615 VanDerWaalsContact O-N 3.11Å; L3613-C3616 PolarHBondContact O-N 3.42Å; L3613-C3616 VanDerWaalsContact O-N 3.1Å
3614L33.4Very low29.9Very low95 Ų95118.1 Ų118.150%0.49771%0.709SS.*G310 helixtrans-65.9-5.5170.5-74.3161.3000113.5E3610 S3611 C3616 Q3617E3610-L3614 PolarHBondContact O-N 3.39Å; S3611-L3614 PolarHBondContact O-N 2.87Å; L3614-C3616 PolarHBondContact O-N 2.9Å; L3614-Q3617 HydrophobicContact CD2-CB 4.23Å; L3614-Q3617 WeakPolarHBondContact O-CA 3.48Å; L3614-Q3617 WeakPolarHBondContact O-CB 3.33Å; L3614-Q3617 PolarHBondContact O-N 2.91Å
3615A30.1Very low29.7Very low82 Ų82121.1 Ų121.168%0.67872%0.717SS**G310 helixtrans-64.6-17.9166.500000113.4S3612 L3613 Q3617S3612-A3615 WeakPolarHBondContact O-CB 3.31Å; L3613-A3615 PolarHBondContact O-N 3.39Å; L3613-A3615 VanDerWaalsContact O-N 3.11Å; A3615-Q3617 VanDerWaalsContact C-N 3.3Å
3616C29.6Very low29.8Very low108 Ų108120.6 Ų120.673%0.7371%0.714SS**G310 helixtrans-81.5-2.7166.7-89.90000113.7L3613 L3614 A3618L3613-C3616 PolarHBondContact O-N 3.42Å; L3613-C3616 VanDerWaalsContact O-N 3.1Å; L3614-C3616 PolarHBondContact O-N 2.9Å; C3616-A3618 PolarHBondContact O-N 3.46Å
3617Q27.8Very low29.8Very low134 Ų134122 Ų12263%0.62671%0.714SS**  trans-82.238.4174.3-155.5173.758.100112.3L3614 A3615 N3619L3614-Q3617 HydrophobicContact CD2-CB 4.23Å; L3614-Q3617 WeakPolarHBondContact O-CA 3.48Å; L3614-Q3617 WeakPolarHBondContact O-CB 3.33Å; L3614-Q3617 PolarHBondContact O-N 2.91Å; A3615-Q3617 VanDerWaalsContact C-N 3.3Å; Q3617-N3619 PolarHBondContact O-N 3.46Å
3618A27.4Very low30.1Very low86 Ų86124.2 Ų124.271%0.71172%0.716SS**  trans-71.718.8172.300000113.6C3616 S3620C3616-A3618 PolarHBondContact O-N 3.46Å; A3618-S3620 VanDerWaalsContact C-N 3.3Å; A3618-S3620 PolarHBondContact O-N 3.38Å
3619N28.4Very low30Very low147 Ų147122.8 Ų122.879%0.78672%0.716SS**  trans-90.255.2173.4-79.6-5.3000111.3Q3617Q3617-N3619 PolarHBondContact O-N 3.46Å
3620S28.2Very low30Very low111 Ų111123.6 Ų123.678%0.77673%0.725SS**  trans-150.745.3173-78.10000112.1A3618A3618-S3620 VanDerWaalsContact C-N 3.3Å; A3618-S3620 PolarHBondContact O-N 3.38Å
3621L28.1Very low29.8Very low167 Ų167122.7 Ų122.787%0.87473%0.725SS**  trans-146.626.8163.7-111.4171.9000113.3
3622M29.8Very low29.6Very low142 Ų142127.4 Ų127.470%0.774%0.735SS**SBendtrans-82.8135.1146.1-65-65.9-75.600106.3T2968 C3624T2968-M3622 HydrophobicContact CG2-CE 3.54Å; M3622-C3624 VanDerWaalsContact C-N 3.26Å; M3622-C3624 PolarHBondContact O-N 2.94Å
3623G24.9Very low29.3Very low83 Ų83133.7 Ų133.786%0.85676%0.758SS**SBendtrans-70.153-160.300000118.2
3624C27.9Very low29Very low99 Ų99132 Ų13267%0.66976%0.758SS**  trans-91.5108.4168.5-66.10000110.1M3622 L3626M3622-C3624 VanDerWaalsContact C-N 3.26Å; M3622-C3624 PolarHBondContact O-N 2.94Å; C3624-L3626 PolarHBondContact O-N 3.39Å
3625N26.2Very low28.7Very low164 Ų164135 Ų13588%0.87777%0.773SS**  trans-68.899.9169.7-75-51.1000109.8
3626L30.1Very low28.6Very low157 Ų157137.6 Ų137.682%0.82278%0.78SS**  trans-117.5129.2170.3-88.4164.1000110.2C3624C3624-L3626 PolarHBondContact O-N 3.39Å
3627I30.4Very low28.6Very low149 Ų149141.3 Ų141.376%0.76479%0.787SS**PPolyproline II helixtrans-68.7135.4-167-63164000110.6
3628P32.2Very low28.5Very low112 Ų112138.7 Ų138.773%0.72780%0.796SS**PPolyproline II helixtrans-62.3141.4178.2-23.634.6000113.2
3629K29.6Very low28.6Very low202 Ų202140.9 Ų140.988%0.87880%0.8SS**PPolyproline II helixtrans-88.5131-174.2-63.2171.4179.3173.30113.1
3630S32.9Very low28.5Very low107 Ų107141.4 Ų141.475%0.74880%0.803SS**  trans-118.2110.8136.253.70000106.7
3631L29.1Very low28.4Very low149 Ų149144.1 Ų144.178%0.7881%0.808SS**  61.2136.189.6-85119.9000114.2
3632K27.7Very low28.3Very low177 Ų177143 Ų14377%0.7781%0.808SS**  cis-176.995.4-18.7175.7-165.2170.7-170.10109.1
3633E29.4Very low28.2Very low192 Ų192140 Ų14090%0.89781%0.813SS**  trans-156.4119.7162.6-110.2133.1-143.600108.5
3634C26.5Very low28.3Very low110 Ų110139.5 Ų139.574%0.74381%0.808SS**  87.68095.8-155.20000111.1
3635L25.8Very low28.2Very low158 Ų158139.7 Ų139.783%0.82782%0.817SS**  569289.4-72.9171.9000114.5
3636T28.8Very low28.3Very low135 Ų135140.7 Ų140.783%0.82882%0.817SS**  -171.6160.3117.525.20000112.2
3637E29.3Very low28Very low187 Ų187138.6 Ų138.687%0.87481%0.814SS**  trans62.957.7156.8-68177.5-170.900120.6
3638G26Very low27.7Very low78 Ų78140.4 Ų140.480%0.80482%0.823SS**  41.9101121.600000122.3
3639V29Very low27.4Very low133 Ų133137.9 Ų137.981%0.80682%0.817SS**  trans-130.5146.3143.5179.40000108.3
3640N25.8Very low27.3Very low158 Ų158136.8 Ų136.885%0.84582%0.815SS**  trans-66.6130.2-174-66-37.6000113
3641L26.1Very low27Very low168 Ų168136.1 Ų136.188%0.8882%0.816SS**  trans-102.5114.2164.6-82.686.1000110.9
3642T26.5Very low26.9Very low144 Ų144132.8 Ų132.888%0.88380%0.799SS**  trans-116.5101.6162.750.70000108.4
3643G29Very low26.9Very low77 Ų77128.8 Ų128.879%0.79480%0.798SS**  trans-168.564.3-172.400000112.3
3644G26.1Very low26.9Very low73 Ų73124.9 Ų124.975%0.75379%0.79SS**PPolyproline II helixtrans-71.3129.817700000111.7Q3646G3644-Q3646 PolarHBondContact O-N 3.42Å
3645A26.7Very low27Very low104 Ų104124.6 Ų124.686%0.8679%0.789SS**PPolyproline II helixtrans-65.8120.2177.400000110.8
3646Q26.5Very low27.1Very low185 Ų185121.7 Ų121.786%0.86479%0.788SS**PPolyproline II helixtrans-78.3123.8178.1-70-178.1-12.900111.1G3644 I3648G3644-Q3646 PolarHBondContact O-N 3.42Å; Q3646-I3648 PolarHBondContact O-N 3.44Å
3647C24.3Very low27Very low113 Ų113118.5 Ų118.576%0.76477%0.769SS**PPolyproline II helixtrans-64.1132.8168-67.10000110.1G3649C3647-G3649 VanDerWaalsContact C-N 3.29Å; C3647-G3649 PolarHBondContact O-N 2.93Å
3648I25.1Very low27Very low187 Ų187117 Ų11796%0.95976%0.757SS**SBendtrans-72.284.5-179.9-57.9176000109.4Q3646Q3646-I3648 PolarHBondContact O-N 3.44Å
3649G25.6Very low27.2Very low59 Ų59118.1 Ų118.161%0.60876%0.758SS**  trans-145.84-172.800000115.8C3647C3647-G3649 VanDerWaalsContact C-N 3.29Å; C3647-G3649 PolarHBondContact O-N 2.93Å
3650H27.3Very low27Very low178 Ų178118.1 Ų118.182%0.82475%0.753SS**  trans-12286.9179.7-81.4-99.7000111.5
3651A26.9Very low27.1Very low94 Ų94117.7 Ų117.778%0.77775%0.751SS**  trans-148.933.3178.600000113.5
3652L27.4Very low27.3Very low79 Ų79113.4 Ų113.441%0.41475%0.748SS.*  trans-135.458175.1-73.5177.8000111.8F2978F2978-L3652 HydrophobicContact CE1-CB 4.07Å; F2978-L3652 HydrophobicContact CE1-CD1 4.2Å; F2978-L3652 HydrophobicContact CZ-CB 3.68Å; F2978-L3652 HydrophobicContact CZ-CD1 4.09Å
3653A26.5Very low27.3Very low92 Ų92113.5 Ų113.576%0.7675%0.748SS**  trans-14297168.200000109.4S3655A3653-S3655 PolarHBondContact O-N 3.4Å
3654P28.9Very low27.3Very low110 Ų110114.4 Ų114.471%0.71475%0.748SS**  trans-66.2126.1164.528.5-31.5000108.3A3656P3654-A3656 PolarHBondContact O-N 3.3Å
3655S28.8Very low27.3Very low105 Ų105119.1 Ų119.173%0.73476%0.756SS**  trans-65128.7-172.836.70000112.7A3653A3653-S3655 PolarHBondContact O-N 3.4Å
3656A28.2Very low27.3Very low96 Ų96117.6 Ų117.679%0.79375%0.751SS**  trans-10612015500000107.3P3654P3654-A3656 PolarHBondContact O-N 3.3Å
3657P27.1Very low27.3Very low68 Ų68115.5 Ų115.544%0.44275%0.75SS.*  trans-75.3150.3172.432.7-34000110.4
3658Y29.1Very low27.5Very low157 Ų157113.2 Ų113.262%0.61675%0.746SS**  trans162.8150.2135.4-91.2-65.8000110.7D2820D2820-Y3658 PolarHBondContact OD1-OH 3.41Å
3659A29.5Very low27.6Very low100 Ų100110.9 Ų110.983%0.82673%0.734SS**  trans61.798.4173.500000117.5
3660N25Very low27.6Very low133 Ų133117.9 Ų117.971%0.71175%0.751SS**  trans-91149.7157.7-178.262.6000110
3661D28.7Very low27.6Very low150 Ų150111.6 Ų111.680%0.80273%0.731SS**  trans146.1119.5150.7-79.5-4.7000111.1
3662G29.3Very low27.7Very low78 Ų78110.6 Ų110.680%0.80473%0.729SS**  trans152.263.5176.300000115.5A3664G3662-A3664 PolarHBondContact O-N 3.31Å
3663T26.9Very low27.9Very low145 Ų145109.3 Ų109.389%0.8973%0.73SS**  trans-63.6125.4174.248.50000112.3
3664A28.4Very low28Very low96 Ų96112.7 Ų112.779%0.79373%0.732SS**  trans-151102.6167.300000110.6G3662 G3666G3662-A3664 PolarHBondContact O-N 3.31Å; A3664-G3666 PolarHBondContact O-N 2.88Å
3665D26.3Very low28Very low173 Ų173109.4 Ų109.493%0.92572%0.718SS**  trans-66.9122.3174.8-65.4-65.9000111
3666G27.9Very low28.3Very low72 Ų72105.2 Ų105.274%0.74269%0.69SS**  trans-138.778.3-174.500000112.3A3664 G3668A3664-G3666 PolarHBondContact O-N 2.88Å; G3666-G3668 PolarHBondContact O-N 2.94Å
3667V25.8Very low28.9Very low140 Ų140104.8 Ų104.885%0.84867%0.674SS**  trans-69.496.8177.7-177.90000110.2
3668G28.1Very low29.5Very low66 Ų66107.1 Ų107.168%0.6868%0.682SS**  trans-86.6125.9175.500000112.2G3666 E3670G3666-G3668 PolarHBondContact O-N 2.94Å; G3668-E3670 PolarHBondContact O-N 3.28Å
3669L27.7Very low30.5Very low137 Ų137102.4 Ų102.472%0.71767%0.668SS**  trans-69.1113.3-176-88.663.4000113.2A3671L3669-A3671 HydrophobicContact CB-CB 4.35Å; L3669-A3671 PolarHBondContact O-N 3.44Å; L3669-A3671 VanDerWaalsContact O-N 3.09Å
3670E26Very low32.3Very low206 Ų20699.2 Ų99.296%0.96364%0.638SS**  trans-73.189.3155.9-69-166.814700109.9G3668G3668-E3670 PolarHBondContact O-N 3.28Å
3671A26.4Very low34.5Very low47 Ų4796.6 Ų96.639%0.38863%0.63SS.*  trans-133.9-7.8179.700000115.1L3555 L3669L3555-A3671 HydrophobicContact CD2-CB 4.04Å; L3669-A3671 HydrophobicContact CB-CB 4.35Å; L3669-A3671 PolarHBondContact O-N 3.44Å; L3669-A3671 VanDerWaalsContact O-N 3.09Å
3672G30Very low37.1Very low72 Ų7293.8 Ų93.874%0.74261%0.608SS**SBendtrans-91.1-22.8-171.600000116.9
3673A32Very low39.7Very low53 Ų5391 Ų9144%0.43858%0.575SS.*THydrogen-bonded Turntrans-73.5-40-158.800000115.5G3675 A3676 D3677A3673-G3675 PolarHBondContact O-N 3.18Å; A3673-A3676 WeakPolarHBondContact O-CB 3.09Å; A3673-A3676 PolarHBondContact O-N 2.87Å; A3673-D3677 PolarHBondContact O-N 2.83Å; A3673-D3677 VanDerWaalsContact O-N 3.14Å
3674M27.8Very low42.5Very low163 Ų16385 Ų8580%0.80354%0.538SS*.Hα-helixtrans-60.8-24.1-163.1-57.5-164.379.600115.1
3675G29.2Very low45.2Very low41 Ų4183.4 Ų83.442%0.42352%0.524SS..Hα-helixtrans-85.9-15.3175.400000115.1A3673A3673-G3675 PolarHBondContact O-N 3.18Å
3676A34.5Very low48.3Very low17 Ų1775.3 Ų75.314%0.1448%0.481CS..Hα-helixtrans-89.5-46.3174.600000110.9A3673 L3678 L3679 T3680A3673-A3676 WeakPolarHBondContact O-CB 3.09Å; A3673-A3676 PolarHBondContact O-N 2.87Å; A3676-L3678 VanDerWaalsContact C-N 3.33Å; A3676-L3678 PolarHBondContact O-N 3.03Å; A3676-L3679 PolarHBondContact O-N 2.88Å; A3676-L3679 VanDerWaalsContact O-N 3.13Å; A3676-T3680 PolarHBondContact O-N 3.23Å; A3676-T3680 PolarHBondContact O-OG1 3.26Å
3677D41.9Very low51.3Low86 Ų8671.9 Ų71.946%0.4645%0.446SS..Hα-helixtrans-52.3-47.3-176.5-65.5-38.9000112.8A3673 L3679 T3680 S3681A3673-D3677 PolarHBondContact O-N 2.83Å; A3673-D3677 VanDerWaalsContact O-N 3.14Å; D3677-L3679 VanDerWaalsContact C-N 3.26Å; D3677-L3679 PolarHBondContact O-N 3.17Å; D3677-T3680 WeakPolarHBondContact O-CB 3.25Å; D3677-T3680 PolarHBondContact O-N 3.44Å; D3677-S3681 PolarHBondContact O-N 2.7Å; D3677-S3681 PolarHBondContact O-OG 3.11Å
3678L39.2Very low54.3Low117 Ų11769 Ų6961%0.61342%0.422SS*.Hα-helixtrans-58.8-36.9-176.9-160.379.7000112.8A3676 R3682A3676-L3678 VanDerWaalsContact C-N 3.33Å; A3676-L3678 PolarHBondContact O-N 3.03Å; L3678-R3682 VanDerWaalsContact O-CB 3.25Å; L3678-R3682 WeakPolarHBondContact O-CB 3.27Å; L3678-R3682 PolarHBondContact O-N 2.79Å
3679L50.2Low57.2Low59 Ų5968.9 Ų68.931%0.30940%0.402SS..Hα-helixtrans-76.3-38.6175.4-72.9168.3000111.3A3676 D3677 R3682 L3683A3676-L3679 PolarHBondContact O-N 2.88Å; A3676-L3679 VanDerWaalsContact O-N 3.13Å; D3677-L3679 VanDerWaalsContact C-N 3.26Å; D3677-L3679 PolarHBondContact O-N 3.17Å; L3679-R3682 PolarHBondContact O-N 2.82Å; L3679-L3683 WeakPolarHBondContact O-CB 3.48Å; L3679-L3683 PolarHBondContact O-N 3.28Å
3680T68Low60.2Low33 Ų3362.7 Ų62.720%0.20237%0.37CS..Hα-helixtrans-63.1-49.8177.7-56.90000111.3A3384 A3676 D3677 R3682 L3683 V3684A3384-T3680 VanDerWaalsContact O-CG2 3.25Å; A3384-T3680 WeakPolarHBondContact O-CG2 3.42Å; A3676-T3680 PolarHBondContact O-N 3.23Å; A3676-T3680 PolarHBondContact O-OG1 3.26Å; D3677-T3680 WeakPolarHBondContact O-CB 3.25Å; D3677-T3680 PolarHBondContact O-N 3.44Å; T3680-R3682 VanDerWaalsContact C-N 3.35Å; T3680-R3682 PolarHBondContact O-N 3.27Å; T3680-L3683 PolarHBondContact O-N 3.03Å; T3680-V3684 VanDerWaalsContact O-CG2 3.31Å; T3680-V3684 WeakPolarHBondContact O-CG2 3.48Å; T3680-V3684 PolarHBondContact O-N 3.36Å
3681S71.1Confident63.3Low78 Ų7853 Ų5355%0.54533%0.325SS..Hα-helixtrans-59.8-43.3176.7-54.20000112.2D3677 V3684 A3685D3677-S3681 PolarHBondContact O-N 2.7Å; D3677-S3681 PolarHBondContact O-OG 3.11Å; S3681-V3684 PolarHBondContact O-N 3.39Å; S3681-A3685 WeakPolarHBondContact O-CB 3.49Å; S3681-A3685 PolarHBondContact O-N 3.28Å
3682R81.6Confident66.1Low91 Ų9154.8 Ų54.834%0.34332%0.324SS..Hα-helixtrans-66.4-43178.9-174.1174.2-176.3144.75112.2E3502 L3678 L3679 T3680 A3685 W3686E3502-R3682 PolarHBondContact O-NE 2.91Å; E3502-R3682 PolarHBondContact O-NH2 3.44Å; L3678-R3682 VanDerWaalsContact O-CB 3.25Å; L3678-R3682 WeakPolarHBondContact O-CB 3.27Å; L3678-R3682 PolarHBondContact O-N 2.79Å; L3679-R3682 PolarHBondContact O-N 2.82Å; T3680-R3682 VanDerWaalsContact C-N 3.35Å; T3680-R3682 PolarHBondContact O-N 3.27Å; R3682-A3685 PolarHBondContact O-N 2.97Å; R3682-W3686 WeakPolarHBondContact O-CB 3.28Å; R3682-W3686 PolarHBondContact O-N 3.28Å
3683L85Confident68.8Low20 Ų2053.7 Ų53.711%0.10530%0.302CS..Hα-helixtrans-63.9-45.2175.617761.9000111.4T3380 A3384 I3442 T3446 L3679 T3680 A3685 W3686 L3687T3380-L3683 HydrophobicContact CG2-CD1 4.2Å; A3384-L3683 HydrophobicContact CB-CD2 3.73Å; A3384-L3683 HydrophobicContact CB-CG 4.05Å; I3442-L3683 HydrophobicContact CG2-CD1 3.63Å; T3446-L3683 HydrophobicContact CG2-CD1 4.46Å; T3446-L3683 HydrophobicContact CG2-CD2 3.57Å; L3679-L3683 WeakPolarHBondContact O-CB 3.48Å; L3679-L3683 PolarHBondContact O-N 3.28Å; T3680-L3683 PolarHBondContact O-N 3.03Å; L3683-A3685 VanDerWaalsContact C-N 3.34Å; L3683-A3685 PolarHBondContact O-N 2.92Å; L3683-W3686 PolarHBondContact O-N 2.8Å; L3683-L3687 HydrophobicContact CD1-CD1 3.96Å; L3683-L3687 HydrophobicContact CD1-CG 4.02Å; L3683-L3687 HydrophobicContact CG-CD1 3.85Å; L3683-L3687 HydrophobicContact CG-CG 4.35Å; L3683-L3687 WeakPolarHBondContact O-CB 3.49Å; L3683-L3687 VanDerWaalsContact O-CG 3.22Å; L3683-L3687 WeakPolarHBondContact O-CG 3.48Å; L3683-L3687 PolarHBondContact O-N 3.33Å
3684V85.8Confident71.4Confident18 Ų1851.1 Ų51.111%0.10928%0.281CS..Hα-helixtrans-61.8-41.3176171.60000111.2M3381 A3384 L3385 T3680 S3681 L3687 K3688M3381-V3684 HydrophobicContact SD-CG1 4.43Å; M3381-V3684 HydrophobicContact SD-CG2 4.45Å; A3384-V3684 HydrophobicContact CB-CG2 3.73Å; L3385-V3684 HydrophobicContact CD2-CG1 4.28Å; L3385-V3684 HydrophobicContact CD2-CG2 3.77Å; L3385-V3684 HydrophobicContact CG-CG2 4.4Å; T3680-V3684 VanDerWaalsContact O-CG2 3.31Å; T3680-V3684 WeakPolarHBondContact O-CG2 3.48Å; T3680-V3684 PolarHBondContact O-N 3.36Å; S3681-V3684 PolarHBondContact O-N 3.39Å; V3684-L3687 PolarHBondContact O-N 3.42Å; V3684-K3688 HydrophobicContact CG1-CD 4.04Å; V3684-K3688 HydrophobicContact CG1-CG 4.46Å; V3684-K3688 WeakPolarHBondContact O-CB 3.37Å; V3684-K3688 WeakPolarHBondContact O-CG 3.38Å; V3684-K3688 PolarHBondContact O-N 3.44Å
3685A85.9Confident74.1Confident62 Ų6243.5 Ų43.551%0.51225%0.245SC..Hα-helixtrans-62.2-45.4175.500000112.2S3681 R3682 L3683 K3688 K3689S3681-A3685 WeakPolarHBondContact O-CB 3.49Å; S3681-A3685 PolarHBondContact O-N 3.28Å; R3682-A3685 PolarHBondContact O-N 2.97Å; L3683-A3685 VanDerWaalsContact C-N 3.34Å; L3683-A3685 PolarHBondContact O-N 2.92Å; A3685-K3688 PolarHBondContact O-N 3.34Å; A3685-K3689 PolarHBondContact O-N 2.97Å
3686W90.6Very high76.7Confident4 Ų446.7 Ų46.72%0.01524%0.244CC..Hα-helixtrans-63.5-45.1176.2-175.385.4000112.3Q3438 V3439 I3442 E3499 R3682 L3683 K3688 K3689 H3690Q3438-W3686 HydrophobicContact CB-CH2 4.31Å; Q3438-W3686 HydrophobicContact CB-CZ2 4.21Å; V3439-W3686 HydrophobicContact CG2-CH2 4.25Å; I3442-W3686 HydrophobicContact CB-CH2 4.35Å; I3442-W3686 HydrophobicContact CB-CZ3 4.22Å; I3442-W3686 HydrophobicContact CG1-CH2 3.85Å; I3442-W3686 HydrophobicContact CG1-CZ2 4.31Å; I3442-W3686 HydrophobicContact CG1-CZ3 4.06Å; I3442-W3686 HydrophobicContact CG2-CZ3 4.19Å; E3499-W3686 HydrophobicContact CB-CZ2 4.39Å; E3499-W3686 PolarHBondContact O-NE1 3.16Å; E3499-W3686 PolarHBondContact OE2-NE1 2.84Å; R3682-W3686 WeakPolarHBondContact O-CB 3.28Å; R3682-W3686 PolarHBondContact O-N 3.28Å; L3683-W3686 PolarHBondContact O-N 2.8Å; W3686-K3688 PolarHBondContact O-N 2.71Å; W3686-K3689 WeakPolarHBondContact O-CB 3.21Å; W3686-K3689 PolarHBondContact O-N 2.96Å; W3686-H3690 AromaticContact CD2-CD2 3.55Å; W3686-H3690 AromaticContact CE2-CD2 3.24Å; W3686-H3690 AromaticContact CE2-NE2 3.26Å; W3686-H3690 VanDerWaalsContact CE2-NE2 3.26Å; W3686-H3690 AromaticContact CH2-CD2 3.92Å; W3686-H3690 AromaticContact CZ2-CD2 3.45Å; W3686-H3690 VanDerWaalsContact CZ2-CD2 3.45Å; W3686-H3690 WeakPolarHBondContact CZ2-CD2 3.39Å; W3686-H3690 AromaticContact CZ2-NE2 3.35Å; W3686-H3690 VanDerWaalsContact CZ2-NE2 3.35Å; W3686-H3690 WeakPolarHBondContact CZ2-NE2 3.29Å; W3686-H3690 AromaticContact NE1-CD2 3.55Å; W3686-H3690 AromaticContact NE1-NE2 3.27Å; W3686-H3690 PolarHBondContact NE1-NE2 3.26Å; W3686-H3690 PolarHBondContact O-CD2 3.25Å; W3686-H3690 VanDerWaalsContact O-CD2 3.29Å; W3686-H3690 PolarHBondContact O-N 3.16Å
3687L90.9Very high79Confident0 Ų047.3 Ų47.30%025%0.245CC..Hα-helixtrans-63-43.3176.7-69.4168.1000111.6L3377 T3380 M3381 A3384 L3683 V3684 K3689 H3690 I3691L3377-L3687 HydrophobicContact CD2-CD2 3.71Å; T3380-L3687 HydrophobicContact CG2-CD1 4.03Å; T3380-L3687 HydrophobicContact CG2-CD2 3.97Å; M3381-L3687 HydrophobicContact CB-CD1 4.28Å; M3381-L3687 HydrophobicContact CE-CB 3.47Å; M3381-L3687 VanDerWaalsContact CE-CB 3.47Å; M3381-L3687 HydrophobicContact CE-CD1 4.28Å; M3381-L3687 HydrophobicContact SD-CB 4.37Å; M3381-L3687 HydrophobicContact SD-CD1 4.15Å; A3384-L3687 HydrophobicContact CB-CD1 4.17Å; L3683-L3687 HydrophobicContact CD1-CD1 3.96Å; L3683-L3687 HydrophobicContact CD1-CG 4.02Å; L3683-L3687 HydrophobicContact CG-CD1 3.85Å; L3683-L3687 HydrophobicContact CG-CG 4.35Å; L3683-L3687 WeakPolarHBondContact O-CB 3.49Å; L3683-L3687 VanDerWaalsContact O-CG 3.22Å; L3683-L3687 WeakPolarHBondContact O-CG 3.48Å; L3683-L3687 PolarHBondContact O-N 3.33Å; V3684-L3687 PolarHBondContact O-N 3.42Å; L3687-K3689 VanDerWaalsContact C-N 3.32Å; L3687-K3689 PolarHBondContact O-N 3.19Å; L3687-H3690 PolarHBondContact O-N 3.44Å; L3687-H3690 VanDerWaalsContact O-N 3.14Å; L3687-I3691 WeakPolarHBondContact O-CB 3.33Å; L3687-I3691 WeakPolarHBondContact O-CD1 3.11Å; L3687-I3691 WeakPolarHBondContact O-CG1 3.43Å; L3687-I3691 PolarHBondContact O-N 3.01Å
3688K89.1Confident81Confident80 Ų8043.2 Ų43.235%0.34822%0.223SC..Hα-helixtrans-58.7-42.2174.4-79.9176.957.4167.80112.1E2958 P2959 M3381 V3684 A3685 W3686 F3692E2958-K3688 HydrophobicContact CB-CD 4.47Å; E2958-K3688 HydrophobicContact CB-CG 4.24Å; E2958-K3688 HydrophobicContact CG-CG 4.11Å; P2959-K3688 VanDerWaalsContact O-CE 3.3Å; P2959-K3688 WeakPolarHBondContact O-CE 3.44Å; P2959-K3688 PolarHBondContact O-NZ 3.13Å; M3381-K3688 HydrophobicContact CE-CG 4.13Å; V3684-K3688 HydrophobicContact CG1-CD 4.04Å; V3684-K3688 HydrophobicContact CG1-CG 4.46Å; V3684-K3688 WeakPolarHBondContact O-CB 3.37Å; V3684-K3688 WeakPolarHBondContact O-CG 3.38Å; V3684-K3688 PolarHBondContact O-N 3.44Å; A3685-K3688 PolarHBondContact O-N 3.34Å; W3686-K3688 PolarHBondContact O-N 2.71Å; K3688-F3692 WeakPolarHBondContact O-CB 3.47Å; K3688-F3692 PolarHBondContact O-N 2.97Å
3689K89.6Confident82.8Confident63 Ų6338.8 Ų38.827%0.27420%0.2SC..Hα-helixtrans-58.3-47.2172.7171.6-165.8175.7-162.90111.1E3499 E3502 A3685 W3686 L3687 F3692 V3693E3499-K3689 WeakPolarHBondContact OE1-CE 3.2Å; E3499-K3689 IonicContact OE1-NZ 3.72Å; E3499-K3689 PolarHBondContact OE1-NZ 2.82Å; E3499-K3689 IonicContact OE2-NZ 3.34Å; E3499-K3689 PolarHBondContact OE2-NZ 3.24Å; E3502-K3689 WeakPolarHBondContact OE1-CD 3.3Å; E3502-K3689 IonicContact OE1-NZ 2.65Å; E3502-K3689 PolarHBondContact OE1-NZ 3.43Å; E3502-K3689 IonicContact OE2-NZ 3.68Å; E3502-K3689 PolarHBondContact OE2-NZ 2.95Å; A3685-K3689 PolarHBondContact O-N 2.97Å; W3686-K3689 WeakPolarHBondContact O-CB 3.21Å; W3686-K3689 PolarHBondContact O-N 2.96Å; L3687-K3689 VanDerWaalsContact C-N 3.32Å; L3687-K3689 PolarHBondContact O-N 3.19Å; K3689-F3692 PolarHBondContact O-N 2.87Å; K3689-V3693 VanDerWaalsContact O-CG2 3.28Å; K3689-V3693 WeakPolarHBondContact O-CG2 3.14Å; K3689-V3693 PolarHBondContact O-N 3.01Å
3690H90.1Very high84Confident7 Ų740.6 Ų40.63%0.03221%0.207CC..Hα-helixtrans-70.3-38.1-180-82.1-74.8000114.2L3377 L3435 Q3438 E3499 W3686 L3687 V3693 L3694L3377-H3690 HydrophobicContact CD2-CB 3.97Å; L3435-H3690 WeakPolarHBondContact CD1-ND1 3.28Å; Q3438-H3690 PolarHBondContact OE1-CE1 3.04Å; Q3438-H3690 VanDerWaalsContact OE1-CE1 3.25Å; E3499-H3690 IonicContact OE2-CD2 2.64Å; E3499-H3690 IonicContact OE2-CE1 3.36Å; E3499-H3690 IonicContact OE2-NE2 2.72Å; E3499-H3690 PolarHBondContact OE2-NE2 3.49Å; W3686-H3690 AromaticContact CD2-CD2 3.55Å; W3686-H3690 AromaticContact CE2-CD2 3.24Å; W3686-H3690 AromaticContact CE2-NE2 3.26Å; W3686-H3690 VanDerWaalsContact CE2-NE2 3.26Å; W3686-H3690 AromaticContact CH2-CD2 3.92Å; W3686-H3690 AromaticContact CZ2-CD2 3.45Å; W3686-H3690 VanDerWaalsContact CZ2-CD2 3.45Å; W3686-H3690 WeakPolarHBondContact CZ2-CD2 3.39Å; W3686-H3690 AromaticContact CZ2-NE2 3.35Å; W3686-H3690 VanDerWaalsContact CZ2-NE2 3.35Å; W3686-H3690 WeakPolarHBondContact CZ2-NE2 3.29Å; W3686-H3690 AromaticContact NE1-CD2 3.55Å; W3686-H3690 AromaticContact NE1-NE2 3.27Å; W3686-H3690 PolarHBondContact NE1-NE2 3.26Å; W3686-H3690 PolarHBondContact O-CD2 3.25Å; W3686-H3690 VanDerWaalsContact O-CD2 3.29Å; W3686-H3690 PolarHBondContact O-N 3.16Å; L3687-H3690 PolarHBondContact O-N 3.44Å; L3687-H3690 VanDerWaalsContact O-N 3.14Å; H3690-V3693 PolarHBondContact O-N 3.42Å; H3690-L3694 WeakPolarHBondContact O-CB 3.37Å; H3690-L3694 PolarHBondContact O-N 3.42Å
3691I89.7Confident84.2Confident3 Ų340.1 Ų40.12%0.01520%0.202CC..Hα-helixtrans-57.8-49.4171-72.7157.2000110.5A3100 S3104 W3374 L3377 M3381 L3687 G3695A3100-I3691 HydrophobicContact CB-CG2 4.08Å; S3104-I3691 VanDerWaalsContact OG-CD1 3.27Å; S3104-I3691 WeakPolarHBondContact OG-CD1 3.3Å; W3374-I3691 HydrophobicContact CZ3-CG1 4.47Å; W3374-I3691 HydrophobicContact CZ3-CG2 4.29Å; L3377-I3691 HydrophobicContact CD1-CG1 4.45Å; M3381-I3691 HydrophobicContact CE-CD1 3.39Å; L3687-I3691 WeakPolarHBondContact O-CB 3.33Å; L3687-I3691 WeakPolarHBondContact O-CD1 3.11Å; L3687-I3691 WeakPolarHBondContact O-CG1 3.43Å; L3687-I3691 PolarHBondContact O-N 3.01Å; I3691-G3695 PolarHBondContact O-N 3.04Å
3692F86.3Confident83.9Confident84 Ų8436.5 Ų36.537%0.36818%0.177SC..Hα-helixtrans-61.3-48.8178.5177.7-93.6000112.1V3097 K3688 K3689 R3696V3097-F3692 HydrophobicContact CG1-CD2 4.02Å; V3097-F3692 HydrophobicContact CG1-CE2 4.45Å; V3097-F3692 HydrophobicContact CG2-CE2 4.18Å; K3688-F3692 WeakPolarHBondContact O-CB 3.47Å; K3688-F3692 PolarHBondContact O-N 2.97Å; K3689-F3692 PolarHBondContact O-N 2.87Å; F3692-R3696 WeakPolarHBondContact O-CB 3.4Å; F3692-R3696 PolarHBondContact O-N 3.49Å
3693V86.6Confident83.1Confident48 Ų4834.7 Ų34.729%0.29118%0.176SC..Hα-helixtrans-68.2-39.2-178.41770000111.4Y3431 K3689 H3690 N3697Y3431-V3693 WeakPolarHBondContact OH-CG1 3.28Å; K3689-V3693 VanDerWaalsContact O-CG2 3.28Å; K3689-V3693 WeakPolarHBondContact O-CG2 3.14Å; K3689-V3693 PolarHBondContact O-N 3.01Å; H3690-V3693 PolarHBondContact O-N 3.42Å; V3693-N3697 VanDerWaalsContact O-CB 3.31Å; V3693-N3697 WeakPolarHBondContact O-CB 3.36Å; V3693-N3697 PolarHBondContact O-N 2.93Å; V3693-N3697 PolarHBondContact O-ND2 2.74Å
3694L86.9Confident82.1Confident0 Ų035.7 Ų35.70%019%0.187CC..Hα-helixtrans-65.8-48.1176.4-177.856.8000111.4W3374 L3377 L3435 H3690 R3696 N3697 E3698W3374-L3694 HydrophobicContact CD2-CD2 3.63Å; W3374-L3694 HydrophobicContact CD2-CG 4.38Å; W3374-L3694 VanDerWaalsContact CE2-CD2 3.43Å; W3374-L3694 HydrophobicContact CE3-CD2 4.16Å; W3374-L3694 HydrophobicContact CG-CD2 3.97Å; W3374-L3694 HydrophobicContact CH2-CB 4.39Å; W3374-L3694 HydrophobicContact CH2-CD2 4.31Å; W3374-L3694 HydrophobicContact CH2-CG 4.28Å; W3374-L3694 HydrophobicContact CZ2-CB 4.18Å; W3374-L3694 HydrophobicContact CZ2-CD2 3.81Å; W3374-L3694 HydrophobicContact CZ2-CG 3.64Å; W3374-L3694 HydrophobicContact CZ3-CD2 4.47Å; L3377-L3694 HydrophobicContact CD1-CD2 3.87Å; L3435-L3694 HydrophobicContact CD2-CB 4.31Å; L3435-L3694 HydrophobicContact CD2-CD1 3.84Å; L3435-L3694 HydrophobicContact CD2-CD2 4.08Å; L3435-L3694 HydrophobicContact CD2-CG 4.3Å; H3690-L3694 WeakPolarHBondContact O-CB 3.37Å; H3690-L3694 PolarHBondContact O-N 3.42Å; L3694-R3696 PolarHBondContact O-N 3.03Å; L3694-N3697 PolarHBondContact O-N 2.88Å; L3694-E3698 HydrophobicContact CD1-CG 4.45Å; L3694-E3698 PolarHBondContact O-N 3.02Å
3695G84.9Confident80.8Confident3 Ų336.6 Ų36.63%0.03119%0.193CC..Hα-helixtrans-61.4-42.1176.700000113.1I3691 N3697 E3698 D3699I3691-G3695 PolarHBondContact O-N 3.04Å; G3695-N3697 PolarHBondContact O-N 2.9Å; G3695-E3698 PolarHBondContact O-N 3.46Å; G3695-D3699 WeakPolarHBondContact O-CB 3.32Å; G3695-D3699 PolarHBondContact O-N 3.3Å
3696R83.8Confident79.5Confident107 Ų10738.3 Ų38.340%0.40419%0.19SC..Hα-helixtrans-64.7-37174.6-174-179.8-177.589.80.8112.5F3692 L3694 Q3700F3692-R3696 WeakPolarHBondContact O-CB 3.4Å; F3692-R3696 PolarHBondContact O-N 3.49Å; L3694-R3696 PolarHBondContact O-N 3.03Å; R3696-Q3700 WeakPolarHBondContact O-CB 3.48Å; R3696-Q3700 VanDerWaalsContact O-CG 3.31Å; R3696-Q3700 WeakPolarHBondContact O-CG 3.41Å; R3696-Q3700 PolarHBondContact O-N 3.49Å
3697N82.4Confident78.3Confident31 Ų3143.7 Ų43.717%0.16622%0.218CC..Hα-helixtrans-70.5-38.3175.7-71.5-14.1000111.4Y3431 V3693 L3694 G3695 Q3700 H3701Y3431-N3697 WeakPolarHBondContact CE1-ND2 3.33Å; V3693-N3697 VanDerWaalsContact O-CB 3.31Å; V3693-N3697 WeakPolarHBondContact O-CB 3.36Å; V3693-N3697 PolarHBondContact O-N 2.93Å; V3693-N3697 PolarHBondContact O-ND2 2.74Å; L3694-N3697 PolarHBondContact O-N 2.88Å; G3695-N3697 PolarHBondContact O-N 2.9Å; N3697-Q3700 PolarHBondContact O-N 2.96Å; N3697-H3701 WeakPolarHBondContact O-CB 3.21Å; N3697-H3701 PolarHBondContact O-CD2 3.25Å; N3697-H3701 VanDerWaalsContact O-CG 3.26Å; N3697-H3701 PolarHBondContact O-N 2.77Å
3698E83.2Confident76.9Confident0 Ų052.2 Ų52.20%026%0.255CS..Hα-helixtrans-65.8-40.7173.9-69.8-168.6155.900112.2I3000 V3003 K3103 R3370 W3374 L3694 G3695 H3701 S3702I3000-E3698 HydrophobicContact CG1-CB 3.91Å; I3000-E3698 HydrophobicContact CG1-CG 3.99Å; V3003-E3698 HydrophobicContact CG2-CB 4.44Å; K3103-E3698 IonicContact NZ-OE1 2.97Å; K3103-E3698 IonicContact NZ-OE2 3.81Å; K3103-E3698 PolarHBondContact NZ-OE2 3.42Å; R3370-E3698 WeakPolarHBondContact CD-OE1 3.43Å; R3370-E3698 IonicContact CZ-OE1 2.72Å; R3370-E3698 IonicContact NE-OE1 3.44Å; R3370-E3698 IonicContact NH1-OE1 2.66Å; R3370-E3698 PolarHBondContact NH1-OE1 3.22Å; W3374-E3698 PolarHBondContact NE1-OE1 3.29Å; W3374-E3698 VanDerWaalsContact NE1-OE1 3.14Å; W3374-E3698 PolarHBondContact NE1-OE2 3.3Å; W3374-E3698 VanDerWaalsContact NE1-OE2 3.11Å; L3694-E3698 HydrophobicContact CD1-CG 4.45Å; L3694-E3698 PolarHBondContact O-N 3.02Å; G3695-E3698 PolarHBondContact O-N 3.46Å; E3698-H3701 PolarHBondContact O-N 3Å; E3698-S3702 WeakPolarHBondContact O-CB 3.48Å; E3698-S3702 PolarHBondContact O-N 3.14Å
3699D77.6Confident75.4Confident23 Ų2354.3 Ų54.312%0.12327%0.274CS..Hα-helixtrans-59.3-46171.7-177.168.7000112.3V3003 K3007 G3695 T3703V3003-D3699 HydrophobicContact CG1-CB 3.84Å; K3007-D3699 WeakPolarHBondContact CE-OD1 3.35Å; K3007-D3699 IonicContact NZ-OD1 2.68Å; K3007-D3699 PolarHBondContact NZ-OD1 3.15Å; K3007-D3699 IonicContact NZ-OD2 3.56Å; K3007-D3699 PolarHBondContact NZ-OD2 3.02Å; G3695-D3699 WeakPolarHBondContact O-CB 3.32Å; G3695-D3699 PolarHBondContact O-N 3.3Å; D3699-T3703 WeakPolarHBondContact O-CB 3.37Å; D3699-T3703 PolarHBondContact O-N 2.92Å; D3699-T3703 PolarHBondContact O-OG1 2.93Å
3700Q75.9Confident73.4Confident98 Ų9860.7 Ų60.746%0.45831%0.305SS..Hα-helixtrans-66.1-39.7175.7-75-177.311.100112.6R3696 N3697 A3704R3696-Q3700 WeakPolarHBondContact O-CB 3.48Å; R3696-Q3700 VanDerWaalsContact O-CG 3.31Å; R3696-Q3700 WeakPolarHBondContact O-CG 3.41Å; R3696-Q3700 PolarHBondContact O-N 3.49Å; N3697-Q3700 PolarHBondContact O-N 2.96Å; Q3700-A3704 VanDerWaalsContact O-CB 3.26Å; Q3700-A3704 WeakPolarHBondContact O-CB 3.45Å; Q3700-A3704 PolarHBondContact O-N 3.44Å
3701H70.9Confident72.5Confident22 Ų2263.4 Ų63.410%0.10232%0.318CS..Hα-helixtrans-70.2-45.5178-75-39.9000112.3I3000 S3428 H3432 N3697 E3698 T3703 A3704 T3705I3000-H3701 HydrophobicContact CD1-CB 3.62Å; I3000-H3701 HydrophobicContact CG1-CB 4.49Å; S3428-H3701 WeakPolarHBondContact CB-CE1 3.43Å; S3428-H3701 WeakPolarHBondContact CB-NE2 3.43Å; S3428-H3701 PolarHBondContact OG-CE1 3.19Å; S3428-H3701 PolarHBondContact OG-NE2 3.26Å; H3432-H3701 AromaticContact NE2-CD2 3.93Å; N3697-H3701 WeakPolarHBondContact O-CB 3.21Å; N3697-H3701 PolarHBondContact O-CD2 3.25Å; N3697-H3701 VanDerWaalsContact O-CG 3.26Å; N3697-H3701 PolarHBondContact O-N 2.77Å; E3698-H3701 PolarHBondContact O-N 3Å; H3701-T3703 VanDerWaalsContact C-N 3.31Å; H3701-T3703 PolarHBondContact O-N 3.26Å; H3701-A3704 PolarHBondContact O-N 3.26Å; H3701-T3705 WeakPolarHBondContact O-CG2 3.44Å; H3701-T3705 PolarHBondContact O-N 3.04Å; H3701-T3705 PolarHBondContact O-OG1 3.33Å
3702S65.5Low71.6Confident3 Ų366.6 Ų66.62%0.02133%0.334CS..Hα-helixtrans-59-43.5173.8172.40000111H3001 N3004 E3698 T3705 H3706H3001-S3702 PolarHBondContact ND1-OG 3.23Å; N3004-S3702 PolarHBondContact ND2-OG 3.42Å; N3004-S3702 WeakPolarHBondContact OD1-CB 3.29Å; N3004-S3702 PolarHBondContact OD1-OG 2.8Å; E3698-S3702 WeakPolarHBondContact O-CB 3.48Å; E3698-S3702 PolarHBondContact O-N 3.14Å; S3702-T3705 VanDerWaalsContact CA-OG1 3.31Å; S3702-T3705 WeakPolarHBondContact CA-OG1 3.5Å; S3702-T3705 PolarHBondContact O-N 3.03Å; S3702-T3705 PolarHBondContact O-OG1 2.62Å; S3702-H3706 WeakPolarHBondContact O-CB 3.41Å; S3702-H3706 PolarHBondContact O-N 3.32Å
3703T64.3Low70.8Confident53 Ų5365.6 Ų65.633%0.32533%0.333SS..Hα-helixtrans-63.6-43.9173.8-580000112.3N3004 D3699 H3701 T3705 H3706 I3707N3004-T3703 PolarHBondContact ND2-OG1 2.94Å; D3699-T3703 WeakPolarHBondContact O-CB 3.37Å; D3699-T3703 PolarHBondContact O-N 2.92Å; D3699-T3703 PolarHBondContact O-OG1 2.93Å; H3701-T3703 VanDerWaalsContact C-N 3.31Å; H3701-T3703 PolarHBondContact O-N 3.26Å; T3703-T3705 PolarHBondContact O-N 2.98Å; T3703-H3706 PolarHBondContact O-N 2.98Å; T3703-I3707 HydrophobicContact CG2-CD1 3.98Å; T3703-I3707 VanDerWaalsContact O-CG1 3.31Å; T3703-I3707 WeakPolarHBondContact O-CG1 3.22Å; T3703-I3707 PolarHBondContact O-N 3.35Å
3704A63.3Low69.9Low40 Ų4066.6 Ų66.633%0.33134%0.335SS..Hα-helixtrans-64.2-39.5176.200000112.4Q3700 H3701 I3707 F3708Q3700-A3704 VanDerWaalsContact O-CB 3.26Å; Q3700-A3704 WeakPolarHBondContact O-CB 3.45Å; Q3700-A3704 PolarHBondContact O-N 3.44Å; H3701-A3704 PolarHBondContact O-N 3.26Å; A3704-I3707 PolarHBondContact O-N 2.9Å; A3704-F3708 WeakPolarHBondContact O-CB 3.2Å; A3704-F3708 PolarHBondContact O-N 3.37Å
3705T59.7Low68.8Low37 Ų3770.8 Ų70.823%0.22736%0.356CS..Hα-helixtrans-67.4-37173.249.80000112.2H3001 H3701 S3702 T3703 I3707 F3708 V3709H3001-T3705 PolarHBondContact CE1-OG1 3.42Å; H3701-T3705 WeakPolarHBondContact O-CG2 3.44Å; H3701-T3705 PolarHBondContact O-N 3.04Å; H3701-T3705 PolarHBondContact O-OG1 3.33Å; S3702-T3705 VanDerWaalsContact CA-OG1 3.31Å; S3702-T3705 WeakPolarHBondContact CA-OG1 3.5Å; S3702-T3705 PolarHBondContact O-N 3.03Å; S3702-T3705 PolarHBondContact O-OG1 2.62Å; T3703-T3705 PolarHBondContact O-N 2.98Å; T3705-I3707 VanDerWaalsContact C-N 3.3Å; T3705-I3707 PolarHBondContact O-N 2.9Å; T3705-F3708 PolarHBondContact O-N 3.04Å; T3705-V3709 WeakPolarHBondContact O-CB 3.28Å; T3705-V3709 VanDerWaalsContact O-CG2 3.28Å; T3705-V3709 WeakPolarHBondContact O-CG2 3.36Å; T3705-V3709 PolarHBondContact O-N 2.82Å
3706H58.1Low67.7Low99 Ų9975.3 Ų75.346%0.45838%0.378SS..Hα-helixtrans-65.7-34.4174.4-169.4-56.5000111.7S3702 T3703 H3710S3702-H3706 WeakPolarHBondContact O-CB 3.41Å; S3702-H3706 PolarHBondContact O-N 3.32Å; T3703-H3706 PolarHBondContact O-N 2.98Å; H3706-H3710 AromaticContact CE1-CD2 3.47Å; H3706-H3710 PolarHBondContact CE1-CD2 3.32Å; H3706-H3710 VanDerWaalsContact CE1-CD2 3.47Å; H3706-H3710 AromaticContact CE1-NE2 3.9Å; H3706-H3710 AromaticContact ND1-CD2 3.68Å; H3706-H3710 WeakPolarHBondContact O-CB 3.44Å
3707I65.4Low66.6Low117 Ų11773.1 Ų73.160%0.638%0.376SS*.Hα-helixtrans-73.6-28.6173.8-68.5165.1000111.9T3703 A3704 T3705T3703-I3707 HydrophobicContact CG2-CD1 3.98Å; T3703-I3707 VanDerWaalsContact O-CG1 3.31Å; T3703-I3707 WeakPolarHBondContact O-CG1 3.22Å; T3703-I3707 PolarHBondContact O-N 3.35Å; A3704-I3707 PolarHBondContact O-N 2.9Å; T3705-I3707 VanDerWaalsContact C-N 3.3Å; T3705-I3707 PolarHBondContact O-N 2.9Å
3708F61Low65.4Low178 Ų17876.3 Ų76.378%0.78139%0.392SS*.Hα-helixtrans-83.8-20.9178.6-173.7-93.5000113.8A3704 T3705A3704-F3708 WeakPolarHBondContact O-CB 3.2Å; A3704-F3708 PolarHBondContact O-N 3.37Å; T3705-F3708 PolarHBondContact O-N 3.04Å
3709V57.8Low63.9Low124 Ų12482.7 Ų82.775%0.75242%0.424SS*.  trans-87.3-13175.4169.50000112.2T3705T3705-V3709 WeakPolarHBondContact O-CB 3.28Å; T3705-V3709 VanDerWaalsContact O-CG2 3.28Å; T3705-V3709 WeakPolarHBondContact O-CG2 3.36Å; T3705-V3709 PolarHBondContact O-N 2.82Å
3710H47.3Very low62.7Low198 Ų19888.1 Ų88.192%0.91745%0.452SS*.  trans-100.50-177.2-116.4-69.7000114.3H3706H3706-H3710 AromaticContact CE1-CD2 3.47Å; H3706-H3710 PolarHBondContact CE1-CD2 3.32Å; H3706-H3710 VanDerWaalsContact CE1-CD2 3.47Å; H3706-H3710 AromaticContact CE1-NE2 3.9Å; H3706-H3710 AromaticContact ND1-CD2 3.68Å; H3706-H3710 WeakPolarHBondContact O-CB 3.44Å

Retrieved 3,710 of 3,710 residues in 1258.4 ms (Link to these results)

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