A0A077Z224_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z224, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 313 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M46.2Very low57.6Low113 Ų113100.5 Ų100.556%0.55750%0.495SS*.  0-23.70-77.2177.1-172.100113.3A3 S4 G5 F42 F58M1-A3 VanDerWaalsContact C-N 3.33Å; M1-A3 PolarHBondContact O-N 3.07Å; M1-S4 PolarHBondContact O-N 3.35Å; M1-S4 PolarHBondContact O-OG 3.11Å; M1-G5 PolarHBondContact O-N 3Å; M1-F42 HydrophobicContact CE-CE2 3.86Å; M1-F42 HydrophobicContact CE-CZ 4.5Å; M1-F58 HydrophobicContact CE-CD2 3.41Å; M1-F58 VanDerWaalsContact CE-CD2 3.41Å; M1-F58 HydrophobicContact CE-CE2 3.66Å; M1-F58 HydrophobicContact CE-CG 4.24Å; M1-F58 HydrophobicContact SD-CD2 3.41Å; M1-F58 WeakPolarHBondContact SD-CD2 3.48Å; M1-F58 HydrophobicContact SD-CE2 3.99Å; M1-F58 HydrophobicContact SD-CG 4.37Å
2E43.3Very low58.1Low160 Ų16093 Ų9375%0.74846%0.46SS*.Hα-helixtrans-56.3-43.4177.1-72174.1151.700113.1S4 G5E2-S4 PolarHBondContact O-N 2.69Å; E2-S4 VanDerWaalsContact O-N 3.11Å; E2-G5 PolarHBondContact O-N 3.35Å
3A46Very low58.9Low86 Ų8692.7 Ų92.771%0.71146%0.456SS*.Hα-helixtrans-62.1-20.317600000114.6M1M1-A3 VanDerWaalsContact C-N 3.33Å; M1-A3 PolarHBondContact O-N 3.07Å
4S56Low59.4Low44 Ų4490.9 Ų90.931%0.30845%0.453SS..Hα-helixtrans-84.7-30174.655.90000112.8M1 E2 F7 W8M1-S4 PolarHBondContact O-N 3.35Å; M1-S4 PolarHBondContact O-OG 3.11Å; E2-S4 PolarHBondContact O-N 2.69Å; E2-S4 VanDerWaalsContact O-N 3.11Å; S4-F7 PolarHBondContact O-N 3.22Å; S4-W8 VanDerWaalsContact O-CG 3.31Å; S4-W8 PolarHBondContact O-N 3.23Å
5G54.8Low59.5Low27 Ų2785.9 Ų85.928%0.27843%0.428SS..Hα-helixtrans-63.4-49.4179.900000112M1 E2 F7 W8 Y9M1-G5 PolarHBondContact O-N 3Å; E2-G5 PolarHBondContact O-N 3.35Å; G5-F7 VanDerWaalsContact C-N 3.33Å; G5-F7 PolarHBondContact O-N 3.19Å; G5-W8 PolarHBondContact O-N 3.4Å; G5-Y9 PolarHBondContact O-N 3.43Å
6E62.8Low59.7Low157 Ų15791.4 Ų91.473%0.73444%0.444SS*.Hα-helixtrans-61.1-41.6176-67.7-175.4165.800112.1W8 Y9 Y10E6-W8 VanDerWaalsContact C-N 3.35Å; E6-W8 PolarHBondContact O-N 3.23Å; E6-Y9 PolarHBondContact O-N 3.43Å; E6-Y10 WeakPolarHBondContact O-CB 3.42Å; E6-Y10 PolarHBondContact O-N 3.37Å
7F66.2Low60.1Low115 Ų11595.1 Ų95.150%0.50446%0.46SS..Hα-helixtrans-59.4-46.1174.7171.1-95.4000111.5S4 G5 Y10 F11S4-F7 PolarHBondContact O-N 3.22Å; G5-F7 VanDerWaalsContact C-N 3.33Å; G5-F7 PolarHBondContact O-N 3.19Å; F7-Y10 PolarHBondContact O-N 2.63Å; F7-F11 HydrophobicContact CE1-CB 4.39Å; F7-F11 HydrophobicContact CZ-CB 4.49Å; F7-F11 HydrophobicContact CZ-CD2 4.4Å; F7-F11 WeakPolarHBondContact O-CB 3.26Å; F7-F11 PolarHBondContact O-N 3.06Å
8W62.4Low60.1Low50 Ų5093.7 Ų93.719%0.18946%0.459CS..Hα-helixtrans-69.7-36.3-178.2-69.8123.6000112.7S4 G5 E6 F11 S12 F31 I65S4-W8 VanDerWaalsContact O-CG 3.31Å; S4-W8 PolarHBondContact O-N 3.23Å; G5-W8 PolarHBondContact O-N 3.4Å; E6-W8 VanDerWaalsContact C-N 3.35Å; E6-W8 PolarHBondContact O-N 3.23Å; W8-F11 HydrophobicContact CE3-CB 4.36Å; W8-F11 AromaticContact CE3-CD1 3.79Å; W8-F11 HydrophobicContact CE3-CD1 3.79Å; W8-F11 HydrophobicContact CE3-CE1 4.48Å; W8-F11 HydrophobicContact CE3-CG 4.34Å; W8-F11 AromaticContact CZ3-CD1 3.75Å; W8-F11 HydrophobicContact CZ3-CD1 3.75Å; W8-F11 HydrophobicContact CZ3-CE1 4.02Å; W8-F11 HydrophobicContact CZ3-CG 4.41Å; W8-F11 PolarHBondContact O-N 3.27Å; W8-S12 WeakPolarHBondContact O-CB 3.41Å; W8-S12 PolarHBondContact O-N 3.18Å; W8-F31 AromaticContact CD2-CD2 3.94Å; W8-F31 HydrophobicContact CD2-CD2 3.94Å; W8-F31 AromaticContact CD2-CE2 3.54Å; W8-F31 HydrophobicContact CD2-CE2 3.54Å; W8-F31 HydrophobicContact CD2-CZ 4.33Å; W8-F31 AromaticContact CE2-CD2 3.75Å; W8-F31 AromaticContact CE2-CE2 3.41Å; W8-F31 VanDerWaalsContact CE2-CE2 3.41Å; W8-F31 AromaticContact CE3-CD2 3.8Å; W8-F31 HydrophobicContact CE3-CD2 3.8Å; W8-F31 AromaticContact CE3-CE2 3.84Å; W8-F31 HydrophobicContact CE3-CE2 3.84Å; W8-F31 HydrophobicContact CG-CE2 4.09Å; W8-F31 AromaticContact CH2-CD2 3.38Å; W8-F31 HydrophobicContact CH2-CD2 3.38Å; W8-F31 AromaticContact CH2-CE2 3.97Å; W8-F31 HydrophobicContact CH2-CE2 3.97Å; W8-F31 HydrophobicContact CH2-CG 4.31Å; W8-F31 AromaticContact CZ2-CD2 3.5Å; W8-F31 HydrophobicContact CZ2-CD2 3.5Å; W8-F31 VanDerWaalsContact CZ2-CD2 3.5Å; W8-F31 AromaticContact CZ2-CE2 3.66Å; W8-F31 HydrophobicContact CZ2-CE2 3.66Å; W8-F31 HydrophobicContact CZ3-CB 4.46Å; W8-F31 AromaticContact CZ3-CD2 3.53Å; W8-F31 HydrophobicContact CZ3-CD2 3.53Å; W8-F31 HydrophobicContact CZ3-CE2 4.04Å; W8-F31 HydrophobicContact CZ3-CG 4.19Å; W8-F31 AromaticContact NE1-CE2 3.81Å; W8-I65 HydrophobicContact CB-CG2 3.86Å; W8-I65 HydrophobicContact CG-CG2 4.22Å
9Y63.6Low59.9Low133 Ų13394.9 Ų94.952%0.52248%0.477SS..Hα-helixtrans-61.2-49.2171.5-176.2-86.1000110.9G5 E6 F11 S12 E13G5-Y9 PolarHBondContact O-N 3.43Å; E6-Y9 PolarHBondContact O-N 3.43Å; Y9-F11 VanDerWaalsContact C-N 3.3Å; Y9-F11 PolarHBondContact O-N 2.8Å; Y9-S12 PolarHBondContact O-N 2.93Å; Y9-S12 PolarHBondContact O-OG 3.39Å; Y9-E13 HydrophobicContact CE1-CG 4.07Å; Y9-E13 PolarHBondContact O-N 3.49Å
10Y66.2Low60.2Low160 Ų16096.2 Ų96.263%0.62748%0.482SS*.Hα-helixtrans-64.2-37.8178.3-156.7-88.5000111.9E6 F7 E13 V14E6-Y10 WeakPolarHBondContact O-CB 3.42Å; E6-Y10 PolarHBondContact O-N 3.37Å; F7-Y10 PolarHBondContact O-N 2.63Å; Y10-E13 PolarHBondContact O-N 3Å; Y10-V14 HydrophobicContact CD1-CG2 3.95Å; Y10-V14 HydrophobicContact CE1-CG2 3.89Å; Y10-V14 VanDerWaalsContact O-CG2 3.3Å; Y10-V14 WeakPolarHBondContact O-CG2 3.39Å; Y10-V14 PolarHBondContact O-N 3.17Å
11F66.5Low60.4Low60 Ų6097.8 Ų97.826%0.26349%0.492SS..Hα-helixtrans-66-37.6175.3-174.4-109.2000111.9F7 W8 Y9 V14 L15 A27F7-F11 HydrophobicContact CE1-CB 4.39Å; F7-F11 HydrophobicContact CZ-CB 4.49Å; F7-F11 HydrophobicContact CZ-CD2 4.4Å; F7-F11 WeakPolarHBondContact O-CB 3.26Å; F7-F11 PolarHBondContact O-N 3.06Å; W8-F11 HydrophobicContact CE3-CB 4.36Å; W8-F11 AromaticContact CE3-CD1 3.79Å; W8-F11 HydrophobicContact CE3-CD1 3.79Å; W8-F11 HydrophobicContact CE3-CE1 4.48Å; W8-F11 HydrophobicContact CE3-CG 4.34Å; W8-F11 AromaticContact CZ3-CD1 3.75Å; W8-F11 HydrophobicContact CZ3-CD1 3.75Å; W8-F11 HydrophobicContact CZ3-CE1 4.02Å; W8-F11 HydrophobicContact CZ3-CG 4.41Å; W8-F11 PolarHBondContact O-N 3.27Å; Y9-F11 VanDerWaalsContact C-N 3.3Å; Y9-F11 PolarHBondContact O-N 2.8Å; F11-V14 PolarHBondContact O-N 2.98Å; F11-L15 HydrophobicContact CD1-CD1 3.72Å; F11-L15 HydrophobicContact CD1-CG 4.36Å; F11-L15 HydrophobicContact CE1-CD1 3.25Å; F11-L15 HydrophobicContact CE1-CG 4.07Å; F11-L15 HydrophobicContact CE2-CD1 4.35Å; F11-L15 HydrophobicContact CE2-CG 4.34Å; F11-L15 HydrophobicContact CG-CD1 4.46Å; F11-L15 HydrophobicContact CZ-CD1 3.6Å; F11-L15 HydrophobicContact CZ-CD2 4.27Å; F11-L15 HydrophobicContact CZ-CG 4.04Å; F11-L15 WeakPolarHBondContact O-CB 3.44Å; F11-L15 WeakPolarHBondContact O-CG 3.45Å; F11-L15 PolarHBondContact O-N 2.93Å; F11-A27 HydrophobicContact CE1-CB 4.5Å; F11-A27 HydrophobicContact CZ-CB 4.12Å
12S63.5Low61.3Low11 Ų1195.9 Ų95.98%0.07749%0.494CS..Hα-helixtrans-64.7-42.5174.689.60000111.3W8 Y9 L15 Y16W8-S12 WeakPolarHBondContact O-CB 3.41Å; W8-S12 PolarHBondContact O-N 3.18Å; Y9-S12 PolarHBondContact O-N 2.93Å; Y9-S12 PolarHBondContact O-OG 3.39Å; S12-L15 PolarHBondContact O-N 3.37Å; S12-Y16 WeakPolarHBondContact O-CB 3.18Å; S12-Y16 PolarHBondContact O-N 3.47Å
13E68.2Low62.3Low89 Ų8994.6 Ų94.642%0.41649%0.488SS..Hα-helixtrans-62-45.6175.4-82.7-142144.400112Y9 Y10 L15 Y16 Q17Y9-E13 HydrophobicContact CE1-CG 4.07Å; Y9-E13 PolarHBondContact O-N 3.49Å; Y10-E13 PolarHBondContact O-N 3Å; E13-L15 VanDerWaalsContact C-N 3.33Å; E13-L15 PolarHBondContact O-N 2.91Å; E13-Y16 WeakPolarHBondContact O-CB 3.32Å; E13-Y16 PolarHBondContact O-N 2.95Å; E13-Q17 WeakPolarHBondContact O-CG 3.36Å; E13-Q17 PolarHBondContact O-N 3.44Å
14V66.3Low63.2Low67 Ų6791.2 Ų91.241%0.40646%0.458SS..Hα-helixtrans-62.8-42.9177.9171.90000110.5Y10 F11 Y16 Q17 T18Y10-V14 HydrophobicContact CD1-CG2 3.95Å; Y10-V14 HydrophobicContact CE1-CG2 3.89Å; Y10-V14 VanDerWaalsContact O-CG2 3.3Å; Y10-V14 WeakPolarHBondContact O-CG2 3.39Å; Y10-V14 PolarHBondContact O-N 3.17Å; F11-V14 PolarHBondContact O-N 2.98Å; V14-Y16 VanDerWaalsContact C-N 3.35Å; V14-Y16 PolarHBondContact O-N 2.85Å; V14-Q17 PolarHBondContact O-N 3.38Å; V14-Q17 VanDerWaalsContact O-N 3.16Å; V14-T18 PolarHBondContact O-N 3.42Å; V14-T18 PolarHBondContact O-OG1 2.79Å
15L60.3Low63.5Low16 Ų1689.8 Ų89.88%0.08445%0.449CS..Hα-helixtrans-65.8-36.7177.7-74.9-179.9000112.7F11 S12 E13 Q17 T18 N24 I72F11-L15 HydrophobicContact CD1-CD1 3.72Å; F11-L15 HydrophobicContact CD1-CG 4.36Å; F11-L15 HydrophobicContact CE1-CD1 3.25Å; F11-L15 HydrophobicContact CE1-CG 4.07Å; F11-L15 HydrophobicContact CE2-CD1 4.35Å; F11-L15 HydrophobicContact CE2-CG 4.34Å; F11-L15 HydrophobicContact CG-CD1 4.46Å; F11-L15 HydrophobicContact CZ-CD1 3.6Å; F11-L15 HydrophobicContact CZ-CD2 4.27Å; F11-L15 HydrophobicContact CZ-CG 4.04Å; F11-L15 WeakPolarHBondContact O-CB 3.44Å; F11-L15 WeakPolarHBondContact O-CG 3.45Å; F11-L15 PolarHBondContact O-N 2.93Å; S12-L15 PolarHBondContact O-N 3.37Å; E13-L15 VanDerWaalsContact C-N 3.33Å; E13-L15 PolarHBondContact O-N 2.91Å; L15-Q17 PolarHBondContact O-N 3.03Å; L15-T18 WeakPolarHBondContact CA-OG1 3.44Å; L15-T18 PolarHBondContact O-N 2.94Å; L15-T18 VanDerWaalsContact O-N 3.16Å; L15-T18 PolarHBondContact O-OG1 3.46Å; L15-N24 HydrophobicContact CD2-CB 4.29Å; L15-N24 WeakPolarHBondContact CD2-OD1 3.5Å; L15-I72 HydrophobicContact CB-CD1 4.09Å; L15-I72 HydrophobicContact CB-CG1 4.5Å; L15-I72 HydrophobicContact CD1-CD1 3.52Å; L15-I72 HydrophobicContact CG-CD1 4.49Å
16Y62.5Low64.2Low175 Ų17593.1 Ų93.169%0.68646%0.461SS*.Hα-helixtrans-58.6-30.4174.1-172.3-93.4000112.1S12 E13 V14 F71S12-Y16 WeakPolarHBondContact O-CB 3.18Å; S12-Y16 PolarHBondContact O-N 3.47Å; E13-Y16 WeakPolarHBondContact O-CB 3.32Å; E13-Y16 PolarHBondContact O-N 2.95Å; V14-Y16 VanDerWaalsContact C-N 3.35Å; V14-Y16 PolarHBondContact O-N 2.85Å; Y16-F71 HydrophobicContact CD2-CD2 4.12Å; Y16-F71 AromaticContact CD2-CE2 3.54Å; Y16-F71 HydrophobicContact CD2-CE2 3.54Å; Y16-F71 AromaticContact CD2-CZ 3.79Å; Y16-F71 HydrophobicContact CD2-CZ 3.79Å; Y16-F71 HydrophobicContact CE2-CE2 4.48Å; Y16-F71 HydrophobicContact CG-CE2 4.3Å; Y16-F71 HydrophobicContact CG-CZ 4.34Å
17Q66.4Low64.3Low153 Ų15387.2 Ų87.272%0.71544%0.439SS*.Hα-helixtrans-85.5-15.4-179.8-65.4176.316.800113.8E13 V14 L15E13-Q17 WeakPolarHBondContact O-CG 3.36Å; E13-Q17 PolarHBondContact O-N 3.44Å; V14-Q17 PolarHBondContact O-N 3.38Å; V14-Q17 VanDerWaalsContact O-N 3.16Å; L15-Q17 PolarHBondContact O-N 3.03Å
18T61Low64.4Low70 Ų7082 Ų8243%0.42942%0.416SS..  trans-96.8126.4-179.7300000113.1V14 L15 E20 N24V14-T18 PolarHBondContact O-N 3.42Å; V14-T18 PolarHBondContact O-OG1 2.79Å; L15-T18 WeakPolarHBondContact CA-OG1 3.44Å; L15-T18 PolarHBondContact O-N 2.94Å; L15-T18 VanDerWaalsContact O-N 3.16Å; L15-T18 PolarHBondContact O-OG1 3.46Å; T18-E20 PolarHBondContact O-N 2.99Å; T18-N24 PolarHBondContact O-ND2 3.37Å; T18-N24 VanDerWaalsContact O-ND2 3.07Å
19S56.9Low64.7Low117 Ų11784.8 Ų84.882%0.81843%0.426SS*.  trans-83.29.7-174.455.40000116.3
20E65Low64.9Low121 Ų12181.6 Ų81.657%0.56543%0.427SS*.  trans-10084.1-177.2-71.4-167.6-177.300112.9T18 A22 Q23 N24T18-E20 PolarHBondContact O-N 2.99Å; E20-A22 PolarHBondContact O-N 3.39Å; E20-Q23 PolarHBondContact O-N 3.47Å; E20-N24 PolarHBondContact O-N 3.33Å; E20-N24 PolarHBondContact O-OD1 3.16Å
21D64Low65Low129 Ų12974.5 Ų74.569%0.6940%0.4SS*.Hα-helixtrans-48-36.4-175.8-71.9-18.1000115.2A25D21-A25 VanDerWaalsContact O-CB 3.3Å; D21-A25 WeakPolarHBondContact O-CB 3.3Å; D21-A25 PolarHBondContact O-N 3.17Å
22A64.7Low64.9Low74 Ų7472.3 Ų72.361%0.61239%0.391SS*.Hα-helixtrans-74.6-39.6-173.700000113.5E20 N26E20-A22 PolarHBondContact O-N 3.39Å; A22-N26 PolarHBondContact O-N 3.04Å
23Q66Low65.1Low132 Ų13274.2 Ų74.262%0.61741%0.408SS*.Hα-helixtrans-69-42.9174.8-89.6-175.85.600110.5E20 A25 N26 A27E20-Q23 PolarHBondContact O-N 3.47Å; Q23-A25 VanDerWaalsContact C-N 3.32Å; Q23-A25 PolarHBondContact O-N 2.92Å; Q23-N26 PolarHBondContact O-N 3.11Å; Q23-N26 VanDerWaalsContact O-N 3.14Å; Q23-A27 WeakPolarHBondContact O-CB 3.21Å; Q23-A27 PolarHBondContact O-N 3.13Å
24N63.7Low65Low15 Ų1578.7 Ų78.78%0.0842%0.421CS..Hα-helixtrans-59.7-44.2178.2-60.2-8.1000110.8L15 T18 E20 N26 A27 F28 I72L15-N24 HydrophobicContact CD2-CB 4.29Å; L15-N24 WeakPolarHBondContact CD2-OD1 3.5Å; T18-N24 PolarHBondContact O-ND2 3.37Å; T18-N24 VanDerWaalsContact O-ND2 3.07Å; E20-N24 PolarHBondContact O-N 3.33Å; E20-N24 PolarHBondContact O-OD1 3.16Å; N24-N26 PolarHBondContact O-N 3.48Å; N24-A27 PolarHBondContact O-N 2.9Å; N24-F28 WeakPolarHBondContact O-CB 3.23Å; N24-F28 PolarHBondContact O-N 3.18Å; N24-I72 HydrophobicContact CB-CG2 3.6Å; N24-I72 WeakPolarHBondContact O-CG2 3.4Å
25A63.8Low64.9Low15 Ų1575.7 Ų75.712%0.12440%0.402CS..Hα-helixtrans-64.5-36.2176.200000113.5D21 Q23 R29 I73D21-A25 VanDerWaalsContact O-CB 3.3Å; D21-A25 WeakPolarHBondContact O-CB 3.3Å; D21-A25 PolarHBondContact O-N 3.17Å; Q23-A25 VanDerWaalsContact C-N 3.32Å; Q23-A25 PolarHBondContact O-N 2.92Å; A25-R29 PolarHBondContact O-N 2.96Å; A25-I73 HydrophobicContact CB-CD1 4.15Å; A25-I73 HydrophobicContact CB-CG1 3.91Å
26N68.4Low65Low96 Ų9676.3 Ų76.351%0.51341%0.405SS..Hα-helixtrans-73.7-40.1177.8-76.2-14.5000112.3A22 Q23 N24 F28 R29 A30A22-N26 PolarHBondContact O-N 3.04Å; Q23-N26 PolarHBondContact O-N 3.11Å; Q23-N26 VanDerWaalsContact O-N 3.14Å; N24-N26 PolarHBondContact O-N 3.48Å; N26-F28 VanDerWaalsContact C-N 3.31Å; N26-F28 PolarHBondContact O-N 3.21Å; N26-R29 PolarHBondContact O-N 3.42Å; N26-R29 PolarHBondContact OD1-NH2 3.46Å; N26-A30 PolarHBondContact O-N 3.35Å
27A65.2Low65Low33 Ų3371.4 Ų71.427%0.27340%0.396SS..Hα-helixtrans-60.2-43.2172.300000111F11 Q23 N24 A30 F31F11-A27 HydrophobicContact CE1-CB 4.5Å; F11-A27 HydrophobicContact CZ-CB 4.12Å; Q23-A27 WeakPolarHBondContact O-CB 3.21Å; Q23-A27 PolarHBondContact O-N 3.13Å; N24-A27 PolarHBondContact O-N 2.9Å; A27-A30 PolarHBondContact O-N 3.5Å; A27-F31 WeakPolarHBondContact O-CB 3.36Å; A27-F31 PolarHBondContact O-N 2.92Å
28F68.3Low64.8Low6 Ų667.5 Ų67.53%0.02638%0.379CS..Hα-helixtrans-63.5-42.9175.1-175.6-87.4000112.6N24 N26 A30 F31 V32 V69 I72 I73 L78N24-F28 WeakPolarHBondContact O-CB 3.23Å; N24-F28 PolarHBondContact O-N 3.18Å; N26-F28 VanDerWaalsContact C-N 3.31Å; N26-F28 PolarHBondContact O-N 3.21Å; F28-A30 VanDerWaalsContact C-N 3.33Å; F28-A30 PolarHBondContact O-N 2.88Å; F28-F31 WeakPolarHBondContact O-CB 3.35Å; F28-F31 PolarHBondContact O-N 3.04Å; F28-F31 VanDerWaalsContact O-N 3.17Å; F28-V32 HydrophobicContact CD1-CG2 3.83Å; F28-V32 HydrophobicContact CE1-CG2 3.36Å; F28-V32 HydrophobicContact CE2-CG2 4.47Å; F28-V32 HydrophobicContact CZ-CG2 3.72Å; F28-V32 WeakPolarHBondContact O-CG2 3.29Å; F28-V32 PolarHBondContact O-N 3.21Å; F28-V69 HydrophobicContact CD2-CB 4.24Å; F28-V69 HydrophobicContact CD2-CG2 4.04Å; F28-V69 HydrophobicContact CE2-CB 4Å; F28-V69 HydrophobicContact CE2-CG2 3.49Å; F28-V69 VanDerWaalsContact CE2-CG2 3.49Å; F28-V69 WeakPolarHBondContact CE2-O 3.12Å; F28-I72 HydrophobicContact CB-CG2 4.09Å; F28-I72 HydrophobicContact CD2-CB 4.35Å; F28-I72 HydrophobicContact CD2-CD1 4.4Å; F28-I73 HydrophobicContact CB-CD1 4.21Å; F28-I73 HydrophobicContact CB-CG1 4.26Å; F28-I73 HydrophobicContact CD1-CB 4.2Å; F28-I73 HydrophobicContact CD1-CD1 3.4Å; F28-I73 VanDerWaalsContact CD1-CD1 3.4Å; F28-I73 HydrophobicContact CD1-CG1 3.81Å; F28-I73 HydrophobicContact CE1-CB 4.36Å; F28-I73 HydrophobicContact CE1-CD1 4.11Å; F28-I73 HydrophobicContact CE1-CG1 4.44Å; F28-I73 HydrophobicContact CG-CD1 4.12Å; F28-I73 HydrophobicContact CG-CG1 4.17Å; F28-L78 HydrophobicContact CE1-CD1 4.13Å; F28-L78 HydrophobicContact CE1-CD2 4.14Å; F28-L78 HydrophobicContact CZ-CD2 4Å
29R67.7Low64.9Low109 Ų10964.2 Ų64.241%0.41136%0.359SS..Hα-helixtrans-59.8-43.4174.9-85.3-171.9-90.9-110.51112.3A25 N26 F31 V32 A33 I73A25-R29 PolarHBondContact O-N 2.96Å; N26-R29 PolarHBondContact O-N 3.42Å; N26-R29 PolarHBondContact OD1-NH2 3.46Å; R29-F31 VanDerWaalsContact C-N 3.3Å; R29-F31 PolarHBondContact O-N 2.8Å; R29-V32 PolarHBondContact O-N 3.28Å; R29-A33 WeakPolarHBondContact O-CB 3.49Å; R29-A33 PolarHBondContact O-N 2.99Å; R29-I73 HydrophobicContact CG-CD1 4.16Å
30A69.3Low65Low65 Ų6561.1 Ų61.154%0.53733%0.331SS..Hα-helixtrans-63.4-38.4175.600000111.7N26 A27 F28 R34N26-A30 PolarHBondContact O-N 3.35Å; A27-A30 PolarHBondContact O-N 3.5Å; F28-A30 VanDerWaalsContact C-N 3.33Å; F28-A30 PolarHBondContact O-N 2.88Å; A30-R34 WeakPolarHBondContact O-CB 3.3Å; A30-R34 PolarHBondContact O-N 3.38Å
31F67.3Low64.6Low12 Ų1260.3 Ų60.35%0.05333%0.33CS..Hα-helixtrans-62-51.7174.4171.5-111.6000112.2W8 A27 F28 R29 A33 R34 L35 I65 I66 V69W8-F31 AromaticContact CD2-CD2 3.94Å; W8-F31 HydrophobicContact CD2-CD2 3.94Å; W8-F31 AromaticContact CD2-CE2 3.54Å; W8-F31 HydrophobicContact CD2-CE2 3.54Å; W8-F31 HydrophobicContact CD2-CZ 4.33Å; W8-F31 AromaticContact CE2-CD2 3.75Å; W8-F31 AromaticContact CE2-CE2 3.41Å; W8-F31 VanDerWaalsContact CE2-CE2 3.41Å; W8-F31 AromaticContact CE3-CD2 3.8Å; W8-F31 HydrophobicContact CE3-CD2 3.8Å; W8-F31 AromaticContact CE3-CE2 3.84Å; W8-F31 HydrophobicContact CE3-CE2 3.84Å; W8-F31 HydrophobicContact CG-CE2 4.09Å; W8-F31 AromaticContact CH2-CD2 3.38Å; W8-F31 HydrophobicContact CH2-CD2 3.38Å; W8-F31 AromaticContact CH2-CE2 3.97Å; W8-F31 HydrophobicContact CH2-CE2 3.97Å; W8-F31 HydrophobicContact CH2-CG 4.31Å; W8-F31 AromaticContact CZ2-CD2 3.5Å; W8-F31 HydrophobicContact CZ2-CD2 3.5Å; W8-F31 VanDerWaalsContact CZ2-CD2 3.5Å; W8-F31 AromaticContact CZ2-CE2 3.66Å; W8-F31 HydrophobicContact CZ2-CE2 3.66Å; W8-F31 HydrophobicContact CZ3-CB 4.46Å; W8-F31 AromaticContact CZ3-CD2 3.53Å; W8-F31 HydrophobicContact CZ3-CD2 3.53Å; W8-F31 HydrophobicContact CZ3-CE2 4.04Å; W8-F31 HydrophobicContact CZ3-CG 4.19Å; W8-F31 AromaticContact NE1-CE2 3.81Å; A27-F31 WeakPolarHBondContact O-CB 3.36Å; A27-F31 PolarHBondContact O-N 2.92Å; F28-F31 WeakPolarHBondContact O-CB 3.35Å; F28-F31 PolarHBondContact O-N 3.04Å; F28-F31 VanDerWaalsContact O-N 3.17Å; R29-F31 VanDerWaalsContact C-N 3.3Å; R29-F31 PolarHBondContact O-N 2.8Å; F31-A33 VanDerWaalsContact C-N 3.34Å; F31-A33 PolarHBondContact O-N 3.03Å; F31-R34 PolarHBondContact O-N 2.96Å; F31-R34 VanDerWaalsContact O-N 3.13Å; F31-L35 HydrophobicContact CD1-CD1 4.05Å; F31-L35 HydrophobicContact CD2-CD1 4.49Å; F31-L35 HydrophobicContact CE1-CD1 3.33Å; F31-L35 HydrophobicContact CE1-CG 4.3Å; F31-L35 HydrophobicContact CE2-CD1 3.84Å; F31-L35 HydrophobicContact CE2-CG 3.95Å; F31-L35 HydrophobicContact CZ-CD1 3.21Å; F31-L35 HydrophobicContact CZ-CG 3.83Å; F31-L35 PolarHBondContact O-N 3.43Å; F31-I65 HydrophobicContact CE1-CG2 4.01Å; F31-I65 HydrophobicContact CE2-CG2 4.35Å; F31-I65 HydrophobicContact CZ-CB 4.46Å; F31-I65 HydrophobicContact CZ-CG2 3.42Å; F31-I65 VanDerWaalsContact CZ-CG2 3.42Å; F31-I66 HydrophobicContact CE1-CD1 3.91Å; F31-V69 HydrophobicContact CD1-CG2 4.15Å; F31-V69 HydrophobicContact CE1-CG2 3.68Å
32V65.3Low64.1Low13 Ų1357.7 Ų57.78%0.07931%0.313CS..Hα-helixtrans-59.2-45.5177173.30000110.7F28 R29 R34 L35 M36 I66 L98F28-V32 HydrophobicContact CD1-CG2 3.83Å; F28-V32 HydrophobicContact CE1-CG2 3.36Å; F28-V32 HydrophobicContact CE2-CG2 4.47Å; F28-V32 HydrophobicContact CZ-CG2 3.72Å; F28-V32 WeakPolarHBondContact O-CG2 3.29Å; F28-V32 PolarHBondContact O-N 3.21Å; R29-V32 PolarHBondContact O-N 3.28Å; V32-R34 VanDerWaalsContact C-N 3.27Å; V32-R34 PolarHBondContact O-N 3.5Å; V32-L35 WeakPolarHBondContact O-CB 3.27Å; V32-L35 PolarHBondContact O-N 2.9Å; V32-M36 HydrophobicContact CG1-CG 4.33Å; V32-M36 HydrophobicContact CG1-SD 4.38Å; V32-M36 VanDerWaalsContact O-CG 3.3Å; V32-M36 WeakPolarHBondContact O-CG 3.25Å; V32-M36 PolarHBondContact O-N 3.35Å; V32-I66 HydrophobicContact CG2-CD1 4.26Å; V32-L98 HydrophobicContact CG1-CD1 3.77Å
33A66.3Low63.7Low52 Ų5255.3 Ų55.343%0.4329%0.289SS..Hα-helixtrans-60-38.3177.500000112.4R29 F31 M36 S37R29-A33 WeakPolarHBondContact O-CB 3.49Å; R29-A33 PolarHBondContact O-N 2.99Å; F31-A33 VanDerWaalsContact C-N 3.34Å; F31-A33 PolarHBondContact O-N 3.03Å; A33-M36 PolarHBondContact O-N 2.84Å; A33-S37 PolarHBondContact O-N 3.49Å; A33-S37 PolarHBondContact O-OG 3.38Å
34R66.8Low63.1Low182 Ų18253.8 Ų53.869%0.68728%0.281SS*.Hα-helixtrans-71.2-39.3177.2-162.9165.6-173.1136.9-0.7112.1A30 F31 V32 S37 M38A30-R34 WeakPolarHBondContact O-CB 3.3Å; A30-R34 PolarHBondContact O-N 3.38Å; F31-R34 PolarHBondContact O-N 2.96Å; F31-R34 VanDerWaalsContact O-N 3.13Å; V32-R34 VanDerWaalsContact C-N 3.27Å; V32-R34 PolarHBondContact O-N 3.5Å; R34-S37 WeakPolarHBondContact O-CB 3.36Å; R34-S37 PolarHBondContact O-N 3.19Å; R34-M38 WeakPolarHBondContact O-CG 3.28Å; R34-M38 PolarHBondContact O-N 2.97Å
35L64.6Low62.4Low4 Ų459.8 Ų59.82%0.02131%0.308CS..Hα-helixtrans-59.4-48.6170.9-92.3175.3000111.5F31 V32 S37 M38 F39 V62 I66F31-L35 HydrophobicContact CD1-CD1 4.05Å; F31-L35 HydrophobicContact CD2-CD1 4.49Å; F31-L35 HydrophobicContact CE1-CD1 3.33Å; F31-L35 HydrophobicContact CE1-CG 4.3Å; F31-L35 HydrophobicContact CE2-CD1 3.84Å; F31-L35 HydrophobicContact CE2-CG 3.95Å; F31-L35 HydrophobicContact CZ-CD1 3.21Å; F31-L35 HydrophobicContact CZ-CG 3.83Å; F31-L35 PolarHBondContact O-N 3.43Å; V32-L35 WeakPolarHBondContact O-CB 3.27Å; V32-L35 PolarHBondContact O-N 2.9Å; L35-S37 VanDerWaalsContact C-N 3.29Å; L35-S37 PolarHBondContact O-N 3.5Å; L35-M38 HydrophobicContact CD2-CE 3.84Å; L35-M38 PolarHBondContact O-N 3.36Å; L35-F39 WeakPolarHBondContact O-CD2 3.41Å; L35-F39 PolarHBondContact O-N 3.05Å; L35-V62 HydrophobicContact CD1-CG1 3.71Å; L35-V62 HydrophobicContact CD2-CB 4.1Å; L35-V62 HydrophobicContact CD2-CG1 3.54Å; L35-V62 HydrophobicContact CD2-CG2 3.42Å; L35-V62 VanDerWaalsContact CD2-CG2 3.42Å; L35-V62 HydrophobicContact CG-CG1 4.22Å; L35-I66 HydrophobicContact CD1-CD1 3.63Å; L35-I66 HydrophobicContact CD1-CG1 3.92Å
36M63Low61.4Low30 Ų3064.6 Ų64.615%0.14833%0.332CS..Hα-helixtrans-55.1-48.3174.7-66.8-172.875.400110V32 A33 M38 F39 F40 C94 L98V32-M36 HydrophobicContact CG1-CG 4.33Å; V32-M36 HydrophobicContact CG1-SD 4.38Å; V32-M36 VanDerWaalsContact O-CG 3.3Å; V32-M36 WeakPolarHBondContact O-CG 3.25Å; V32-M36 PolarHBondContact O-N 3.35Å; A33-M36 PolarHBondContact O-N 2.84Å; M36-M38 VanDerWaalsContact C-N 3.25Å; M36-M38 PolarHBondContact O-N 2.84Å; M36-F39 WeakPolarHBondContact O-CA 3.38Å; M36-F39 VanDerWaalsContact O-CB 3.27Å; M36-F39 WeakPolarHBondContact O-CB 3.45Å; M36-F39 PolarHBondContact O-N 2.85Å; M36-F40 VanDerWaalsContact O-CD2 3.25Å; M36-F40 WeakPolarHBondContact O-CD2 3.49Å; M36-F40 PolarHBondContact O-N 3.22Å; M36-C94 HydrophobicContact CE-CB 4.12Å; M36-C94 VanDerWaalsContact CG-SG 3.6Å; M36-L98 HydrophobicContact CG-CD1 3.78Å; M36-L98 HydrophobicContact SD-CD1 4.28Å
37S62.6Low60.2Low71 Ų7163.3 Ų63.350%0.49734%0.341SS..Hα-helixtrans-58-35.5177.7-530000113.3A33 R34 L35 L41A33-S37 PolarHBondContact O-N 3.49Å; A33-S37 PolarHBondContact O-OG 3.38Å; R34-S37 WeakPolarHBondContact O-CB 3.36Å; R34-S37 PolarHBondContact O-N 3.19Å; L35-S37 VanDerWaalsContact C-N 3.29Å; L35-S37 PolarHBondContact O-N 3.5Å; S37-L41 PolarHBondContact O-N 3.42Å
38M61.8Low59Low72 Ų7266.6 Ų66.636%0.35536%0.358SS..Hα-helixtrans-71.7-36.6175-68.2-163.3-60.300112.6R34 L35 M36 F40 L41 F42 F58R34-M38 WeakPolarHBondContact O-CG 3.28Å; R34-M38 PolarHBondContact O-N 2.97Å; L35-M38 HydrophobicContact CD2-CE 3.84Å; L35-M38 PolarHBondContact O-N 3.36Å; M36-M38 VanDerWaalsContact C-N 3.25Å; M36-M38 PolarHBondContact O-N 2.84Å; M38-F40 VanDerWaalsContact C-N 3.33Å; M38-F40 PolarHBondContact O-N 3.42Å; M38-L41 PolarHBondContact O-N 3.32Å; M38-F42 PolarHBondContact O-N 3.44Å; M38-F58 HydrophobicContact CB-CZ 3.99Å; M38-F58 HydrophobicContact CE-CE2 4.38Å
39F63Low57.8Low0 Ų067.7 Ų67.70%037%0.365CS..Hα-helixtrans-57.2-46.8171.3-95.7-78.4000112L35 M36 L41 F42 I43 F55 F58 R59 V62 F97L35-F39 WeakPolarHBondContact O-CD2 3.41Å; L35-F39 PolarHBondContact O-N 3.05Å; M36-F39 WeakPolarHBondContact O-CA 3.38Å; M36-F39 VanDerWaalsContact O-CB 3.27Å; M36-F39 WeakPolarHBondContact O-CB 3.45Å; M36-F39 PolarHBondContact O-N 2.85Å; F39-L41 VanDerWaalsContact C-N 3.3Å; F39-L41 PolarHBondContact O-N 2.95Å; F39-F42 PolarHBondContact O-N 2.86Å; F39-I43 HydrophobicContact CD1-CD1 4.3Å; F39-I43 WeakPolarHBondContact O-CG1 3.42Å; F39-I43 PolarHBondContact O-N 3.48Å; F39-F55 HydrophobicContact CD1-CE2 4.02Å; F39-F55 HydrophobicContact CD1-CZ 4.08Å; F39-F55 HydrophobicContact CE1-CE2 4.06Å; F39-F55 HydrophobicContact CE1-CZ 4.03Å; F39-F58 HydrophobicContact CD1-CE1 4.06Å; F39-F58 AromaticContact CD2-CE1 3.94Å; F39-F58 HydrophobicContact CD2-CE1 3.94Å; F39-F58 HydrophobicContact CD2-CZ 4.32Å; F39-F58 HydrophobicContact CE1-CD1 4.25Å; F39-F58 AromaticContact CE1-CE1 3.9Å; F39-F58 HydrophobicContact CE1-CE1 3.9Å; F39-F58 AromaticContact CE2-CE1 3.77Å; F39-F58 HydrophobicContact CE2-CE1 3.77Å; F39-F58 HydrophobicContact CE2-CZ 4.21Å; F39-F58 HydrophobicContact CG-CE1 4.05Å; F39-F58 HydrophobicContact CZ-CD1 4.2Å; F39-F58 AromaticContact CZ-CE1 3.72Å; F39-F58 HydrophobicContact CZ-CE1 3.72Å; F39-R59 HydrophobicContact CE1-CG 3.6Å; F39-R59 HydrophobicContact CZ-CG 3.86Å; F39-V62 HydrophobicContact CE2-CB 4.09Å; F39-V62 HydrophobicContact CE2-CG1 3.9Å; F39-V62 HydrophobicContact CE2-CG2 3.96Å; F39-V62 HydrophobicContact CZ-CB 4.34Å; F39-V62 HydrophobicContact CZ-CG2 4.34Å; F39-F97 AromaticContact CE1-CD1 3.93Å; F39-F97 HydrophobicContact CE1-CD1 3.93Å; F39-F97 HydrophobicContact CE1-CE1 4.05Å; F39-F97 HydrophobicContact CE1-CG 4.37Å; F39-F97 AromaticContact CE2-CD1 3.68Å; F39-F97 HydrophobicContact CE2-CD1 3.68Å; F39-F97 AromaticContact CE2-CE1 3.48Å; F39-F97 HydrophobicContact CE2-CE1 3.48Å; F39-F97 VanDerWaalsContact CE2-CE1 3.48Å; F39-F97 HydrophobicContact CE2-CZ 4.44Å; F39-F97 AromaticContact CZ-CD1 3.33Å; F39-F97 HydrophobicContact CZ-CD1 3.33Å; F39-F97 AromaticContact CZ-CE1 3.09Å; F39-F97 HydrophobicContact CZ-CE1 3.09Å; F39-F97 HydrophobicContact CZ-CE2 4.44Å; F39-F97 HydrophobicContact CZ-CG 4.15Å; F39-F97 AromaticContact CZ-CZ 3.71Å; F39-F97 HydrophobicContact CZ-CZ 3.71Å
40F58.5Low56.6Low52 Ų5267.5 Ų67.523%0.22838%0.378CS..Hα-helixtrans-59.4-39.6176.7-87.1-88.3000112.2M36 M38 F42 F44 E90 N91 C94M36-F40 VanDerWaalsContact O-CD2 3.25Å; M36-F40 WeakPolarHBondContact O-CD2 3.49Å; M36-F40 PolarHBondContact O-N 3.22Å; M38-F40 VanDerWaalsContact C-N 3.33Å; M38-F40 PolarHBondContact O-N 3.42Å; F40-F42 VanDerWaalsContact C-N 3.33Å; F40-F42 PolarHBondContact O-N 3.13Å; F40-F44 HydrophobicContact CB-CD2 4.46Å; F40-F44 AromaticContact CD1-CD2 3.84Å; F40-F44 HydrophobicContact CD1-CD2 3.84Å; F40-F44 AromaticContact CD1-CE2 3.13Å; F40-F44 HydrophobicContact CD1-CE2 3.13Å; F40-F44 AromaticContact CD1-CZ 3.8Å; F40-F44 HydrophobicContact CD1-CZ 3.8Å; F40-F44 AromaticContact CE1-CE2 3.48Å; F40-F44 HydrophobicContact CE1-CE2 3.48Å; F40-F44 VanDerWaalsContact CE1-CE2 3.48Å; F40-F44 AromaticContact CE1-CZ 3.83Å; F40-F44 HydrophobicContact CE1-CZ 3.83Å; F40-F44 HydrophobicContact CG-CE2 4.14Å; F40-F44 WeakPolarHBondContact O-CB 3.26Å; F40-F44 WeakPolarHBondContact O-CD2 3.47Å; F40-F44 PolarHBondContact O-N 2.93Å; F40-E90 HydrophobicContact CD1-CB 4.25Å; F40-E90 HydrophobicContact CE1-CB 3.33Å; F40-E90 HydrophobicContact CE1-CG 4.36Å; F40-E90 HydrophobicContact CZ-CB 3.61Å; F40-N91 VanDerWaalsContact CE2-OD1 3.28Å; F40-N91 WeakPolarHBondContact CE2-OD1 3.33Å; F40-N91 HydrophobicContact CZ-CB 4.22Å; F40-N91 VanDerWaalsContact CZ-CG 3.46Å; F40-N91 WeakPolarHBondContact CZ-OD1 3.32Å; F40-C94 HydrophobicContact CE2-CB 4.44Å
41L56.9Low55.8Low104 Ų10468.8 Ų68.855%0.54538%0.376SS..Hα-helixtrans-63.5-38177.1-106.6146.6000112.8S37 M38 F39 Q45S37-L41 PolarHBondContact O-N 3.42Å; M38-L41 PolarHBondContact O-N 3.32Å; F39-L41 VanDerWaalsContact C-N 3.3Å; F39-L41 PolarHBondContact O-N 2.95Å; L41-Q45 WeakPolarHBondContact O-CG 3.43Å
42F54.2Low55.4Low75 Ų7573 Ų7333%0.32940%0.399SS..Hα-helixtrans-78.5-37.8-179.6-108.1-91.1000113.7M1 M38 F39 F40 F55M1-F42 HydrophobicContact CE-CE2 3.86Å; M1-F42 HydrophobicContact CE-CZ 4.5Å; M38-F42 PolarHBondContact O-N 3.44Å; F39-F42 PolarHBondContact O-N 2.86Å; F40-F42 VanDerWaalsContact C-N 3.33Å; F40-F42 PolarHBondContact O-N 3.13Å; F42-F55 HydrophobicContact CB-CD2 3.83Å; F42-F55 HydrophobicContact CB-CE2 3.92Å; F42-F55 HydrophobicContact CD1-CB 4.42Å; F42-F55 AromaticContact CD1-CD2 3.89Å; F42-F55 HydrophobicContact CD1-CD2 3.89Å; F42-F55 HydrophobicContact CG-CD2 4.15Å
43I56.1Low55.5Low23 Ų2375 Ų7512%0.11841%0.414CS..Hα-helixtrans-72-32.9-178.7-67.1170.8000111.4F39 F55 W89F39-I43 HydrophobicContact CD1-CD1 4.3Å; F39-I43 WeakPolarHBondContact O-CG1 3.42Å; F39-I43 PolarHBondContact O-N 3.48Å; I43-F55 HydrophobicContact CD1-CZ 4.05Å; I43-F55 HydrophobicContact CG1-CE2 3.92Å; I43-F55 HydrophobicContact CG1-CZ 3.62Å; I43-W89 HydrophobicContact CG2-CH2 3.6Å; I43-W89 HydrophobicContact CG2-CZ3 4.22Å
44F52.3Low55.7Low101 Ų10177 Ų7744%0.44342%0.416SS..Hα-helixtrans-100.9-6.6-170.1-74.5-97.8000115.8F40 D46 E90F40-F44 HydrophobicContact CB-CD2 4.46Å; F40-F44 AromaticContact CD1-CD2 3.84Å; F40-F44 HydrophobicContact CD1-CD2 3.84Å; F40-F44 AromaticContact CD1-CE2 3.13Å; F40-F44 HydrophobicContact CD1-CE2 3.13Å; F40-F44 AromaticContact CD1-CZ 3.8Å; F40-F44 HydrophobicContact CD1-CZ 3.8Å; F40-F44 AromaticContact CE1-CE2 3.48Å; F40-F44 HydrophobicContact CE1-CE2 3.48Å; F40-F44 VanDerWaalsContact CE1-CE2 3.48Å; F40-F44 AromaticContact CE1-CZ 3.83Å; F40-F44 HydrophobicContact CE1-CZ 3.83Å; F40-F44 HydrophobicContact CG-CE2 4.14Å; F40-F44 WeakPolarHBondContact O-CB 3.26Å; F40-F44 WeakPolarHBondContact O-CD2 3.47Å; F40-F44 PolarHBondContact O-N 2.93Å; F44-D46 VanDerWaalsContact C-N 3.33Å; F44-D46 PolarHBondContact O-N 3.14Å; F44-E90 HydrophobicContact CE1-CG 3.96Å; F44-E90 VanDerWaalsContact CE1-OE1 3.27Å; F44-E90 WeakPolarHBondContact CE1-OE1 3.43Å; F44-E90 HydrophobicContact CE2-CB 3.6Å; F44-E90 HydrophobicContact CE2-CG 3.44Å; F44-E90 VanDerWaalsContact CE2-CG 3.44Å; F44-E90 HydrophobicContact CZ-CB 3.62Å; F44-E90 HydrophobicContact CZ-CG 3.08Å; F44-E90 WeakPolarHBondContact CZ-OE1 3.46Å
45Q49.3Very low56Low140 Ų14068.9 Ų68.965%0.65439%0.387SS*.THydrogen-bonded Turntrans-69.9-26.6-177.6-93.2-172.1-14.500113.7L41L41-Q45 WeakPolarHBondContact O-CG 3.43Å
46D42.8Very low56.4Low117 Ų11772.8 Ų72.863%0.62641%0.405SS*.THydrogen-bonded Turntrans-145.55.5-178.4-75.4-52.9000116.5F44 V48F44-D46 VanDerWaalsContact C-N 3.33Å; F44-D46 PolarHBondContact O-N 3.14Å; D46-V48 PolarHBondContact O-N 3.43Å
47G42.9Very low57.1Low69 Ų6975.9 Ų75.971%0.71142%0.419SS*.SBendtrans68.4-8.5-179.700000115.3
48V39.6Very low57.9Low101 Ų10173 Ų7361%0.61240%0.397SS*.SBendtrans-146.6127.2166.1-179.20000105.5D46 P50D46-V48 PolarHBondContact O-N 3.43Å; V48-P50 WeakPolarHBondContact O-CD 3.39Å
49P43.7Very low58.8Low29 Ų2970.8 Ų70.819%0.18839%0.385CS..  trans-56.2125.6177.4-21.531.8000109.6D51 L52 F55P49-D51 PolarHBondContact O-N 3.17Å; P49-L52 HydrophobicContact CG-CD2 4.17Å; P49-F55 HydrophobicContact CB-CB 3.79Å; P49-F55 HydrophobicContact CB-CG 4.27Å; P49-F55 HydrophobicContact CG-CB 4.21Å; P49-F55 HydrophobicContact CG-CD1 4.01Å; P49-F55 HydrophobicContact CG-CG 4.19Å
50P42.7Very low59.7Low106 Ų10676.2 Ų76.269%0.68841%0.413SS*.SBendtrans-66.5-10-170.520.2-29000114.5V48V48-P50 WeakPolarHBondContact O-CD 3.39Å
51D53Low60.8Low91 Ų9176.5 Ų76.549%0.48742%0.415SS..SBendtrans-147.8123153.2-155.8-24.6000106P49 S53 D54P49-D51 PolarHBondContact O-N 3.17Å; D51-S53 PolarHBondContact O-N 2.99Å; D51-S53 VanDerWaalsContact O-N 3.13Å; D51-S53 PolarHBondContact OD1-N 3.29Å; D51-S53 PolarHBondContact OD1-OG 3.48Å; D51-S53 VanDerWaalsContact OD1-OG 3.11Å; D51-S53 PolarHBondContact OD2-OG 3.44Å; D51-D54 PolarHBondContact O-N 2.91Å
52L58.3Low62Low102 Ų10271.7 Ų71.753%0.53439%0.389SS..Hα-helixtrans-58.2-27.1178.5-80164000110.3P49 E56P49-L52 HydrophobicContact CG-CD2 4.17Å; L52-E56 VanDerWaalsContact O-CB 3.23Å; L52-E56 WeakPolarHBondContact O-CB 3.07Å; L52-E56 WeakPolarHBondContact O-CG 3.35Å; L52-E56 PolarHBondContact O-N 3.33Å
53S68Low63.6Low55 Ų5568.9 Ų68.939%0.38538%0.379SS..Hα-helixtrans-61-46.4176.663.30000113D51 F55 E56 E57D51-S53 PolarHBondContact O-N 2.99Å; D51-S53 VanDerWaalsContact O-N 3.13Å; D51-S53 PolarHBondContact OD1-N 3.29Å; D51-S53 PolarHBondContact OD1-OG 3.48Å; D51-S53 VanDerWaalsContact OD1-OG 3.11Å; D51-S53 PolarHBondContact OD2-OG 3.44Å; S53-F55 PolarHBondContact O-N 2.96Å; S53-E56 PolarHBondContact O-N 2.95Å; S53-E57 VanDerWaalsContact O-CB 3.29Å; S53-E57 WeakPolarHBondContact O-CB 3.44Å; S53-E57 PolarHBondContact O-N 3.45Å
54D69.9Low65Low92 Ų9273.4 Ų73.449%0.49240%0.4SS..Hα-helixtrans-69.7-39.1-174.4-75.84.2000111D51 F58D51-D54 PolarHBondContact O-N 2.91Å; D54-F58 WeakPolarHBondContact O-CB 3.38Å; D54-F58 PolarHBondContact O-N 3.45Å
55F72.9Confident66.4Low13 Ų1369.8 Ų69.86%0.05739%0.385CS..Hα-helixtrans-70.3-41175.4-176.9-116.3000111.7F39 F42 I43 P49 S53 F58 R59F39-F55 HydrophobicContact CD1-CE2 4.02Å; F39-F55 HydrophobicContact CD1-CZ 4.08Å; F39-F55 HydrophobicContact CE1-CE2 4.06Å; F39-F55 HydrophobicContact CE1-CZ 4.03Å; F42-F55 HydrophobicContact CB-CD2 3.83Å; F42-F55 HydrophobicContact CB-CE2 3.92Å; F42-F55 HydrophobicContact CD1-CB 4.42Å; F42-F55 AromaticContact CD1-CD2 3.89Å; F42-F55 HydrophobicContact CD1-CD2 3.89Å; F42-F55 HydrophobicContact CG-CD2 4.15Å; I43-F55 HydrophobicContact CD1-CZ 4.05Å; I43-F55 HydrophobicContact CG1-CE2 3.92Å; I43-F55 HydrophobicContact CG1-CZ 3.62Å; P49-F55 HydrophobicContact CB-CB 3.79Å; P49-F55 HydrophobicContact CB-CG 4.27Å; P49-F55 HydrophobicContact CG-CB 4.21Å; P49-F55 HydrophobicContact CG-CD1 4.01Å; P49-F55 HydrophobicContact CG-CG 4.19Å; S53-F55 PolarHBondContact O-N 2.96Å; F55-F58 HydrophobicContact CD2-CD1 4.29Å; F55-F58 HydrophobicContact CE2-CD1 4.32Å; F55-F58 WeakPolarHBondContact O-CB 3.45Å; F55-F58 PolarHBondContact O-N 2.9Å; F55-R59 HydrophobicContact CE1-CG 4.25Å; F55-R59 HydrophobicContact CE2-CG 4.4Å; F55-R59 HydrophobicContact CZ-CG 4.17Å; F55-R59 VanDerWaalsContact O-CG 3.3Å; F55-R59 WeakPolarHBondContact O-CG 3.39Å; F55-R59 PolarHBondContact O-N 3Å
56E74.1Confident68Low86 Ų8663.1 Ų63.140%0.40235%0.354SS..Hα-helixtrans-63.2-42.1174-77.7180-178.800111.8L52 S53 F58 R59 L60L52-E56 VanDerWaalsContact O-CB 3.23Å; L52-E56 WeakPolarHBondContact O-CB 3.07Å; L52-E56 WeakPolarHBondContact O-CG 3.35Å; L52-E56 PolarHBondContact O-N 3.33Å; S53-E56 PolarHBondContact O-N 2.95Å; E56-F58 PolarHBondContact O-N 3.14Å; E56-R59 WeakPolarHBondContact O-CB 3.43Å; E56-R59 PolarHBondContact O-N 3.3Å; E56-L60 WeakPolarHBondContact O-CG 3.42Å; E56-L60 PolarHBondContact O-N 3.4Å
57E77.6Confident70Confident95 Ų9562.4 Ų62.444%0.44435%0.345SS..Hα-helixtrans-64.5-41.2176.2-167.3-173.416000111.3S53 R59 L60 K61S53-E57 VanDerWaalsContact O-CB 3.29Å; S53-E57 WeakPolarHBondContact O-CB 3.44Å; S53-E57 PolarHBondContact O-N 3.45Å; E57-R59 VanDerWaalsContact C-N 3.35Å; E57-R59 PolarHBondContact O-N 2.87Å; E57-L60 PolarHBondContact O-N 3.23Å; E57-K61 WeakPolarHBondContact O-CG 3.42Å; E57-K61 PolarHBondContact O-N 3.32Å; E57-K61 VanDerWaalsContact OE1-CE 3.26Å; E57-K61 WeakPolarHBondContact OE1-CE 3.46Å; E57-K61 IonicContact OE1-NZ 2.63Å; E57-K61 PolarHBondContact OE1-NZ 3.2Å
58F77.6Confident71.8Confident10 Ų1063 Ų634%0.04433%0.332CS..Hα-helixtrans-58.1-48.4171.2170.6-112.1000111.1M1 M38 F39 D54 F55 E56 L60 K61 V62M1-F58 HydrophobicContact CE-CD2 3.41Å; M1-F58 VanDerWaalsContact CE-CD2 3.41Å; M1-F58 HydrophobicContact CE-CE2 3.66Å; M1-F58 HydrophobicContact CE-CG 4.24Å; M1-F58 HydrophobicContact SD-CD2 3.41Å; M1-F58 WeakPolarHBondContact SD-CD2 3.48Å; M1-F58 HydrophobicContact SD-CE2 3.99Å; M1-F58 HydrophobicContact SD-CG 4.37Å; M38-F58 HydrophobicContact CB-CZ 3.99Å; M38-F58 HydrophobicContact CE-CE2 4.38Å; F39-F58 HydrophobicContact CD1-CE1 4.06Å; F39-F58 AromaticContact CD2-CE1 3.94Å; F39-F58 HydrophobicContact CD2-CE1 3.94Å; F39-F58 HydrophobicContact CD2-CZ 4.32Å; F39-F58 HydrophobicContact CE1-CD1 4.25Å; F39-F58 AromaticContact CE1-CE1 3.9Å; F39-F58 HydrophobicContact CE1-CE1 3.9Å; F39-F58 AromaticContact CE2-CE1 3.77Å; F39-F58 HydrophobicContact CE2-CE1 3.77Å; F39-F58 HydrophobicContact CE2-CZ 4.21Å; F39-F58 HydrophobicContact CG-CE1 4.05Å; F39-F58 HydrophobicContact CZ-CD1 4.2Å; F39-F58 AromaticContact CZ-CE1 3.72Å; F39-F58 HydrophobicContact CZ-CE1 3.72Å; D54-F58 WeakPolarHBondContact O-CB 3.38Å; D54-F58 PolarHBondContact O-N 3.45Å; F55-F58 HydrophobicContact CD2-CD1 4.29Å; F55-F58 HydrophobicContact CE2-CD1 4.32Å; F55-F58 WeakPolarHBondContact O-CB 3.45Å; F55-F58 PolarHBondContact O-N 2.9Å; E56-F58 PolarHBondContact O-N 3.14Å; F58-L60 VanDerWaalsContact C-N 3.34Å; F58-L60 PolarHBondContact O-N 3.18Å; F58-K61 PolarHBondContact O-N 3.26Å; F58-V62 HydrophobicContact CD1-CG2 4.49Å; F58-V62 HydrophobicContact CD2-CG2 4Å; F58-V62 HydrophobicContact CE1-CG2 4.05Å; F58-V62 HydrophobicContact CE2-CG2 3.54Å; F58-V62 HydrophobicContact CG-CG2 4.49Å; F58-V62 HydrophobicContact CZ-CG2 3.57Å; F58-V62 WeakPolarHBondContact O-CG2 3.33Å; F58-V62 PolarHBondContact O-N 3.28Å
59R81.5Confident73.7Confident26 Ų2658.4 Ų58.410%0.09830%0.304CS..Hα-helixtrans-58.6-44.8177.4-75.9-170111.5142.422.3112F39 F55 E56 E57 V62 S63 E93 F97 T133F39-R59 HydrophobicContact CE1-CG 3.6Å; F39-R59 HydrophobicContact CZ-CG 3.86Å; F55-R59 HydrophobicContact CE1-CG 4.25Å; F55-R59 HydrophobicContact CE2-CG 4.4Å; F55-R59 HydrophobicContact CZ-CG 4.17Å; F55-R59 VanDerWaalsContact O-CG 3.3Å; F55-R59 WeakPolarHBondContact O-CG 3.39Å; F55-R59 PolarHBondContact O-N 3Å; E56-R59 WeakPolarHBondContact O-CB 3.43Å; E56-R59 PolarHBondContact O-N 3.3Å; E57-R59 VanDerWaalsContact C-N 3.35Å; E57-R59 PolarHBondContact O-N 2.87Å; R59-V62 PolarHBondContact O-N 3.16Å; R59-S63 WeakPolarHBondContact O-CB 3.18Å; R59-S63 PolarHBondContact O-N 3.25Å; R59-E93 IonicContact CZ-OE1 3.16Å; R59-E93 IonicContact CZ-OE2 3.14Å; R59-E93 IonicContact NH1-OE1 3Å; R59-E93 PolarHBondContact NH1-OE1 3.31Å; R59-E93 IonicContact NH2-OE1 3.21Å; R59-E93 PolarHBondContact NH2-OE1 2.99Å; R59-E93 IonicContact NH2-OE2 2.65Å; R59-E93 PolarHBondContact NH2-OE2 3.5Å; R59-F97 HydrophobicContact CB-CE2 3.78Å; R59-F97 HydrophobicContact CB-CZ 3.9Å; R59-F97 HydrophobicContact CG-CE2 3.98Å; R59-F97 HydrophobicContact CG-CZ 4.16Å; R59-F97 VanDerWaalsContact NH2-CB 3.3Å; R59-F97 VanDerWaalsContact O-CZ 3.31Å; R59-F97 WeakPolarHBondContact O-CZ 3.12Å; R59-T133 PolarHBondContact NH1-OG1 3.01Å
60L82.8Confident75.6Confident113 Ų11357.2 Ų57.259%0.59230%0.296SS*.Hα-helixtrans-59-49.9177.5-73.2168.9000110.8E56 E57 F58 V62 S63 E64E56-L60 WeakPolarHBondContact O-CG 3.42Å; E56-L60 PolarHBondContact O-N 3.4Å; E57-L60 PolarHBondContact O-N 3.23Å; F58-L60 VanDerWaalsContact C-N 3.34Å; F58-L60 PolarHBondContact O-N 3.18Å; L60-V62 VanDerWaalsContact C-N 3.33Å; L60-V62 PolarHBondContact O-N 2.76Å; L60-S63 WeakPolarHBondContact O-CB 3.48Å; L60-S63 PolarHBondContact O-N 3.07Å; L60-E64 WeakPolarHBondContact O-CG 3.38Å; L60-E64 PolarHBondContact O-N 2.93Å
61K81.4Confident77.3Confident59 Ų5956.8 Ų56.826%0.25728%0.283SS..Hα-helixtrans-58.8-42.4176.5-73.4175-175.2168.60112.3E57 F58 E64 I65E57-K61 WeakPolarHBondContact O-CG 3.42Å; E57-K61 PolarHBondContact O-N 3.32Å; E57-K61 VanDerWaalsContact OE1-CE 3.26Å; E57-K61 WeakPolarHBondContact OE1-CE 3.46Å; E57-K61 IonicContact OE1-NZ 2.63Å; E57-K61 PolarHBondContact OE1-NZ 3.2Å; F58-K61 PolarHBondContact O-N 3.26Å; K61-E64 PolarHBondContact O-N 3.03Å; K61-I65 WeakPolarHBondContact O-CD1 3.48Å; K61-I65 VanDerWaalsContact O-CG1 3.26Å; K61-I65 WeakPolarHBondContact O-CG1 3.27Å; K61-I65 PolarHBondContact O-N 3.34Å
62V82.4Confident78.4Confident3 Ų353.6 Ų53.62%0.01827%0.266CS..Hα-helixtrans-64.9-42.2175.3177.60000111.3L35 F39 F58 R59 L60 E64 I65 I66 F97L35-V62 HydrophobicContact CD1-CG1 3.71Å; L35-V62 HydrophobicContact CD2-CB 4.1Å; L35-V62 HydrophobicContact CD2-CG1 3.54Å; L35-V62 HydrophobicContact CD2-CG2 3.42Å; L35-V62 VanDerWaalsContact CD2-CG2 3.42Å; L35-V62 HydrophobicContact CG-CG1 4.22Å; F39-V62 HydrophobicContact CE2-CB 4.09Å; F39-V62 HydrophobicContact CE2-CG1 3.9Å; F39-V62 HydrophobicContact CE2-CG2 3.96Å; F39-V62 HydrophobicContact CZ-CB 4.34Å; F39-V62 HydrophobicContact CZ-CG2 4.34Å; F58-V62 HydrophobicContact CD1-CG2 4.49Å; F58-V62 HydrophobicContact CD2-CG2 4Å; F58-V62 HydrophobicContact CE1-CG2 4.05Å; F58-V62 HydrophobicContact CE2-CG2 3.54Å; F58-V62 HydrophobicContact CG-CG2 4.49Å; F58-V62 HydrophobicContact CZ-CG2 3.57Å; F58-V62 WeakPolarHBondContact O-CG2 3.33Å; F58-V62 PolarHBondContact O-N 3.28Å; R59-V62 PolarHBondContact O-N 3.16Å; L60-V62 VanDerWaalsContact C-N 3.33Å; L60-V62 PolarHBondContact O-N 2.76Å; V62-E64 VanDerWaalsContact C-N 3.28Å; V62-E64 PolarHBondContact O-N 3.43Å; V62-I65 PolarHBondContact O-N 2.65Å; V62-I66 HydrophobicContact CG1-CG1 3.9Å; V62-I66 WeakPolarHBondContact O-CB 3.45Å; V62-I66 VanDerWaalsContact O-CG1 3.32Å; V62-I66 WeakPolarHBondContact O-CG1 3.44Å; V62-I66 PolarHBondContact O-N 2.78Å; V62-F97 HydrophobicContact CB-CE1 4.21Å; V62-F97 HydrophobicContact CB-CZ 4.43Å; V62-F97 HydrophobicContact CG1-CE1 3.96Å
63S86Confident79.4Confident16 Ų1649.4 Ų49.411%0.11224%0.244CC..Hα-helixtrans-60.4-40.8178.61780000111.6R59 L60 K67 C101R59-S63 WeakPolarHBondContact O-CB 3.18Å; R59-S63 PolarHBondContact O-N 3.25Å; L60-S63 WeakPolarHBondContact O-CB 3.48Å; L60-S63 PolarHBondContact O-N 3.07Å; S63-K67 WeakPolarHBondContact O-CB 3.31Å; S63-K67 WeakPolarHBondContact O-CD 3.48Å; S63-K67 WeakPolarHBondContact O-CG 3.04Å; S63-K67 PolarHBondContact O-N 2.61Å; S63-K67 WeakPolarHBondContact OG-CE 3.31Å; S63-K67 PolarHBondContact OG-NZ 2.95Å; S63-C101 PolarHBondContact OG-SG 3.23Å
64E85.7Confident80.1Confident118 Ų11848.1 Ų48.155%0.55124%0.24SC*.Hα-helixtrans-62.4-53.1176.1-71.6174.1167.400110.4L60 K61 V62 I66 K67 D68L60-E64 WeakPolarHBondContact O-CG 3.38Å; L60-E64 PolarHBondContact O-N 2.93Å; K61-E64 PolarHBondContact O-N 3.03Å; V62-E64 VanDerWaalsContact C-N 3.28Å; V62-E64 PolarHBondContact O-N 3.43Å; E64-I66 VanDerWaalsContact C-N 3.32Å; E64-I66 PolarHBondContact O-N 3.28Å; E64-K67 WeakPolarHBondContact O-CB 3.21Å; E64-K67 PolarHBondContact O-N 2.82Å; E64-K67 VanDerWaalsContact O-N 3.09Å; E64-D68 PolarHBondContact O-N 3.01Å
65I82.1Confident80.9Confident25 Ų2544.6 Ų44.613%0.12822%0.222CC..Hα-helixtrans-59-45.1-179.8-61.6162.2000110.9W8 F31 K61 V62 K67 D68 V69W8-I65 HydrophobicContact CB-CG2 3.86Å; W8-I65 HydrophobicContact CG-CG2 4.22Å; F31-I65 HydrophobicContact CE1-CG2 4.01Å; F31-I65 HydrophobicContact CE2-CG2 4.35Å; F31-I65 HydrophobicContact CZ-CB 4.46Å; F31-I65 HydrophobicContact CZ-CG2 3.42Å; F31-I65 VanDerWaalsContact CZ-CG2 3.42Å; K61-I65 WeakPolarHBondContact O-CD1 3.48Å; K61-I65 VanDerWaalsContact O-CG1 3.26Å; K61-I65 WeakPolarHBondContact O-CG1 3.27Å; K61-I65 PolarHBondContact O-N 3.34Å; V62-I65 PolarHBondContact O-N 2.65Å; I65-K67 VanDerWaalsContact C-N 3.33Å; I65-K67 PolarHBondContact O-N 3.39Å; I65-D68 PolarHBondContact O-N 2.94Å; I65-D68 VanDerWaalsContact O-N 3.14Å; I65-V69 HydrophobicContact CG2-CG1 4.48Å; I65-V69 HydrophobicContact CG2-CG2 4.36Å; I65-V69 WeakPolarHBondContact O-CG2 3.3Å; I65-V69 PolarHBondContact O-N 3.4Å
66I84.2Confident81.5Confident0 Ų046.3 Ų46.30%023%0.232CC..Hα-helixtrans-61.3-42.6178.5-72.9-72.1000111.2F31 V32 L35 V62 E64 D68 V69 V70 L98 C101 V102F31-I66 HydrophobicContact CE1-CD1 3.91Å; V32-I66 HydrophobicContact CG2-CD1 4.26Å; L35-I66 HydrophobicContact CD1-CD1 3.63Å; L35-I66 HydrophobicContact CD1-CG1 3.92Å; V62-I66 HydrophobicContact CG1-CG1 3.9Å; V62-I66 WeakPolarHBondContact O-CB 3.45Å; V62-I66 VanDerWaalsContact O-CG1 3.32Å; V62-I66 WeakPolarHBondContact O-CG1 3.44Å; V62-I66 PolarHBondContact O-N 2.78Å; E64-I66 VanDerWaalsContact C-N 3.32Å; E64-I66 PolarHBondContact O-N 3.28Å; I66-D68 PolarHBondContact O-N 3.48Å; I66-V69 PolarHBondContact O-N 3.02Å; I66-V70 VanDerWaalsContact O-CB 3.23Å; I66-V70 WeakPolarHBondContact O-CB 3.39Å; I66-V70 PolarHBondContact O-N 3.32Å; I66-L98 HydrophobicContact CD1-CD2 4.02Å; I66-L98 HydrophobicContact CG1-CD2 3.96Å; I66-C101 HydrophobicContact CB-CB 4.33Å; I66-C101 HydrophobicContact CG2-CB 3.75Å; I66-V102 HydrophobicContact CG2-CG1 3.54Å
67K84.6Confident81.9Confident101 Ų10148.4 Ų48.444%0.43924%0.24SC..Hα-helixtrans-62.8-34.1176.5-76.5168.4179.3168.20111.7S63 E64 I65 C101S63-K67 WeakPolarHBondContact O-CB 3.31Å; S63-K67 WeakPolarHBondContact O-CD 3.48Å; S63-K67 WeakPolarHBondContact O-CG 3.04Å; S63-K67 PolarHBondContact O-N 2.61Å; S63-K67 WeakPolarHBondContact OG-CE 3.31Å; S63-K67 PolarHBondContact OG-NZ 2.95Å; E64-K67 WeakPolarHBondContact O-CB 3.21Å; E64-K67 PolarHBondContact O-N 2.82Å; E64-K67 VanDerWaalsContact O-N 3.09Å; I65-K67 VanDerWaalsContact C-N 3.33Å; I65-K67 PolarHBondContact O-N 3.39Å; K67-C101 VanDerWaalsContact CE-O 3.27Å; K67-C101 WeakPolarHBondContact CE-O 3.38Å; K67-C101 WeakPolarHBondContact CG-O 3.33Å
68D80.2Confident82.2Confident82 Ų8244 Ų4444%0.43922%0.22SC..Hα-helixtrans-75.9-33.3178.2-68.7-14.5000113.3E64 I65 I66 F71E64-D68 PolarHBondContact O-N 3.01Å; I65-D68 PolarHBondContact O-N 2.94Å; I65-D68 VanDerWaalsContact O-N 3.14Å; I66-D68 PolarHBondContact O-N 3.48Å; D68-F71 WeakPolarHBondContact O-CD1 3.44Å; D68-F71 WeakPolarHBondContact O-CE1 3.32Å
69V79.6Confident82.6Confident4 Ų443.6 Ų43.62%0.02422%0.217CC..Hα-helixtrans-101.6-12.7-175-65.10000114.7F28 F31 I65 I66 F71 I72F28-V69 HydrophobicContact CD2-CB 4.24Å; F28-V69 HydrophobicContact CD2-CG2 4.04Å; F28-V69 HydrophobicContact CE2-CB 4Å; F28-V69 HydrophobicContact CE2-CG2 3.49Å; F28-V69 VanDerWaalsContact CE2-CG2 3.49Å; F28-V69 WeakPolarHBondContact CE2-O 3.12Å; F31-V69 HydrophobicContact CD1-CG2 4.15Å; F31-V69 HydrophobicContact CE1-CG2 3.68Å; I65-V69 HydrophobicContact CG2-CG1 4.48Å; I65-V69 HydrophobicContact CG2-CG2 4.36Å; I65-V69 WeakPolarHBondContact O-CG2 3.3Å; I65-V69 PolarHBondContact O-N 3.4Å; I66-V69 PolarHBondContact O-N 3.02Å; V69-F71 PolarHBondContact O-N 3.06Å; V69-I72 HydrophobicContact CB-CD1 4.13Å; V69-I72 WeakPolarHBondContact O-CB 3.38Å; V69-I72 WeakPolarHBondContact O-CD1 3.49Å; V69-I72 WeakPolarHBondContact O-CG1 3.47Å; V69-I72 PolarHBondContact O-N 2.86Å; V69-I72 VanDerWaalsContact O-N 3.13Å
70V82.5Confident82.7Confident5 Ų548 Ų483%0.0324%0.239CC..G310 helixtrans-60.3-24.8-173.966.60000113.2I66 I72 I73 G74 L78 V102I66-V70 VanDerWaalsContact O-CB 3.23Å; I66-V70 WeakPolarHBondContact O-CB 3.39Å; I66-V70 PolarHBondContact O-N 3.32Å; V70-I72 PolarHBondContact O-N 3.34Å; V70-I72 VanDerWaalsContact O-N 3.08Å; V70-I73 PolarHBondContact O-N 2.95Å; V70-G74 WeakPolarHBondContact O-CA 3.23Å; V70-G74 PolarHBondContact O-N 3.3Å; V70-L78 HydrophobicContact CG2-CD2 3.89Å; V70-V102 HydrophobicContact CB-CG1 4.06Å; V70-V102 HydrophobicContact CG1-CG1 4.3Å; V70-V102 HydrophobicContact CG2-CB 4.26Å; V70-V102 HydrophobicContact CG2-CG1 3.75Å
71F79.2Confident82.7Confident96 Ų9645.2 Ų45.242%0.42122%0.223SC..G310 helixtrans-56.7-27.2178.574.9-94000112.9Y16 D68 V69 I73Y16-F71 HydrophobicContact CD2-CD2 4.12Å; Y16-F71 AromaticContact CD2-CE2 3.54Å; Y16-F71 HydrophobicContact CD2-CE2 3.54Å; Y16-F71 AromaticContact CD2-CZ 3.79Å; Y16-F71 HydrophobicContact CD2-CZ 3.79Å; Y16-F71 HydrophobicContact CE2-CE2 4.48Å; Y16-F71 HydrophobicContact CG-CE2 4.3Å; Y16-F71 HydrophobicContact CG-CZ 4.34Å; D68-F71 WeakPolarHBondContact O-CD1 3.44Å; D68-F71 WeakPolarHBondContact O-CE1 3.32Å; V69-F71 PolarHBondContact O-N 3.06Å; F71-I73 VanDerWaalsContact C-N 3.31Å; F71-I73 PolarHBondContact O-N 3.09Å
72I74.9Confident82.7Confident24 Ų2442.7 Ų42.712%0.12321%0.213CC..G310 helixtrans-60.1-39.6-179.2-67.5162000111.9L15 N24 F28 V69 V70L15-I72 HydrophobicContact CB-CD1 4.09Å; L15-I72 HydrophobicContact CB-CG1 4.5Å; L15-I72 HydrophobicContact CD1-CD1 3.52Å; L15-I72 HydrophobicContact CG-CD1 4.49Å; N24-I72 HydrophobicContact CB-CG2 3.6Å; N24-I72 WeakPolarHBondContact O-CG2 3.4Å; F28-I72 HydrophobicContact CB-CG2 4.09Å; F28-I72 HydrophobicContact CD2-CB 4.35Å; F28-I72 HydrophobicContact CD2-CD1 4.4Å; V69-I72 HydrophobicContact CB-CD1 4.13Å; V69-I72 WeakPolarHBondContact O-CB 3.38Å; V69-I72 WeakPolarHBondContact O-CD1 3.49Å; V69-I72 WeakPolarHBondContact O-CG1 3.47Å; V69-I72 PolarHBondContact O-N 2.86Å; V69-I72 VanDerWaalsContact O-N 3.13Å; V70-I72 PolarHBondContact O-N 3.34Å; V70-I72 VanDerWaalsContact O-N 3.08Å
73I79.3Confident82.6Confident15 Ų1544.1 Ų44.18%0.07722%0.219CC..THydrogen-bonded Turntrans-102.5-30.6176.6-82.5-166.8000112A25 F28 R29 V70 F71 K77 L78A25-I73 HydrophobicContact CB-CD1 4.15Å; A25-I73 HydrophobicContact CB-CG1 3.91Å; F28-I73 HydrophobicContact CB-CD1 4.21Å; F28-I73 HydrophobicContact CB-CG1 4.26Å; F28-I73 HydrophobicContact CD1-CB 4.2Å; F28-I73 HydrophobicContact CD1-CD1 3.4Å; F28-I73 VanDerWaalsContact CD1-CD1 3.4Å; F28-I73 HydrophobicContact CD1-CG1 3.81Å; F28-I73 HydrophobicContact CE1-CB 4.36Å; F28-I73 HydrophobicContact CE1-CD1 4.11Å; F28-I73 HydrophobicContact CE1-CG1 4.44Å; F28-I73 HydrophobicContact CG-CD1 4.12Å; F28-I73 HydrophobicContact CG-CG1 4.17Å; R29-I73 HydrophobicContact CG-CD1 4.16Å; V70-I73 PolarHBondContact O-N 2.95Å; F71-I73 VanDerWaalsContact C-N 3.31Å; F71-I73 PolarHBondContact O-N 3.09Å; I73-K77 HydrophobicContact CG2-CB 3.66Å; I73-K77 WeakPolarHBondContact O-CD 3.42Å; I73-L78 HydrophobicContact CG2-CB 4.38Å
74G83Confident82.3Confident28 Ų2849.3 Ų49.329%0.28924%0.242SC..  trans88.7136.5-170.200000112.6V70 N76 K77 L78V70-G74 WeakPolarHBondContact O-CA 3.23Å; V70-G74 PolarHBondContact O-N 3.3Å; G74-N76 VanDerWaalsContact C-N 3.34Å; G74-N76 PolarHBondContact O-N 3.36Å; G74-K77 PolarHBondContact O-N 3.4Å; G74-L78 PolarHBondContact O-N 3.08Å; G74-L78 VanDerWaalsContact O-N 3.15Å
75S86.8Confident81.8Confident18 Ų1851.1 Ų51.113%0.12626%0.255CS..Hα-helixtrans-57.3-41.2-173.1-48.70000113.7K77 L78 L79 N105S75-K77 PolarHBondContact O-N 2.91Å; S75-L78 PolarHBondContact O-N 3.07Å; S75-L79 WeakPolarHBondContact O-CB 3.41Å; S75-L79 VanDerWaalsContact O-CG 3.27Å; S75-L79 WeakPolarHBondContact O-CG 3.3Å; S75-L79 PolarHBondContact O-N 3.07Å; S75-N105 WeakPolarHBondContact OG-CB 3.41Å
76N85.6Confident81.6Confident48 Ų4852.8 Ų52.826%0.25726%0.262SS..Hα-helixtrans-64.3-42.8-179.5-66-14.6000112G74 L78 L79 E80 S106G74-N76 VanDerWaalsContact C-N 3.34Å; G74-N76 PolarHBondContact O-N 3.36Å; N76-L78 VanDerWaalsContact C-N 3.34Å; N76-L78 PolarHBondContact O-N 3.36Å; N76-L79 PolarHBondContact O-N 3.29Å; N76-E80 WeakPolarHBondContact O-CG 3.1Å; N76-E80 PolarHBondContact O-N 2.96Å; N76-S106 PolarHBondContact OD1-OG 3.13Å; N76-S106 VanDerWaalsContact OD1-OG 3.09Å
77K82.7Confident81.2Confident130 Ų13060.5 Ų60.557%0.56530%0.298SS*.Hα-helixtrans-65.8-38.3177.6-71.7-171.4-169.3163.90111.5I73 G74 S75 Q81I73-K77 HydrophobicContact CG2-CB 3.66Å; I73-K77 WeakPolarHBondContact O-CD 3.42Å; G74-K77 PolarHBondContact O-N 3.4Å; S75-K77 PolarHBondContact O-N 2.91Å; K77-Q81 WeakPolarHBondContact O-CG 3.08Å; K77-Q81 PolarHBondContact O-N 2.98Å; K77-Q81 VanDerWaalsContact O-N 3.12Å
78L84.3Confident80.9Confident4 Ų457.4 Ų57.42%0.02130%0.295CS..Hα-helixtrans-66-44.5175.4-179.857.5000111.2F28 V70 I73 G74 S75 N76 E80 Q81 L82 V102F28-L78 HydrophobicContact CE1-CD1 4.13Å; F28-L78 HydrophobicContact CE1-CD2 4.14Å; F28-L78 HydrophobicContact CZ-CD2 4Å; V70-L78 HydrophobicContact CG2-CD2 3.89Å; I73-L78 HydrophobicContact CG2-CB 4.38Å; G74-L78 PolarHBondContact O-N 3.08Å; G74-L78 VanDerWaalsContact O-N 3.15Å; S75-L78 PolarHBondContact O-N 3.07Å; N76-L78 VanDerWaalsContact C-N 3.34Å; N76-L78 PolarHBondContact O-N 3.36Å; L78-E80 PolarHBondContact O-N 3.19Å; L78-Q81 PolarHBondContact O-N 2.96Å; L78-L82 HydrophobicContact CD1-CD1 3.87Å; L78-L82 HydrophobicContact CD1-CD2 4.48Å; L78-L82 HydrophobicContact CD1-CG 3.94Å; L78-L82 HydrophobicContact CD2-CD1 4.44Å; L78-L82 HydrophobicContact CG-CD1 3.79Å; L78-L82 HydrophobicContact CG-CG 4.29Å; L78-L82 WeakPolarHBondContact O-CG 3.4Å; L78-L82 PolarHBondContact O-N 3.04Å; L78-V102 HydrophobicContact CD2-CG1 4.11Å; L78-V102 HydrophobicContact CD2-CG2 4.25Å
79L86.1Confident80.8Confident0 Ų056.8 Ų56.80%029%0.286CS..Hα-helixtrans-56.7-48.6175-74168.9000111.1S75 N76 Q81 L82 M83 M99 V102 V103 A111S75-L79 WeakPolarHBondContact O-CB 3.41Å; S75-L79 VanDerWaalsContact O-CG 3.27Å; S75-L79 WeakPolarHBondContact O-CG 3.3Å; S75-L79 PolarHBondContact O-N 3.07Å; N76-L79 PolarHBondContact O-N 3.29Å; L79-Q81 VanDerWaalsContact C-N 3.29Å; L79-Q81 PolarHBondContact O-N 3.01Å; L79-L82 PolarHBondContact O-N 2.63Å; L79-M83 HydrophobicContact CB-CE 4.28Å; L79-M83 VanDerWaalsContact O-CB 3.31Å; L79-M83 WeakPolarHBondContact O-CB 3.32Å; L79-M83 WeakPolarHBondContact O-CG 3.34Å; L79-M83 PolarHBondContact O-N 3.45Å; L79-M99 HydrophobicContact CD2-CB 3.95Å; L79-M99 HydrophobicContact CD2-CE 4.37Å; L79-M99 HydrophobicContact CD2-CG 3.94Å; L79-V102 HydrophobicContact CD2-CG2 3.89Å; L79-V102 HydrophobicContact CG-CG2 4.01Å; L79-V103 HydrophobicContact CD2-CB 4.36Å; L79-A111 HydrophobicContact CD1-CB 4.22Å
80E82.8Confident80.7Confident119 Ų11958.2 Ų58.256%0.55629%0.293SS*.Hα-helixtrans-57.9-38.5176.9-74.8173.7-175.500113.1N76 L78N76-E80 WeakPolarHBondContact O-CG 3.1Å; N76-E80 PolarHBondContact O-N 2.96Å; L78-E80 PolarHBondContact O-N 3.19Å
81Q82.6Confident80.4Confident55 Ų5560.6 Ų60.626%0.25731%0.305SS..Hα-helixtrans-71.3-39.8177.2-73.3173.915.200112.6K77 L78 L79 M83 Q84K77-Q81 WeakPolarHBondContact O-CG 3.08Å; K77-Q81 PolarHBondContact O-N 2.98Å; K77-Q81 VanDerWaalsContact O-N 3.12Å; L78-Q81 PolarHBondContact O-N 2.96Å; L79-Q81 VanDerWaalsContact C-N 3.29Å; L79-Q81 PolarHBondContact O-N 3.01Å; Q81-M83 VanDerWaalsContact C-N 3.27Å; Q81-M83 PolarHBondContact O-N 3.4Å; Q81-Q84 PolarHBondContact O-N 3.45Å
82L82.9Confident80.5Confident6 Ų657.6 Ų57.63%0.03129%0.293CS..Hα-helixtrans-71.7-25.5178-66.5173.1000111.9L78 L79 Q84 A95 L98 M99 F117L78-L82 HydrophobicContact CD1-CD1 3.87Å; L78-L82 HydrophobicContact CD1-CD2 4.48Å; L78-L82 HydrophobicContact CD1-CG 3.94Å; L78-L82 HydrophobicContact CD2-CD1 4.44Å; L78-L82 HydrophobicContact CG-CD1 3.79Å; L78-L82 HydrophobicContact CG-CG 4.29Å; L78-L82 WeakPolarHBondContact O-CG 3.4Å; L78-L82 PolarHBondContact O-N 3.04Å; L79-L82 PolarHBondContact O-N 2.63Å; L82-Q84 VanDerWaalsContact C-N 3.27Å; L82-Q84 PolarHBondContact O-N 3.41Å; L82-A95 HydrophobicContact CD2-CB 4.42Å; L82-L98 HydrophobicContact CD1-CB 3.58Å; L82-L98 HydrophobicContact CD2-CB 4.35Å; L82-L98 HydrophobicContact CD2-CD1 4.05Å; L82-M99 HydrophobicContact CB-CG 3.6Å; L82-M99 HydrophobicContact CB-SD 3.9Å; L82-M99 HydrophobicContact CD1-CG 3.65Å; L82-M99 HydrophobicContact CG-CG 4.28Å; L82-F117 WeakPolarHBondContact O-CE2 3.21Å; L82-F117 WeakPolarHBondContact O-CZ 3.21Å
83M80.1Confident80.8Confident33 Ų3356.4 Ų56.416%0.16329%0.287CS..THydrogen-bonded Turntrans-74.9-3.9174.8-72.4175.5-178.300115.8L79 Q81 M99 A111 P114 F117L79-M83 HydrophobicContact CB-CE 4.28Å; L79-M83 VanDerWaalsContact O-CB 3.31Å; L79-M83 WeakPolarHBondContact O-CB 3.32Å; L79-M83 WeakPolarHBondContact O-CG 3.34Å; L79-M83 PolarHBondContact O-N 3.45Å; Q81-M83 VanDerWaalsContact C-N 3.27Å; Q81-M83 PolarHBondContact O-N 3.4Å; M83-M99 HydrophobicContact CE-CE 3.7Å; M83-M99 HydrophobicContact CG-CE 3.81Å; M83-A111 WeakPolarHBondContact CE-O 3.43Å; M83-P114 HydrophobicContact CE-CB 3.54Å; M83-P114 HydrophobicContact CE-CG 3.84Å; M83-P114 HydrophobicContact CG-CB 3.92Å; M83-P114 HydrophobicContact SD-CB 3.8Å; M83-F117 VanDerWaalsContact CA-CE2 3.46Å; M83-F117 HydrophobicContact CB-CD2 4.4Å; M83-F117 HydrophobicContact CB-CE2 4.21Å; M83-F117 HydrophobicContact CG-CD2 4.04Å; M83-F117 HydrophobicContact CG-CE2 3.98Å
84Q79.5Confident81Confident124 Ų12455.7 Ų55.758%0.57928%0.284SS*.SBendtrans-72.4150.5173.6-63-178.9-600111.1Q81 L82 K86Q81-Q84 PolarHBondContact O-N 3.45Å; L82-Q84 VanDerWaalsContact C-N 3.27Å; L82-Q84 PolarHBondContact O-N 3.41Å; Q84-K86 WeakPolarHBondContact O-CE 3.4Å; Q84-K86 WeakPolarHBondContact O-CG 3.33Å; Q84-K86 PolarHBondContact O-N 3.05Å
85D75.2Confident81Confident156 Ų15654.4 Ų54.483%0.83427%0.27SS*.  trans-50.7129.1-176.7-67.2-30.8000112.3
86K77Confident80.9Confident60 Ų6053.5 Ų53.526%0.26126%0.264SS..  trans-117.4143.2178.2-56.9-57.6177.9-176.30109.4Q84 N91 I92 A95Q84-K86 WeakPolarHBondContact O-CE 3.4Å; Q84-K86 WeakPolarHBondContact O-CG 3.33Å; Q84-K86 PolarHBondContact O-N 3.05Å; K86-N91 HydrophobicContact CB-CB 3.95Å; K86-N91 HydrophobicContact CG-CB 4.5Å; K86-I92 HydrophobicContact CB-CG1 3.88Å; K86-A95 HydrophobicContact CG-CB 4.42Å
87Q77.3Confident81Confident162 Ų16252 Ų5276%0.75726%0.255SS*.  trans-103.8132.6175.2-68.7-66.6-28.200109.5N91Q87-N91 WeakPolarHBondContact O-CB 3.24Å; Q87-N91 PolarHBondContact O-ND2 2.93Å
88G77.6Confident81.2Confident37 Ų3745.9 Ų45.938%0.38123%0.228SC..SBendtrans84.5144.1-177.400000113.4E90 N91 I92G88-E90 WeakPolarHBondContact CA-OE2 3.43Å; G88-E90 PolarHBondContact O-N 3.32Å; G88-N91 PolarHBondContact O-N 2.93Å; G88-I92 WeakPolarHBondContact O-CG1 3.39Å; G88-I92 PolarHBondContact O-N 3.23Å
89W77.5Confident81.4Confident69 Ų6945.7 Ų45.726%0.26123%0.227SC..Hα-helixtrans-63.3-25-176.968.3-90.3000111.8I43 I92 E93 V126 P127 L130I43-W89 HydrophobicContact CG2-CH2 3.6Å; I43-W89 HydrophobicContact CG2-CZ3 4.22Å; W89-I92 PolarHBondContact O-N 3.41Å; W89-E93 HydrophobicContact CE3-CB 4.38Å; W89-E93 VanDerWaalsContact O-CB 3.24Å; W89-E93 WeakPolarHBondContact O-CB 3.24Å; W89-E93 PolarHBondContact O-N 2.79Å; W89-V126 HydrophobicContact CB-CG1 4.18Å; W89-P127 HydrophobicContact CD2-CG 3.56Å; W89-P127 VanDerWaalsContact CE2-CG 3.48Å; W89-P127 HydrophobicContact CE3-CB 4.19Å; W89-P127 HydrophobicContact CE3-CG 3.72Å; W89-P127 HydrophobicContact CG-CG 4.31Å; W89-P127 HydrophobicContact CH2-CB 4.14Å; W89-P127 HydrophobicContact CH2-CG 3.77Å; W89-P127 HydrophobicContact CZ2-CB 4.46Å; W89-P127 HydrophobicContact CZ2-CG 3.62Å; W89-P127 HydrophobicContact CZ3-CB 3.99Å; W89-P127 HydrophobicContact CZ3-CG 3.82Å; W89-L130 HydrophobicContact CB-CD2 3.98Å; W89-L130 HydrophobicContact CE3-CB 4.39Å
90E77Confident81.6Confident33 Ų3346.1 Ų46.115%0.15423%0.231CC..Hα-helixtrans-77.7-38-174.2-50.199.2145.600111.4F40 F44 G88 I92 E93 C94F40-E90 HydrophobicContact CD1-CB 4.25Å; F40-E90 HydrophobicContact CE1-CB 3.33Å; F40-E90 HydrophobicContact CE1-CG 4.36Å; F40-E90 HydrophobicContact CZ-CB 3.61Å; F44-E90 HydrophobicContact CE1-CG 3.96Å; F44-E90 VanDerWaalsContact CE1-OE1 3.27Å; F44-E90 WeakPolarHBondContact CE1-OE1 3.43Å; F44-E90 HydrophobicContact CE2-CB 3.6Å; F44-E90 HydrophobicContact CE2-CG 3.44Å; F44-E90 VanDerWaalsContact CE2-CG 3.44Å; F44-E90 HydrophobicContact CZ-CB 3.62Å; F44-E90 HydrophobicContact CZ-CG 3.08Å; F44-E90 WeakPolarHBondContact CZ-OE1 3.46Å; G88-E90 WeakPolarHBondContact CA-OE2 3.43Å; G88-E90 PolarHBondContact O-N 3.32Å; E90-I92 VanDerWaalsContact C-N 3.31Å; E90-E93 PolarHBondContact O-N 3.4Å; E90-C94 VanDerWaalsContact O-CB 3.31Å; E90-C94 WeakPolarHBondContact O-CB 3.42Å; E90-C94 PolarHBondContact O-N 2.82Å
91N77.9Confident82Confident55 Ų5540.7 Ų40.729%0.29421%0.206SC..Hα-helixtrans-69.2-37.1173.2-76.6-56000110.4F40 K86 Q87 G88 A95F40-N91 VanDerWaalsContact CE2-OD1 3.28Å; F40-N91 WeakPolarHBondContact CE2-OD1 3.33Å; F40-N91 HydrophobicContact CZ-CB 4.22Å; F40-N91 VanDerWaalsContact CZ-CG 3.46Å; F40-N91 WeakPolarHBondContact CZ-OD1 3.32Å; K86-N91 HydrophobicContact CB-CB 3.95Å; K86-N91 HydrophobicContact CG-CB 4.5Å; Q87-N91 WeakPolarHBondContact O-CB 3.24Å; Q87-N91 PolarHBondContact O-ND2 2.93Å; G88-N91 PolarHBondContact O-N 2.93Å; N91-A95 WeakPolarHBondContact O-CB 3.48Å; N91-A95 PolarHBondContact O-N 3.01Å
92I80.5Confident82.3Confident33 Ų3338.1 Ų38.117%0.16919%0.194CC..Hα-helixtrans-65.2-45.9174.5-63.3169.2000109.8K86 G88 W89 E90 A95 L96 F117 L130K86-I92 HydrophobicContact CB-CG1 3.88Å; G88-I92 WeakPolarHBondContact O-CG1 3.39Å; G88-I92 PolarHBondContact O-N 3.23Å; W89-I92 PolarHBondContact O-N 3.41Å; E90-I92 VanDerWaalsContact C-N 3.31Å; I92-A95 PolarHBondContact O-N 3.07Å; I92-L96 HydrophobicContact CG2-CD1 3.87Å; I92-L96 HydrophobicContact CG2-CG 4.38Å; I92-L96 WeakPolarHBondContact O-CB 3.4Å; I92-L96 WeakPolarHBondContact O-CG 3.22Å; I92-L96 PolarHBondContact O-N 2.89Å; I92-F117 HydrophobicContact CG2-CE1 4.14Å; I92-L130 HydrophobicContact CB-CD1 4.4Å; I92-L130 HydrophobicContact CG2-CD1 3.84Å; I92-L130 HydrophobicContact CG2-CD2 4.49Å
93E82.2Confident82.6Confident0 Ų037.8 Ų37.80%019%0.192CC..Hα-helixtrans-60.1-50.1179.6-161.8-81.5169.400111.2R59 W89 E90 A95 L96 F97 L130 T133R59-E93 IonicContact CZ-OE1 3.16Å; R59-E93 IonicContact CZ-OE2 3.14Å; R59-E93 IonicContact NH1-OE1 3Å; R59-E93 PolarHBondContact NH1-OE1 3.31Å; R59-E93 IonicContact NH2-OE1 3.21Å; R59-E93 PolarHBondContact NH2-OE1 2.99Å; R59-E93 IonicContact NH2-OE2 2.65Å; R59-E93 PolarHBondContact NH2-OE2 3.5Å; W89-E93 HydrophobicContact CE3-CB 4.38Å; W89-E93 VanDerWaalsContact O-CB 3.24Å; W89-E93 WeakPolarHBondContact O-CB 3.24Å; W89-E93 PolarHBondContact O-N 2.79Å; E90-E93 PolarHBondContact O-N 3.4Å; E93-A95 VanDerWaalsContact C-N 3.33Å; E93-A95 PolarHBondContact O-N 3.22Å; E93-L96 PolarHBondContact O-N 3.41Å; E93-F97 WeakPolarHBondContact O-CB 3.41Å; E93-F97 PolarHBondContact O-N 2.86Å; E93-L130 HydrophobicContact CB-CB 4.44Å; E93-L130 HydrophobicContact CB-CD1 3.85Å; E93-L130 HydrophobicContact CG-CB 4.21Å; E93-L130 HydrophobicContact CG-CD1 4.17Å; E93-T133 HydrophobicContact CG-CG2 4.46Å; E93-T133 WeakPolarHBondContact O-CG2 3.33Å; E93-T133 WeakPolarHBondContact OE1-CB 3.12Å; E93-T133 PolarHBondContact OE1-OG1 3.33Å
94C82.5Confident82.9Confident0 Ų037 Ų370%019%0.193CC..Hα-helixtrans-63.5-40.8179.1-170.90000111.5M36 F40 E90 F97 L98M36-C94 HydrophobicContact CE-CB 4.12Å; M36-C94 VanDerWaalsContact CG-SG 3.6Å; F40-C94 HydrophobicContact CE2-CB 4.44Å; E90-C94 VanDerWaalsContact O-CB 3.31Å; E90-C94 WeakPolarHBondContact O-CB 3.42Å; E90-C94 PolarHBondContact O-N 2.82Å; C94-F97 PolarHBondContact O-N 3.26Å; C94-L98 WeakPolarHBondContact O-CG 3.27Å; C94-L98 PolarHBondContact O-N 2.83Å
95A83.7Confident83.2Confident0 Ų035.4 Ų35.40%019%0.188CC..Hα-helixtrans-61.8-46.717500000111.4L82 K86 N91 I92 E93 F97 L98 M99 F117L82-A95 HydrophobicContact CD2-CB 4.42Å; K86-A95 HydrophobicContact CG-CB 4.42Å; N91-A95 WeakPolarHBondContact O-CB 3.48Å; N91-A95 PolarHBondContact O-N 3.01Å; I92-A95 PolarHBondContact O-N 3.07Å; E93-A95 VanDerWaalsContact C-N 3.33Å; E93-A95 PolarHBondContact O-N 3.22Å; A95-F97 VanDerWaalsContact C-N 3.32Å; A95-F97 PolarHBondContact O-N 3.24Å; A95-L98 PolarHBondContact O-N 2.85Å; A95-M99 WeakPolarHBondContact O-CB 3.32Å; A95-M99 WeakPolarHBondContact O-CG 3.46Å; A95-M99 PolarHBondContact O-N 3.25Å; A95-F117 HydrophobicContact CB-CZ 4.31Å
96L84.8Confident83.6Confident0 Ų028 Ų280%015%0.148CC..Hα-helixtrans-62.2-39178-75.2170000112.4I92 E93 M99 S100 I119 L130 T133 S134 F137I92-L96 HydrophobicContact CG2-CD1 3.87Å; I92-L96 HydrophobicContact CG2-CG 4.38Å; I92-L96 WeakPolarHBondContact O-CB 3.4Å; I92-L96 WeakPolarHBondContact O-CG 3.22Å; I92-L96 PolarHBondContact O-N 2.89Å; E93-L96 PolarHBondContact O-N 3.41Å; L96-M99 HydrophobicContact CD2-SD 4.45Å; L96-M99 PolarHBondContact O-N 3.41Å; L96-S100 PolarHBondContact O-N 3.4Å; L96-I119 HydrophobicContact CD2-CD1 4.08Å; L96-L130 HydrophobicContact CD1-CD1 3.62Å; L96-T133 HydrophobicContact CB-CG2 3.84Å; L96-S134 VanDerWaalsContact CD1-OG 3.31Å; L96-S134 WeakPolarHBondContact CD1-OG 3.37Å; L96-F137 HydrophobicContact CD2-CB 4.43Å; L96-F137 HydrophobicContact CD2-CD1 4.14Å; L96-F137 HydrophobicContact CD2-CG 4.2Å
97F87.2Confident83.5Confident16 Ų1630.9 Ų30.97%0.0717%0.171CC..Hα-helixtrans-62.1-47.4174.5172.4-100000111.9F39 R59 V62 E93 C94 A95 M99 S100 C101 T133F39-F97 AromaticContact CE1-CD1 3.93Å; F39-F97 HydrophobicContact CE1-CD1 3.93Å; F39-F97 HydrophobicContact CE1-CE1 4.05Å; F39-F97 HydrophobicContact CE1-CG 4.37Å; F39-F97 AromaticContact CE2-CD1 3.68Å; F39-F97 HydrophobicContact CE2-CD1 3.68Å; F39-F97 AromaticContact CE2-CE1 3.48Å; F39-F97 HydrophobicContact CE2-CE1 3.48Å; F39-F97 VanDerWaalsContact CE2-CE1 3.48Å; F39-F97 HydrophobicContact CE2-CZ 4.44Å; F39-F97 AromaticContact CZ-CD1 3.33Å; F39-F97 HydrophobicContact CZ-CD1 3.33Å; F39-F97 AromaticContact CZ-CE1 3.09Å; F39-F97 HydrophobicContact CZ-CE1 3.09Å; F39-F97 HydrophobicContact CZ-CE2 4.44Å; F39-F97 HydrophobicContact CZ-CG 4.15Å; F39-F97 AromaticContact CZ-CZ 3.71Å; F39-F97 HydrophobicContact CZ-CZ 3.71Å; R59-F97 HydrophobicContact CB-CE2 3.78Å; R59-F97 HydrophobicContact CB-CZ 3.9Å; R59-F97 HydrophobicContact CG-CE2 3.98Å; R59-F97 HydrophobicContact CG-CZ 4.16Å; R59-F97 VanDerWaalsContact NH2-CB 3.3Å; R59-F97 VanDerWaalsContact O-CZ 3.31Å; R59-F97 WeakPolarHBondContact O-CZ 3.12Å; V62-F97 HydrophobicContact CB-CE1 4.21Å; V62-F97 HydrophobicContact CB-CZ 4.43Å; V62-F97 HydrophobicContact CG1-CE1 3.96Å; E93-F97 WeakPolarHBondContact O-CB 3.41Å; E93-F97 PolarHBondContact O-N 2.86Å; C94-F97 PolarHBondContact O-N 3.26Å; A95-F97 VanDerWaalsContact C-N 3.32Å; A95-F97 PolarHBondContact O-N 3.24Å; F97-M99 VanDerWaalsContact C-N 3.28Å; F97-M99 PolarHBondContact O-N 3.15Å; F97-S100 PolarHBondContact O-N 3.34Å; F97-S100 PolarHBondContact O-OG 3.09Å; F97-C101 PolarHBondContact O-N 3.41Å; F97-C101 PolarHBondContact O-SG 3.32Å; F97-T133 HydrophobicContact CB-CG2 3.71Å; F97-T133 VanDerWaalsContact N-CG2 3.34Å
98L87.1Confident83.6Confident1 Ų126 Ų261%0.00515%0.15CC..Hα-helixtrans-65-36.3176.7-68.4174.6000111.6V32 M36 I66 L82 C94 A95 C101V32-L98 HydrophobicContact CG1-CD1 3.77Å; M36-L98 HydrophobicContact CG-CD1 3.78Å; M36-L98 HydrophobicContact SD-CD1 4.28Å; I66-L98 HydrophobicContact CD1-CD2 4.02Å; I66-L98 HydrophobicContact CG1-CD2 3.96Å; L82-L98 HydrophobicContact CD1-CB 3.58Å; L82-L98 HydrophobicContact CD2-CB 4.35Å; L82-L98 HydrophobicContact CD2-CD1 4.05Å; C94-L98 WeakPolarHBondContact O-CG 3.27Å; C94-L98 PolarHBondContact O-N 2.83Å; A95-L98 PolarHBondContact O-N 2.85Å; L98-C101 WeakPolarHBondContact O-CB 3.39Å; L98-C101 PolarHBondContact O-N 3.28Å
99M88.8Confident83.4Confident0 Ų028.2 Ų28.20%016%0.157CC..Hα-helixtrans-64.9-41.5174.8-69.3167.466.100111.5L79 L82 M83 A95 L96 F97 C101 V102 V103 P114 F117 F137L79-M99 HydrophobicContact CD2-CB 3.95Å; L79-M99 HydrophobicContact CD2-CE 4.37Å; L79-M99 HydrophobicContact CD2-CG 3.94Å; L82-M99 HydrophobicContact CB-CG 3.6Å; L82-M99 HydrophobicContact CB-SD 3.9Å; L82-M99 HydrophobicContact CD1-CG 3.65Å; L82-M99 HydrophobicContact CG-CG 4.28Å; M83-M99 HydrophobicContact CE-CE 3.7Å; M83-M99 HydrophobicContact CG-CE 3.81Å; A95-M99 WeakPolarHBondContact O-CB 3.32Å; A95-M99 WeakPolarHBondContact O-CG 3.46Å; A95-M99 PolarHBondContact O-N 3.25Å; L96-M99 HydrophobicContact CD2-SD 4.45Å; L96-M99 PolarHBondContact O-N 3.41Å; F97-M99 VanDerWaalsContact C-N 3.28Å; F97-M99 PolarHBondContact O-N 3.15Å; M99-C101 PolarHBondContact O-N 3.34Å; M99-V102 PolarHBondContact O-N 2.91Å; M99-V102 VanDerWaalsContact O-N 3.09Å; M99-V103 WeakPolarHBondContact O-CB 3.36Å; M99-V103 PolarHBondContact O-N 3.45Å; M99-P114 HydrophobicContact CE-CG 3.96Å; M99-F117 HydrophobicContact CE-CD2 4.07Å; M99-F117 HydrophobicContact CE-CE2 3.81Å; M99-F117 HydrophobicContact SD-CD2 4.28Å; M99-F117 HydrophobicContact SD-CE2 3.46Å; M99-F117 WeakPolarHBondContact SD-CE2 3.33Å; M99-F117 HydrophobicContact SD-CZ 4.07Å; M99-F137 HydrophobicContact CB-CD2 3.7Å; M99-F137 HydrophobicContact CB-CE2 3.72Å; M99-F137 HydrophobicContact CE-CD2 4.49Å; M99-F137 HydrophobicContact CE-CE2 3.75Å; M99-F137 HydrophobicContact CE-CZ 3.79Å
100S89.1Confident83.2Confident10 Ų1032.3 Ų32.37%0.0718%0.177CC..Hα-helixtrans-63-30178.371.70000111.9L96 F97 V102L96-S100 PolarHBondContact O-N 3.4Å; F97-S100 PolarHBondContact O-N 3.34Å; F97-S100 PolarHBondContact O-OG 3.09Å; S100-V102 VanDerWaalsContact C-N 3.26Å; S100-V102 PolarHBondContact O-N 3.21Å
101C90.7Very high83Confident5 Ų531.1 Ų31.13%0.03417%0.173CC..Hα-helixtrans-64.3-29175.8-61.20000113.2S63 I66 K67 F97 L98 M99S63-C101 PolarHBondContact OG-SG 3.23Å; I66-C101 HydrophobicContact CB-CB 4.33Å; I66-C101 HydrophobicContact CG2-CB 3.75Å; K67-C101 VanDerWaalsContact CE-O 3.27Å; K67-C101 WeakPolarHBondContact CE-O 3.38Å; K67-C101 WeakPolarHBondContact CG-O 3.33Å; F97-C101 PolarHBondContact O-N 3.41Å; F97-C101 PolarHBondContact O-SG 3.32Å; L98-C101 WeakPolarHBondContact O-CB 3.39Å; L98-C101 PolarHBondContact O-N 3.28Å; M99-C101 PolarHBondContact O-N 3.34Å
102V90Very high82.7Confident0 Ų029 Ų290%016%0.16CC..Hα-helixtrans-123-14-166.9-55.20000114.5I66 V70 L78 L79 M99 S100 G104 N105I66-V102 HydrophobicContact CG2-CG1 3.54Å; V70-V102 HydrophobicContact CB-CG1 4.06Å; V70-V102 HydrophobicContact CG1-CG1 4.3Å; V70-V102 HydrophobicContact CG2-CB 4.26Å; V70-V102 HydrophobicContact CG2-CG1 3.75Å; L78-V102 HydrophobicContact CD2-CG1 4.11Å; L78-V102 HydrophobicContact CD2-CG2 4.25Å; L79-V102 HydrophobicContact CD2-CG2 3.89Å; L79-V102 HydrophobicContact CG-CG2 4.01Å; M99-V102 PolarHBondContact O-N 2.91Å; M99-V102 VanDerWaalsContact O-N 3.09Å; S100-V102 VanDerWaalsContact C-N 3.26Å; S100-V102 PolarHBondContact O-N 3.21Å; V102-G104 PolarHBondContact O-N 3.18Å; V102-N105 WeakPolarHBondContact O-CB 3.22Å; V102-N105 PolarHBondContact O-N 3.12Å
103V89.9Confident82.2Confident0 Ų031.8 Ų31.80%017%0.172CC..G310 helixtrans-60.9-31.8-178.570.20000112.5L79 M99 N105 S106 R112 F137 E140 A141L79-V103 HydrophobicContact CD2-CB 4.36Å; M99-V103 WeakPolarHBondContact O-CB 3.36Å; M99-V103 PolarHBondContact O-N 3.45Å; V103-N105 PolarHBondContact O-N 3.15Å; V103-S106 WeakPolarHBondContact O-CB 3.34Å; V103-S106 PolarHBondContact O-N 3.32Å; V103-S106 VanDerWaalsContact O-N 3.07Å; V103-R112 HydrophobicContact CG2-CB 4.05Å; V103-R112 HydrophobicContact CG2-CG 4.02Å; V103-F137 HydrophobicContact CB-CD2 4.37Å; V103-F137 HydrophobicContact CB-CE2 3.87Å; V103-F137 HydrophobicContact CG1-CD2 4.18Å; V103-F137 HydrophobicContact CG1-CE2 4.12Å; V103-F137 HydrophobicContact CG2-CE2 3.81Å; V103-F137 HydrophobicContact CG2-CZ 4.28Å; V103-E140 HydrophobicContact CG1-CB 3.49Å; V103-E140 VanDerWaalsContact CG1-CB 3.49Å; V103-A141 HydrophobicContact CG1-CB 4.42Å; V103-A141 HydrophobicContact CG2-CB 3.92Å
104G85.8Confident81.2Confident17 Ų1732.4 Ų32.418%0.17518%0.176CC..G310 helixtrans-62.2-20173.500000114.3V102 K144V102-G104 PolarHBondContact O-N 3.18Å; G104-K144 WeakPolarHBondContact O-CD 3.45Å; G104-K144 WeakPolarHBondContact O-CE 3.37Å; G104-K144 WeakPolarHBondContact O-CG 3.45Å; G104-K144 PolarHBondContact O-NZ 3.31Å
105N86.3Confident80.1Confident90 Ų9041.3 Ų41.348%0.48121%0.211SC..G310 helixtrans-94.5-7177.7-65.4-13.6000112.6S75 V102 V103 V107S75-N105 WeakPolarHBondContact OG-CB 3.41Å; V102-N105 WeakPolarHBondContact O-CB 3.22Å; V102-N105 PolarHBondContact O-N 3.12Å; V103-N105 PolarHBondContact O-N 3.15Å; N105-V107 PolarHBondContact O-N 3.48Å
106S82.2Confident78.7Confident0 Ų048.8 Ų48.80%024%0.243CC..  trans-70.8126.1-179.41740000111.3N76 V103 D108 R112N76-S106 PolarHBondContact OD1-OG 3.13Å; N76-S106 VanDerWaalsContact OD1-OG 3.09Å; V103-S106 WeakPolarHBondContact O-CB 3.34Å; V103-S106 PolarHBondContact O-N 3.32Å; V103-S106 VanDerWaalsContact O-N 3.07Å; S106-D108 PolarHBondContact OG-N 3.2Å; S106-D108 PolarHBondContact OG-O 3.26Å; S106-R112 VanDerWaalsContact O-CZ 3.28Å; S106-R112 PolarHBondContact O-NE 3.47Å; S106-R112 PolarHBondContact O-NH2 3.48Å
107V75.3Confident77.2Confident121 Ų12150 Ų5073%0.73325%0.248SC*.  trans-86-17.6169.2-80.10000112.9N105 P109N105-V107 PolarHBondContact O-N 3.48Å; V107-P109 WeakPolarHBondContact O-CD 3.46Å
108D79.5Confident75.3Confident60 Ų6051.9 Ų51.932%0.32127%0.272SS..  trans-91113.2179.3-177.90.8000110.6S106 K110 A111 R112S106-D108 PolarHBondContact OG-N 3.2Å; S106-D108 PolarHBondContact OG-O 3.26Å; D108-K110 PolarHBondContact O-N 2.81Å; D108-K110 WeakPolarHBondContact OD1-CB 3.24Å; D108-K110 PolarHBondContact OD1-N 2.82Å; D108-A111 HydrophobicContact CB-CB 4.03Å; D108-A111 PolarHBondContact O-N 3.38Å; D108-A111 VanDerWaalsContact O-N 3.09Å; D108-R112 PolarHBondContact O-N 3.34Å
109P74Confident73.5Confident82 Ų8253.9 Ų53.953%0.53228%0.282SS..Hα-helixtrans-56.4-31.4176.5-23.134.2000113.5V107 A111 R112V107-P109 WeakPolarHBondContact O-CD 3.46Å; P109-A111 VanDerWaalsContact C-N 3.34Å; P109-R112 PolarHBondContact O-N 3.44Å
110K72.8Confident71.3Confident155 Ų15560.3 Ų60.367%0.67432%0.321SS*.Hα-helixtrans-69.5-34.6179.5-65.1-180179.1177.40111.8D108 R112D108-K110 PolarHBondContact O-N 2.81Å; D108-K110 WeakPolarHBondContact OD1-CB 3.24Å; D108-K110 PolarHBondContact OD1-N 2.82Å; K110-R112 PolarHBondContact O-N 3.1Å
111A72.4Confident69.2Low8 Ų865 Ų657%0.06635%0.354CS..Hα-helixtrans-73.9-12.9176.100000113L79 M83 D108 P109L79-A111 HydrophobicContact CD1-CB 4.22Å; M83-A111 WeakPolarHBondContact CE-O 3.43Å; D108-A111 HydrophobicContact CB-CB 4.03Å; D108-A111 PolarHBondContact O-N 3.38Å; D108-A111 VanDerWaalsContact O-N 3.09Å; P109-A111 VanDerWaalsContact C-N 3.34Å
112R72.6Confident67.4Low10 Ų1067.5 Ų67.54%0.03837%0.367CS..Hα-helixtrans-82.7-27.4176.6-63.1-179.6-164.9162.9-0.1113.4V103 S106 D108 P109 K110 P114 F137 A141 K144 S148V103-R112 HydrophobicContact CG2-CB 4.05Å; V103-R112 HydrophobicContact CG2-CG 4.02Å; S106-R112 VanDerWaalsContact O-CZ 3.28Å; S106-R112 PolarHBondContact O-NE 3.47Å; S106-R112 PolarHBondContact O-NH2 3.48Å; D108-R112 PolarHBondContact O-N 3.34Å; P109-R112 PolarHBondContact O-N 3.44Å; K110-R112 PolarHBondContact O-N 3.1Å; R112-P114 WeakPolarHBondContact O-CD 3.47Å; R112-F137 WeakPolarHBondContact O-CZ 3.45Å; R112-A141 HydrophobicContact CB-CB 4.41Å; R112-K144 PolarHBondContact NH1-O 2.89Å; R112-S148 PolarHBondContact NH1-OG 3.42Å; R112-S148 PolarHBondContact NH2-OG 3.38Å
113F69.9Low65.6Low93 Ų9375.6 Ų75.641%0.40841%0.405SS..SBendtrans-123.685.5-174.8-60.5-72.5000109.4Y115 A141 V142 C145F113-Y115 VanDerWaalsContact C-N 3.32Å; F113-Y115 PolarHBondContact O-N 3.04Å; F113-A141 HydrophobicContact CE1-CB 4.02Å; F113-A141 HydrophobicContact CZ-CB 4.32Å; F113-V142 HydrophobicContact CE1-CG2 4.33Å; F113-C145 HydrophobicContact CZ-CB 4.43Å
114P60.8Low63.9Low13 Ų1385.3 Ų85.38%0.08445%0.45CS..  trans-6892.3178.227.2-33.2000110.1M83 M99 R112 K116 F117 F137M83-P114 HydrophobicContact CE-CB 3.54Å; M83-P114 HydrophobicContact CE-CG 3.84Å; M83-P114 HydrophobicContact CG-CB 3.92Å; M83-P114 HydrophobicContact SD-CB 3.8Å; M99-P114 HydrophobicContact CE-CG 3.96Å; R112-P114 WeakPolarHBondContact O-CD 3.47Å; P114-K116 PolarHBondContact O-N 3.12Å; P114-F117 HydrophobicContact CB-CB 3.96Å; P114-F117 HydrophobicContact CB-CD2 3.77Å; P114-F117 HydrophobicContact CB-CG 4.37Å; P114-F117 HydrophobicContact CG-CB 4.03Å; P114-F117 HydrophobicContact CG-CD2 3.88Å; P114-F117 HydrophobicContact CG-CG 4.4Å; P114-F117 PolarHBondContact O-N 2.94Å; P114-F117 VanDerWaalsContact O-N 3.15Å; P114-F137 HydrophobicContact CG-CE1 4.1Å; P114-F137 HydrophobicContact CG-CZ 4.07Å
115Y58.6Low62.7Low186 Ų18692 Ų9273%0.72948%0.482SS*.THydrogen-bonded Turntrans-63.5-15.8169.254.2-89.5000112.4F113F113-Y115 VanDerWaalsContact C-N 3.32Å; F113-Y115 PolarHBondContact O-N 3.04Å
116K56.1Low61.8Low158 Ų15890.3 Ų90.369%0.68748%0.475SS*.THydrogen-bonded Turntrans-82.9-24.9174.2-77.1-170.1175.7-174.90114P114 G118P114-K116 PolarHBondContact O-N 3.12Å; K116-G118 PolarHBondContact O-N 3.18Å; K116-G118 VanDerWaalsContact O-N 3.07Å
117F51.9Low61.3Low25 Ų2592.3 Ų92.311%0.1149%0.488CS..SBendtrans-70.1112.5171.5-105.6-72.7000106.7L82 M83 I92 A95 M99 P114 I119L82-F117 WeakPolarHBondContact O-CE2 3.21Å; L82-F117 WeakPolarHBondContact O-CZ 3.21Å; M83-F117 VanDerWaalsContact CA-CE2 3.46Å; M83-F117 HydrophobicContact CB-CD2 4.4Å; M83-F117 HydrophobicContact CB-CE2 4.21Å; M83-F117 HydrophobicContact CG-CD2 4.04Å; M83-F117 HydrophobicContact CG-CE2 3.98Å; I92-F117 HydrophobicContact CG2-CE1 4.14Å; A95-F117 HydrophobicContact CB-CZ 4.31Å; M99-F117 HydrophobicContact CE-CD2 4.07Å; M99-F117 HydrophobicContact CE-CE2 3.81Å; M99-F117 HydrophobicContact SD-CD2 4.28Å; M99-F117 HydrophobicContact SD-CE2 3.46Å; M99-F117 WeakPolarHBondContact SD-CE2 3.33Å; M99-F117 HydrophobicContact SD-CZ 4.07Å; P114-F117 HydrophobicContact CB-CB 3.96Å; P114-F117 HydrophobicContact CB-CD2 3.77Å; P114-F117 HydrophobicContact CB-CG 4.37Å; P114-F117 HydrophobicContact CG-CB 4.03Å; P114-F117 HydrophobicContact CG-CD2 3.88Å; P114-F117 HydrophobicContact CG-CG 4.4Å; P114-F117 PolarHBondContact O-N 2.94Å; P114-F117 VanDerWaalsContact O-N 3.15Å; F117-I119 HydrophobicContact CB-CD1 3.83Å; F117-I119 HydrophobicContact CB-CG1 3.92Å; F117-I119 HydrophobicContact CG-CD1 4.42Å; F117-I119 HydrophobicContact CG-CG1 4.48Å; F117-I119 PolarHBondContact O-N 3.25Å
118G48.3Very low61.2Low55 Ų5591.8 Ų91.857%0.56748%0.48SS*.  trans-65.551.5164.500000111.7K116 V120 S121K116-G118 PolarHBondContact O-N 3.18Å; K116-G118 VanDerWaalsContact O-N 3.07Å; G118-V120 PolarHBondContact O-N 2.67Å; G118-S121 PolarHBondContact O-N 2.99Å; G118-S121 VanDerWaalsContact O-N 3.15Å
119I48.7Very low60.9Low43 Ų4390.8 Ų90.822%0.22148%0.481CS..THydrogen-bonded Turntrans-54.3-11.6168.4-75156.4000110.5L96 F117L96-I119 HydrophobicContact CD2-CD1 4.08Å; F117-I119 HydrophobicContact CB-CD1 3.83Å; F117-I119 HydrophobicContact CB-CG1 3.92Å; F117-I119 HydrophobicContact CG-CD1 4.42Å; F117-I119 HydrophobicContact CG-CG1 4.48Å; F117-I119 PolarHBondContact O-N 3.25Å
120V41.8Very low61.1Low135 Ų13586.9 Ų86.982%0.81846%0.455SS*.THydrogen-bonded Turntrans-11416-175.1-163.20000114G118G118-V120 PolarHBondContact O-N 2.67Å
121S46.3Very low61.2Low109 Ų10984.5 Ų84.576%0.76244%0.442SS*.  trans-127.949.4160.5-65.10000110.5G118 E123G118-S121 PolarHBondContact O-N 2.99Å; G118-S121 VanDerWaalsContact O-N 3.15Å; S121-E123 PolarHBondContact O-N 3.13Å
122L51.8Low61.6Low58 Ų5886.7 Ų86.730%0.30445%0.449SS..  trans-77.6117.9165.6-58.6177.9000106.9V126 L130L122-V126 HydrophobicContact CB-CB 4.37Å; L122-V126 HydrophobicContact CB-CG1 3.95Å; L122-V126 HydrophobicContact CB-CG2 3.58Å; L122-V126 HydrophobicContact CD1-CG2 4.14Å; L122-V126 HydrophobicContact CD2-CG1 4.13Å; L122-V126 HydrophobicContact CG-CG1 4.41Å; L122-V126 HydrophobicContact CG-CG2 4.41Å; L122-L130 HydrophobicContact CD1-CD2 3.79Å; L122-L130 HydrophobicContact CD1-CG 4.19Å; L122-L130 HydrophobicContact CD2-CD2 3.75Å; L122-L130 HydrophobicContact CG-CD2 4.4Å
123E53Low62.1Low169 Ų16986.3 Ų86.379%0.7945%0.448SS*.  trans-54.8154.4173.4-65.2-178.6165.400110S121 D125 V126S121-E123 PolarHBondContact O-N 3.13Å; E123-D125 PolarHBondContact O-N 2.97Å; E123-V126 WeakPolarHBondContact O-CG2 3.29Å; E123-V126 PolarHBondContact O-N 3.38Å
124Q54.3Low62.8Low204 Ų20482.3 Ų82.395%0.95343%0.431SS*.THydrogen-bonded Turntrans-57.1-11.6-169.8-74.8-177.8-20.500115.3
125D59.9Low63.9Low159 Ų15982 Ų8285%0.8543%0.43SS*.THydrogen-bonded Turntrans-106.926.5-175.9-70.9-33.4000114.6E123E123-D125 PolarHBondContact O-N 2.97Å
126V67.1Low65.2Low53 Ų5374.2 Ų74.232%0.32140%0.401SS..  trans-72.6140.8173.2-90.70000113W89 L122 E123 L130W89-V126 HydrophobicContact CB-CG1 4.18Å; L122-V126 HydrophobicContact CB-CB 4.37Å; L122-V126 HydrophobicContact CB-CG1 3.95Å; L122-V126 HydrophobicContact CB-CG2 3.58Å; L122-V126 HydrophobicContact CD1-CG2 4.14Å; L122-V126 HydrophobicContact CD2-CG1 4.13Å; L122-V126 HydrophobicContact CG-CG1 4.41Å; L122-V126 HydrophobicContact CG-CG2 4.41Å; E123-V126 WeakPolarHBondContact O-CG2 3.29Å; E123-V126 PolarHBondContact O-N 3.38Å; V126-L130 HydrophobicContact CB-CD2 4.22Å; V126-L130 HydrophobicContact CG1-CD2 3.74Å
127P73.4Confident66.8Low42 Ų4266.9 Ų66.927%0.27337%0.37SS..  trans-63146.2178.3-27.339000113.3W89 A129 L130W89-P127 HydrophobicContact CD2-CG 3.56Å; W89-P127 VanDerWaalsContact CE2-CG 3.48Å; W89-P127 HydrophobicContact CE3-CB 4.19Å; W89-P127 HydrophobicContact CE3-CG 3.72Å; W89-P127 HydrophobicContact CG-CG 4.31Å; W89-P127 HydrophobicContact CH2-CB 4.14Å; W89-P127 HydrophobicContact CH2-CG 3.77Å; W89-P127 HydrophobicContact CZ2-CB 4.46Å; W89-P127 HydrophobicContact CZ2-CG 3.62Å; W89-P127 HydrophobicContact CZ3-CB 3.99Å; W89-P127 HydrophobicContact CZ3-CG 3.82Å; P127-A129 PolarHBondContact O-N 2.9Å; P127-L130 PolarHBondContact O-N 2.68Å
128L72Confident68.5Low110 Ų11068.9 Ų68.958%0.57638%0.381SS*.Hα-helixtrans-53.8-31.1176.8-172.266.1000112.7L130 W131 Y132L128-L130 PolarHBondContact O-N 3.37Å; L128-W131 HydrophobicContact CD1-CE3 3.67Å; L128-W131 HydrophobicContact CD1-CZ3 4.05Å; L128-W131 PolarHBondContact O-N 2.93Å; L128-Y132 PolarHBondContact O-N 3.23Å
129A73.7Confident70.6Confident40 Ų4066.6 Ų66.633%0.33136%0.355SS..Hα-helixtrans-57.7-44.5175.500000112.4P127 W131 Y132 T133P127-A129 PolarHBondContact O-N 2.9Å; A129-W131 VanDerWaalsContact C-N 3.32Å; A129-W131 PolarHBondContact O-N 3.36Å; A129-Y132 PolarHBondContact O-N 3.03Å; A129-T133 WeakPolarHBondContact O-CB 3.4Å; A129-T133 PolarHBondContact O-N 3.06Å; A129-T133 PolarHBondContact O-OG1 2.91Å; A129-T133 VanDerWaalsContact O-OG1 3.05Å
130L77.5Confident72.6Confident0 Ų066.7 Ų66.70%036%0.355CS..Hα-helixtrans-65.2-39.6178.4175.859.7000111.5W89 I92 E93 L96 L122 V126 P127 L128 S134W89-L130 HydrophobicContact CB-CD2 3.98Å; W89-L130 HydrophobicContact CE3-CB 4.39Å; I92-L130 HydrophobicContact CB-CD1 4.4Å; I92-L130 HydrophobicContact CG2-CD1 3.84Å; I92-L130 HydrophobicContact CG2-CD2 4.49Å; E93-L130 HydrophobicContact CB-CB 4.44Å; E93-L130 HydrophobicContact CB-CD1 3.85Å; E93-L130 HydrophobicContact CG-CB 4.21Å; E93-L130 HydrophobicContact CG-CD1 4.17Å; L96-L130 HydrophobicContact CD1-CD1 3.62Å; L122-L130 HydrophobicContact CD1-CD2 3.79Å; L122-L130 HydrophobicContact CD1-CG 4.19Å; L122-L130 HydrophobicContact CD2-CD2 3.75Å; L122-L130 HydrophobicContact CG-CD2 4.4Å; V126-L130 HydrophobicContact CB-CD2 4.22Å; V126-L130 HydrophobicContact CG1-CD2 3.74Å; P127-L130 PolarHBondContact O-N 2.68Å; L128-L130 PolarHBondContact O-N 3.37Å; L130-S134 VanDerWaalsContact O-CB 3.29Å; L130-S134 WeakPolarHBondContact O-CB 3.36Å; L130-S134 PolarHBondContact O-N 2.89Å; L130-S134 PolarHBondContact O-OG 2.82Å
131W75.8Confident74.9Confident105 Ų10560.3 Ų60.340%0.39832%0.316SS..Hα-helixtrans-65.7-44.6177.8-177.372.2000112.3L128 A129 S134 A135 S169 L170L128-W131 HydrophobicContact CD1-CE3 3.67Å; L128-W131 HydrophobicContact CD1-CZ3 4.05Å; L128-W131 PolarHBondContact O-N 2.93Å; A129-W131 VanDerWaalsContact C-N 3.32Å; A129-W131 PolarHBondContact O-N 3.36Å; W131-S134 WeakPolarHBondContact O-CB 3.33Å; W131-S134 PolarHBondContact O-N 3.21Å; W131-A135 PolarHBondContact O-N 3.41Å; W131-S169 VanDerWaalsContact CH2-C 3.48Å; W131-S169 WeakPolarHBondContact CH2-O 3.5Å; W131-L170 HydrophobicContact CD2-CD2 4.45Å; W131-L170 HydrophobicContact CE3-CD2 3.8Å; W131-L170 HydrophobicContact CH2-CD2 3.87Å; W131-L170 HydrophobicContact CZ2-CD2 4.43Å; W131-L170 HydrophobicContact CZ3-CD2 3.49Å; W131-L170 VanDerWaalsContact CZ3-CD2 3.49Å
132Y81Confident77.1Confident53 Ų5355.6 Ų55.621%0.20828%0.283CS..Hα-helixtrans-59.9-50.7174.5178.9-102.5000111.6L128 A129 S134 A135 V136 L170 H173L128-Y132 PolarHBondContact O-N 3.23Å; A129-Y132 PolarHBondContact O-N 3.03Å; Y132-S134 VanDerWaalsContact C-N 3.28Å; Y132-S134 PolarHBondContact O-N 2.98Å; Y132-A135 WeakPolarHBondContact O-CA 3.46Å; Y132-A135 WeakPolarHBondContact O-CB 3.3Å; Y132-A135 PolarHBondContact O-N 2.99Å; Y132-V136 HydrophobicContact CD1-CG2 4.1Å; Y132-V136 HydrophobicContact CE1-CG2 3.67Å; Y132-V136 HydrophobicContact CE2-CG2 4.16Å; Y132-V136 WeakPolarHBondContact O-CG2 3.29Å; Y132-V136 PolarHBondContact O-N 3.33Å; Y132-L170 HydrophobicContact CD2-CD2 4.08Å; Y132-H173 WeakPolarHBondContact CE2-O 3.25Å
133T83.1Confident79.1Confident3 Ų352.9 Ų52.92%0.01827%0.269CS..Hα-helixtrans-62.4-36.7-179.8-61.70000112R59 E93 L96 F97 A129 V136 F137R59-T133 PolarHBondContact NH1-OG1 3.01Å; E93-T133 HydrophobicContact CG-CG2 4.46Å; E93-T133 WeakPolarHBondContact O-CG2 3.33Å; E93-T133 WeakPolarHBondContact OE1-CB 3.12Å; E93-T133 PolarHBondContact OE1-OG1 3.33Å; L96-T133 HydrophobicContact CB-CG2 3.84Å; F97-T133 HydrophobicContact CB-CG2 3.71Å; F97-T133 VanDerWaalsContact N-CG2 3.34Å; A129-T133 WeakPolarHBondContact O-CB 3.4Å; A129-T133 PolarHBondContact O-N 3.06Å; A129-T133 PolarHBondContact O-OG1 2.91Å; A129-T133 VanDerWaalsContact O-OG1 3.05Å; T133-V136 PolarHBondContact O-N 2.93Å; T133-F137 PolarHBondContact O-N 3.01Å
134S82.9Confident80.9Confident8 Ų847.2 Ų47.26%0.05624%0.241CC..Hα-helixtrans-61.2-44.2171.7-59.50000111.7L96 L130 W131 Y132 F137 I138L96-S134 VanDerWaalsContact CD1-OG 3.31Å; L96-S134 WeakPolarHBondContact CD1-OG 3.37Å; L130-S134 VanDerWaalsContact O-CB 3.29Å; L130-S134 WeakPolarHBondContact O-CB 3.36Å; L130-S134 PolarHBondContact O-N 2.89Å; L130-S134 PolarHBondContact O-OG 2.82Å; W131-S134 WeakPolarHBondContact O-CB 3.33Å; W131-S134 PolarHBondContact O-N 3.21Å; Y132-S134 VanDerWaalsContact C-N 3.28Å; Y132-S134 PolarHBondContact O-N 2.98Å; S134-F137 PolarHBondContact O-N 3.35Å; S134-I138 VanDerWaalsContact O-CG1 3.3Å; S134-I138 WeakPolarHBondContact O-CG1 3.39Å; S134-I138 PolarHBondContact O-N 3.33Å
135A84.7Confident82.7Confident6 Ų638.6 Ų38.65%0.0520%0.203CC..Hα-helixtrans-63.9-43.3177.100000111.4W131 Y132 F137 I138 Y139 L166 L170W131-A135 PolarHBondContact O-N 3.41Å; Y132-A135 WeakPolarHBondContact O-CA 3.46Å; Y132-A135 WeakPolarHBondContact O-CB 3.3Å; Y132-A135 PolarHBondContact O-N 2.99Å; A135-F137 VanDerWaalsContact C-N 3.33Å; A135-F137 PolarHBondContact O-N 2.99Å; A135-I138 PolarHBondContact O-N 3.37Å; A135-Y139 WeakPolarHBondContact O-CB 3.31Å; A135-Y139 PolarHBondContact O-N 3.45Å; A135-L166 HydrophobicContact CB-CD1 4.45Å; A135-L166 HydrophobicContact CB-CG 4.21Å; A135-L166 WeakPolarHBondContact O-CD1 3.35Å; A135-L170 HydrophobicContact CB-CD1 3.78Å; A135-L170 HydrophobicContact CB-CD2 3.89Å; A135-L170 HydrophobicContact CB-CG 4.06Å
136V86.7Confident84.3Confident23 Ų2331 Ų3114%0.13916%0.163CC..Hα-helixtrans-59.5-43.8175.4177.40000111.3Y132 T133 I138 Y139 E140 L177Y132-V136 HydrophobicContact CD1-CG2 4.1Å; Y132-V136 HydrophobicContact CE1-CG2 3.67Å; Y132-V136 HydrophobicContact CE2-CG2 4.16Å; Y132-V136 WeakPolarHBondContact O-CG2 3.29Å; Y132-V136 PolarHBondContact O-N 3.33Å; T133-V136 PolarHBondContact O-N 2.93Å; V136-I138 PolarHBondContact O-N 3.4Å; V136-Y139 WeakPolarHBondContact O-CB 3.44Å; V136-Y139 PolarHBondContact O-N 3.42Å; V136-E140 PolarHBondContact O-N 3.31Å; V136-L177 HydrophobicContact CG2-CD2 4.41Å
137F88.2Confident85.6Confident5 Ų532.1 Ų32.12%0.02216%0.164CC..Hα-helixtrans-58.7-48.1174.4170.3-101.4000112.4L96 M99 V103 R112 P114 T133 S134 A135 Y139 E140 A141L96-F137 HydrophobicContact CD2-CB 4.43Å; L96-F137 HydrophobicContact CD2-CD1 4.14Å; L96-F137 HydrophobicContact CD2-CG 4.2Å; M99-F137 HydrophobicContact CB-CD2 3.7Å; M99-F137 HydrophobicContact CB-CE2 3.72Å; M99-F137 HydrophobicContact CE-CD2 4.49Å; M99-F137 HydrophobicContact CE-CE2 3.75Å; M99-F137 HydrophobicContact CE-CZ 3.79Å; V103-F137 HydrophobicContact CB-CD2 4.37Å; V103-F137 HydrophobicContact CB-CE2 3.87Å; V103-F137 HydrophobicContact CG1-CD2 4.18Å; V103-F137 HydrophobicContact CG1-CE2 4.12Å; V103-F137 HydrophobicContact CG2-CE2 3.81Å; V103-F137 HydrophobicContact CG2-CZ 4.28Å; R112-F137 WeakPolarHBondContact O-CZ 3.45Å; P114-F137 HydrophobicContact CG-CE1 4.1Å; P114-F137 HydrophobicContact CG-CZ 4.07Å; T133-F137 PolarHBondContact O-N 3.01Å; S134-F137 PolarHBondContact O-N 3.35Å; A135-F137 VanDerWaalsContact C-N 3.33Å; A135-F137 PolarHBondContact O-N 2.99Å; F137-Y139 VanDerWaalsContact C-N 3.32Å; F137-Y139 PolarHBondContact O-N 3.03Å; F137-E140 PolarHBondContact O-N 3.3Å; F137-A141 WeakPolarHBondContact O-CB 3.16Å; F137-A141 PolarHBondContact O-N 2.87Å
138I88.6Confident86.4Confident67 Ų6732.9 Ų32.934%0.34417%0.171SC..Hα-helixtrans-62.4-42.1178.5-67.2166.3000110.5S134 A135 V136 E140 A141 V142 L166S134-I138 VanDerWaalsContact O-CG1 3.3Å; S134-I138 WeakPolarHBondContact O-CG1 3.39Å; S134-I138 PolarHBondContact O-N 3.33Å; A135-I138 PolarHBondContact O-N 3.37Å; V136-I138 PolarHBondContact O-N 3.4Å; I138-E140 PolarHBondContact O-N 3.48Å; I138-A141 PolarHBondContact O-N 2.82Å; I138-V142 HydrophobicContact CG2-CG2 4.01Å; I138-V142 WeakPolarHBondContact O-CB 3.44Å; I138-V142 VanDerWaalsContact O-CG2 3.23Å; I138-V142 WeakPolarHBondContact O-CG2 3.35Å; I138-V142 PolarHBondContact O-N 3.45Å; I138-L166 HydrophobicContact CB-CD1 3.95Å; I138-L166 HydrophobicContact CG2-CD1 3.75Å
139Y92.3Very high87.4Confident6 Ų630.7 Ų30.72%0.02416%0.16CC..Hα-helixtrans-56.2-48.2176.5161.8-95.9000111.5A135 V136 F137 S143 L163 L177 L181 K184A135-Y139 WeakPolarHBondContact O-CB 3.31Å; A135-Y139 PolarHBondContact O-N 3.45Å; V136-Y139 WeakPolarHBondContact O-CB 3.44Å; V136-Y139 PolarHBondContact O-N 3.42Å; F137-Y139 VanDerWaalsContact C-N 3.32Å; F137-Y139 PolarHBondContact O-N 3.03Å; Y139-S143 VanDerWaalsContact O-CB 3.24Å; Y139-S143 WeakPolarHBondContact O-CB 3.46Å; Y139-S143 PolarHBondContact O-N 3.05Å; Y139-S143 PolarHBondContact O-OG 3.04Å; Y139-L163 HydrophobicContact CD2-CD2 3.92Å; Y139-L177 HydrophobicContact CD1-CD2 3.91Å; Y139-L177 HydrophobicContact CD2-CD1 4.26Å; Y139-L177 HydrophobicContact CE1-CD2 4.14Å; Y139-L177 HydrophobicContact CG-CD1 4.08Å; Y139-L177 HydrophobicContact CG-CD2 4.26Å; Y139-L181 HydrophobicContact CE2-CB 3.96Å; Y139-L181 HydrophobicContact CE2-CD1 4.09Å; Y139-L181 HydrophobicContact CE2-CD2 4.25Å; Y139-L181 HydrophobicContact CE2-CG 4.31Å; Y139-L181 PolarHBondContact OH-N 3.25Å; Y139-K184 PolarHBondContact OH-NZ 3.45Å
140E91.4Very high88.3Confident46 Ų4629.4 Ų29.422%0.21515%0.148CC..Hα-helixtrans-67.9-42.6-179.8-68.7-62.1173.800111.9V103 V136 F137 I138 V142 S143 K144 K184V103-E140 HydrophobicContact CG1-CB 3.49Å; V103-E140 VanDerWaalsContact CG1-CB 3.49Å; V136-E140 PolarHBondContact O-N 3.31Å; F137-E140 PolarHBondContact O-N 3.3Å; I138-E140 PolarHBondContact O-N 3.48Å; E140-V142 PolarHBondContact O-N 2.9Å; E140-S143 PolarHBondContact O-N 3.49Å; E140-K144 WeakPolarHBondContact O-CB 3.27Å; E140-K144 PolarHBondContact O-N 2.85Å; E140-K184 IonicContact OE2-NZ 2.98Å
141A89.8Confident89Confident1 Ų138.1 Ų38.11%0.00819%0.186CC..Hα-helixtrans-62-44.3177.500000112.2V103 R112 F113 F137 I138 K144 C145V103-A141 HydrophobicContact CG1-CB 4.42Å; V103-A141 HydrophobicContact CG2-CB 3.92Å; R112-A141 HydrophobicContact CB-CB 4.41Å; F113-A141 HydrophobicContact CE1-CB 4.02Å; F113-A141 HydrophobicContact CZ-CB 4.32Å; F137-A141 WeakPolarHBondContact O-CB 3.16Å; F137-A141 PolarHBondContact O-N 2.87Å; I138-A141 PolarHBondContact O-N 2.82Å; A141-K144 PolarHBondContact O-N 2.95Å; A141-C145 WeakPolarHBondContact O-CB 3.47Å; A141-C145 PolarHBondContact O-N 2.99Å
142V92.4Very high89.9Confident10 Ų1036.6 Ų36.66%0.06119%0.185CC..Hα-helixtrans-70.3-43.7178.7174.80000110.9F113 I138 E140 K144 C145 I146 A162 L163F113-V142 HydrophobicContact CE1-CG2 4.33Å; I138-V142 HydrophobicContact CG2-CG2 4.01Å; I138-V142 WeakPolarHBondContact O-CB 3.44Å; I138-V142 VanDerWaalsContact O-CG2 3.23Å; I138-V142 WeakPolarHBondContact O-CG2 3.35Å; I138-V142 PolarHBondContact O-N 3.45Å; E140-V142 PolarHBondContact O-N 2.9Å; V142-K144 VanDerWaalsContact C-N 3.27Å; V142-K144 PolarHBondContact O-N 3.33Å; V142-C145 WeakPolarHBondContact O-CA 3.1Å; V142-C145 VanDerWaalsContact O-CB 3.24Å; V142-C145 WeakPolarHBondContact O-CB 3.33Å; V142-C145 PolarHBondContact O-N 3.07Å; V142-I146 WeakPolarHBondContact O-CG1 3.42Å; V142-I146 PolarHBondContact O-N 2.94Å; V142-A162 HydrophobicContact CG2-CB 4.47Å; V142-L163 HydrophobicContact CB-CD2 4.1Å; V142-L163 HydrophobicContact CB-CG 4.48Å; V142-L163 HydrophobicContact CG1-CD1 4.23Å; V142-L163 HydrophobicContact CG1-CD2 3.91Å; V142-L163 HydrophobicContact CG1-CG 3.74Å
143S93.4Very high90.5Very high1 Ų137.2 Ų37.21%0.00720%0.198CC..Hα-helixtrans-54.2-47.1174.2-66.10000110.7Y139 E140 C145 I146 E147Y139-S143 VanDerWaalsContact O-CB 3.24Å; Y139-S143 WeakPolarHBondContact O-CB 3.46Å; Y139-S143 PolarHBondContact O-N 3.05Å; Y139-S143 PolarHBondContact O-OG 3.04Å; E140-S143 PolarHBondContact O-N 3.49Å; S143-C145 VanDerWaalsContact C-N 3.3Å; S143-C145 PolarHBondContact O-N 3.42Å; S143-I146 PolarHBondContact O-N 3.1Å; S143-E147 WeakPolarHBondContact O-CG 3.32Å; S143-E147 PolarHBondContact O-N 3.24Å
144K91.4Very high91Very high49 Ų4940.7 Ų40.721%0.21322%0.219CC..Hα-helixtrans-66.2-33.5178.2-171.155.3174.6-163.60113.3G104 R112 E140 A141 V142 I146 E147 S148G104-K144 WeakPolarHBondContact O-CD 3.45Å; G104-K144 WeakPolarHBondContact O-CE 3.37Å; G104-K144 WeakPolarHBondContact O-CG 3.45Å; G104-K144 PolarHBondContact O-NZ 3.31Å; R112-K144 PolarHBondContact NH1-O 2.89Å; E140-K144 WeakPolarHBondContact O-CB 3.27Å; E140-K144 PolarHBondContact O-N 2.85Å; A141-K144 PolarHBondContact O-N 2.95Å; V142-K144 VanDerWaalsContact C-N 3.27Å; V142-K144 PolarHBondContact O-N 3.33Å; K144-I146 VanDerWaalsContact C-N 3.34Å; K144-E147 HydrophobicContact CD-CB 4.33Å; K144-E147 WeakPolarHBondContact CD-OE2 3.41Å; K144-E147 IonicContact NZ-OE2 3.17Å; K144-E147 PolarHBondContact NZ-OE2 3.49Å; K144-E147 PolarHBondContact O-N 3.09Å; K144-S148 WeakPolarHBondContact O-CB 2.91Å; K144-S148 PolarHBondContact O-N 3.4Å; K144-S148 PolarHBondContact O-OG 3.33Å
145C91.7Very high91.5Very high23 Ų2342 Ų4216%0.15523%0.227CC..Hα-helixtrans-60.5-44.9173.6-168.20000111.3F113 A141 V142 S143 S148 N149F113-C145 HydrophobicContact CZ-CB 4.43Å; A141-C145 WeakPolarHBondContact O-CB 3.47Å; A141-C145 PolarHBondContact O-N 2.99Å; V142-C145 WeakPolarHBondContact O-CA 3.1Å; V142-C145 VanDerWaalsContact O-CB 3.24Å; V142-C145 WeakPolarHBondContact O-CB 3.33Å; V142-C145 PolarHBondContact O-N 3.07Å; S143-C145 VanDerWaalsContact C-N 3.3Å; S143-C145 PolarHBondContact O-N 3.42Å; C145-S148 PolarHBondContact O-N 3.46Å; C145-N149 WeakPolarHBondContact O-CB 3.31Å; C145-N149 PolarHBondContact O-N 2.88Å; C145-N149 PolarHBondContact O-ND2 3.2Å
146I93.9Very high92Very high1 Ų141.8 Ų41.81%0.00522%0.224CC..Hα-helixtrans-62.3-52175.4-59.6172.3000110.1V142 S143 K144 S148 N149 V150 L163 F188 F197V142-I146 WeakPolarHBondContact O-CG1 3.42Å; V142-I146 PolarHBondContact O-N 2.94Å; S143-I146 PolarHBondContact O-N 3.1Å; K144-I146 VanDerWaalsContact C-N 3.34Å; I146-S148 VanDerWaalsContact C-N 3.26Å; I146-S148 PolarHBondContact O-N 3.18Å; I146-N149 CarbonylContact O-C 3.56Å; I146-N149 PolarHBondContact O-N 2.97Å; I146-V150 WeakPolarHBondContact O-CA 3.46Å; I146-V150 PolarHBondContact O-N 3.2Å; I146-L163 HydrophobicContact CD1-CD1 3.88Å; I146-F188 HydrophobicContact CB-CD2 4.4Å; I146-F188 HydrophobicContact CB-CE2 4.01Å; I146-F188 HydrophobicContact CB-CZ 4.48Å; I146-F188 HydrophobicContact CD1-CE2 4.49Å; I146-F188 HydrophobicContact CG2-CD2 3.49Å; I146-F188 VanDerWaalsContact CG2-CD2 3.49Å; I146-F188 HydrophobicContact CG2-CE2 3.58Å; I146-F188 HydrophobicContact CG2-CG 4.01Å; I146-F188 HydrophobicContact CG2-CZ 4.2Å; I146-F197 HydrophobicContact CG2-CE1 3.91Å; I146-F197 HydrophobicContact CG2-CZ 3.8Å
147E93.2Very high92.3Very high75 Ų7544.9 Ų44.935%0.3524%0.237SC..Hα-helixtrans-52.3-46.4-179.9-72.9172.5-162.500112.1S143 K144 N149 F188S143-E147 WeakPolarHBondContact O-CG 3.32Å; S143-E147 PolarHBondContact O-N 3.24Å; K144-E147 HydrophobicContact CD-CB 4.33Å; K144-E147 WeakPolarHBondContact CD-OE2 3.41Å; K144-E147 IonicContact NZ-OE2 3.17Å; K144-E147 PolarHBondContact NZ-OE2 3.49Å; K144-E147 PolarHBondContact O-N 3.09Å; E147-N149 PolarHBondContact O-N 3.46Å; E147-F188 HydrophobicContact CB-CE1 4.44Å; E147-F188 HydrophobicContact CB-CZ 4.5Å; E147-F188 HydrophobicContact CG-CE1 3.56Å; E147-F188 HydrophobicContact CG-CZ 3.43Å; E147-F188 VanDerWaalsContact CG-CZ 3.43Å
148S91.5Very high92.6Very high59 Ų5953.4 Ų53.441%0.41327%0.269SS..Hα-helixtrans-69.7-21.4-177.7-51.90000112.7R112 K144 C145 I146R112-S148 PolarHBondContact NH1-OG 3.42Å; R112-S148 PolarHBondContact NH2-OG 3.38Å; K144-S148 WeakPolarHBondContact O-CB 2.91Å; K144-S148 PolarHBondContact O-N 3.4Å; K144-S148 PolarHBondContact O-OG 3.33Å; C145-S148 PolarHBondContact O-N 3.46Å; I146-S148 VanDerWaalsContact C-N 3.26Å; I146-S148 PolarHBondContact O-N 3.18Å
149N92.2Very high92.9Very high64 Ų6450.8 Ų50.834%0.34226%0.257SS..THydrogen-bonded Turntrans-130.828.6-171.8-61-82.7000112C145 I146 E147 K151 N152 V155C145-N149 WeakPolarHBondContact O-CB 3.31Å; C145-N149 PolarHBondContact O-N 2.88Å; C145-N149 PolarHBondContact O-ND2 3.2Å; I146-N149 CarbonylContact O-C 3.56Å; I146-N149 PolarHBondContact O-N 2.97Å; E147-N149 PolarHBondContact O-N 3.46Å; N149-K151 PolarHBondContact O-N 2.79Å; N149-N152 HydrophobicContact CB-CB 4.4Å; N149-N152 WeakPolarHBondContact O-CB 3.05Å; N149-N152 PolarHBondContact O-N 3.09Å; N149-V155 HydrophobicContact CB-CB 4.13Å; N149-V155 HydrophobicContact CB-CG1 3.78Å; N149-V155 HydrophobicContact CB-CG2 4.42Å
150V92Very high93.1Very high13 Ų1350.5 Ų50.58%0.07926%0.256CS..THydrogen-bonded Turntrans-58.8-30-165.870.80000112.9I146 N152 F188 M191 T192 H194I146-V150 WeakPolarHBondContact O-CA 3.46Å; I146-V150 PolarHBondContact O-N 3.2Å; V150-N152 VanDerWaalsContact C-N 3.33Å; V150-F188 HydrophobicContact CG2-CB 3.92Å; V150-F188 HydrophobicContact CG2-CD1 3.97Å; V150-F188 HydrophobicContact CG2-CG 4.13Å; V150-M191 HydrophobicContact CG1-CE 3.95Å; V150-T192 HydrophobicContact CB-CG2 4.42Å; V150-T192 HydrophobicContact CG1-CG2 4.09Å; V150-T192 HydrophobicContact CG2-CG2 3.91Å; V150-T192 WeakPolarHBondContact O-CG2 3.49Å; V150-H194 PolarHBondContact O-CD2 2.83Å; V150-H194 PolarHBondContact O-NE2 2.89Å; V150-H194 VanDerWaalsContact O-NE2 3.16Å
151K93.7Very high93.2Very high183 Ų18354.9 Ų54.980%0.79627%0.27SS*.THydrogen-bonded Turntrans-75.6-15.3178-61-175.3-179.7-178.50114.2N149 S153 T192N149-K151 PolarHBondContact O-N 2.79Å; K151-S153 PolarHBondContact O-N 2.63Å; K151-T192 HydrophobicContact CG-CG2 4.28Å
152N94.5Very high93.4Very high73 Ų7356.7 Ų56.739%0.3929%0.285SS..  trans-90.8100.8-179.8-174.3-34.5000109.3N149 V150 T154 V155 A156N149-N152 HydrophobicContact CB-CB 4.4Å; N149-N152 WeakPolarHBondContact O-CB 3.05Å; N149-N152 PolarHBondContact O-N 3.09Å; V150-N152 VanDerWaalsContact C-N 3.33Å; N152-T154 VanDerWaalsContact C-N 3.27Å; N152-T154 PolarHBondContact O-N 3.29Å; N152-T154 WeakPolarHBondContact OD1-CB 3.36Å; N152-T154 PolarHBondContact OD1-N 3.42Å; N152-T154 VanDerWaalsContact OD1-N 3.13Å; N152-V155 HydrophobicContact CB-CB 4.14Å; N152-V155 HydrophobicContact CB-CG2 4.11Å; N152-V155 PolarHBondContact O-N 3.36Å; N152-V155 VanDerWaalsContact O-N 3.11Å; N152-V155 PolarHBondContact OD1-N 3.32Å; N152-V155 VanDerWaalsContact OD1-N 3.16Å; N152-A156 PolarHBondContact O-N 2.81Å
153S93.2Very high93.6Very high66 Ų6656.3 Ų56.346%0.46228%0.283SS..Hα-helixtrans-56.3-39.4-178.655.50000112.9K151 V155 A156 E157K151-S153 PolarHBondContact O-N 2.63Å; S153-V155 PolarHBondContact O-N 3.48Å; S153-A156 PolarHBondContact O-N 2.89Å; S153-E157 VanDerWaalsContact O-CB 3.23Å; S153-E157 WeakPolarHBondContact O-CB 3.39Å; S153-E157 PolarHBondContact O-N 3.24Å
154T94.5Very high93.6Very high76 Ų7658.8 Ų58.847%0.46629%0.292SS..Hα-helixtrans-63.5-40.3178.4-57.40000112.1N152 R158N152-T154 VanDerWaalsContact C-N 3.27Å; N152-T154 PolarHBondContact O-N 3.29Å; N152-T154 WeakPolarHBondContact OD1-CB 3.36Å; N152-T154 PolarHBondContact OD1-N 3.42Å; N152-T154 VanDerWaalsContact OD1-N 3.13Å; T154-R158 VanDerWaalsContact O-CG 3.32Å; T154-R158 WeakPolarHBondContact O-CG 3.41Å; T154-R158 PolarHBondContact O-N 3.21Å; T154-R158 VanDerWaalsContact O-N 3.17Å
155V93Very high93.7Very high36 Ų3662.3 Ų62.322%0.21831%0.305CS..Hα-helixtrans-70.2-43.9176.8175.80000110.3N149 N152 S153 R158 S159N149-V155 HydrophobicContact CB-CB 4.13Å; N149-V155 HydrophobicContact CB-CG1 3.78Å; N149-V155 HydrophobicContact CB-CG2 4.42Å; N152-V155 HydrophobicContact CB-CB 4.14Å; N152-V155 HydrophobicContact CB-CG2 4.11Å; N152-V155 PolarHBondContact O-N 3.36Å; N152-V155 VanDerWaalsContact O-N 3.11Å; N152-V155 PolarHBondContact OD1-N 3.32Å; N152-V155 VanDerWaalsContact OD1-N 3.16Å; S153-V155 PolarHBondContact O-N 3.48Å; V155-R158 PolarHBondContact O-N 2.86Å; V155-S159 WeakPolarHBondContact O-CB 3.38Å; V155-S159 PolarHBondContact O-N 3.41Å; V155-S159 PolarHBondContact O-OG 2.88Å
156A94.7Very high93.7Very high0 Ų061.7 Ų61.70%030%0.3CS..Hα-helixtrans-59.5-47.2177.100000111.6N152 S153 S159 C160 F197N152-A156 PolarHBondContact O-N 2.81Å; S153-A156 PolarHBondContact O-N 2.89Å; A156-S159 PolarHBondContact O-N 3.33Å; A156-C160 WeakPolarHBondContact O-CB 3.44Å; A156-C160 PolarHBondContact O-N 3.32Å; A156-C160 PolarHBondContact O-SG 3.35Å; A156-F197 HydrophobicContact CB-CE2 4.45Å; A156-F197 HydrophobicContact CB-CZ 3.9Å
157E93.7Very high93.6Very high88 Ų8861.7 Ų61.741%0.41130%0.3SS..Hα-helixtrans-56.2-54.7177.1-176.563.2-14100111.8S153 S159 C160 R161 C196S153-E157 VanDerWaalsContact O-CB 3.23Å; S153-E157 WeakPolarHBondContact O-CB 3.39Å; S153-E157 PolarHBondContact O-N 3.24Å; E157-S159 VanDerWaalsContact C-N 3.29Å; E157-S159 PolarHBondContact O-N 2.92Å; E157-C160 PolarHBondContact O-N 2.9Å; E157-R161 WeakPolarHBondContact O-CB 3.29Å; E157-R161 PolarHBondContact O-N 2.87Å; E157-C196 WeakPolarHBondContact OE2-CB 3.13Å
158R94.2Very high93.5Very high185 Ų18562.2 Ų62.270%0.69830%0.299SS*.Hα-helixtrans-63.6-36.8-179.2-70.1179.9-177.7-162.51.5112T154 V155 R161 A162T154-R158 VanDerWaalsContact O-CG 3.32Å; T154-R158 WeakPolarHBondContact O-CG 3.41Å; T154-R158 PolarHBondContact O-N 3.21Å; T154-R158 VanDerWaalsContact O-N 3.17Å; V155-R158 PolarHBondContact O-N 2.86Å; R158-R161 PolarHBondContact O-N 3.05Å; R158-A162 PolarHBondContact O-N 3.33Å
159S94.9Very high93.1Very high11 Ų1162.4 Ų62.48%0.07730%0.3CS..Hα-helixtrans-70.6-43.3178.3-58.30000111.7V155 A156 E157 R161 A162 L163V155-S159 WeakPolarHBondContact O-CB 3.38Å; V155-S159 PolarHBondContact O-N 3.41Å; V155-S159 PolarHBondContact O-OG 2.88Å; A156-S159 PolarHBondContact O-N 3.33Å; E157-S159 VanDerWaalsContact C-N 3.29Å; E157-S159 PolarHBondContact O-N 2.92Å; S159-R161 VanDerWaalsContact C-N 3.25Å; S159-R161 PolarHBondContact O-N 2.92Å; S159-A162 WeakPolarHBondContact O-CB 2.83Å; S159-A162 PolarHBondContact O-N 3.15Å; S159-A162 VanDerWaalsContact O-N 3.13Å; S159-L163 WeakPolarHBondContact O-CG 3.5Å; S159-L163 PolarHBondContact O-N 2.88Å
160C95.3Very high92.8Very high0 Ų059.6 Ų59.60%029%0.285CS..Hα-helixtrans-60.6-37.8173-68.30000111.2A156 E157 L163 R164 C196 L200A156-C160 WeakPolarHBondContact O-CB 3.44Å; A156-C160 PolarHBondContact O-N 3.32Å; A156-C160 PolarHBondContact O-SG 3.35Å; E157-C160 PolarHBondContact O-N 2.9Å; C160-L163 PolarHBondContact O-N 3.39Å; C160-R164 WeakPolarHBondContact O-CB 3.33Å; C160-R164 PolarHBondContact O-N 3.08Å; C160-C196 HydrophobicContact CB-CB 4.18Å; C160-L200 HydrophobicContact CB-CB 4.37Å; C160-L200 HydrophobicContact CB-CD2 4.27Å
161R94.7Very high92.4Very high138 Ų13859.8 Ų59.852%0.52129%0.289SS..Hα-helixtrans-64.8-40.2173.8-173.2172.6179.2148.7-2.4112.6E157 R158 S159 R164 Y165E157-R161 WeakPolarHBondContact O-CB 3.29Å; E157-R161 PolarHBondContact O-N 2.87Å; R158-R161 PolarHBondContact O-N 3.05Å; S159-R161 VanDerWaalsContact C-N 3.25Å; S159-R161 PolarHBondContact O-N 2.92Å; R161-R164 WeakPolarHBondContact O-CB 2.93Å; R161-R164 PolarHBondContact O-N 3.18Å; R161-Y165 HydrophobicContact CG-CD2 4.19Å; R161-Y165 HydrophobicContact CG-CE2 3.67Å; R161-Y165 PolarHBondContact NH2-OH 3.07Å; R161-Y165 WeakPolarHBondContact O-CD2 3.29Å; R161-Y165 PolarHBondContact O-N 3.27Å
162A93.7Very high91.8Very high40 Ų4056.5 Ų56.533%0.33129%0.285SS..Hα-helixtrans-64.3-47.6174.400000111.5V142 R158 S159 R164 Y165 L166V142-A162 HydrophobicContact CG2-CB 4.47Å; R158-A162 PolarHBondContact O-N 3.33Å; S159-A162 WeakPolarHBondContact O-CB 2.83Å; S159-A162 PolarHBondContact O-N 3.15Å; S159-A162 VanDerWaalsContact O-N 3.13Å; A162-R164 VanDerWaalsContact C-N 3.28Å; A162-R164 PolarHBondContact O-N 3.44Å; A162-Y165 PolarHBondContact O-N 3.02Å; A162-Y165 VanDerWaalsContact O-N 3.13Å; A162-L166 PolarHBondContact O-N 3.48Å
163L95.6Very high91.2Very high1 Ų158 Ų581%0.00529%0.289CS..Hα-helixtrans-60.1-38176.1-69.2178000111.9Y139 V142 I146 S159 C160 Y165 L166 I167 L181 L200Y139-L163 HydrophobicContact CD2-CD2 3.92Å; V142-L163 HydrophobicContact CB-CD2 4.1Å; V142-L163 HydrophobicContact CB-CG 4.48Å; V142-L163 HydrophobicContact CG1-CD1 4.23Å; V142-L163 HydrophobicContact CG1-CD2 3.91Å; V142-L163 HydrophobicContact CG1-CG 3.74Å; I146-L163 HydrophobicContact CD1-CD1 3.88Å; S159-L163 WeakPolarHBondContact O-CG 3.5Å; S159-L163 PolarHBondContact O-N 2.88Å; C160-L163 PolarHBondContact O-N 3.39Å; L163-Y165 PolarHBondContact O-N 2.74Å; L163-L166 PolarHBondContact O-N 3.39Å; L163-I167 WeakPolarHBondContact O-CB 3.42Å; L163-I167 VanDerWaalsContact O-CG1 3.27Å; L163-I167 WeakPolarHBondContact O-CG1 3.25Å; L163-I167 PolarHBondContact O-N 2.86Å; L163-L181 HydrophobicContact CD1-CD1 3.97Å; L163-L200 HydrophobicContact CB-CD1 4.11Å; L163-L200 HydrophobicContact CB-CD2 4.3Å; L163-L200 HydrophobicContact CD1-CD2 3.81Å
164R94.4Very high90.9Very high53 Ų5354.9 Ų54.920%0.227%0.267CS..Hα-helixtrans-56.3-53.1172.3174.7-17775.1116-1.6111.5C160 R161 A162 L166 I167 R168 Y199 I203C160-R164 WeakPolarHBondContact O-CB 3.33Å; C160-R164 PolarHBondContact O-N 3.08Å; R161-R164 WeakPolarHBondContact O-CB 2.93Å; R161-R164 PolarHBondContact O-N 3.18Å; A162-R164 VanDerWaalsContact C-N 3.28Å; A162-R164 PolarHBondContact O-N 3.44Å; R164-L166 PolarHBondContact O-N 3.36Å; R164-I167 PolarHBondContact O-N 3.32Å; R164-R168 HydrophobicContact CG-CG 4.14Å; R164-R168 WeakPolarHBondContact O-CB 3.49Å; R164-R168 WeakPolarHBondContact O-CG 3.27Å; R164-R168 PolarHBondContact O-N 2.97Å; R164-Y199 WeakPolarHBondContact CD-OH 3.32Å; R164-Y199 PolarHBondContact NE-OH 3.32Å; R164-I203 HydrophobicContact CB-CG1 4.32Å; R164-I203 HydrophobicContact CG-CD1 3.67Å; R164-I203 HydrophobicContact CG-CG1 3.91Å; R164-I203 HydrophobicContact CG-CG2 4.34Å
165Y92.4Very high90.6Very high123 Ų12354.6 Ų54.648%0.48226%0.263SS..Hα-helixtrans-61.2-38.4-177.8-71.4-62.6000111.6R161 A162 L163 S169R161-Y165 HydrophobicContact CG-CD2 4.19Å; R161-Y165 HydrophobicContact CG-CE2 3.67Å; R161-Y165 PolarHBondContact NH2-OH 3.07Å; R161-Y165 WeakPolarHBondContact O-CD2 3.29Å; R161-Y165 PolarHBondContact O-N 3.27Å; A162-Y165 PolarHBondContact O-N 3.02Å; A162-Y165 VanDerWaalsContact O-N 3.13Å; L163-Y165 PolarHBondContact O-N 2.74Å; Y165-S169 VanDerWaalsContact O-CB 3.29Å; Y165-S169 WeakPolarHBondContact O-CB 3.43Å; Y165-S169 PolarHBondContact O-N 3.25Å; Y165-S169 PolarHBondContact O-OG 2.87Å
166L92.7Very high90.4Very high11 Ų1156.6 Ų56.66%0.05828%0.276CS..Hα-helixtrans-63.1-49.7176.2-177.1156.6000112.5A135 I138 A162 L163 R164 S169 L170 L177A135-L166 HydrophobicContact CB-CD1 4.45Å; A135-L166 HydrophobicContact CB-CG 4.21Å; A135-L166 WeakPolarHBondContact O-CD1 3.35Å; I138-L166 HydrophobicContact CB-CD1 3.95Å; I138-L166 HydrophobicContact CG2-CD1 3.75Å; A162-L166 PolarHBondContact O-N 3.48Å; L163-L166 PolarHBondContact O-N 3.39Å; R164-L166 PolarHBondContact O-N 3.36Å; L166-S169 PolarHBondContact O-N 3.45Å; L166-S169 PolarHBondContact O-OG 3.48Å; L166-L170 HydrophobicContact CD2-CD1 3.83Å; L166-L170 WeakPolarHBondContact O-CG 3.46Å; L166-L170 PolarHBondContact O-N 3.37Å; L166-L177 HydrophobicContact CD2-CD1 4.03Å
167I91.9Very high90.1Very high0 Ų057.2 Ų57.20%028%0.28CS..Hα-helixtrans-63.3-44.7178.6-68.3-62000110.4L163 R164 S169 L170 G171 L181 I203 E207L163-I167 WeakPolarHBondContact O-CB 3.42Å; L163-I167 VanDerWaalsContact O-CG1 3.27Å; L163-I167 WeakPolarHBondContact O-CG1 3.25Å; L163-I167 PolarHBondContact O-N 2.86Å; R164-I167 PolarHBondContact O-N 3.32Å; I167-S169 VanDerWaalsContact C-N 3.31Å; I167-S169 PolarHBondContact O-N 2.78Å; I167-L170 PolarHBondContact O-N 3.23Å; I167-G171 PolarHBondContact O-N 3.19Å; I167-L181 HydrophobicContact CD1-CD2 3.97Å; I167-L181 HydrophobicContact CG1-CD2 4.03Å; I167-I203 HydrophobicContact CB-CG2 4.47Å; I167-I203 HydrophobicContact CG2-CG2 4.04Å; I167-E207 HydrophobicContact CG2-CB 4.42Å; I167-E207 HydrophobicContact CG2-CG 3.85Å
168R89.8Confident90Very high86 Ų8653.8 Ų53.833%0.32526%0.264SS..Hα-helixtrans-64.2-35.6177.5-68.3-61.5-177.8151.62.1113R164 I203 D206 E207R164-R168 HydrophobicContact CG-CG 4.14Å; R164-R168 WeakPolarHBondContact O-CB 3.49Å; R164-R168 WeakPolarHBondContact O-CG 3.27Å; R164-R168 PolarHBondContact O-N 2.97Å; R168-I203 VanDerWaalsContact NH2-CD1 3.27Å; R168-D206 IonicContact CZ-OD2 2.63Å; R168-D206 IonicContact NH1-OD2 3.19Å; R168-D206 PolarHBondContact NH1-OD2 2.89Å; R168-D206 IonicContact NH2-OD2 3.98Å; R168-D206 PolarHBondContact NH2-OD2 2.88Å; R168-E207 WeakPolarHBondContact CD-OE1 3.3Å; R168-E207 IonicContact CZ-OE1 2.9Å; R168-E207 IonicContact NE-OE1 2.74Å; R168-E207 PolarHBondContact NE-OE1 3.48Å; R168-E207 IonicContact NH1-OE1 2.63Å; R168-E207 PolarHBondContact NH1-OE1 2.85Å
169S84.8Confident89.9Confident64 Ų6452.6 Ų52.645%0.44827%0.266SS..Hα-helixtrans-68.9-48.3178.672.30000109.8W131 Y165 L166 I167 G171W131-S169 VanDerWaalsContact CH2-C 3.48Å; W131-S169 WeakPolarHBondContact CH2-O 3.5Å; Y165-S169 VanDerWaalsContact O-CB 3.29Å; Y165-S169 WeakPolarHBondContact O-CB 3.43Å; Y165-S169 PolarHBondContact O-N 3.25Å; Y165-S169 PolarHBondContact O-OG 2.87Å; L166-S169 PolarHBondContact O-N 3.45Å; L166-S169 PolarHBondContact O-OG 3.48Å; I167-S169 VanDerWaalsContact C-N 3.31Å; I167-S169 PolarHBondContact O-N 2.78Å; S169-G171 PolarHBondContact O-N 2.87Å
170L84.2Confident89.7Confident5 Ų553.7 Ų53.73%0.02628%0.279CS..Hα-helixtrans-68.6-30179.6-70.3-180000113.9W131 Y132 A135 L166 I167 V172 H173 L177W131-L170 HydrophobicContact CD2-CD2 4.45Å; W131-L170 HydrophobicContact CE3-CD2 3.8Å; W131-L170 HydrophobicContact CH2-CD2 3.87Å; W131-L170 HydrophobicContact CZ2-CD2 4.43Å; W131-L170 HydrophobicContact CZ3-CD2 3.49Å; W131-L170 VanDerWaalsContact CZ3-CD2 3.49Å; Y132-L170 HydrophobicContact CD2-CD2 4.08Å; A135-L170 HydrophobicContact CB-CD1 3.78Å; A135-L170 HydrophobicContact CB-CD2 3.89Å; A135-L170 HydrophobicContact CB-CG 4.06Å; L166-L170 HydrophobicContact CD2-CD1 3.83Å; L166-L170 WeakPolarHBondContact O-CG 3.46Å; L166-L170 PolarHBondContact O-N 3.37Å; I167-L170 PolarHBondContact O-N 3.23Å; L170-V172 PolarHBondContact O-N 2.98Å; L170-H173 WeakPolarHBondContact O-CB 3.36Å; L170-H173 PolarHBondContact O-CD2 2.87Å; L170-H173 PolarHBondContact O-N 3.15Å; L170-H173 VanDerWaalsContact O-N 3.1Å; L170-L177 HydrophobicContact CD1-CD1 4.13Å
171G84.7Confident89.7Confident16 Ų1653.9 Ų53.917%0.16528%0.28CS..G310 helixtrans54.7-128.9-175.200000111.6I167 S169 H173 S174I167-G171 PolarHBondContact O-N 3.19Å; S169-G171 PolarHBondContact O-N 2.87Å; G171-H173 PolarHBondContact O-N 3.38Å; G171-H173 VanDerWaalsContact O-N 3.13Å; G171-S174 PolarHBondContact O-N 3.19Å; G171-S174 PolarHBondContact O-OG 2.79Å
172V81.3Confident89.6Confident115 Ų11548.3 Ų48.370%0.69726%0.264SS*.G310 helixtrans-57.9-26.8179.1-62.10000113.6L170 S174 L175L170-V172 PolarHBondContact O-N 2.98Å; V172-S174 PolarHBondContact O-N 3.37Å; V172-L175 WeakPolarHBondContact O-CB 3.24Å; V172-L175 PolarHBondContact O-N 2.98Å
173H81.7Confident89.6Confident105 Ų10550.2 Ų50.249%0.48627%0.272SS..G310 helixtrans-70.5-13.1178.2-58.5-67.7000112.9Y132 L170 G171 L175 P176Y132-H173 WeakPolarHBondContact CE2-O 3.25Å; L170-H173 WeakPolarHBondContact O-CB 3.36Å; L170-H173 PolarHBondContact O-CD2 2.87Å; L170-H173 PolarHBondContact O-N 3.15Å; L170-H173 VanDerWaalsContact O-N 3.1Å; G171-H173 PolarHBondContact O-N 3.38Å; G171-H173 VanDerWaalsContact O-N 3.13Å; H173-L175 PolarHBondContact O-N 3.48Å; H173-P176 WeakPolarHBondContact O-CD 3.31Å
174S87.6Confident89.5Confident0 Ų052 Ų520%028%0.279CS..G310 helixtrans-80.21.3172.861.10000114.1G171 V172 P176 L177 F208G171-S174 PolarHBondContact O-N 3.19Å; G171-S174 PolarHBondContact O-OG 2.79Å; V172-S174 PolarHBondContact O-N 3.37Å; S174-P176 VanDerWaalsContact C-CD 3.45Å; S174-P176 VanDerWaalsContact C-N 3.34Å; S174-L177 WeakPolarHBondContact O-CA 3.47Å; S174-L177 WeakPolarHBondContact O-CB 3.34Å; S174-L177 PolarHBondContact O-N 3.49Å; S174-F208 VanDerWaalsContact OG-CZ 3.24Å; S174-F208 WeakPolarHBondContact OG-CZ 3.43Å
175L87.6Confident89.4Confident70 Ų7049.5 Ų49.537%0.36627%0.27SS..G310 helixtrans-51.5-42.5-179.7179.563000114V172 H173 L177 L178 F208 F214V172-L175 WeakPolarHBondContact O-CB 3.24Å; V172-L175 PolarHBondContact O-N 2.98Å; H173-L175 PolarHBondContact O-N 3.48Å; L175-L177 PolarHBondContact O-N 2.96Å; L175-L177 VanDerWaalsContact O-N 3.07Å; L175-L178 HydrophobicContact CD1-CB 4.41Å; L175-L178 HydrophobicContact CD1-CD2 3.96Å; L175-L178 VanDerWaalsContact O-CB 3.24Å; L175-L178 WeakPolarHBondContact O-CB 3.23Å; L175-L178 PolarHBondContact O-N 3.34Å; L175-F208 HydrophobicContact CB-CE1 3.96Å; L175-F208 HydrophobicContact CD1-CD1 4.08Å; L175-F208 HydrophobicContact CD1-CE1 4.05Å; L175-F214 HydrophobicContact CD1-CE1 3.93Å; L175-F214 HydrophobicContact CD1-CE2 3.8Å; L175-F214 HydrophobicContact CD1-CZ 3.34Å; L175-F214 HydrophobicContact CD2-CZ 4.14Å; L175-F214 HydrophobicContact CG-CZ 4.37Å
176P87.8Confident89.3Confident78 Ų7846.4 Ų46.451%0.50626%0.259SS..G310 helixtrans-60.7-19.3176.7-25.537.3000114.4H173 S174H173-P176 WeakPolarHBondContact O-CD 3.31Å; S174-P176 VanDerWaalsContact C-CD 3.45Å; S174-P176 VanDerWaalsContact C-N 3.34Å
177L90.1Very high89.3Confident13 Ų1348.6 Ų48.67%0.06827%0.273CS..G310 helixtrans-88.7-13.8178.1-52.6-179.3000113V136 Y139 L166 L170 S174 L175 L181V136-L177 HydrophobicContact CG2-CD2 4.41Å; Y139-L177 HydrophobicContact CD1-CD2 3.91Å; Y139-L177 HydrophobicContact CD2-CD1 4.26Å; Y139-L177 HydrophobicContact CE1-CD2 4.14Å; Y139-L177 HydrophobicContact CG-CD1 4.08Å; Y139-L177 HydrophobicContact CG-CD2 4.26Å; L166-L177 HydrophobicContact CD2-CD1 4.03Å; L170-L177 HydrophobicContact CD1-CD1 4.13Å; S174-L177 WeakPolarHBondContact O-CA 3.47Å; S174-L177 WeakPolarHBondContact O-CB 3.34Å; S174-L177 PolarHBondContact O-N 3.49Å; L175-L177 PolarHBondContact O-N 2.96Å; L175-L177 VanDerWaalsContact O-N 3.07Å; L177-L181 WeakPolarHBondContact O-CB 3.43Å; L177-L181 PolarHBondContact O-N 3.43Å
178L91.6Very high89.3Confident15 Ų1549.2 Ų49.28%0.07928%0.276CS..Hα-helixtrans-60.2-53.3-168.217456.6000112.4L175 L181 A182 L204 F208 F214 F218L175-L178 HydrophobicContact CD1-CB 4.41Å; L175-L178 HydrophobicContact CD1-CD2 3.96Å; L175-L178 VanDerWaalsContact O-CB 3.24Å; L175-L178 WeakPolarHBondContact O-CB 3.23Å; L175-L178 PolarHBondContact O-N 3.34Å; L178-L181 PolarHBondContact O-N 3.41Å; L178-A182 VanDerWaalsContact O-CB 3.29Å; L178-A182 WeakPolarHBondContact O-CB 3.39Å; L178-A182 PolarHBondContact O-N 3.18Å; L178-L204 HydrophobicContact CD1-CB 4.13Å; L178-L204 HydrophobicContact CD1-CD1 4.25Å; L178-L204 HydrophobicContact CD1-CD2 4.19Å; L178-L204 HydrophobicContact CD1-CG 4.42Å; L178-F208 HydrophobicContact CB-CE2 4.27Å; L178-F208 HydrophobicContact CB-CZ 4.44Å; L178-F208 HydrophobicContact CD1-CD2 3.63Å; L178-F208 HydrophobicContact CD1-CE2 3.9Å; L178-F208 HydrophobicContact CD1-CG 4.37Å; L178-F208 HydrophobicContact CD2-CB 4.03Å; L178-F208 HydrophobicContact CD2-CD1 4.26Å; L178-F208 HydrophobicContact CD2-CD2 3.91Å; L178-F208 HydrophobicContact CD2-CE2 4.41Å; L178-F208 HydrophobicContact CD2-CG 3.81Å; L178-F208 HydrophobicContact CG-CD2 4.23Å; L178-F208 HydrophobicContact CG-CE2 4.41Å; L178-F214 HydrophobicContact CD2-CD1 4.22Å; L178-F214 HydrophobicContact CD2-CD2 4.5Å; L178-F214 HydrophobicContact CD2-CG 4.25Å; L178-F218 HydrophobicContact CD1-CE1 4.06Å; L178-F218 HydrophobicContact CD1-CZ 3.95Å; L178-F218 HydrophobicContact CD2-CZ 4.19Å
179E91.1Very high89.4Confident160 Ų16045.2 Ų45.275%0.74826%0.261SS*.Hα-helixtrans-64.2-47.2-174.2-174175.9178.400111.6L181 A182 T183E179-L181 VanDerWaalsContact C-N 3.35Å; E179-L181 PolarHBondContact O-N 3.09Å; E179-A182 PolarHBondContact O-N 3.38Å; E179-T183 WeakPolarHBondContact O-CB 3.49Å; E179-T183 PolarHBondContact O-N 2.99Å; E179-T183 PolarHBondContact O-OG1 3.46Å
180G91.8Very high89.6Confident34 Ų3446.5 Ų46.535%0.35126%0.26SS..Hα-helixtrans-62.5-40.5176.800000112.5K184G180-K184 WeakPolarHBondContact O-CB 3.18Å; G180-K184 WeakPolarHBondContact O-CG 3.14Å; G180-K184 PolarHBondContact O-N 3.01Å; G180-K184 VanDerWaalsContact O-N 3.1Å
181L94.2Very high89.9Confident4 Ų452.1 Ų52.12%0.02129%0.287CS..Hα-helixtrans-71-42.1177.8-175.648.8000112.5Y139 L163 I167 L177 L178 E179 T183 K184 V185 L200 L204Y139-L181 HydrophobicContact CE2-CB 3.96Å; Y139-L181 HydrophobicContact CE2-CD1 4.09Å; Y139-L181 HydrophobicContact CE2-CD2 4.25Å; Y139-L181 HydrophobicContact CE2-CG 4.31Å; Y139-L181 PolarHBondContact OH-N 3.25Å; L163-L181 HydrophobicContact CD1-CD1 3.97Å; I167-L181 HydrophobicContact CD1-CD2 3.97Å; I167-L181 HydrophobicContact CG1-CD2 4.03Å; L177-L181 WeakPolarHBondContact O-CB 3.43Å; L177-L181 PolarHBondContact O-N 3.43Å; L178-L181 PolarHBondContact O-N 3.41Å; E179-L181 VanDerWaalsContact C-N 3.35Å; E179-L181 PolarHBondContact O-N 3.09Å; L181-T183 VanDerWaalsContact C-N 3.32Å; L181-T183 PolarHBondContact O-N 3Å; L181-K184 PolarHBondContact O-N 2.74Å; L181-V185 HydrophobicContact CD1-CG2 4.11Å; L181-V185 HydrophobicContact CG-CG2 4.43Å; L181-V185 WeakPolarHBondContact O-CB 3.44Å; L181-V185 VanDerWaalsContact O-CG2 3.31Å; L181-V185 WeakPolarHBondContact O-CG2 3.42Å; L181-V185 PolarHBondContact O-N 3.01Å; L181-L200 HydrophobicContact CD1-CD2 4.1Å; L181-L204 HydrophobicContact CD2-CD2 3.76Å; L181-L204 HydrophobicContact CG-CD1 4.24Å; L181-L204 HydrophobicContact CG-CD2 4.2Å
182A92.8Very high90.2Very high22 Ų2252.3 Ų52.318%0.18229%0.285CS..Hα-helixtrans-60.5-43.5176.800000111.3L178 E179 K184 V185 F186 L204 M221L178-A182 VanDerWaalsContact O-CB 3.29Å; L178-A182 WeakPolarHBondContact O-CB 3.39Å; L178-A182 PolarHBondContact O-N 3.18Å; E179-A182 PolarHBondContact O-N 3.38Å; A182-K184 PolarHBondContact O-N 3.01Å; A182-V185 PolarHBondContact O-N 3.02Å; A182-F186 WeakPolarHBondContact O-CB 3.2Å; A182-F186 PolarHBondContact O-N 3.06Å; A182-L204 HydrophobicContact CB-CD1 4.2Å; A182-M221 HydrophobicContact CB-SD 4.39Å
183T93.3Very high90.5Very high80 Ų8048.2 Ų48.249%0.49126%0.261SS..Hα-helixtrans-62.1-42.6175.9-56.90000111.9E179 L181 F186 T187E179-T183 WeakPolarHBondContact O-CB 3.49Å; E179-T183 PolarHBondContact O-N 2.99Å; E179-T183 PolarHBondContact O-OG1 3.46Å; L181-T183 VanDerWaalsContact C-N 3.32Å; L181-T183 PolarHBondContact O-N 3Å; T183-F186 WeakPolarHBondContact O-CB 3.34Å; T183-T187 WeakPolarHBondContact O-CB 3.48Å; T183-T187 PolarHBondContact O-N 3.17Å; T183-T187 PolarHBondContact O-OG1 3.21Å
184K93.1Very high91Very high37 Ų3744.8 Ų44.816%0.16124%0.244CC..Hα-helixtrans-65.3-46.7175.9-78.4171.6-178.8159.30112Y139 E140 G180 L181 A182 F186 T187 F188Y139-K184 PolarHBondContact OH-NZ 3.45Å; E140-K184 IonicContact OE2-NZ 2.98Å; G180-K184 WeakPolarHBondContact O-CB 3.18Å; G180-K184 WeakPolarHBondContact O-CG 3.14Å; G180-K184 PolarHBondContact O-N 3.01Å; G180-K184 VanDerWaalsContact O-N 3.1Å; L181-K184 PolarHBondContact O-N 2.74Å; A182-K184 PolarHBondContact O-N 3.01Å; K184-F186 VanDerWaalsContact C-N 3.28Å; K184-F186 PolarHBondContact O-N 3.36Å; K184-T187 PolarHBondContact O-N 3.11Å; K184-F188 HydrophobicContact CB-CD2 4.35Å; K184-F188 HydrophobicContact CB-CE2 3.71Å; K184-F188 HydrophobicContact CB-CZ 3.9Å; K184-F188 HydrophobicContact CG-CE2 4.33Å; K184-F188 HydrophobicContact CG-CZ 4.07Å; K184-F188 WeakPolarHBondContact O-CD2 2.94Å; K184-F188 WeakPolarHBondContact O-CG 3.5Å; K184-F188 PolarHBondContact O-N 2.77Å
185V92.8Very high91.2Very high1 Ų145.6 Ų45.61%0.00625%0.25CS..Hα-helixtrans-54.3-48.3176.2164.30000110.6L181 A182 Y189 F197 L200 A201L181-V185 HydrophobicContact CD1-CG2 4.11Å; L181-V185 HydrophobicContact CG-CG2 4.43Å; L181-V185 WeakPolarHBondContact O-CB 3.44Å; L181-V185 VanDerWaalsContact O-CG2 3.31Å; L181-V185 WeakPolarHBondContact O-CG2 3.42Å; L181-V185 PolarHBondContact O-N 3.01Å; A182-V185 PolarHBondContact O-N 3.02Å; V185-Y189 WeakPolarHBondContact O-CB 3.46Å; V185-Y189 PolarHBondContact O-N 3.21Å; V185-F197 HydrophobicContact CG1-CB 4.24Å; V185-F197 VanDerWaalsContact CG1-O 3.32Å; V185-F197 WeakPolarHBondContact CG1-O 3.33Å; V185-L200 HydrophobicContact CG2-CB 4.27Å; V185-L200 HydrophobicContact CG2-CD2 3.74Å; V185-L200 HydrophobicContact CG2-CG 3.91Å; V185-A201 HydrophobicContact CG1-CB 4.09Å
186F90Very high91.5Very high58 Ų5842.3 Ų42.325%0.25423%0.233SC..Hα-helixtrans-57-54.2175.8170.7-109.7000111.9A182 T183 K184 F188 Y189 Q190 V224 L225A182-F186 WeakPolarHBondContact O-CB 3.2Å; A182-F186 PolarHBondContact O-N 3.06Å; T183-F186 WeakPolarHBondContact O-CB 3.34Å; K184-F186 VanDerWaalsContact C-N 3.28Å; K184-F186 PolarHBondContact O-N 3.36Å; F186-F188 PolarHBondContact O-N 3.31Å; F186-Y189 PolarHBondContact O-N 3.01Å; F186-Q190 HydrophobicContact CD2-CG 4.31Å; F186-Q190 VanDerWaalsContact CE1-OE1 3.31Å; F186-Q190 VanDerWaalsContact CE2-CD 3.46Å; F186-Q190 HydrophobicContact CE2-CG 3.82Å; F186-Q190 HydrophobicContact CZ-CG 4.02Å; F186-Q190 WeakPolarHBondContact O-CG 3.37Å; F186-Q190 PolarHBondContact O-N 2.93Å; F186-V224 HydrophobicContact CD2-CB 4.36Å; F186-V224 HydrophobicContact CD2-CG1 4.44Å; F186-V224 HydrophobicContact CE2-CB 3.68Å; F186-V224 HydrophobicContact CE2-CG1 3.41Å; F186-V224 VanDerWaalsContact CE2-CG1 3.41Å; F186-V224 HydrophobicContact CE2-CG2 4.21Å; F186-V224 HydrophobicContact CZ-CG1 4.04Å; F186-L225 HydrophobicContact CD2-CD2 4.43Å
187T92.7Very high91.8Very high58 Ų5838.6 Ų38.636%0.35621%0.209SC..Hα-helixtrans-58.6-47.2-177.8-56.80000111.6T183 K184 Y189 Q190 M191T183-T187 WeakPolarHBondContact O-CB 3.48Å; T183-T187 PolarHBondContact O-N 3.17Å; T183-T187 PolarHBondContact O-OG1 3.21Å; K184-T187 PolarHBondContact O-N 3.11Å; T187-Y189 PolarHBondContact O-N 3.37Å; T187-Q190 PolarHBondContact O-N 3.44Å; T187-M191 HydrophobicContact CG2-SD 4.33Å; T187-M191 WeakPolarHBondContact O-CG 3.49Å; T187-M191 PolarHBondContact O-N 2.9Å
188F93.5Very high91.9Very high13 Ų1338 Ų386%0.05721%0.206CC..Hα-helixtrans-67.3-38.8-179.2-56.2-29000112.3I146 E147 V150 K184 F186 Q190 M191 T192 F197I146-F188 HydrophobicContact CB-CD2 4.4Å; I146-F188 HydrophobicContact CB-CE2 4.01Å; I146-F188 HydrophobicContact CB-CZ 4.48Å; I146-F188 HydrophobicContact CD1-CE2 4.49Å; I146-F188 HydrophobicContact CG2-CD2 3.49Å; I146-F188 VanDerWaalsContact CG2-CD2 3.49Å; I146-F188 HydrophobicContact CG2-CE2 3.58Å; I146-F188 HydrophobicContact CG2-CG 4.01Å; I146-F188 HydrophobicContact CG2-CZ 4.2Å; E147-F188 HydrophobicContact CB-CE1 4.44Å; E147-F188 HydrophobicContact CB-CZ 4.5Å; E147-F188 HydrophobicContact CG-CE1 3.56Å; E147-F188 HydrophobicContact CG-CZ 3.43Å; E147-F188 VanDerWaalsContact CG-CZ 3.43Å; V150-F188 HydrophobicContact CG2-CB 3.92Å; V150-F188 HydrophobicContact CG2-CD1 3.97Å; V150-F188 HydrophobicContact CG2-CG 4.13Å; K184-F188 HydrophobicContact CB-CD2 4.35Å; K184-F188 HydrophobicContact CB-CE2 3.71Å; K184-F188 HydrophobicContact CB-CZ 3.9Å; K184-F188 HydrophobicContact CG-CE2 4.33Å; K184-F188 HydrophobicContact CG-CZ 4.07Å; K184-F188 WeakPolarHBondContact O-CD2 2.94Å; K184-F188 WeakPolarHBondContact O-CG 3.5Å; K184-F188 PolarHBondContact O-N 2.77Å; F186-F188 PolarHBondContact O-N 3.31Å; F188-Q190 PolarHBondContact O-N 3.04Å; F188-M191 PolarHBondContact O-N 2.74Å; F188-T192 PolarHBondContact O-N 3.01Å; F188-T192 VanDerWaalsContact O-N 3.1Å; F188-T192 PolarHBondContact O-OG1 3.27Å; F188-F197 HydrophobicContact CB-CD1 4.12Å; F188-F197 HydrophobicContact CB-CD2 4Å; F188-F197 HydrophobicContact CB-CE1 3.7Å; F188-F197 HydrophobicContact CB-CE2 3.54Å; F188-F197 HydrophobicContact CB-CG 4.28Å; F188-F197 HydrophobicContact CB-CZ 3.39Å; F188-F197 HydrophobicContact CD2-CD1 4.36Å; F188-F197 AromaticContact CD2-CE1 3.7Å; F188-F197 HydrophobicContact CD2-CE1 3.7Å; F188-F197 HydrophobicContact CD2-CZ 4.05Å; F188-F197 HydrophobicContact CG-CE1 4.14Å; F188-F197 HydrophobicContact CG-CZ 4.06Å
189Y91.9Very high91.9Very high1 Ų139 Ų390%0.00421%0.209CC..Hα-helixtrans-65-40.3178.2-169.5-109.7000112.1V185 F186 T187 M191 T192 T193 H194 F197 L198 L225 H228 A229V185-Y189 WeakPolarHBondContact O-CB 3.46Å; V185-Y189 PolarHBondContact O-N 3.21Å; F186-Y189 PolarHBondContact O-N 3.01Å; T187-Y189 PolarHBondContact O-N 3.37Å; Y189-M191 PolarHBondContact O-N 3Å; Y189-T192 PolarHBondContact O-N 2.97Å; Y189-T193 HydrophobicContact CE1-CG2 4.4Å; Y189-T193 WeakPolarHBondContact O-CA 3.41Å; Y189-T193 VanDerWaalsContact O-CG2 3.25Å; Y189-T193 WeakPolarHBondContact O-CG2 3.38Å; Y189-T193 PolarHBondContact O-N 3.4Å; Y189-H194 VanDerWaalsContact CD2-O 3.32Å; Y189-H194 WeakPolarHBondContact CD2-O 3.31Å; Y189-H194 WeakPolarHBondContact CE2-O 3.31Å; Y189-F197 HydrophobicContact CD2-CB 3.94Å; Y189-F197 HydrophobicContact CD2-CD2 4.34Å; Y189-F197 HydrophobicContact CG-CB 4.39Å; Y189-L198 HydrophobicContact CD1-CD2 4.42Å; Y189-L198 HydrophobicContact CD2-CD2 4.4Å; Y189-L198 HydrophobicContact CD2-CG 4.35Å; Y189-L198 HydrophobicContact CE1-CD2 3.94Å; Y189-L198 HydrophobicContact CE2-CD1 4.16Å; Y189-L198 HydrophobicContact CE2-CD2 3.96Å; Y189-L198 HydrophobicContact CE2-CG 3.7Å; Y189-L225 HydrophobicContact CD1-CD2 3.37Å; Y189-L225 HydrophobicContact CE1-CD2 4.16Å; Y189-L225 HydrophobicContact CG-CD2 3.83Å; Y189-H228 HydrophobicContact CD1-CB 4.3Å; Y189-H228 HydrophobicContact CE1-CB 3.64Å; Y189-A229 VanDerWaalsContact OH-CA 3.24Å; Y189-A229 WeakPolarHBondContact OH-CA 3.44Å; Y189-A229 WeakPolarHBondContact OH-CB 3.43Å; Y189-A229 PolarHBondContact OH-N 3.47Å
190Q88.5Confident92Very high92 Ų9231.4 Ų31.443%0.4317%0.173SC..Hα-helixtrans-61-34.4174.4-71.2-167.7-48.700112.6F186 T187 F188F186-Q190 HydrophobicContact CD2-CG 4.31Å; F186-Q190 VanDerWaalsContact CE1-OE1 3.31Å; F186-Q190 VanDerWaalsContact CE2-CD 3.46Å; F186-Q190 HydrophobicContact CE2-CG 3.82Å; F186-Q190 HydrophobicContact CZ-CG 4.02Å; F186-Q190 WeakPolarHBondContact O-CG 3.37Å; F186-Q190 PolarHBondContact O-N 2.93Å; T187-Q190 PolarHBondContact O-N 3.44Å; F188-Q190 PolarHBondContact O-N 3.04Å
191M89.8Confident92Very high123 Ų12329.8 Ų29.861%0.60616%0.157SC*.Hα-helixtrans-76.1-38.4-178.4-68.2176.474.700113.7V150 T187 F188 Y189V150-M191 HydrophobicContact CG1-CE 3.95Å; T187-M191 HydrophobicContact CG2-SD 4.33Å; T187-M191 WeakPolarHBondContact O-CG 3.49Å; T187-M191 PolarHBondContact O-N 2.9Å; F188-M191 PolarHBondContact O-N 2.74Å; Y189-M191 PolarHBondContact O-N 3Å
192T90.4Very high91.9Very high19 Ų1929.6 Ų29.612%0.11716%0.156CC..Hα-helixtrans-132.8-11.7-168.664.90000115.6V150 K151 F188 Y189 H194 K232V150-T192 HydrophobicContact CB-CG2 4.42Å; V150-T192 HydrophobicContact CG1-CG2 4.09Å; V150-T192 HydrophobicContact CG2-CG2 3.91Å; V150-T192 WeakPolarHBondContact O-CG2 3.49Å; K151-T192 HydrophobicContact CG-CG2 4.28Å; F188-T192 PolarHBondContact O-N 3.01Å; F188-T192 VanDerWaalsContact O-N 3.1Å; F188-T192 PolarHBondContact O-OG1 3.27Å; Y189-T192 PolarHBondContact O-N 2.97Å; T192-H194 PolarHBondContact O-N 3.07Å; T192-H194 PolarHBondContact OG1-CD2 3.4Å; T192-H194 PolarHBondContact OG1-NE2 3.47Å; T192-K232 PolarHBondContact O-NZ 2.92Å
193T89.1Confident91.8Very high30 Ų3028.6 Ų28.618%0.18415%0.147CC..  trans47.741179.949.40000112.7Y189 K232Y189-T193 HydrophobicContact CE1-CG2 4.4Å; Y189-T193 WeakPolarHBondContact O-CA 3.41Å; Y189-T193 VanDerWaalsContact O-CG2 3.25Å; Y189-T193 WeakPolarHBondContact O-CG2 3.38Å; Y189-T193 PolarHBondContact O-N 3.4Å; T193-K232 PolarHBondContact O-NZ 2.89Å; T193-K232 WeakPolarHBondContact OG1-CE 3.39Å; T193-K232 PolarHBondContact OG1-NZ 3.39Å
194H91.8Very high91.6Very high32 Ų3224.8 Ų24.815%0.14812%0.124CC..  trans-74.8131.4171.1-63.7-31.9000109.9V150 Y189 T192 C196 F197V150-H194 PolarHBondContact O-CD2 2.83Å; V150-H194 PolarHBondContact O-NE2 2.89Å; V150-H194 VanDerWaalsContact O-NE2 3.16Å; Y189-H194 VanDerWaalsContact CD2-O 3.32Å; Y189-H194 WeakPolarHBondContact CD2-O 3.31Å; Y189-H194 WeakPolarHBondContact CE2-O 3.31Å; T192-H194 PolarHBondContact O-N 3.07Å; T192-H194 PolarHBondContact OG1-CD2 3.4Å; T192-H194 PolarHBondContact OG1-NE2 3.47Å; H194-C196 PolarHBondContact O-N 2.93Å; H194-F197 HydrophobicContact CB-CD2 3.93Å; H194-F197 HydrophobicContact CB-CE2 3.91Å; H194-F197 PolarHBondContact O-N 3.47Å
195S92Very high91.4Very high17 Ų1723.1 Ų23.112%0.11912%0.117CC..Hα-helixtrans-61.7-29-175.972.40000112.5F197 L198 Y199 D240S195-F197 PolarHBondContact O-N 3.23Å; S195-L198 WeakPolarHBondContact O-CA 3.49Å; S195-L198 VanDerWaalsContact O-CB 3.28Å; S195-L198 WeakPolarHBondContact O-CB 3.16Å; S195-L198 PolarHBondContact O-N 3.46Å; S195-Y199 PolarHBondContact O-N 3.05Å; S195-D240 WeakPolarHBondContact CB-OD2 3.09Å; S195-D240 PolarHBondContact OG-OD2 3.43Å
196C93.1Very high91.2Very high2 Ų224.8 Ų24.81%0.01413%0.126CC..Hα-helixtrans-55.7-23.1176.567.30000115.1E157 C160 H194 Y199 L200E157-C196 WeakPolarHBondContact OE2-CB 3.13Å; C160-C196 HydrophobicContact CB-CB 4.18Å; H194-C196 PolarHBondContact O-N 2.93Å; C196-Y199 WeakPolarHBondContact O-CB 3.18Å; C196-L200 WeakPolarHBondContact O-CB 3.25Å; C196-L200 PolarHBondContact O-N 3.22Å
197F93.8Very high91Very high0 Ų024.2 Ų24.20%012%0.124CC..Hα-helixtrans-78.2-32.3172.7-61.2-53.9000112.6I146 A156 V185 F188 Y189 H194 S195 Y199 L200 A201I146-F197 HydrophobicContact CG2-CE1 3.91Å; I146-F197 HydrophobicContact CG2-CZ 3.8Å; A156-F197 HydrophobicContact CB-CE2 4.45Å; A156-F197 HydrophobicContact CB-CZ 3.9Å; V185-F197 HydrophobicContact CG1-CB 4.24Å; V185-F197 VanDerWaalsContact CG1-O 3.32Å; V185-F197 WeakPolarHBondContact CG1-O 3.33Å; F188-F197 HydrophobicContact CB-CD1 4.12Å; F188-F197 HydrophobicContact CB-CD2 4Å; F188-F197 HydrophobicContact CB-CE1 3.7Å; F188-F197 HydrophobicContact CB-CE2 3.54Å; F188-F197 HydrophobicContact CB-CG 4.28Å; F188-F197 HydrophobicContact CB-CZ 3.39Å; F188-F197 HydrophobicContact CD2-CD1 4.36Å; F188-F197 AromaticContact CD2-CE1 3.7Å; F188-F197 HydrophobicContact CD2-CE1 3.7Å; F188-F197 HydrophobicContact CD2-CZ 4.05Å; F188-F197 HydrophobicContact CG-CE1 4.14Å; F188-F197 HydrophobicContact CG-CZ 4.06Å; Y189-F197 HydrophobicContact CD2-CB 3.94Å; Y189-F197 HydrophobicContact CD2-CD2 4.34Å; Y189-F197 HydrophobicContact CG-CB 4.39Å; H194-F197 HydrophobicContact CB-CD2 3.93Å; H194-F197 HydrophobicContact CB-CE2 3.91Å; H194-F197 PolarHBondContact O-N 3.47Å; S195-F197 PolarHBondContact O-N 3.23Å; F197-Y199 VanDerWaalsContact C-N 3.34Å; F197-L200 PolarHBondContact O-N 2.63Å; F197-A201 WeakPolarHBondContact O-CB 3.49Å; F197-A201 PolarHBondContact O-N 3.13Å
198L92.7Very high90.8Very high0 Ų022.1 Ų22.10%011%0.11CC..Hα-helixtrans-65.9-41.6167.6-59.2179.3000110.2Y189 S195 L200 A201 S202 L225 A229 T237 D240 L241 L244Y189-L198 HydrophobicContact CD1-CD2 4.42Å; Y189-L198 HydrophobicContact CD2-CD2 4.4Å; Y189-L198 HydrophobicContact CD2-CG 4.35Å; Y189-L198 HydrophobicContact CE1-CD2 3.94Å; Y189-L198 HydrophobicContact CE2-CD1 4.16Å; Y189-L198 HydrophobicContact CE2-CD2 3.96Å; Y189-L198 HydrophobicContact CE2-CG 3.7Å; S195-L198 WeakPolarHBondContact O-CA 3.49Å; S195-L198 VanDerWaalsContact O-CB 3.28Å; S195-L198 WeakPolarHBondContact O-CB 3.16Å; S195-L198 PolarHBondContact O-N 3.46Å; L198-L200 VanDerWaalsContact C-N 3.34Å; L198-L200 PolarHBondContact O-N 3.36Å; L198-A201 WeakPolarHBondContact O-CB 3.47Å; L198-A201 PolarHBondContact O-N 3.49Å; L198-S202 PolarHBondContact O-N 2.89Å; L198-L225 HydrophobicContact CD2-CB 3.94Å; L198-L225 HydrophobicContact CD2-CD1 4.22Å; L198-L225 HydrophobicContact CD2-CD2 4.5Å; L198-L225 HydrophobicContact CD2-CG 4.45Å; L198-A229 HydrophobicContact CD1-CB 3.92Å; L198-T237 HydrophobicContact CD1-CG2 3.94Å; L198-D240 HydrophobicContact CB-CB 3.88Å; L198-D240 HydrophobicContact CD1-CB 4.5Å; L198-L241 HydrophobicContact CD1-CB 4.21Å; L198-L244 HydrophobicContact CB-CD2 4.46Å; L198-L244 HydrophobicContact CD2-CD2 4.24Å
199Y91.9Very high90.5Very high35 Ų3521.7 Ų21.714%0.13711%0.11CC..Hα-helixtrans-57.7-47.8173.1178.8-124.9000111.6R164 S195 C196 F197 S202 I203 D240R164-Y199 WeakPolarHBondContact CD-OH 3.32Å; R164-Y199 PolarHBondContact NE-OH 3.32Å; S195-Y199 PolarHBondContact O-N 3.05Å; C196-Y199 WeakPolarHBondContact O-CB 3.18Å; F197-Y199 VanDerWaalsContact C-N 3.34Å; Y199-S202 WeakPolarHBondContact O-CA 3.48Å; Y199-S202 VanDerWaalsContact O-CB 3.31Å; Y199-S202 WeakPolarHBondContact O-CB 3.22Å; Y199-S202 PolarHBondContact O-N 3.06Å; Y199-S202 PolarHBondContact O-OG 3.12Å; Y199-I203 HydrophobicContact CE2-CD1 4.24Å; Y199-I203 HydrophobicContact CE2-CG1 4.46Å; Y199-I203 PolarHBondContact O-N 3.31Å; Y199-I203 VanDerWaalsContact O-N 3.11Å; Y199-D240 WeakPolarHBondContact CB-OD1 3.36Å
200L93.4Very high90.1Very high1 Ų124.6 Ų24.61%0.00513%0.134CC..Hα-helixtrans-64.7-41.5178.9-171.754.7000111.8C160 L163 L181 V185 C196 F197 L198 S202 I203 L204C160-L200 HydrophobicContact CB-CB 4.37Å; C160-L200 HydrophobicContact CB-CD2 4.27Å; L163-L200 HydrophobicContact CB-CD1 4.11Å; L163-L200 HydrophobicContact CB-CD2 4.3Å; L163-L200 HydrophobicContact CD1-CD2 3.81Å; L181-L200 HydrophobicContact CD1-CD2 4.1Å; V185-L200 HydrophobicContact CG2-CB 4.27Å; V185-L200 HydrophobicContact CG2-CD2 3.74Å; V185-L200 HydrophobicContact CG2-CG 3.91Å; C196-L200 WeakPolarHBondContact O-CB 3.25Å; C196-L200 PolarHBondContact O-N 3.22Å; F197-L200 PolarHBondContact O-N 2.63Å; L198-L200 VanDerWaalsContact C-N 3.34Å; L198-L200 PolarHBondContact O-N 3.36Å; L200-S202 PolarHBondContact O-N 3.31Å; L200-I203 WeakPolarHBondContact O-CB 3.47Å; L200-I203 PolarHBondContact O-N 3.11Å; L200-L204 PolarHBondContact O-N 3.11Å; L200-L204 VanDerWaalsContact O-N 3.11Å
201A92.4Very high89.9Confident0 Ų022.5 Ų22.50%013%0.125CC..Hα-helixtrans-54.5-41.6169.900000111.2V185 F197 L198 I203 L204 V205 M221 L225 L244V185-A201 HydrophobicContact CG1-CB 4.09Å; F197-A201 WeakPolarHBondContact O-CB 3.49Å; F197-A201 PolarHBondContact O-N 3.13Å; L198-A201 WeakPolarHBondContact O-CB 3.47Å; L198-A201 PolarHBondContact O-N 3.49Å; A201-I203 PolarHBondContact O-N 2.89Å; A201-L204 WeakPolarHBondContact O-CB 3.38Å; A201-L204 PolarHBondContact O-N 2.66Å; A201-L204 VanDerWaalsContact O-N 3.12Å; A201-V205 WeakPolarHBondContact O-CG2 3.45Å; A201-V205 PolarHBondContact O-N 2.86Å; A201-M221 HydrophobicContact CB-CE 3.71Å; A201-M221 HydrophobicContact CB-SD 4.23Å; A201-L225 HydrophobicContact CB-CD1 3.96Å; A201-L244 HydrophobicContact CB-CD1 4.02Å; A201-L244 HydrophobicContact CB-CD2 4.13Å
202S90.3Very high89.7Confident0 Ų020.6 Ų20.60%012%0.115CC..Hα-helixtrans-63.9-3317988.80000111.9L198 Y199 L200 D206 L244 R247L198-S202 PolarHBondContact O-N 2.89Å; Y199-S202 WeakPolarHBondContact O-CA 3.48Å; Y199-S202 VanDerWaalsContact O-CB 3.31Å; Y199-S202 WeakPolarHBondContact O-CB 3.22Å; Y199-S202 PolarHBondContact O-N 3.06Å; Y199-S202 PolarHBondContact O-OG 3.12Å; L200-S202 PolarHBondContact O-N 3.31Å; S202-D206 WeakPolarHBondContact O-CB 3.47Å; S202-D206 PolarHBondContact O-N 3.45Å; S202-L244 VanDerWaalsContact CA-CD1 3.49Å; S202-R247 PolarHBondContact OG-NH1 3.09Å
203I90.4Very high89.6Confident1 Ų128.5 Ų28.51%0.00514%0.143CC..Hα-helixtrans-67.3-44.1174.4-62-67.1000110.3R164 I167 R168 Y199 L200 A201 V205 D206 E207 R247R164-I203 HydrophobicContact CB-CG1 4.32Å; R164-I203 HydrophobicContact CG-CD1 3.67Å; R164-I203 HydrophobicContact CG-CG1 3.91Å; R164-I203 HydrophobicContact CG-CG2 4.34Å; I167-I203 HydrophobicContact CB-CG2 4.47Å; I167-I203 HydrophobicContact CG2-CG2 4.04Å; R168-I203 VanDerWaalsContact NH2-CD1 3.27Å; Y199-I203 HydrophobicContact CE2-CD1 4.24Å; Y199-I203 HydrophobicContact CE2-CG1 4.46Å; Y199-I203 PolarHBondContact O-N 3.31Å; Y199-I203 VanDerWaalsContact O-N 3.11Å; L200-I203 WeakPolarHBondContact O-CB 3.47Å; L200-I203 PolarHBondContact O-N 3.11Å; A201-I203 PolarHBondContact O-N 2.89Å; I203-V205 VanDerWaalsContact C-N 3.34Å; I203-V205 PolarHBondContact O-N 3.05Å; I203-D206 CarbonylContact O-C 3.54Å; I203-D206 PolarHBondContact O-N 3.35Å; I203-E207 PolarHBondContact O-N 2.99Å; I203-R247 VanDerWaalsContact CD1-NH1 3.34Å
204L90.7Very high89.5Confident0 Ų029.4 Ų29.40%014%0.144CC..Hα-helixtrans-60.1-46.4178.3-59.3-179.3000111.1L178 L181 A182 L200 A201 D206 E207 F208 F218L178-L204 HydrophobicContact CD1-CB 4.13Å; L178-L204 HydrophobicContact CD1-CD1 4.25Å; L178-L204 HydrophobicContact CD1-CD2 4.19Å; L178-L204 HydrophobicContact CD1-CG 4.42Å; L181-L204 HydrophobicContact CD2-CD2 3.76Å; L181-L204 HydrophobicContact CG-CD1 4.24Å; L181-L204 HydrophobicContact CG-CD2 4.2Å; A182-L204 HydrophobicContact CB-CD1 4.2Å; L200-L204 PolarHBondContact O-N 3.11Å; L200-L204 VanDerWaalsContact O-N 3.11Å; A201-L204 WeakPolarHBondContact O-CB 3.38Å; A201-L204 PolarHBondContact O-N 2.66Å; A201-L204 VanDerWaalsContact O-N 3.12Å; L204-D206 VanDerWaalsContact C-N 3.33Å; L204-D206 PolarHBondContact O-N 3.44Å; L204-E207 PolarHBondContact O-N 3.16Å; L204-F208 HydrophobicContact CD2-CE2 4.46Å; L204-F208 VanDerWaalsContact O-CD2 3.25Å; L204-F208 WeakPolarHBondContact O-CD2 3.44Å; L204-F208 PolarHBondContact O-N 2.89Å; L204-F218 HydrophobicContact CB-CE1 4.08Å; L204-F218 HydrophobicContact CB-CZ 4.48Å
205V88.8Confident89.3Confident3 Ų328.5 Ų28.52%0.01814%0.141CC..Hα-helixtrans-67.8-37.3178.4-167.80000111.3A201 I203 E207 G209 F218 M221 L244 S248 K252A201-V205 WeakPolarHBondContact O-CG2 3.45Å; A201-V205 PolarHBondContact O-N 2.86Å; I203-V205 VanDerWaalsContact C-N 3.34Å; I203-V205 PolarHBondContact O-N 3.05Å; V205-E207 PolarHBondContact O-N 3.41Å; V205-G209 WeakPolarHBondContact O-CA 3.41Å; V205-G209 PolarHBondContact O-N 3.42Å; V205-F218 HydrophobicContact CG1-CD2 4.26Å; V205-F218 HydrophobicContact CG1-CG 4.4Å; V205-F218 HydrophobicContact CG2-CB 4.22Å; V205-F218 HydrophobicContact CG2-CD1 3.64Å; V205-F218 HydrophobicContact CG2-CD2 4.37Å; V205-F218 HydrophobicContact CG2-CE1 4.04Å; V205-F218 HydrophobicContact CG2-CG 3.83Å; V205-M221 HydrophobicContact CG2-CE 4.16Å; V205-L244 HydrophobicContact CG2-CD1 4.14Å; V205-S248 VanDerWaalsContact CG1-CA 3.42Å; V205-K252 WeakPolarHBondContact O-CD 3.34Å
206D87.6Confident89.1Confident35 Ų3531.1 Ų31.119%0.18716%0.158CC..Hα-helixtrans-68.8-18.6175.9-166.253.5000114R168 S202 I203 L204 R247 K252R168-D206 IonicContact CZ-OD2 2.63Å; R168-D206 IonicContact NH1-OD2 3.19Å; R168-D206 PolarHBondContact NH1-OD2 2.89Å; R168-D206 IonicContact NH2-OD2 3.98Å; R168-D206 PolarHBondContact NH2-OD2 2.88Å; S202-D206 WeakPolarHBondContact O-CB 3.47Å; S202-D206 PolarHBondContact O-N 3.45Å; I203-D206 CarbonylContact O-C 3.54Å; I203-D206 PolarHBondContact O-N 3.35Å; L204-D206 VanDerWaalsContact C-N 3.33Å; L204-D206 PolarHBondContact O-N 3.44Å; D206-R247 HydrophobicContact CB-CB 4.47Å; D206-R247 HydrophobicContact CB-CG 4.27Å; D206-R247 IonicContact OD2-CZ 2.83Å; D206-R247 IonicContact OD2-NH2 3.97Å; D206-K252 VanDerWaalsContact C-NZ 3.26Å; D206-K252 WeakPolarHBondContact O-CE 3.26Å; D206-K252 PolarHBondContact O-NZ 2.99Å
207E87.3Confident88.9Confident47 Ų4732.9 Ų32.922%0.2218%0.176CC..Hα-helixtrans-92.3-46172.2-72.8-56.3138.200111.3I167 R168 I203 L204 V205 K252I167-E207 HydrophobicContact CG2-CB 4.42Å; I167-E207 HydrophobicContact CG2-CG 3.85Å; R168-E207 WeakPolarHBondContact CD-OE1 3.3Å; R168-E207 IonicContact CZ-OE1 2.9Å; R168-E207 IonicContact NE-OE1 2.74Å; R168-E207 PolarHBondContact NE-OE1 3.48Å; R168-E207 IonicContact NH1-OE1 2.63Å; R168-E207 PolarHBondContact NH1-OE1 2.85Å; I203-E207 PolarHBondContact O-N 2.99Å; L204-E207 PolarHBondContact O-N 3.16Å; V205-E207 PolarHBondContact O-N 3.41Å; E207-K252 PolarHBondContact O-NZ 3.19Å
208F88.2Confident88.6Confident13 Ų1333.5 Ų33.56%0.05718%0.179CC..Hα-helixtrans-107.5-16.6-167.7-58.2-73.8000115.4S174 L175 L178 L204 A210 D211 F214 F218S174-F208 VanDerWaalsContact OG-CZ 3.24Å; S174-F208 WeakPolarHBondContact OG-CZ 3.43Å; L175-F208 HydrophobicContact CB-CE1 3.96Å; L175-F208 HydrophobicContact CD1-CD1 4.08Å; L175-F208 HydrophobicContact CD1-CE1 4.05Å; L178-F208 HydrophobicContact CB-CE2 4.27Å; L178-F208 HydrophobicContact CB-CZ 4.44Å; L178-F208 HydrophobicContact CD1-CD2 3.63Å; L178-F208 HydrophobicContact CD1-CE2 3.9Å; L178-F208 HydrophobicContact CD1-CG 4.37Å; L178-F208 HydrophobicContact CD2-CB 4.03Å; L178-F208 HydrophobicContact CD2-CD1 4.26Å; L178-F208 HydrophobicContact CD2-CD2 3.91Å; L178-F208 HydrophobicContact CD2-CE2 4.41Å; L178-F208 HydrophobicContact CD2-CG 3.81Å; L178-F208 HydrophobicContact CG-CD2 4.23Å; L178-F208 HydrophobicContact CG-CE2 4.41Å; L204-F208 HydrophobicContact CD2-CE2 4.46Å; L204-F208 VanDerWaalsContact O-CD2 3.25Å; L204-F208 WeakPolarHBondContact O-CD2 3.44Å; L204-F208 PolarHBondContact O-N 2.89Å; F208-A210 PolarHBondContact O-N 3.31Å; F208-D211 PolarHBondContact O-N 3.2Å; F208-D211 VanDerWaalsContact O-N 3.12Å; F208-F214 HydrophobicContact CB-CD2 4.05Å; F208-F218 HydrophobicContact CB-CE2 3.9Å; F208-F218 HydrophobicContact CB-CZ 3.8Å
209G85.9Confident88.4Confident5 Ų535.2 Ų35.25%0.05219%0.188CC..THydrogen-bonded Turntrans-65.5-6.5-17200000116.3V205 D211 K252V205-G209 WeakPolarHBondContact O-CA 3.41Å; V205-G209 PolarHBondContact O-N 3.42Å; G209-D211 VanDerWaalsContact C-N 3.25Å; G209-K252 VanDerWaalsContact C-CB 3.43Å; G209-K252 VanDerWaalsContact O-CB 3.29Å; G209-K252 WeakPolarHBondContact O-CB 3.38Å
210A83.4Confident88.2Confident62 Ų6240.3 Ų40.351%0.51221%0.213SC..THydrogen-bonded Turntrans-73.8-29.7177.700000109.8F208 Q212 K252F208-A210 PolarHBondContact O-N 3.31Å; A210-Q212 PolarHBondContact O-N 2.83Å; A210-K252 HydrophobicContact CB-CB 4.45Å; A210-K252 HydrophobicContact CB-CD 3.71Å
211D86Confident88Confident47 Ų4741 Ų4125%0.25122%0.216SC..SBendtrans-81.1111.6176.5-170.6-24.4000109.1F208 G209 R213 F214F208-D211 PolarHBondContact O-N 3.2Å; F208-D211 VanDerWaalsContact O-N 3.12Å; G209-D211 VanDerWaalsContact C-N 3.25Å; D211-R213 VanDerWaalsContact CG-NE 3.35Å; D211-R213 PolarHBondContact O-N 3.21Å; D211-R213 WeakPolarHBondContact OD1-CB 3.41Å; D211-R213 WeakPolarHBondContact OD1-CG 3.32Å; D211-R213 IonicContact OD1-CZ 3.9Å; D211-R213 PolarHBondContact OD1-N 2.9Å; D211-R213 IonicContact OD1-NE 2.78Å; D211-R213 PolarHBondContact OD1-NE 2.99Å; D211-R213 IonicContact OD2-CZ 2.95Å; D211-R213 IonicContact OD2-NE 3.99Å; D211-R213 PolarHBondContact OD2-NE 3Å; D211-R213 IonicContact OD2-NH2 2.96Å; D211-R213 PolarHBondContact OD2-NH2 3.05Å; D211-F214 HydrophobicContact CB-CD2 3.63Å; D211-F214 HydrophobicContact CB-CE2 3.74Å; D211-F214 PolarHBondContact O-N 2.98Å; D211-F214 WeakPolarHBondContact OD2-CE2 3.2Å
212Q85Confident87.8Confident84 Ų8441.1 Ų41.139%0.39322%0.217SC..THydrogen-bonded Turntrans-59.2-20-177.7-62.8-60.4-56.600112.7A210 F214 V215A210-Q212 PolarHBondContact O-N 2.83Å; Q212-F214 VanDerWaalsContact C-N 3.26Å; Q212-F214 PolarHBondContact O-N 2.77Å; Q212-V215 PolarHBondContact O-N 3.04Å
213R88.1Confident87.7Confident185 Ų18544.4 Ų44.470%0.69823%0.232SC*.THydrogen-bonded Turntrans-63.2-31.5176.1-61.5178.1-68.2174.11112.4D211D211-R213 VanDerWaalsContact CG-NE 3.35Å; D211-R213 PolarHBondContact O-N 3.21Å; D211-R213 WeakPolarHBondContact OD1-CB 3.41Å; D211-R213 WeakPolarHBondContact OD1-CG 3.32Å; D211-R213 IonicContact OD1-CZ 3.9Å; D211-R213 PolarHBondContact OD1-N 2.9Å; D211-R213 IonicContact OD1-NE 2.78Å; D211-R213 PolarHBondContact OD1-NE 2.99Å; D211-R213 IonicContact OD2-CZ 2.95Å; D211-R213 IonicContact OD2-NE 3.99Å; D211-R213 PolarHBondContact OD2-NE 3Å; D211-R213 IonicContact OD2-NH2 2.96Å; D211-R213 PolarHBondContact OD2-NH2 3.05Å
214F87.8Confident87.5Confident49 Ų4946.9 Ų46.922%0.21525%0.247CC..THydrogen-bonded Turntrans-94.3-15-176.8-53.2-53.9000113.8L175 L178 F208 D211 Q212 P216 G217 F218L175-F214 HydrophobicContact CD1-CE1 3.93Å; L175-F214 HydrophobicContact CD1-CE2 3.8Å; L175-F214 HydrophobicContact CD1-CZ 3.34Å; L175-F214 HydrophobicContact CD2-CZ 4.14Å; L175-F214 HydrophobicContact CG-CZ 4.37Å; L178-F214 HydrophobicContact CD2-CD1 4.22Å; L178-F214 HydrophobicContact CD2-CD2 4.5Å; L178-F214 HydrophobicContact CD2-CG 4.25Å; F208-F214 HydrophobicContact CB-CD2 4.05Å; D211-F214 HydrophobicContact CB-CD2 3.63Å; D211-F214 HydrophobicContact CB-CE2 3.74Å; D211-F214 PolarHBondContact O-N 2.98Å; D211-F214 WeakPolarHBondContact OD2-CE2 3.2Å; Q212-F214 VanDerWaalsContact C-N 3.26Å; Q212-F214 PolarHBondContact O-N 2.77Å; F214-P216 VanDerWaalsContact C-CD 3.5Å; F214-G217 PolarHBondContact O-N 3.05Å; F214-F218 HydrophobicContact CB-CD2 3.98Å; F214-F218 HydrophobicContact CB-CE2 3.59Å; F214-F218 HydrophobicContact CB-CZ 4.37Å; F214-F218 WeakPolarHBondContact O-CD2 3.42Å; F214-F218 PolarHBondContact O-N 3.5Å
215V86.6Confident87.4Confident13 Ų1346.9 Ų46.98%0.07925%0.247CC..Hα-helixtrans-52.3-46-178.7171.60000112.6Q212 G217 F218 L219 A254 Q257Q212-V215 PolarHBondContact O-N 3.04Å; V215-G217 VanDerWaalsContact C-N 3.33Å; V215-G217 PolarHBondContact O-N 3.42Å; V215-F218 PolarHBondContact O-N 3.26Å; V215-L219 HydrophobicContact CG1-CD1 3.9Å; V215-L219 HydrophobicContact CG1-CG 4.29Å; V215-L219 WeakPolarHBondContact O-CG 3.22Å; V215-L219 PolarHBondContact O-N 3.4Å; V215-A254 HydrophobicContact CB-CB 4.47Å; V215-A254 HydrophobicContact CG1-CB 3.7Å; V215-A254 HydrophobicContact CG2-CB 3.92Å; V215-Q257 HydrophobicContact CG1-CB 4.33Å
216P88.3Confident87.4Confident72 Ų7246.9 Ų46.947%0.46825%0.247SC..Hα-helixtrans-58.9-42.1177.6-24.735.4000113.2F214 L219 Q220F214-P216 VanDerWaalsContact C-CD 3.5Å; P216-L219 PolarHBondContact O-N 3.18Å; P216-Q220 WeakPolarHBondContact O-CG 3.33Å; P216-Q220 PolarHBondContact O-N 3.27Å
217G88.2Confident87.4Confident39 Ų3947.7 Ų47.740%0.40225%0.254SS..Hα-helixtrans-65.5-39.517800000112.4F214 V215 Q220 M221F214-G217 PolarHBondContact O-N 3.05Å; V215-G217 VanDerWaalsContact C-N 3.33Å; V215-G217 PolarHBondContact O-N 3.42Å; G217-Q220 PolarHBondContact O-N 3.1Å; G217-M221 PolarHBondContact O-N 2.96Å
218F88.1Confident87.3Confident13 Ų1347.9 Ų47.96%0.05726%0.255CS..Hα-helixtrans-67.3-39.8174.9-69.2-49000112.8L178 L204 V205 F208 F214 V215 Q220 M221 L222L178-F218 HydrophobicContact CD1-CE1 4.06Å; L178-F218 HydrophobicContact CD1-CZ 3.95Å; L178-F218 HydrophobicContact CD2-CZ 4.19Å; L204-F218 HydrophobicContact CB-CE1 4.08Å; L204-F218 HydrophobicContact CB-CZ 4.48Å; V205-F218 HydrophobicContact CG1-CD2 4.26Å; V205-F218 HydrophobicContact CG1-CG 4.4Å; V205-F218 HydrophobicContact CG2-CB 4.22Å; V205-F218 HydrophobicContact CG2-CD1 3.64Å; V205-F218 HydrophobicContact CG2-CD2 4.37Å; V205-F218 HydrophobicContact CG2-CE1 4.04Å; V205-F218 HydrophobicContact CG2-CG 3.83Å; F208-F218 HydrophobicContact CB-CE2 3.9Å; F208-F218 HydrophobicContact CB-CZ 3.8Å; F214-F218 HydrophobicContact CB-CD2 3.98Å; F214-F218 HydrophobicContact CB-CE2 3.59Å; F214-F218 HydrophobicContact CB-CZ 4.37Å; F214-F218 WeakPolarHBondContact O-CD2 3.42Å; F214-F218 PolarHBondContact O-N 3.5Å; V215-F218 PolarHBondContact O-N 3.26Å; F218-Q220 VanDerWaalsContact C-N 3.32Å; F218-Q220 PolarHBondContact O-N 3.3Å; F218-M221 HydrophobicContact CD1-CE 3.91Å; F218-M221 WeakPolarHBondContact O-CB 3.48Å; F218-M221 PolarHBondContact O-N 3.22Å; F218-L222 VanDerWaalsContact O-CG 3.25Å; F218-L222 WeakPolarHBondContact O-CG 3.34Å; F218-L222 PolarHBondContact O-N 3.33Å
219L87.9Confident87.2Confident36 Ų3647.3 Ų47.319%0.18825%0.253CS..Hα-helixtrans-63.5-39.7175-69.8172.8000111.6V215 P216 L222 Q223 Q257 M258 A261 F263V215-L219 HydrophobicContact CG1-CD1 3.9Å; V215-L219 HydrophobicContact CG1-CG 4.29Å; V215-L219 WeakPolarHBondContact O-CG 3.22Å; V215-L219 PolarHBondContact O-N 3.4Å; P216-L219 PolarHBondContact O-N 3.18Å; L219-L222 PolarHBondContact O-N 3.49Å; L219-Q223 WeakPolarHBondContact O-CB 3.36Å; L219-Q223 PolarHBondContact O-N 3.3Å; L219-Q257 HydrophobicContact CD1-CB 3.66Å; L219-M258 HydrophobicContact CD2-SD 4.04Å; L219-A261 HydrophobicContact CD2-CB 4.47Å; L219-F263 HydrophobicContact CD2-CE1 4.35Å; L219-F263 HydrophobicContact CD2-CZ 4.16Å
220Q88.8Confident87.1Confident141 Ų14149 Ų4966%0.65926%0.259SS*.Hα-helixtrans-61.9-43.8173-72.7175.311.800111.9P216 G217 F218 L222 Q223P216-Q220 WeakPolarHBondContact O-CG 3.33Å; P216-Q220 PolarHBondContact O-N 3.27Å; G217-Q220 PolarHBondContact O-N 3.1Å; F218-Q220 VanDerWaalsContact C-N 3.32Å; F218-Q220 PolarHBondContact O-N 3.3Å; Q220-L222 PolarHBondContact O-N 2.77Å; Q220-Q223 PolarHBondContact O-N 3.23Å
221M88.2Confident86.9Confident17 Ų1754 Ų548%0.08427%0.269CS..Hα-helixtrans-59.4-47.1175.1-176.7-175.667.900111.1A182 A201 V205 G217 F218 V224 L225A182-M221 HydrophobicContact CB-SD 4.39Å; A201-M221 HydrophobicContact CB-CE 3.71Å; A201-M221 HydrophobicContact CB-SD 4.23Å; V205-M221 HydrophobicContact CG2-CE 4.16Å; G217-M221 PolarHBondContact O-N 2.96Å; F218-M221 HydrophobicContact CD1-CE 3.91Å; F218-M221 WeakPolarHBondContact O-CB 3.48Å; F218-M221 PolarHBondContact O-N 3.22Å; M221-V224 PolarHBondContact O-N 3.5Å; M221-L225 HydrophobicContact CE-CD1 4.35Å; M221-L225 HydrophobicContact CG-CD1 3.68Å; M221-L225 HydrophobicContact CG-CG 4.17Å; M221-L225 WeakPolarHBondContact O-CG 3.46Å; M221-L225 PolarHBondContact O-N 2.8Å; M221-L225 HydrophobicContact SD-CD1 4.16Å
222L87.8Confident86.1Confident2 Ų255.1 Ų55.11%0.0127%0.272CS..Hα-helixtrans-65.1-39.2179.8-68.7171.4000113.1F218 L219 Q220 V224 L225 V226 L244 S248 M258 F263F218-L222 VanDerWaalsContact O-CG 3.25Å; F218-L222 WeakPolarHBondContact O-CG 3.34Å; F218-L222 PolarHBondContact O-N 3.33Å; L219-L222 PolarHBondContact O-N 3.49Å; Q220-L222 PolarHBondContact O-N 2.77Å; L222-V224 PolarHBondContact O-N 3.02Å; L222-L225 PolarHBondContact O-N 2.9Å; L222-V226 HydrophobicContact CB-CG2 4.27Å; L222-V226 HydrophobicContact CD2-CG2 4.32Å; L222-V226 VanDerWaalsContact O-CB 3.28Å; L222-V226 WeakPolarHBondContact O-CB 3.42Å; L222-V226 VanDerWaalsContact O-CG2 3.26Å; L222-V226 WeakPolarHBondContact O-CG2 3.17Å; L222-V226 PolarHBondContact O-N 3.22Å; L222-L244 HydrophobicContact CD2-CD1 3.85Å; L222-L244 HydrophobicContact CD2-CD2 3.38Å; L222-L244 HydrophobicContact CD2-CG 3.51Å; L222-S248 WeakPolarHBondContact CD1-OG 3.39Å; L222-M258 HydrophobicContact CD1-SD 4.48Å; L222-F263 HydrophobicContact CB-CE1 3.76Å; L222-F263 HydrophobicContact CB-CE2 3.82Å; L222-F263 HydrophobicContact CB-CZ 3.33Å; L222-F263 HydrophobicContact CD1-CE2 4.43Å; L222-F263 HydrophobicContact CD1-CZ 3.91Å; L222-F263 HydrophobicContact CG-CZ 4.25Å
223Q88.3Confident85.3Confident69 Ų6958.5 Ų58.532%0.32229%0.288SS..Hα-helixtrans-53.9-28.8176.1-17765.961.300112L219 Q220 P227 F263L219-Q223 WeakPolarHBondContact O-CB 3.36Å; L219-Q223 PolarHBondContact O-N 3.3Å; Q220-Q223 PolarHBondContact O-N 3.23Å; Q223-P227 WeakPolarHBondContact O-CD 3.48Å; Q223-P227 WeakPolarHBondContact O-CG 3.24Å; Q223-F263 VanDerWaalsContact CA-CD1 3.48Å; Q223-F263 HydrophobicContact CB-CD1 3.9Å; Q223-F263 HydrophobicContact CB-CE1 4.3Å; Q223-F263 HydrophobicContact CG-CD1 4.48Å
224V87.5Confident84.9Confident52 Ų5253.6 Ų53.632%0.31528%0.278SS..Hα-helixtrans-96.3-39.6176.2-158.70000113.1F186 M221 L222 H228F186-V224 HydrophobicContact CD2-CB 4.36Å; F186-V224 HydrophobicContact CD2-CG1 4.44Å; F186-V224 HydrophobicContact CE2-CB 3.68Å; F186-V224 HydrophobicContact CE2-CG1 3.41Å; F186-V224 VanDerWaalsContact CE2-CG1 3.41Å; F186-V224 HydrophobicContact CE2-CG2 4.21Å; F186-V224 HydrophobicContact CZ-CG1 4.04Å; M221-V224 PolarHBondContact O-N 3.5Å; L222-V224 PolarHBondContact O-N 3.02Å; V224-H228 PolarHBondContact O-ND1 3.46Å
225L88.6Confident84.6Confident1 Ų152 Ų521%0.00527%0.274CS..Hα-helixtrans-67.5-44.3-178.7-67.1-179.7000112.6F186 Y189 L198 A201 M221 L222 H228 A229 L244F186-L225 HydrophobicContact CD2-CD2 4.43Å; Y189-L225 HydrophobicContact CD1-CD2 3.37Å; Y189-L225 HydrophobicContact CE1-CD2 4.16Å; Y189-L225 HydrophobicContact CG-CD2 3.83Å; L198-L225 HydrophobicContact CD2-CB 3.94Å; L198-L225 HydrophobicContact CD2-CD1 4.22Å; L198-L225 HydrophobicContact CD2-CD2 4.5Å; L198-L225 HydrophobicContact CD2-CG 4.45Å; A201-L225 HydrophobicContact CB-CD1 3.96Å; M221-L225 HydrophobicContact CE-CD1 4.35Å; M221-L225 HydrophobicContact CG-CD1 3.68Å; M221-L225 HydrophobicContact CG-CG 4.17Å; M221-L225 WeakPolarHBondContact O-CG 3.46Å; M221-L225 PolarHBondContact O-N 2.8Å; M221-L225 HydrophobicContact SD-CD1 4.16Å; L222-L225 PolarHBondContact O-N 2.9Å; L225-H228 WeakPolarHBondContact O-CB 3.33Å; L225-H228 PolarHBondContact O-N 2.87Å; L225-H228 VanDerWaalsContact O-N 3.16Å; L225-A229 PolarHBondContact O-N 3.05Å; L225-A229 VanDerWaalsContact O-N 3.09Å; L225-L244 HydrophobicContact CD1-CD2 4.5Å
226V88.2Confident84.5Confident2 Ų255.5 Ų55.51%0.01229%0.292CS..Hα-helixtrans-61.1-49.2-172.1169.80000112.4L222 H228 A229 F230 L241 F263 L267L222-V226 HydrophobicContact CB-CG2 4.27Å; L222-V226 HydrophobicContact CD2-CG2 4.32Å; L222-V226 VanDerWaalsContact O-CB 3.28Å; L222-V226 WeakPolarHBondContact O-CB 3.42Å; L222-V226 VanDerWaalsContact O-CG2 3.26Å; L222-V226 WeakPolarHBondContact O-CG2 3.17Å; L222-V226 PolarHBondContact O-N 3.22Å; V226-H228 PolarHBondContact O-N 2.93Å; V226-A229 WeakPolarHBondContact O-CB 3.34Å; V226-A229 PolarHBondContact O-N 3.31Å; V226-F230 HydrophobicContact CG1-CE1 3.81Å; V226-F230 HydrophobicContact CG1-CE2 3.59Å; V226-F230 HydrophobicContact CG1-CZ 3.15Å; V226-F230 PolarHBondContact O-N 3.46Å; V226-L241 HydrophobicContact CB-CD1 4.39Å; V226-L241 HydrophobicContact CG1-CD1 4.38Å; V226-L241 HydrophobicContact CG2-CD1 3.88Å; V226-F263 HydrophobicContact CB-CB 4.47Å; V226-F263 HydrophobicContact CB-CD2 4.02Å; V226-F263 HydrophobicContact CB-CG 4.46Å; V226-F263 HydrophobicContact CG1-CB 4.35Å; V226-F263 HydrophobicContact CG1-CD2 4.01Å; V226-F263 HydrophobicContact CG2-CD2 3.82Å; V226-F263 HydrophobicContact CG2-CE2 3.98Å; V226-L267 HydrophobicContact CG1-CB 4.32Å; V226-L267 HydrophobicContact CG1-CD1 3.93Å
227P86.4Confident84.4Confident52 Ų5252.4 Ų52.434%0.33827%0.272SS..Hα-helixtrans-62.1-26.9177.5-25.235.7000114.5Q223Q223-P227 WeakPolarHBondContact O-CD 3.48Å; Q223-P227 WeakPolarHBondContact O-CG 3.24Å
228H85.8Confident84.2Confident51 Ų5151.2 Ų51.224%0.23626%0.257CS..Hα-helixtrans-75.7-33.6175.5-73.782000111.6Y189 V224 L225 V226 K231Y189-H228 HydrophobicContact CD1-CB 4.3Å; Y189-H228 HydrophobicContact CE1-CB 3.64Å; V224-H228 PolarHBondContact O-ND1 3.46Å; L225-H228 WeakPolarHBondContact O-CB 3.33Å; L225-H228 PolarHBondContact O-N 2.87Å; L225-H228 VanDerWaalsContact O-N 3.16Å; V226-H228 PolarHBondContact O-N 2.93Å; H228-K231 PolarHBondContact O-N 3.01Å
229A86.9Confident84.2Confident2 Ų252.7 Ų52.72%0.01726%0.264CS..Hα-helixtrans-65.7-38.9177.300000112.3Y189 L198 L225 V226 K231 K232 T237 L241Y189-A229 VanDerWaalsContact OH-CA 3.24Å; Y189-A229 WeakPolarHBondContact OH-CA 3.44Å; Y189-A229 WeakPolarHBondContact OH-CB 3.43Å; Y189-A229 PolarHBondContact OH-N 3.47Å; L198-A229 HydrophobicContact CD1-CB 3.92Å; L225-A229 PolarHBondContact O-N 3.05Å; L225-A229 VanDerWaalsContact O-N 3.09Å; V226-A229 WeakPolarHBondContact O-CB 3.34Å; V226-A229 PolarHBondContact O-N 3.31Å; A229-K231 PolarHBondContact O-N 3.03Å; A229-K231 VanDerWaalsContact O-N 3.12Å; A229-K232 CarbonylContact O-C 3.22Å; A229-K232 PolarHBondContact O-N 3.34Å; A229-T237 HydrophobicContact CB-CG2 4.01Å; A229-L241 HydrophobicContact CB-CB 4.44Å; A229-L241 HydrophobicContact CB-CD1 3.93Å; A229-L241 HydrophobicContact CB-CD2 3.9Å; A229-L241 HydrophobicContact CB-CG 4.32Å
230F83.5Confident84.2Confident40 Ų4051.6 Ų51.618%0.17526%0.258CS..THydrogen-bonded Turntrans-59.3-25.8177-57.9-34.1000113.8V226 K232 L241 P266 L267 N270V226-F230 HydrophobicContact CG1-CE1 3.81Å; V226-F230 HydrophobicContact CG1-CE2 3.59Å; V226-F230 HydrophobicContact CG1-CZ 3.15Å; V226-F230 PolarHBondContact O-N 3.46Å; F230-K232 PolarHBondContact O-N 3.23Å; F230-L241 HydrophobicContact CD1-CD2 4.04Å; F230-L241 HydrophobicContact CE1-CD2 3.83Å; F230-P266 HydrophobicContact CE2-CB 3.78Å; F230-P266 HydrophobicContact CZ-CB 4.25Å; F230-L267 HydrophobicContact CE1-CD1 3.97Å; F230-L267 HydrophobicContact CZ-CB 4.04Å; F230-L267 HydrophobicContact CZ-CD1 4.1Å; F230-N270 HydrophobicContact CD1-CB 3.84Å; F230-N270 VanDerWaalsContact CD1-CG 3.42Å; F230-N270 WeakPolarHBondContact CD1-OD1 3.38Å; F230-N270 HydrophobicContact CE1-CB 3.63Å; F230-N270 HydrophobicContact CZ-CB 4.37Å
231K78.4Confident84.2Confident167 Ų16745.1 Ų45.173%0.72623%0.228SC*.THydrogen-bonded Turntrans-73.6-12.5177.9-60.7178.1-175.7175.10112.8H228 A229H228-K231 PolarHBondContact O-N 3.01Å; A229-K231 PolarHBondContact O-N 3.03Å; A229-K231 VanDerWaalsContact O-N 3.12Å
232K70.8Confident84.2Confident71 Ų7144.5 Ų44.531%0.30923%0.225SC..  trans-119.287.6178.8-83.6-166.3169.6179.60109.4T192 T193 A229 F230 V234 T237T192-K232 PolarHBondContact O-NZ 2.92Å; T193-K232 PolarHBondContact O-NZ 2.89Å; T193-K232 WeakPolarHBondContact OG1-CE 3.39Å; T193-K232 PolarHBondContact OG1-NZ 3.39Å; A229-K232 CarbonylContact O-C 3.22Å; A229-K232 PolarHBondContact O-N 3.34Å; F230-K232 PolarHBondContact O-N 3.23Å; K232-V234 PolarHBondContact O-N 3.44Å; K232-T237 HydrophobicContact CB-CG2 4.15Å
233E67.3Low84.1Confident155 Ų15548.4 Ų48.472%0.72424%0.239SC*.  trans-74.560.6169.1-66-178.9179.500110.8
234V79.7Confident83.8Confident82 Ų8245.1 Ų45.150%0.49722%0.224SC..  trans-114.2132.9174.3-175.60000107.3K232 N236 T237 V238K232-V234 PolarHBondContact O-N 3.44Å; V234-N236 VanDerWaalsContact C-N 3.31Å; V234-N236 PolarHBondContact O-N 2.82Å; V234-N236 VanDerWaalsContact O-N 3.14Å; V234-T237 WeakPolarHBondContact O-CA 3.35Å; V234-T237 WeakPolarHBondContact O-CB 3.4Å; V234-T237 PolarHBondContact O-N 2.77Å; V234-V238 PolarHBondContact O-N 3.29Å; V234-V238 VanDerWaalsContact O-N 3.11Å
235A80.7Confident83.2Confident15 Ų1542.8 Ų42.812%0.12421%0.211CC..Hα-helixtrans-42.9-51.4-175.500000113.7T237 V238 E239 L277 D279 A282A235-T237 VanDerWaalsContact C-N 3.27Å; A235-T237 PolarHBondContact O-N 2.97Å; A235-V238 WeakPolarHBondContact O-CB 3.4Å; A235-V238 PolarHBondContact O-N 3.11Å; A235-V238 VanDerWaalsContact O-N 3.1Å; A235-E239 PolarHBondContact O-N 2.82Å; A235-L277 HydrophobicContact CB-CD2 4.22Å; A235-D279 HydrophobicContact CB-CB 3.7Å; A235-D279 WeakPolarHBondContact CB-OD2 3.14Å; A235-A282 HydrophobicContact CB-CB 4.26Å
236N85.2Confident82.6Confident86 Ų8646 Ų4646%0.4623%0.226SC..Hα-helixtrans-60.8-33.5179.1-57.219.9000113.6V234 D240V234-N236 VanDerWaalsContact C-N 3.31Å; V234-N236 PolarHBondContact O-N 2.82Å; V234-N236 VanDerWaalsContact O-N 3.14Å; N236-D240 WeakPolarHBondContact O-CB 3.34Å; N236-D240 PolarHBondContact O-N 2.92Å
237T86.2Confident82Confident8 Ų847.8 Ų47.85%0.04923%0.233CC..Hα-helixtrans-72.3-39.3177.6-550000110.7L198 A229 K232 V234 A235 L241L198-T237 HydrophobicContact CD1-CG2 3.94Å; A229-T237 HydrophobicContact CB-CG2 4.01Å; K232-T237 HydrophobicContact CB-CG2 4.15Å; V234-T237 WeakPolarHBondContact O-CA 3.35Å; V234-T237 WeakPolarHBondContact O-CB 3.4Å; V234-T237 PolarHBondContact O-N 2.77Å; A235-T237 VanDerWaalsContact C-N 3.27Å; A235-T237 PolarHBondContact O-N 2.97Å; T237-L241 WeakPolarHBondContact O-CB 3.38Å; T237-L241 PolarHBondContact O-N 3.35Å
238V83.9Confident80.8Confident13 Ų1346.1 Ų46.18%0.07922%0.223CC..Hα-helixtrans-61.4-53172.9168.60000109.7V234 A235 D240 L241 Y242 A274 L277 A282 D286V234-V238 PolarHBondContact O-N 3.29Å; V234-V238 VanDerWaalsContact O-N 3.11Å; A235-V238 WeakPolarHBondContact O-CB 3.4Å; A235-V238 PolarHBondContact O-N 3.11Å; A235-V238 VanDerWaalsContact O-N 3.1Å; V238-D240 PolarHBondContact O-N 3.16Å; V238-L241 PolarHBondContact O-N 3.4Å; V238-Y242 HydrophobicContact CG1-CD2 3.79Å; V238-Y242 HydrophobicContact CG1-CE2 3.82Å; V238-Y242 WeakPolarHBondContact O-CD2 3.45Å; V238-Y242 PolarHBondContact O-N 3.37Å; V238-A274 HydrophobicContact CG1-CB 3.97Å; V238-L277 HydrophobicContact CG2-CD1 4.28Å; V238-A282 HydrophobicContact CB-CB 4.26Å; V238-A282 HydrophobicContact CG1-CB 3.87Å; V238-D286 VanDerWaalsContact CG1-OD1 3.28Å; V238-D286 WeakPolarHBondContact CG1-OD1 3.37Å
239E87.5Confident79.6Confident44 Ų4443.8 Ų43.821%0.20621%0.212CC..Hα-helixtrans-51.6-54.6177.1-170.5-157.2158.200111.6A235 L241 Y242 R243 S285A235-E239 PolarHBondContact O-N 2.82Å; E239-L241 PolarHBondContact O-N 3.08Å; E239-Y242 PolarHBondContact O-N 2.82Å; E239-R243 WeakPolarHBondContact O-CB 3.36Å; E239-R243 PolarHBondContact O-N 2.94Å; E239-S285 VanDerWaalsContact CG-OG 3.29Å; E239-S285 WeakPolarHBondContact CG-OG 3.08Å
240D89.6Confident78.2Confident14 Ų1444 Ų448%0.07521%0.212CC..Hα-helixtrans-68.5-33-177.1-75.5-39.6000112.7S195 L198 Y199 N236 V238 L244S195-D240 WeakPolarHBondContact CB-OD2 3.09Å; S195-D240 PolarHBondContact OG-OD2 3.43Å; L198-D240 HydrophobicContact CB-CB 3.88Å; L198-D240 HydrophobicContact CD1-CB 4.5Å; Y199-D240 WeakPolarHBondContact CB-OD1 3.36Å; N236-D240 WeakPolarHBondContact O-CB 3.34Å; N236-D240 PolarHBondContact O-N 2.92Å; V238-D240 PolarHBondContact O-N 3.16Å; D240-L244 VanDerWaalsContact O-CB 3.23Å; D240-L244 WeakPolarHBondContact O-CB 3.42Å; D240-L244 PolarHBondContact O-N 2.63Å
241L88.6Confident76.8Confident5 Ų545.2 Ų45.23%0.02623%0.23CC..Hα-helixtrans-64.4-48.8176174.963.7000111.3L198 V226 A229 F230 T237 V238 E239 L244 G245 L267L198-L241 HydrophobicContact CD1-CB 4.21Å; V226-L241 HydrophobicContact CB-CD1 4.39Å; V226-L241 HydrophobicContact CG1-CD1 4.38Å; V226-L241 HydrophobicContact CG2-CD1 3.88Å; A229-L241 HydrophobicContact CB-CB 4.44Å; A229-L241 HydrophobicContact CB-CD1 3.93Å; A229-L241 HydrophobicContact CB-CD2 3.9Å; A229-L241 HydrophobicContact CB-CG 4.32Å; F230-L241 HydrophobicContact CD1-CD2 4.04Å; F230-L241 HydrophobicContact CE1-CD2 3.83Å; T237-L241 WeakPolarHBondContact O-CB 3.38Å; T237-L241 PolarHBondContact O-N 3.35Å; V238-L241 PolarHBondContact O-N 3.4Å; E239-L241 PolarHBondContact O-N 3.08Å; L241-L244 WeakPolarHBondContact O-CB 2.99Å; L241-L244 PolarHBondContact O-N 2.94Å; L241-G245 PolarHBondContact O-N 3.41Å; L241-L267 HydrophobicContact CD1-CD1 4.09Å; L241-L267 HydrophobicContact CD2-CD1 4.02Å; L241-L267 HydrophobicContact CG-CD1 4.02Å
242Y87.4Confident75.8Confident3 Ų338.9 Ų38.91%0.01220%0.202CC..Hα-helixtrans-80.8-25.8-176.8-66.1-67000112.6V238 E239 L244 G245 M246 L267 N270 A271 A274 D286 F289V238-Y242 HydrophobicContact CG1-CD2 3.79Å; V238-Y242 HydrophobicContact CG1-CE2 3.82Å; V238-Y242 WeakPolarHBondContact O-CD2 3.45Å; V238-Y242 PolarHBondContact O-N 3.37Å; E239-Y242 PolarHBondContact O-N 2.82Å; Y242-L244 VanDerWaalsContact C-N 3.34Å; Y242-G245 PolarHBondContact O-N 3.37Å; Y242-M246 WeakPolarHBondContact O-CB 3.36Å; Y242-M246 PolarHBondContact O-N 3.13Å; Y242-L267 HydrophobicContact CD1-CD1 4.23Å; Y242-L267 HydrophobicContact CE1-CD1 3.57Å; Y242-L267 HydrophobicContact CE1-CG 4.13Å; Y242-N270 WeakPolarHBondContact OH-CB 3.36Å; Y242-N270 PolarHBondContact OH-O 3.25Å; Y242-A271 HydrophobicContact CD1-CB 4.22Å; Y242-A271 HydrophobicContact CE1-CB 3.5Å; Y242-A271 VanDerWaalsContact OH-CA 3.23Å; Y242-A271 WeakPolarHBondContact OH-CA 3.32Å; Y242-A271 PolarHBondContact OH-N 3.01Å; Y242-A274 HydrophobicContact CE2-CB 4.23Å; Y242-D286 WeakPolarHBondContact CD2-OD1 3.34Å; Y242-D286 WeakPolarHBondContact CE2-OD1 3.42Å; Y242-F289 HydrophobicContact CD1-CB 4.31Å; Y242-F289 AromaticContact CD1-CD1 3.6Å; Y242-F289 HydrophobicContact CD1-CD1 3.6Å; Y242-F289 HydrophobicContact CD1-CD2 4.47Å; Y242-F289 AromaticContact CD1-CE1 3.99Å; Y242-F289 HydrophobicContact CD1-CE1 3.99Å; Y242-F289 AromaticContact CD1-CG 3.86Å; Y242-F289 HydrophobicContact CD1-CG 3.86Å; Y242-F289 HydrophobicContact CE1-CD1 4.14Å; Y242-F289 HydrophobicContact CE1-CE1 4.16Å
243R85.1Confident75.5Confident84 Ų8445.8 Ų45.832%0.31723%0.226SC..Hα-helixtrans-60.5-43.6162.4178.1-178-90.8-1157111.5E239 R247E239-R243 WeakPolarHBondContact O-CB 3.36Å; E239-R243 PolarHBondContact O-N 2.94Å; R243-R247 WeakPolarHBondContact O-CB 3.23Å; R243-R247 WeakPolarHBondContact O-CG 2.85Å; R243-R247 PolarHBondContact O-N 3.41Å; R243-R247 VanDerWaalsContact O-N 3.16Å
244L82.4Confident75.9Confident1 Ų138.7 Ų38.71%0.00519%0.194CC..Hα-helixtrans-63.5-45.5174.2172.661.2000111.2L198 A201 S202 V205 L222 L225 D240 L241 Y242 R247 S248L198-L244 HydrophobicContact CB-CD2 4.46Å; L198-L244 HydrophobicContact CD2-CD2 4.24Å; A201-L244 HydrophobicContact CB-CD1 4.02Å; A201-L244 HydrophobicContact CB-CD2 4.13Å; S202-L244 VanDerWaalsContact CA-CD1 3.49Å; V205-L244 HydrophobicContact CG2-CD1 4.14Å; L222-L244 HydrophobicContact CD2-CD1 3.85Å; L222-L244 HydrophobicContact CD2-CD2 3.38Å; L222-L244 HydrophobicContact CD2-CG 3.51Å; L225-L244 HydrophobicContact CD1-CD2 4.5Å; D240-L244 VanDerWaalsContact O-CB 3.23Å; D240-L244 WeakPolarHBondContact O-CB 3.42Å; D240-L244 PolarHBondContact O-N 2.63Å; L241-L244 WeakPolarHBondContact O-CB 2.99Å; L241-L244 PolarHBondContact O-N 2.94Å; Y242-L244 VanDerWaalsContact C-N 3.34Å; L244-R247 PolarHBondContact O-N 3.11Å; L244-S248 WeakPolarHBondContact O-CB 3.31Å; L244-S248 PolarHBondContact O-N 3.3Å; L244-S248 PolarHBondContact O-OG 3.45Å
245G75.4Confident76Confident3 Ų335.6 Ų35.63%0.03118%0.176CC..Hα-helixtrans-52.9-60.9172.700000111.1L241 Y242 R247 S248 V249L241-G245 PolarHBondContact O-N 3.41Å; Y242-G245 PolarHBondContact O-N 3.37Å; G245-R247 PolarHBondContact O-N 3.09Å; G245-R247 VanDerWaalsContact O-N 3.11Å; G245-S248 WeakPolarHBondContact CA-OG 3.46Å; G245-S248 PolarHBondContact O-N 2.95Å; G245-S248 PolarHBondContact O-OG 2.97Å; G245-S248 VanDerWaalsContact O-OG 3.08Å; G245-V249 WeakPolarHBondContact O-CB 3.47Å; G245-V249 WeakPolarHBondContact O-CG2 3.06Å; G245-V249 PolarHBondContact O-N 2.81Å
246M76.2Confident76.1Confident67 Ų6740 Ų4033%0.3320%0.197SC..Hα-helixtrans-50.1-44.7-179-172.2-166.4-177.300112.8Y242 F250 K288 E292Y242-M246 WeakPolarHBondContact O-CB 3.36Å; Y242-M246 PolarHBondContact O-N 3.13Å; M246-F250 PolarHBondContact O-N 2.92Å; M246-K288 HydrophobicContact CE-CB 4.39Å; M246-K288 HydrophobicContact SD-CB 4.04Å; M246-E292 HydrophobicContact CG-CB 4.35Å; M246-E292 HydrophobicContact CG-CG 4.45Å
247R74.7Confident76.2Confident40 Ų4039.6 Ų39.615%0.15119%0.192CC..Hα-helixtrans-72.9-40.7179.8-74.6169165.3-162.3-5.4113.5S202 I203 D206 R243 L244 G245S202-R247 PolarHBondContact OG-NH1 3.09Å; I203-R247 VanDerWaalsContact CD1-NH1 3.34Å; D206-R247 HydrophobicContact CB-CB 4.47Å; D206-R247 HydrophobicContact CB-CG 4.27Å; D206-R247 IonicContact OD2-CZ 2.83Å; D206-R247 IonicContact OD2-NH2 3.97Å; R243-R247 WeakPolarHBondContact O-CB 3.23Å; R243-R247 WeakPolarHBondContact O-CG 2.85Å; R243-R247 PolarHBondContact O-N 3.41Å; R243-R247 VanDerWaalsContact O-N 3.16Å; L244-R247 PolarHBondContact O-N 3.11Å; G245-R247 PolarHBondContact O-N 3.09Å; G245-R247 VanDerWaalsContact O-N 3.11Å
248S62.5Low76.1Confident18 Ų1839.3 Ų39.313%0.12619%0.19CC..Hα-helixtrans-74.3-31.2-177.656.20000114.2V205 L222 L244 G245V205-S248 VanDerWaalsContact CG1-CA 3.42Å; L222-S248 WeakPolarHBondContact CD1-OG 3.39Å; L244-S248 WeakPolarHBondContact O-CB 3.31Å; L244-S248 PolarHBondContact O-N 3.3Å; L244-S248 PolarHBondContact O-OG 3.45Å; G245-S248 WeakPolarHBondContact CA-OG 3.46Å; G245-S248 PolarHBondContact O-N 2.95Å; G245-S248 PolarHBondContact O-OG 2.97Å; G245-S248 VanDerWaalsContact O-OG 3.08Å
249V59Low76.2Confident1 Ų141.4 Ų41.41%0.00620%0.199CC..Hα-helixtrans-89-42-170-168.80000112G245 M258 F289G245-V249 WeakPolarHBondContact O-CB 3.47Å; G245-V249 WeakPolarHBondContact O-CG2 3.06Å; G245-V249 PolarHBondContact O-N 2.81Å; V249-M258 HydrophobicContact CB-CB 4.46Å; V249-M258 HydrophobicContact CB-CG 4.15Å; V249-M258 HydrophobicContact CB-SD 4.35Å; V249-M258 HydrophobicContact CG1-CB 3.59Å; V249-M258 HydrophobicContact CG1-CG 3.51Å; V249-M258 HydrophobicContact CG1-SD 4.33Å; V249-M258 HydrophobicContact CG2-CB 4.48Å; V249-M258 HydrophobicContact CG2-CE 3.4Å; V249-M258 HydrophobicContact CG2-CG 3.68Å; V249-M258 HydrophobicContact CG2-SD 3.49Å; V249-M258 WeakPolarHBondContact CG2-SD 3.18Å; V249-F289 HydrophobicContact CG2-CE2 4.25Å
250F58.2Low76.3Confident7 Ų743.1 Ų43.13%0.03122%0.22CC..THydrogen-bonded Turntrans-128.9-39.3-152-62.8-57000114.9M246 K252 P255 F259 F289 E292 L293 N296M246-F250 PolarHBondContact O-N 2.92Å; F250-K252 PolarHBondContact O-N 3Å; F250-P255 HydrophobicContact CD1-CB 4.09Å; F250-P255 HydrophobicContact CE1-CB 4.18Å; F250-F259 AromaticContact CE1-CE1 3.79Å; F250-F259 HydrophobicContact CE1-CE1 3.79Å; F250-F259 AromaticContact CE1-CZ 3.82Å; F250-F259 HydrophobicContact CE1-CZ 3.82Å; F250-F259 AromaticContact CZ-CE1 3.93Å; F250-F259 HydrophobicContact CZ-CE1 3.93Å; F250-F259 HydrophobicContact CZ-CZ 4.31Å; F250-F289 HydrophobicContact CE2-CD2 4.34Å; F250-F289 HydrophobicContact CE2-CE2 4.11Å; F250-E292 HydrophobicContact CB-CG 3.21Å; F250-E292 WeakPolarHBondContact CB-OE1 3.41Å; F250-E292 HydrophobicContact CD1-CG 4.49Å; F250-E292 HydrophobicContact CD2-CB 3.88Å; F250-E292 HydrophobicContact CD2-CG 3.38Å; F250-E292 HydrophobicContact CE2-CG 4.4Å; F250-E292 HydrophobicContact CG-CB 4.4Å; F250-E292 HydrophobicContact CG-CG 3.47Å; F250-E292 VanDerWaalsContact CG-CG 3.47Å; F250-L293 HydrophobicContact CE2-CB 3.75Å; F250-L293 HydrophobicContact CZ-CB 3.55Å; F250-L293 HydrophobicContact CZ-CD1 4.28Å; F250-L293 HydrophobicContact CZ-CG 3.97Å; F250-N296 WeakPolarHBondContact CB-ND2 3.42Å; F250-N296 HydrophobicContact CD1-CB 3.44Å; F250-N296 VanDerWaalsContact CD1-CB 3.44Å; F250-N296 WeakPolarHBondContact CD1-ND2 3.48Å; F250-N296 HydrophobicContact CE1-CB 3.58Å; F250-N296 HydrophobicContact CG-CB 4.47Å; F250-N296 VanDerWaalsContact CG-ND2 3.34Å; F250-N296 WeakPolarHBondContact CG-ND2 3.43Å
251A53.3Low76.3Confident66 Ų6643.1 Ų43.155%0.54522%0.222SC..THydrogen-bonded Turntrans-59.2-25.9-17900000112.5
252K58.2Low76.4Confident33 Ų3349.2 Ų49.214%0.14326%0.255CS..THydrogen-bonded Turntrans-12011.9-164.8-60.3-132.4171.2-167.60115.7V205 D206 E207 G209 A210 F250V205-K252 WeakPolarHBondContact O-CD 3.34Å; D206-K252 VanDerWaalsContact C-NZ 3.26Å; D206-K252 WeakPolarHBondContact O-CE 3.26Å; D206-K252 PolarHBondContact O-NZ 2.99Å; E207-K252 PolarHBondContact O-NZ 3.19Å; G209-K252 VanDerWaalsContact C-CB 3.43Å; G209-K252 VanDerWaalsContact O-CB 3.29Å; G209-K252 WeakPolarHBondContact O-CB 3.38Å; A210-K252 HydrophobicContact CB-CB 4.45Å; A210-K252 HydrophobicContact CB-CD 3.71Å; F250-K252 PolarHBondContact O-N 3Å
253R65.6Low76.6Confident216 Ų21649.3 Ų49.382%0.81526%0.255SS*.SBendtrans77.229.8167.2-47.8-179.5176.9-178-0.8117.6P255R253-P255 WeakPolarHBondContact O-CD 3.28Å
254A75.2Confident76.8Confident6 Ų646.4 Ų46.45%0.0525%0.245CC..  trans-117.344.917100000114.9V215 L256 Q257 M258V215-A254 HydrophobicContact CB-CB 4.47Å; V215-A254 HydrophobicContact CG1-CB 3.7Å; V215-A254 HydrophobicContact CG2-CB 3.92Å; A254-L256 VanDerWaalsContact C-N 3.33Å; A254-L256 PolarHBondContact O-N 2.83Å; A254-Q257 VanDerWaalsContact C-OE1 3.28Å; A254-Q257 VanDerWaalsContact CA-OE1 3.23Å; A254-Q257 PolarHBondContact O-N 3.32Å; A254-Q257 PolarHBondContact O-OE1 3.17Å; A254-M258 PolarHBondContact O-N 3.21Å
255P80.4Confident77.3Confident18 Ų1849.7 Ų49.712%0.11727%0.267CS..Hα-helixtrans-65.4-34.9-174.427.7-35.6000112.8F250 R253 M258 F259 N296 I300F250-P255 HydrophobicContact CD1-CB 4.09Å; F250-P255 HydrophobicContact CE1-CB 4.18Å; R253-P255 WeakPolarHBondContact O-CD 3.28Å; P255-M258 PolarHBondContact O-N 3.17Å; P255-F259 HydrophobicContact CB-CE2 4.35Å; P255-F259 HydrophobicContact CB-CZ 4.33Å; P255-F259 WeakPolarHBondContact O-CD1 3.41Å; P255-F259 WeakPolarHBondContact O-CD2 3.44Å; P255-F259 WeakPolarHBondContact O-CG 3.4Å; P255-F259 PolarHBondContact O-N 3.33Å; P255-N296 HydrophobicContact CB-CB 4.25Å; P255-I300 HydrophobicContact CB-CD1 3.94Å; P255-I300 HydrophobicContact CG-CD1 3.83Å; P255-I300 HydrophobicContact CG-CG1 4.42Å
256L83.9Confident78.1Confident107 Ų10752.2 Ų52.256%0.5628%0.282SS*.Hα-helixtrans-66.9-42.4-179.3-67.6176.6000112A254 M258 F259 A260 I300A254-L256 VanDerWaalsContact C-N 3.33Å; A254-L256 PolarHBondContact O-N 2.83Å; L256-M258 VanDerWaalsContact C-N 3.29Å; L256-M258 PolarHBondContact O-N 3.48Å; L256-F259 PolarHBondContact O-N 3.35Å; L256-A260 PolarHBondContact O-N 3.09Å; L256-A260 VanDerWaalsContact O-N 3.08Å; L256-I300 HydrophobicContact CD2-CD1 3.83Å; L256-I300 HydrophobicContact CD2-CG1 4.4Å; L256-I300 HydrophobicContact CD2-CG2 4.07Å; L256-I300 HydrophobicContact CG-CD1 4.29Å
257Q86.4Confident78.8Confident77 Ų7749 Ų4936%0.3627%0.267SS..Hα-helixtrans-65.9-35.1179.2-60.992.4-35.800111.4V215 L219 A254 A261V215-Q257 HydrophobicContact CG1-CB 4.33Å; L219-Q257 HydrophobicContact CD1-CB 3.66Å; A254-Q257 VanDerWaalsContact C-OE1 3.28Å; A254-Q257 VanDerWaalsContact CA-OE1 3.23Å; A254-Q257 PolarHBondContact O-N 3.32Å; A254-Q257 PolarHBondContact O-OE1 3.17Å; Q257-A261 PolarHBondContact O-N 2.94Å
258M84.1Confident79.5Confident3 Ų349.6 Ų49.62%0.01527%0.272CS..Hα-helixtrans-67.1-45.9172.3-176.290.1175.300112.1L219 L222 V249 A254 P255 L256 A260 A261 F263 F264 L267L219-M258 HydrophobicContact CD2-SD 4.04Å; L222-M258 HydrophobicContact CD1-SD 4.48Å; V249-M258 HydrophobicContact CB-CB 4.46Å; V249-M258 HydrophobicContact CB-CG 4.15Å; V249-M258 HydrophobicContact CB-SD 4.35Å; V249-M258 HydrophobicContact CG1-CB 3.59Å; V249-M258 HydrophobicContact CG1-CG 3.51Å; V249-M258 HydrophobicContact CG1-SD 4.33Å; V249-M258 HydrophobicContact CG2-CB 4.48Å; V249-M258 HydrophobicContact CG2-CE 3.4Å; V249-M258 HydrophobicContact CG2-CG 3.68Å; V249-M258 HydrophobicContact CG2-SD 3.49Å; V249-M258 WeakPolarHBondContact CG2-SD 3.18Å; A254-M258 PolarHBondContact O-N 3.21Å; P255-M258 PolarHBondContact O-N 3.17Å; L256-M258 VanDerWaalsContact C-N 3.29Å; L256-M258 PolarHBondContact O-N 3.48Å; M258-A260 PolarHBondContact O-N 3.46Å; M258-A261 VanDerWaalsContact O-CB 3.25Å; M258-A261 WeakPolarHBondContact O-CB 3.28Å; M258-A261 PolarHBondContact O-N 3.04Å; M258-F263 HydrophobicContact CE-CD2 4.19Å; M258-F263 HydrophobicContact CE-CE2 3.22Å; M258-F263 HydrophobicContact CE-CZ 3.75Å; M258-F263 HydrophobicContact SD-CE2 3.81Å; M258-F263 HydrophobicContact SD-CZ 3.65Å; M258-F264 HydrophobicContact CE-CD2 3.88Å; M258-F264 HydrophobicContact CG-CD2 3.71Å; M258-F264 HydrophobicContact CG-CE2 4.23Å; M258-F264 HydrophobicContact CG-CG 4.46Å; M258-F264 WeakPolarHBondContact O-CB 3.39Å; M258-L267 HydrophobicContact CE-CD2 3.48Å; M258-L267 VanDerWaalsContact CE-CD2 3.48Å
259F87.2Confident80.9Confident57 Ų5753.3 Ų53.325%0.2529%0.29CS..Hα-helixtrans-61.6-27-179.7-63-17.7000112.4F250 P255 L256 A261 F264 I297 I300F250-F259 AromaticContact CE1-CE1 3.79Å; F250-F259 HydrophobicContact CE1-CE1 3.79Å; F250-F259 AromaticContact CE1-CZ 3.82Å; F250-F259 HydrophobicContact CE1-CZ 3.82Å; F250-F259 AromaticContact CZ-CE1 3.93Å; F250-F259 HydrophobicContact CZ-CE1 3.93Å; F250-F259 HydrophobicContact CZ-CZ 4.31Å; P255-F259 HydrophobicContact CB-CE2 4.35Å; P255-F259 HydrophobicContact CB-CZ 4.33Å; P255-F259 WeakPolarHBondContact O-CD1 3.41Å; P255-F259 WeakPolarHBondContact O-CD2 3.44Å; P255-F259 WeakPolarHBondContact O-CG 3.4Å; P255-F259 PolarHBondContact O-N 3.33Å; L256-F259 PolarHBondContact O-N 3.35Å; F259-A261 VanDerWaalsContact C-N 3.35Å; F259-F264 HydrophobicContact CD1-CD1 4.28Å; F259-F264 HydrophobicContact CD1-CD2 4.34Å; F259-F264 AromaticContact CD1-CE1 3.67Å; F259-F264 HydrophobicContact CD1-CE1 3.67Å; F259-F264 AromaticContact CD1-CE2 3.73Å; F259-F264 HydrophobicContact CD1-CE2 3.73Å; F259-F264 AromaticContact CD1-CZ 3.34Å; F259-F264 HydrophobicContact CD1-CZ 3.34Å; F259-F264 HydrophobicContact CE1-CE1 4.24Å; F259-F264 AromaticContact CE1-CE2 3.92Å; F259-F264 HydrophobicContact CE1-CE2 3.92Å; F259-F264 AromaticContact CE1-CZ 3.52Å; F259-F264 HydrophobicContact CE1-CZ 3.52Å; F259-F264 HydrophobicContact CG-CE1 4.42Å; F259-F264 HydrophobicContact CG-CZ 4.45Å; F259-I297 HydrophobicContact CE2-CG1 4.06Å; F259-I297 HydrophobicContact CZ-CG1 3.89Å; F259-I300 HydrophobicContact CD2-CD1 4.29Å; F259-I300 HydrophobicContact CE2-CD1 3.66Å
260A88.7Confident82.5Confident79 Ų7954.8 Ų54.865%0.65330%0.297SS*.THydrogen-bonded Turntrans-81.5-8.6173.700000114.1L256 M258L256-A260 PolarHBondContact O-N 3.09Å; L256-A260 VanDerWaalsContact O-N 3.08Å; M258-A260 PolarHBondContact O-N 3.46Å
261A89.7Confident84Confident15 Ų1554.4 Ų54.412%0.12430%0.296CS..SBendtrans-78.2138.2-177.900000111.9L219 Q257 M258 F259 F263 F264L219-A261 HydrophobicContact CD2-CB 4.47Å; Q257-A261 PolarHBondContact O-N 2.94Å; M258-A261 VanDerWaalsContact O-CB 3.25Å; M258-A261 WeakPolarHBondContact O-CB 3.28Å; M258-A261 PolarHBondContact O-N 3.04Å; F259-A261 VanDerWaalsContact C-N 3.35Å; A261-F263 HydrophobicContact CB-CD1 3.75Å; A261-F263 HydrophobicContact CB-CE1 3.46Å; A261-F263 VanDerWaalsContact CB-CE1 3.46Å; A261-F263 HydrophobicContact CB-CZ 4.04Å; A261-F263 PolarHBondContact O-N 3.19Å; A261-F263 VanDerWaalsContact O-N 3.16Å; A261-F264 VanDerWaalsContact O-CB 3.3Å; A261-F264 WeakPolarHBondContact O-CB 3.24Å; A261-F264 PolarHBondContact O-N 3.16Å
262D91.8Very high85.8Confident133 Ų13356 Ų5671%0.71129%0.294SS*.THydrogen-bonded Turntrans-63-28.1-174.3-62.3-31.5000113.2F264D262-F264 VanDerWaalsContact C-N 3.3Å
263F90Very high87.3Confident5 Ų559.2 Ų59.22%0.02231%0.31CS..THydrogen-bonded Turntrans-78.1-11.6177.870-94.9000113.8L219 L222 Q223 V226 M258 A261 P266 L267L219-F263 HydrophobicContact CD2-CE1 4.35Å; L219-F263 HydrophobicContact CD2-CZ 4.16Å; L222-F263 HydrophobicContact CB-CE1 3.76Å; L222-F263 HydrophobicContact CB-CE2 3.82Å; L222-F263 HydrophobicContact CB-CZ 3.33Å; L222-F263 HydrophobicContact CD1-CE2 4.43Å; L222-F263 HydrophobicContact CD1-CZ 3.91Å; L222-F263 HydrophobicContact CG-CZ 4.25Å; Q223-F263 VanDerWaalsContact CA-CD1 3.48Å; Q223-F263 HydrophobicContact CB-CD1 3.9Å; Q223-F263 HydrophobicContact CB-CE1 4.3Å; Q223-F263 HydrophobicContact CG-CD1 4.48Å; V226-F263 HydrophobicContact CB-CB 4.47Å; V226-F263 HydrophobicContact CB-CD2 4.02Å; V226-F263 HydrophobicContact CB-CG 4.46Å; V226-F263 HydrophobicContact CG1-CB 4.35Å; V226-F263 HydrophobicContact CG1-CD2 4.01Å; V226-F263 HydrophobicContact CG2-CD2 3.82Å; V226-F263 HydrophobicContact CG2-CE2 3.98Å; M258-F263 HydrophobicContact CE-CD2 4.19Å; M258-F263 HydrophobicContact CE-CE2 3.22Å; M258-F263 HydrophobicContact CE-CZ 3.75Å; M258-F263 HydrophobicContact SD-CE2 3.81Å; M258-F263 HydrophobicContact SD-CZ 3.65Å; A261-F263 HydrophobicContact CB-CD1 3.75Å; A261-F263 HydrophobicContact CB-CE1 3.46Å; A261-F263 VanDerWaalsContact CB-CE1 3.46Å; A261-F263 HydrophobicContact CB-CZ 4.04Å; A261-F263 PolarHBondContact O-N 3.19Å; A261-F263 VanDerWaalsContact O-N 3.16Å; F263-P266 WeakPolarHBondContact O-CD 3.22Å; F263-L267 HydrophobicContact CD2-CD2 4.48Å; F263-L267 HydrophobicContact CE2-CD2 4.41Å; F263-L267 WeakPolarHBondContact O-CB 3.5Å; F263-L267 PolarHBondContact O-N 2.97Å; F263-L267 VanDerWaalsContact O-N 3.09Å
264F90.8Very high88.4Confident22 Ų2249.3 Ų49.310%0.09627%0.274CS..Hα-helixtrans-69.8-46.7-173.8178.3-99.3000114.1M258 F259 A261 D262 L267 L268 L293M258-F264 HydrophobicContact CE-CD2 3.88Å; M258-F264 HydrophobicContact CG-CD2 3.71Å; M258-F264 HydrophobicContact CG-CE2 4.23Å; M258-F264 HydrophobicContact CG-CG 4.46Å; M258-F264 WeakPolarHBondContact O-CB 3.39Å; F259-F264 HydrophobicContact CD1-CD1 4.28Å; F259-F264 HydrophobicContact CD1-CD2 4.34Å; F259-F264 AromaticContact CD1-CE1 3.67Å; F259-F264 HydrophobicContact CD1-CE1 3.67Å; F259-F264 AromaticContact CD1-CE2 3.73Å; F259-F264 HydrophobicContact CD1-CE2 3.73Å; F259-F264 AromaticContact CD1-CZ 3.34Å; F259-F264 HydrophobicContact CD1-CZ 3.34Å; F259-F264 HydrophobicContact CE1-CE1 4.24Å; F259-F264 AromaticContact CE1-CE2 3.92Å; F259-F264 HydrophobicContact CE1-CE2 3.92Å; F259-F264 AromaticContact CE1-CZ 3.52Å; F259-F264 HydrophobicContact CE1-CZ 3.52Å; F259-F264 HydrophobicContact CG-CE1 4.42Å; F259-F264 HydrophobicContact CG-CZ 4.45Å; A261-F264 VanDerWaalsContact O-CB 3.3Å; A261-F264 WeakPolarHBondContact O-CB 3.24Å; A261-F264 PolarHBondContact O-N 3.16Å; D262-F264 VanDerWaalsContact C-N 3.3Å; F264-L267 WeakPolarHBondContact O-CB 3.42Å; F264-L267 PolarHBondContact O-N 3.33Å; F264-L267 VanDerWaalsContact O-N 3.11Å; F264-L268 PolarHBondContact O-N 3.26Å; F264-L293 HydrophobicContact CE2-CD1 3.8Å; F264-L293 HydrophobicContact CZ-CD1 3.51Å; F264-L293 HydrophobicContact CZ-CG 4.46Å
265P92.3Very high89.1Confident71 Ų7151.7 Ų51.746%0.46129%0.286SS..Hα-helixtrans-59.3-45177.2-18.328.7000113.2L267 L268 I269P265-L267 VanDerWaalsContact C-N 3.32Å; P265-L267 PolarHBondContact O-N 2.81Å; P265-L268 PolarHBondContact O-N 3.18Å; P265-I269 WeakPolarHBondContact O-CG1 3.32Å; P265-I269 PolarHBondContact O-N 2.83Å; P265-I269 VanDerWaalsContact O-N 3.09Å
266P92.2Very high89.5Confident55 Ų5559.2 Ų59.236%0.35732%0.317SS..Hα-helixtrans-59.6-37.7171.8-25.935.1000114.1F230 F263 I269 N270F230-P266 HydrophobicContact CE2-CB 3.78Å; F230-P266 HydrophobicContact CZ-CB 4.25Å; F263-P266 WeakPolarHBondContact O-CD 3.22Å; P266-I269 PolarHBondContact O-N 3.12Å; P266-N270 WeakPolarHBondContact O-CB 3.25Å; P266-N270 PolarHBondContact O-N 3.37Å; P266-N270 PolarHBondContact O-ND2 2.69Å
267L90.5Very high89.7Confident1 Ų156.6 Ų56.61%0.00530%0.303CS..Hα-helixtrans-63.1-42.5176.7-177.968.6000111.8V226 F230 L241 Y242 M258 F263 F264 P265 A271 F289V226-L267 HydrophobicContact CG1-CB 4.32Å; V226-L267 HydrophobicContact CG1-CD1 3.93Å; F230-L267 HydrophobicContact CE1-CD1 3.97Å; F230-L267 HydrophobicContact CZ-CB 4.04Å; F230-L267 HydrophobicContact CZ-CD1 4.1Å; L241-L267 HydrophobicContact CD1-CD1 4.09Å; L241-L267 HydrophobicContact CD2-CD1 4.02Å; L241-L267 HydrophobicContact CG-CD1 4.02Å; Y242-L267 HydrophobicContact CD1-CD1 4.23Å; Y242-L267 HydrophobicContact CE1-CD1 3.57Å; Y242-L267 HydrophobicContact CE1-CG 4.13Å; M258-L267 HydrophobicContact CE-CD2 3.48Å; M258-L267 VanDerWaalsContact CE-CD2 3.48Å; F263-L267 HydrophobicContact CD2-CD2 4.48Å; F263-L267 HydrophobicContact CE2-CD2 4.41Å; F263-L267 WeakPolarHBondContact O-CB 3.5Å; F263-L267 PolarHBondContact O-N 2.97Å; F263-L267 VanDerWaalsContact O-N 3.09Å; F264-L267 WeakPolarHBondContact O-CB 3.42Å; F264-L267 PolarHBondContact O-N 3.33Å; F264-L267 VanDerWaalsContact O-N 3.11Å; P265-L267 VanDerWaalsContact C-N 3.32Å; P265-L267 PolarHBondContact O-N 2.81Å; L267-A271 WeakPolarHBondContact O-CB 3.16Å; L267-A271 PolarHBondContact O-N 3.16Å; L267-F289 HydrophobicContact CD2-CE2 4.36Å; L267-F289 HydrophobicContact CD2-CZ 4.04Å; L267-F289 HydrophobicContact CG-CZ 4.24Å
268L90.6Very high89.8Confident52 Ų5261.3 Ų61.327%0.27233%0.33SS..Hα-helixtrans-66.5-43177.3179.160.4000112.2F264 P265 A271 I272 L290 L293F264-L268 PolarHBondContact O-N 3.26Å; P265-L268 PolarHBondContact O-N 3.18Å; L268-A271 WeakPolarHBondContact O-CB 3.35Å; L268-A271 PolarHBondContact O-N 3.49Å; L268-I272 WeakPolarHBondContact O-CG1 3.41Å; L268-I272 PolarHBondContact O-N 3.48Å; L268-L290 HydrophobicContact CD1-CD2 3.88Å; L268-L293 HydrophobicContact CD1-CD1 4.01Å
269I92Very high90.2Very high95 Ų9563.3 Ų63.349%0.48734%0.341SS..Hα-helixtrans-61.5-48.1177.4-67.7167.5000109.9P265 P266 A271 I272 E273P265-I269 WeakPolarHBondContact O-CG1 3.32Å; P265-I269 PolarHBondContact O-N 2.83Å; P265-I269 VanDerWaalsContact O-N 3.09Å; P266-I269 PolarHBondContact O-N 3.12Å; I269-A271 VanDerWaalsContact C-N 3.25Å; I269-A271 PolarHBondContact O-N 2.84Å; I269-I272 PolarHBondContact O-N 3.36Å; I269-E273 WeakPolarHBondContact O-CG 3.36Å; I269-E273 PolarHBondContact O-N 3.12Å
270N91Very high90.4Very high32 Ų3266.5 Ų66.517%0.17136%0.36CS..Hα-helixtrans-61.2-34.5176.9-88.7-99.4000111.9F230 Y242 P266 I272 E273 A274F230-N270 HydrophobicContact CD1-CB 3.84Å; F230-N270 VanDerWaalsContact CD1-CG 3.42Å; F230-N270 WeakPolarHBondContact CD1-OD1 3.38Å; F230-N270 HydrophobicContact CE1-CB 3.63Å; F230-N270 HydrophobicContact CZ-CB 4.37Å; Y242-N270 WeakPolarHBondContact OH-CB 3.36Å; Y242-N270 PolarHBondContact OH-O 3.25Å; P266-N270 WeakPolarHBondContact O-CB 3.25Å; P266-N270 PolarHBondContact O-N 3.37Å; P266-N270 PolarHBondContact O-ND2 2.69Å; N270-I272 VanDerWaalsContact C-N 3.31Å; N270-I272 PolarHBondContact O-N 3.49Å; N270-E273 PolarHBondContact O-N 3.43Å; N270-A274 WeakPolarHBondContact O-CB 3.46Å; N270-A274 PolarHBondContact O-N 2.87Å
271A90.1Very high90.5Very high0 Ų068.4 Ų68.40%036%0.356CS..Hα-helixtrans-63.6-40.9179.200000111.1Y242 L267 L268 I269 L275 F289 L290Y242-A271 HydrophobicContact CD1-CB 4.22Å; Y242-A271 HydrophobicContact CE1-CB 3.5Å; Y242-A271 VanDerWaalsContact OH-CA 3.23Å; Y242-A271 WeakPolarHBondContact OH-CA 3.32Å; Y242-A271 PolarHBondContact OH-N 3.01Å; L267-A271 WeakPolarHBondContact O-CB 3.16Å; L267-A271 PolarHBondContact O-N 3.16Å; L268-A271 WeakPolarHBondContact O-CB 3.35Å; L268-A271 PolarHBondContact O-N 3.49Å; I269-A271 VanDerWaalsContact C-N 3.25Å; I269-A271 PolarHBondContact O-N 2.84Å; A271-L275 WeakPolarHBondContact O-CG 3.5Å; A271-L275 PolarHBondContact O-N 2.96Å; A271-F289 HydrophobicContact CB-CD1 3.99Å; A271-F289 HydrophobicContact CB-CE1 3.87Å; A271-L290 HydrophobicContact CB-CD2 4.03Å; A271-L290 HydrophobicContact CB-CG 4.49Å
272I91.4Very high90.5Very high98 Ų9867.7 Ų67.750%0.50335%0.35SS..Hα-helixtrans-69.3-38.1177.6-63.1168.1000110.8L268 I269 N270L268-I272 WeakPolarHBondContact O-CG1 3.41Å; L268-I272 PolarHBondContact O-N 3.48Å; I269-I272 PolarHBondContact O-N 3.36Å; N270-I272 VanDerWaalsContact C-N 3.31Å; N270-I272 PolarHBondContact O-N 3.49Å
273E89.7Confident90.4Very high101 Ų10165.3 Ų65.347%0.47233%0.333SS..Hα-helixtrans-68.3-39.6177.3-71.2177.616500112.2I269 N270 L275 K276I269-E273 WeakPolarHBondContact O-CG 3.36Å; I269-E273 PolarHBondContact O-N 3.12Å; N270-E273 PolarHBondContact O-N 3.43Å; E273-L275 PolarHBondContact O-N 2.94Å; E273-K276 WeakPolarHBondContact O-CB 3.45Å; E273-K276 WeakPolarHBondContact O-CG 3.45Å; E273-K276 PolarHBondContact O-N 3.26Å; E273-K276 VanDerWaalsContact O-N 3.16Å
274A88.8Confident90.5Very high9 Ų969.4 Ų69.47%0.07435%0.352CS..Hα-helixtrans-68.1-18.9-178.600000113.6V238 Y242 N270 K276 L277 D286V238-A274 HydrophobicContact CG1-CB 3.97Å; Y242-A274 HydrophobicContact CE2-CB 4.23Å; N270-A274 WeakPolarHBondContact O-CB 3.46Å; N270-A274 PolarHBondContact O-N 2.87Å; A274-K276 PolarHBondContact O-N 3.22Å; A274-L277 HydrophobicContact CB-CD1 4.16Å; A274-L277 WeakPolarHBondContact O-CB 3.41Å; A274-L277 PolarHBondContact O-N 2.96Å; A274-D286 WeakPolarHBondContact CB-OD2 3.06Å
275L89.6Confident90.5Very high55 Ų5569 Ų6929%0.28835%0.352SS..THydrogen-bonded Turntrans-57.8-14169-64.4178.7000114.2A271 E273 F283 D286 I287 L290A271-L275 WeakPolarHBondContact O-CG 3.5Å; A271-L275 PolarHBondContact O-N 2.96Å; E273-L275 PolarHBondContact O-N 2.94Å; L275-F283 HydrophobicContact CB-CE2 4.35Å; L275-F283 HydrophobicContact CD2-CD2 4.02Å; L275-F283 HydrophobicContact CD2-CE2 3.82Å; L275-D286 HydrophobicContact CD2-CB 3.93Å; L275-I287 HydrophobicContact CD2-CD1 3.6Å; L275-I287 HydrophobicContact CD2-CG1 4.02Å; L275-L290 HydrophobicContact CD1-CD1 4.02Å; L275-L290 HydrophobicContact CD2-CD1 4.26Å; L275-L290 HydrophobicContact CG-CD1 4.42Å
276K89.1Confident90.4Very high177 Ų17765.6 Ų65.677%0.7733%0.33SS*.THydrogen-bonded Turntrans-87-9.1175.8-59.8173.1-173.3166.60113.3E273 A274 D278E273-K276 WeakPolarHBondContact O-CB 3.45Å; E273-K276 WeakPolarHBondContact O-CG 3.45Å; E273-K276 PolarHBondContact O-N 3.26Å; E273-K276 VanDerWaalsContact O-N 3.16Å; A274-K276 PolarHBondContact O-N 3.22Å; K276-D278 PolarHBondContact O-N 3.42Å
277L87.2Confident90.4Very high51 Ų5166.3 Ų66.327%0.26733%0.33SS..SBendtrans-64.6133.7175-96.7103000110A235 V238 A274 D279A235-L277 HydrophobicContact CB-CD2 4.22Å; V238-L277 HydrophobicContact CG2-CD1 4.28Å; A274-L277 HydrophobicContact CB-CD1 4.16Å; A274-L277 WeakPolarHBondContact O-CB 3.41Å; A274-L277 PolarHBondContact O-N 2.96Å; L277-D279 PolarHBondContact O-N 3.47Å
278D89.8Confident90.5Very high176 Ų17670.8 Ų70.894%0.94135%0.35SS*.SBendtrans-83.861.6173.4-16824.4000110.2K276K276-D278 PolarHBondContact O-N 3.42Å
279D92.4Very high90.5Very high46 Ų4668.3 Ų68.325%0.24634%0.337CS..  trans-144.5122.6177-174.5-82.2000110.5A235 L277 E281 A282 F283A235-D279 HydrophobicContact CB-CB 3.7Å; A235-D279 WeakPolarHBondContact CB-OD2 3.14Å; L277-D279 PolarHBondContact O-N 3.47Å; D279-E281 PolarHBondContact OD1-N 3.22Å; D279-E281 VanDerWaalsContact OD1-N 3.08Å; D279-A282 HydrophobicContact CB-CB 4.07Å; D279-A282 WeakPolarHBondContact OD1-CB 2.8Å; D279-A282 PolarHBondContact OD1-N 3.22Å; D279-F283 WeakPolarHBondContact O-CB 3.2Å; D279-F283 PolarHBondContact O-N 2.91Å
280L91.3Very high90.4Very high123 Ų12365.1 Ų65.164%0.64432%0.321SS*.Hα-helixtrans-68.5-39-172.6-179.363.3000112.6F283 E284L280-F283 PolarHBondContact O-N 3.41Å; L280-E284 HydrophobicContact CD1-CG 4.43Å; L280-E284 WeakPolarHBondContact O-CB 3.43Å; L280-E284 WeakPolarHBondContact O-CG 3.21Å; L280-E284 PolarHBondContact O-N 2.99Å
281E90.7Very high90.4Very high119 Ų11968.3 Ų68.356%0.55634%0.338SS*.Hα-helixtrans-75-41.3-172.9-68.4160.5163.600110.5D279 S285D279-E281 PolarHBondContact OD1-N 3.22Å; D279-E281 VanDerWaalsContact OD1-N 3.08Å; E281-S285 PolarHBondContact O-N 3.18Å; E281-S285 PolarHBondContact O-OG 2.97Å
282A88.9Confident90.3Very high0 Ų070.1 Ų70.10%035%0.346CS..Hα-helixtrans-60.9-51.9169.200000110.9A235 V238 D279 E284 S285 D286A235-A282 HydrophobicContact CB-CB 4.26Å; V238-A282 HydrophobicContact CB-CB 4.26Å; V238-A282 HydrophobicContact CG1-CB 3.87Å; D279-A282 HydrophobicContact CB-CB 4.07Å; D279-A282 WeakPolarHBondContact OD1-CB 2.8Å; D279-A282 PolarHBondContact OD1-N 3.22Å; A282-E284 VanDerWaalsContact C-N 3.34Å; A282-E284 PolarHBondContact O-N 3.45Å; A282-S285 PolarHBondContact O-N 3.36Å; A282-D286 PolarHBondContact O-N 3.45Å; A282-D286 VanDerWaalsContact O-OD1 3.12Å
283F90.5Very high90.1Very high84 Ų8465.9 Ų65.937%0.36832%0.324SS..Hα-helixtrans-57.5-44.5-179.9-178.8-93.1000112.5L275 D279 L280 S285 D286 I287L275-F283 HydrophobicContact CB-CE2 4.35Å; L275-F283 HydrophobicContact CD2-CD2 4.02Å; L275-F283 HydrophobicContact CD2-CE2 3.82Å; D279-F283 WeakPolarHBondContact O-CB 3.2Å; D279-F283 PolarHBondContact O-N 2.91Å; L280-F283 PolarHBondContact O-N 3.41Å; F283-S285 VanDerWaalsContact C-N 3.3Å; F283-S285 PolarHBondContact O-N 3.03Å; F283-D286 PolarHBondContact O-N 3.01Å; F283-I287 HydrophobicContact CD1-CG1 4.07Å; F283-I287 HydrophobicContact CE1-CD1 4.33Å; F283-I287 HydrophobicContact CE1-CG1 3.65Å; F283-I287 HydrophobicContact CE2-CD1 4.36Å; F283-I287 HydrophobicContact CE2-CG1 4.23Å; F283-I287 HydrophobicContact CZ-CD1 3.93Å; F283-I287 HydrophobicContact CZ-CG1 3.73Å; F283-I287 WeakPolarHBondContact O-CG1 3.23Å; F283-I287 PolarHBondContact O-N 2.89Å
284E92Very high90.1Very high90 Ų9066 Ų6642%0.42133%0.328SS..Hα-helixtrans-60.6-39.8176.3-83.6-165.5-168.900112.8L280 A282 K288L280-E284 HydrophobicContact CD1-CG 4.43Å; L280-E284 WeakPolarHBondContact O-CB 3.43Å; L280-E284 WeakPolarHBondContact O-CG 3.21Å; L280-E284 PolarHBondContact O-N 2.99Å; A282-E284 VanDerWaalsContact C-N 3.34Å; A282-E284 PolarHBondContact O-N 3.45Å; E284-K288 WeakPolarHBondContact O-CB 3.32Å; E284-K288 VanDerWaalsContact O-CD 3.32Å; E284-K288 WeakPolarHBondContact O-CD 3.43Å; E284-K288 WeakPolarHBondContact O-CG 3.43Å; E284-K288 PolarHBondContact O-N 3.31Å; E284-K288 IonicContact OE2-NZ 3.55Å; E284-K288 PolarHBondContact OE2-NZ 3.35Å
285S90.5Very high90Very high13 Ų1367.5 Ų67.59%0.09134%0.336CS..Hα-helixtrans-69.3-39.5179.7-63.90000111.6E239 E281 A282 F283 K288 F289E239-S285 VanDerWaalsContact CG-OG 3.29Å; E239-S285 WeakPolarHBondContact CG-OG 3.08Å; E281-S285 PolarHBondContact O-N 3.18Å; E281-S285 PolarHBondContact O-OG 2.97Å; A282-S285 PolarHBondContact O-N 3.36Å; F283-S285 VanDerWaalsContact C-N 3.3Å; F283-S285 PolarHBondContact O-N 3.03Å; S285-K288 PolarHBondContact O-N 3.44Å; S285-F289 PolarHBondContact O-N 2.91Å
286D90.5Very high89.8Confident0 Ų065.3 Ų65.30%033%0.325CS..Hα-helixtrans-63.3-47.5175.8-70.414.2000111.2V238 Y242 A274 L275 A282 F283 K288 F289 L290V238-D286 VanDerWaalsContact CG1-OD1 3.28Å; V238-D286 WeakPolarHBondContact CG1-OD1 3.37Å; Y242-D286 WeakPolarHBondContact CD2-OD1 3.34Å; Y242-D286 WeakPolarHBondContact CE2-OD1 3.42Å; A274-D286 WeakPolarHBondContact CB-OD2 3.06Å; L275-D286 HydrophobicContact CD2-CB 3.93Å; A282-D286 PolarHBondContact O-N 3.45Å; A282-D286 VanDerWaalsContact O-OD1 3.12Å; F283-D286 PolarHBondContact O-N 3.01Å; D286-K288 PolarHBondContact O-N 2.95Å; D286-F289 WeakPolarHBondContact O-CB 2.95Å; D286-F289 PolarHBondContact O-N 3.1Å; D286-L290 WeakPolarHBondContact O-CG 3.32Å; D286-L290 PolarHBondContact O-N 2.83Å
287I92.3Very high89.6Confident71 Ų7161 Ų6136%0.36431%0.309SS..Hα-helixtrans-62.5-43.2177.6-68.2-65.9000111.1L275 F283 F289 L290 D291L275-I287 HydrophobicContact CD2-CD1 3.6Å; L275-I287 HydrophobicContact CD2-CG1 4.02Å; F283-I287 HydrophobicContact CD1-CG1 4.07Å; F283-I287 HydrophobicContact CE1-CD1 4.33Å; F283-I287 HydrophobicContact CE1-CG1 3.65Å; F283-I287 HydrophobicContact CE2-CD1 4.36Å; F283-I287 HydrophobicContact CE2-CG1 4.23Å; F283-I287 HydrophobicContact CZ-CD1 3.93Å; F283-I287 HydrophobicContact CZ-CG1 3.73Å; F283-I287 WeakPolarHBondContact O-CG1 3.23Å; F283-I287 PolarHBondContact O-N 2.89Å; I287-F289 VanDerWaalsContact C-N 3.3Å; I287-F289 PolarHBondContact O-N 3.11Å; I287-L290 PolarHBondContact O-N 3.32Å; I287-D291 WeakPolarHBondContact O-CB 3.29Å; I287-D291 PolarHBondContact O-N 2.95Å
288K91.3Very high89.6Confident94 Ų9462.5 Ų62.541%0.40932%0.32SS..Hα-helixtrans-61.1-39.8176.1-73.9163.7-166.6156.80111.6M246 E284 S285 D286 E292M246-K288 HydrophobicContact CE-CB 4.39Å; M246-K288 HydrophobicContact SD-CB 4.04Å; E284-K288 WeakPolarHBondContact O-CB 3.32Å; E284-K288 VanDerWaalsContact O-CD 3.32Å; E284-K288 WeakPolarHBondContact O-CD 3.43Å; E284-K288 WeakPolarHBondContact O-CG 3.43Å; E284-K288 PolarHBondContact O-N 3.31Å; E284-K288 IonicContact OE2-NZ 3.55Å; E284-K288 PolarHBondContact OE2-NZ 3.35Å; S285-K288 PolarHBondContact O-N 3.44Å; D286-K288 PolarHBondContact O-N 2.95Å; K288-E292 WeakPolarHBondContact O-CB 3.4Å; K288-E292 PolarHBondContact O-N 2.86Å; K288-E292 VanDerWaalsContact O-N 3.12Å
289F90.6Very high89.3Confident0 Ų060.8 Ų60.80%030%0.301CS..Hα-helixtrans-63.1-47174.6166.5-103.9000112.1Y242 V249 F250 L267 A271 S285 D286 I287 E292 L293Y242-F289 HydrophobicContact CD1-CB 4.31Å; Y242-F289 AromaticContact CD1-CD1 3.6Å; Y242-F289 HydrophobicContact CD1-CD1 3.6Å; Y242-F289 HydrophobicContact CD1-CD2 4.47Å; Y242-F289 AromaticContact CD1-CE1 3.99Å; Y242-F289 HydrophobicContact CD1-CE1 3.99Å; Y242-F289 AromaticContact CD1-CG 3.86Å; Y242-F289 HydrophobicContact CD1-CG 3.86Å; Y242-F289 HydrophobicContact CE1-CD1 4.14Å; Y242-F289 HydrophobicContact CE1-CE1 4.16Å; V249-F289 HydrophobicContact CG2-CE2 4.25Å; F250-F289 HydrophobicContact CE2-CD2 4.34Å; F250-F289 HydrophobicContact CE2-CE2 4.11Å; L267-F289 HydrophobicContact CD2-CE2 4.36Å; L267-F289 HydrophobicContact CD2-CZ 4.04Å; L267-F289 HydrophobicContact CG-CZ 4.24Å; A271-F289 HydrophobicContact CB-CD1 3.99Å; A271-F289 HydrophobicContact CB-CE1 3.87Å; S285-F289 PolarHBondContact O-N 2.91Å; D286-F289 WeakPolarHBondContact O-CB 2.95Å; D286-F289 PolarHBondContact O-N 3.1Å; I287-F289 VanDerWaalsContact C-N 3.3Å; I287-F289 PolarHBondContact O-N 3.11Å; F289-E292 PolarHBondContact O-N 3.45Å; F289-L293 HydrophobicContact CE1-CD1 4.29Å; F289-L293 HydrophobicContact CZ-CD1 4.01Å; F289-L293 WeakPolarHBondContact O-CB 3.01Å; F289-L293 PolarHBondContact O-N 3.11Å
290L91.5Very high88.7Confident28 Ų2861.2 Ų61.215%0.14730%0.302CS..Hα-helixtrans-65.7-41.1179.8-68.6173.3000112.5L268 A271 L275 D286 I287 L293 L294L268-L290 HydrophobicContact CD1-CD2 3.88Å; A271-L290 HydrophobicContact CB-CD2 4.03Å; A271-L290 HydrophobicContact CB-CG 4.49Å; L275-L290 HydrophobicContact CD1-CD1 4.02Å; L275-L290 HydrophobicContact CD2-CD1 4.26Å; L275-L290 HydrophobicContact CG-CD1 4.42Å; D286-L290 WeakPolarHBondContact O-CG 3.32Å; D286-L290 PolarHBondContact O-N 2.83Å; I287-L290 PolarHBondContact O-N 3.32Å; L290-L293 WeakPolarHBondContact O-CB 3.48Å; L290-L293 PolarHBondContact O-N 3.16Å; L290-L294 WeakPolarHBondContact O-CG 3.28Å; L290-L294 PolarHBondContact O-N 3.27Å
291D90.3Very high88.3Confident100 Ų10057.5 Ų57.554%0.53529%0.294SS..Hα-helixtrans-62.5-45.8177.1-17854000111.7I287 L293 L294 T295I287-D291 WeakPolarHBondContact O-CB 3.29Å; I287-D291 PolarHBondContact O-N 2.95Å; D291-L293 VanDerWaalsContact C-N 3.3Å; D291-L293 PolarHBondContact O-N 3.12Å; D291-L294 PolarHBondContact O-N 3.13Å; D291-T295 WeakPolarHBondContact O-CB 3.49Å; D291-T295 PolarHBondContact O-N 3.34Å; D291-T295 PolarHBondContact O-OG1 2.83Å
292E87.4Confident87.7Confident38 Ų3858.8 Ų58.818%0.17830%0.298CS..Hα-helixtrans-65.5-36.8177-171.766.3-141.800111.1M246 F250 K288 F289 T295 N296 R299M246-E292 HydrophobicContact CG-CB 4.35Å; M246-E292 HydrophobicContact CG-CG 4.45Å; F250-E292 HydrophobicContact CB-CG 3.21Å; F250-E292 WeakPolarHBondContact CB-OE1 3.41Å; F250-E292 HydrophobicContact CD1-CG 4.49Å; F250-E292 HydrophobicContact CD2-CB 3.88Å; F250-E292 HydrophobicContact CD2-CG 3.38Å; F250-E292 HydrophobicContact CE2-CG 4.4Å; F250-E292 HydrophobicContact CG-CB 4.4Å; F250-E292 HydrophobicContact CG-CG 3.47Å; F250-E292 VanDerWaalsContact CG-CG 3.47Å; K288-E292 WeakPolarHBondContact O-CB 3.4Å; K288-E292 PolarHBondContact O-N 2.86Å; K288-E292 VanDerWaalsContact O-N 3.12Å; F289-E292 PolarHBondContact O-N 3.45Å; E292-T295 PolarHBondContact O-N 2.74Å; E292-N296 PolarHBondContact O-N 2.98Å; E292-N296 PolarHBondContact O-ND2 3.4Å; E292-N296 PolarHBondContact OE1-ND2 3.05Å; E292-R299 IonicContact OE1-NH1 3.93Å
293L88.1Confident86.6Confident8 Ų863.2 Ų63.24%0.04232%0.324CS..Hα-helixtrans-60.6-50.3174.1176.6148.9000112.5F250 F264 L268 F289 L290 D291 T295 N296 I297F250-L293 HydrophobicContact CE2-CB 3.75Å; F250-L293 HydrophobicContact CZ-CB 3.55Å; F250-L293 HydrophobicContact CZ-CD1 4.28Å; F250-L293 HydrophobicContact CZ-CG 3.97Å; F264-L293 HydrophobicContact CE2-CD1 3.8Å; F264-L293 HydrophobicContact CZ-CD1 3.51Å; F264-L293 HydrophobicContact CZ-CG 4.46Å; L268-L293 HydrophobicContact CD1-CD1 4.01Å; F289-L293 HydrophobicContact CE1-CD1 4.29Å; F289-L293 HydrophobicContact CZ-CD1 4.01Å; F289-L293 WeakPolarHBondContact O-CB 3.01Å; F289-L293 PolarHBondContact O-N 3.11Å; L290-L293 WeakPolarHBondContact O-CB 3.48Å; L290-L293 PolarHBondContact O-N 3.16Å; D291-L293 VanDerWaalsContact C-N 3.3Å; D291-L293 PolarHBondContact O-N 3.12Å; L293-T295 VanDerWaalsContact C-N 3.31Å; L293-T295 PolarHBondContact O-N 3.31Å; L293-N296 PolarHBondContact O-N 3.03Å; L293-I297 HydrophobicContact CD2-CD1 3.6Å; L293-I297 HydrophobicContact CG-CD1 4.27Å; L293-I297 WeakPolarHBondContact O-CG1 3.23Å; L293-I297 PolarHBondContact O-N 3.18Å
294L88.7Confident85.1Confident103 Ų10361.8 Ų61.854%0.53933%0.333SS..Hα-helixtrans-61.7-42.8177.7-69.8173.2000111.1L290 D291 N296 I297 V298L290-L294 WeakPolarHBondContact O-CG 3.28Å; L290-L294 PolarHBondContact O-N 3.27Å; D291-L294 PolarHBondContact O-N 3.13Å; L294-N296 VanDerWaalsContact C-N 3.29Å; L294-N296 PolarHBondContact O-N 3.36Å; L294-I297 PolarHBondContact O-N 3.33Å; L294-V298 WeakPolarHBondContact O-CG2 3.17Å; L294-V298 PolarHBondContact O-N 2.9Å
295T87.8Confident83.2Confident41 Ų4160.7 Ų60.725%0.25234%0.335SS..Hα-helixtrans-56.3-43.9176.6-67.80000111.6D291 E292 L293 V298 R299D291-T295 WeakPolarHBondContact O-CB 3.49Å; D291-T295 PolarHBondContact O-N 3.34Å; D291-T295 PolarHBondContact O-OG1 2.83Å; E292-T295 PolarHBondContact O-N 2.74Å; L293-T295 VanDerWaalsContact C-N 3.31Å; L293-T295 PolarHBondContact O-N 3.31Å; T295-V298 PolarHBondContact O-N 3.46Å; T295-R299 VanDerWaalsContact O-CG 3.31Å; T295-R299 WeakPolarHBondContact O-CG 3.38Å; T295-R299 PolarHBondContact O-N 3.2Å
296N84.6Confident81.1Confident10 Ų1064.4 Ų64.45%0.05336%0.362CS..Hα-helixtrans-74.8-35.3-179-77.1-80.1000113.4F250 P255 E292 L293 L294 V298 R299 I300F250-N296 WeakPolarHBondContact CB-ND2 3.42Å; F250-N296 HydrophobicContact CD1-CB 3.44Å; F250-N296 VanDerWaalsContact CD1-CB 3.44Å; F250-N296 WeakPolarHBondContact CD1-ND2 3.48Å; F250-N296 HydrophobicContact CE1-CB 3.58Å; F250-N296 HydrophobicContact CG-CB 4.47Å; F250-N296 VanDerWaalsContact CG-ND2 3.34Å; F250-N296 WeakPolarHBondContact CG-ND2 3.43Å; P255-N296 HydrophobicContact CB-CB 4.25Å; E292-N296 PolarHBondContact O-N 2.98Å; E292-N296 PolarHBondContact O-ND2 3.4Å; E292-N296 PolarHBondContact OE1-ND2 3.05Å; L293-N296 PolarHBondContact O-N 3.03Å; L294-N296 VanDerWaalsContact C-N 3.29Å; L294-N296 PolarHBondContact O-N 3.36Å; N296-V298 VanDerWaalsContact C-N 3.31Å; N296-V298 PolarHBondContact O-N 2.95Å; N296-R299 PolarHBondContact O-N 3.44Å; N296-I300 WeakPolarHBondContact O-CD1 3.39Å; N296-I300 VanDerWaalsContact O-CG1 3.31Å; N296-I300 WeakPolarHBondContact O-CG1 3.38Å; N296-I300 PolarHBondContact O-N 3.43Å
297I85.2Confident78.6Confident85 Ų8573.4 Ų73.444%0.43640%0.401SS..Hα-helixtrans-57.4-46.9171.3-69.1170.5000110.2F259 L293 L294 I300 G301F259-I297 HydrophobicContact CE2-CG1 4.06Å; F259-I297 HydrophobicContact CZ-CG1 3.89Å; L293-I297 HydrophobicContact CD2-CD1 3.6Å; L293-I297 HydrophobicContact CG-CD1 4.27Å; L293-I297 WeakPolarHBondContact O-CG1 3.23Å; L293-I297 PolarHBondContact O-N 3.18Å; L294-I297 PolarHBondContact O-N 3.33Å; I297-I300 PolarHBondContact O-N 2.9Å; I297-G301 PolarHBondContact O-N 2.83Å
298V86.4Confident75.8Confident83 Ų8372.4 Ų72.450%0.50341%0.409SS..Hα-helixtrans-63.5-43.4178173.30000111.4L294 T295 N296 G301 K302L294-V298 WeakPolarHBondContact O-CG2 3.17Å; L294-V298 PolarHBondContact O-N 2.9Å; T295-V298 PolarHBondContact O-N 3.46Å; N296-V298 VanDerWaalsContact C-N 3.31Å; N296-V298 PolarHBondContact O-N 2.95Å; V298-G301 PolarHBondContact O-N 3.02Å; V298-K302 HydrophobicContact CG1-CD 4.34Å; V298-K302 WeakPolarHBondContact O-CG 3.17Å; V298-K302 PolarHBondContact O-N 3.06Å
299R84.1Confident73.2Confident140 Ų14079 Ų7953%0.52843%0.431SS..Hα-helixtrans-58.9-48177.2-75.8173.3179.91664111.4E292 T295 N296 K302 V303E292-R299 IonicContact OE1-NH1 3.93Å; T295-R299 VanDerWaalsContact O-CG 3.31Å; T295-R299 WeakPolarHBondContact O-CG 3.38Å; T295-R299 PolarHBondContact O-N 3.2Å; N296-R299 PolarHBondContact O-N 3.44Å; R299-K302 PolarHBondContact O-N 3.27Å; R299-V303 WeakPolarHBondContact O-CG2 3.46Å; R299-V303 PolarHBondContact O-N 3.22Å
300I81.2Confident70.6Confident55 Ų5587.1 Ų87.128%0.28248%0.475SS..Hα-helixtrans-62.4-45.1178.8-68.1159.7000110.8P255 L256 F259 N296 I297 K302 V303 G304P255-I300 HydrophobicContact CB-CD1 3.94Å; P255-I300 HydrophobicContact CG-CD1 3.83Å; P255-I300 HydrophobicContact CG-CG1 4.42Å; L256-I300 HydrophobicContact CD2-CD1 3.83Å; L256-I300 HydrophobicContact CD2-CG1 4.4Å; L256-I300 HydrophobicContact CD2-CG2 4.07Å; L256-I300 HydrophobicContact CG-CD1 4.29Å; F259-I300 HydrophobicContact CD2-CD1 4.29Å; F259-I300 HydrophobicContact CE2-CD1 3.66Å; N296-I300 WeakPolarHBondContact O-CD1 3.39Å; N296-I300 VanDerWaalsContact O-CG1 3.31Å; N296-I300 WeakPolarHBondContact O-CG1 3.38Å; N296-I300 PolarHBondContact O-N 3.43Å; I297-I300 PolarHBondContact O-N 2.9Å; I300-K302 VanDerWaalsContact C-N 3.31Å; I300-K302 PolarHBondContact O-N 2.82Å; I300-V303 PolarHBondContact O-N 2.81Å; I300-G304 PolarHBondContact O-N 3.14Å
301G81Confident67.6Low45 Ų4590.8 Ų90.846%0.46450%0.503SS..Hα-helixtrans-61-36.417800000113.6I297 V298 S305I297-G301 PolarHBondContact O-N 2.83Å; V298-G301 PolarHBondContact O-N 3.02Å; G301-S305 WeakPolarHBondContact O-CB 3.48Å; G301-S305 PolarHBondContact O-N 2.85Å; G301-S305 VanDerWaalsContact O-N 3.09Å; G301-S305 PolarHBondContact O-OG 3.16Å
302K78Confident64.8Low147 Ų14795.5 Ų95.564%0.63952%0.521SS*.Hα-helixtrans-71.1-36.4175-74.8-173.7177.3-176.60113.2V298 R299 I300 S305 S306V298-K302 HydrophobicContact CG1-CD 4.34Å; V298-K302 WeakPolarHBondContact O-CG 3.17Å; V298-K302 PolarHBondContact O-N 3.06Å; R299-K302 PolarHBondContact O-N 3.27Å; I300-K302 VanDerWaalsContact C-N 3.31Å; I300-K302 PolarHBondContact O-N 2.82Å; K302-S305 WeakPolarHBondContact CA-OG 3.4Å; K302-S305 PolarHBondContact O-OG 3.29Å; K302-S305 VanDerWaalsContact O-OG 3.11Å; K302-S306 PolarHBondContact O-N 2.99Å; K302-S306 PolarHBondContact O-OG 3.08Å
303V67.3Low62.4Low93 Ų93107.2 Ų107.256%0.56457%0.572SS**Hα-helixtrans-70.7-39.4175.4176.70000110.8R299 I300 S305 S306R299-V303 WeakPolarHBondContact O-CG2 3.46Å; R299-V303 PolarHBondContact O-N 3.22Å; I300-V303 PolarHBondContact O-N 2.81Å; V303-S305 VanDerWaalsContact C-N 3.35Å; V303-S305 PolarHBondContact O-N 3.49Å; V303-S306 WeakPolarHBondContact CA-OG 3.39Å; V303-S306 PolarHBondContact O-N 3.03Å; V303-S306 PolarHBondContact O-OG 2.9Å
304G58.3Low61.1Low54 Ų54112.2 Ų112.256%0.55760%0.598SS**Hα-helixtrans-65.3-34.9175.500000113.6I300I300-G304 PolarHBondContact O-N 3.14Å
305S51.7Low59.6Low66 Ų66112.6 Ų112.646%0.46260%0.601SS.*Hα-helixtrans-78.3-24.8178.145.10000114.1G301 K302 V303 F307 G308G301-S305 WeakPolarHBondContact O-CB 3.48Å; G301-S305 PolarHBondContact O-N 2.85Å; G301-S305 VanDerWaalsContact O-N 3.09Å; G301-S305 PolarHBondContact O-OG 3.16Å; K302-S305 WeakPolarHBondContact CA-OG 3.4Å; K302-S305 PolarHBondContact O-OG 3.29Å; K302-S305 VanDerWaalsContact O-OG 3.11Å; V303-S305 VanDerWaalsContact C-N 3.35Å; V303-S305 PolarHBondContact O-N 3.49Å; S305-F307 VanDerWaalsContact C-N 3.29Å; S305-F307 PolarHBondContact O-N 3.48Å; S305-G308 PolarHBondContact O-N 2.95Å
306S46.9Very low58.1Low92 Ų92116.6 Ų116.664%0.64362%0.62SS**Hα-helixtrans-75.9-13.9175.9400000114K302 V303K302-S306 PolarHBondContact O-N 2.99Å; K302-S306 PolarHBondContact O-OG 3.08Å; V303-S306 WeakPolarHBondContact CA-OG 3.39Å; V303-S306 PolarHBondContact O-N 3.03Å; V303-S306 PolarHBondContact O-OG 2.9Å
307F38.7Very low56.5Low188 Ų188122.9 Ų122.983%0.82565%0.654SS**THydrogen-bonded Turntrans-93.8-0.4171-98.1-89.5000114S305S305-F307 VanDerWaalsContact C-N 3.29Å; S305-F307 PolarHBondContact O-N 3.48Å
308G33.2Very low54.7Low51 Ų51125.3 Ų125.353%0.52667%0.667SS.*SBendtrans-107.515.5-168.200000117.4S305S305-G308 PolarHBondContact O-N 2.95Å
309W35.5Very low52.6Low232 Ų232128.1 Ų128.188%0.87968%0.678SS**SBendtrans-124.423.7-173.5-81.274.9000115.7
310D36.6Very low50.3Low171 Ų171127.2 Ų127.291%0.91469%0.689SS**SBendtrans-132.716.7177.9-89.1-34.8000115.2
311S29.8Very low48Very low105 Ų105132.8 Ų132.873%0.73472%0.72SS**  trans-140.569.3177.760.80000112.9
312E31.5Very low45.2Very low198 Ų198140.1 Ų140.193%0.92574%0.742SS**  trans-156.692.5148.1-109.9171.5-163.200107.1
313K35.3Very low42.2Very low284 Ų284139.5 Ų139.5100%1.23575%0.751SS**  trans-116.70160.5-89.8-169.3179.51780107.8

Retrieved 313 of 313 residues in 950.2 ms (Link to these results)

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