A0A3Q0KTH5_SCHMA Loading...

Tetraspanin

AlphaFold DB , UniProt , Accession A0A3Q0KTH5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 225 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
1M50.8Low72.4Confident210 Ų21093.5 Ų93.5100%1.03455%0.551SS**  0-45.60-72.2-172-8600113.5S3 L4 S5M1-S3 PolarHBondContact O-N 3.09Å; M1-L4 PolarHBondContact O-N 3.1Å; M1-S5 PolarHBondContact O-N 3.3Å; M1-S5 VanDerWaalsContact O-N 3.1Å
2A51.2Low73.8Confident83 Ų8388.7 Ų88.769%0.68652%0.519SS*.Hα-helixtrans-60.6-38.7-177.700000115.5S5 C6A2-S5 WeakPolarHBondContact O-CA 3.24Å; A2-S5 VanDerWaalsContact O-CB 3.24Å; A2-S5 WeakPolarHBondContact O-CB 3.44Å; A2-S5 PolarHBondContact O-N 3.39Å; A2-S5 VanDerWaalsContact O-N 3.09Å; A2-C6 PolarHBondContact O-N 3.08Å; A2-C6 VanDerWaalsContact O-N 3.08Å
3S56.8Low75.2Confident103 Ų10389.9 Ų89.972%0.7252%0.521SS*.Hα-helixtrans-64.6-41.4176.946.60000112.8M1 S5 C6 G7M1-S3 PolarHBondContact O-N 3.09Å; S3-S5 PolarHBondContact O-N 3.14Å; S3-C6 PolarHBondContact O-N 3.09Å; S3-G7 PolarHBondContact O-N 3.43Å; S3-G7 VanDerWaalsContact O-N 3.14Å
4L59.8Low76.3Confident140 Ų14089.9 Ų89.973%0.73352%0.517SS*.Hα-helixtrans-62.5-32.3172.5-157.270.2000110.8M1 Y8M1-L4 PolarHBondContact O-N 3.1Å; L4-Y8 WeakPolarHBondContact O-CD1 3.26Å; L4-Y8 PolarHBondContact O-N 3.35Å; L4-Y8 VanDerWaalsContact O-N 3.1Å
5S72.3Confident77.4Confident42 Ų4284 Ų8429%0.29448%0.483SS..Hα-helixtrans-66.4-48.2177.8-1680000113.4M1 A2 S3 G7 Y8 K9M1-S5 PolarHBondContact O-N 3.3Å; M1-S5 VanDerWaalsContact O-N 3.1Å; A2-S5 WeakPolarHBondContact O-CA 3.24Å; A2-S5 VanDerWaalsContact O-CB 3.24Å; A2-S5 WeakPolarHBondContact O-CB 3.44Å; A2-S5 PolarHBondContact O-N 3.39Å; A2-S5 VanDerWaalsContact O-N 3.09Å; S3-S5 PolarHBondContact O-N 3.14Å; S5-G7 VanDerWaalsContact C-N 3.35Å; S5-G7 PolarHBondContact O-N 3.27Å; S5-Y8 WeakPolarHBondContact O-CD1 3.17Å; S5-Y8 WeakPolarHBondContact O-CE1 3.06Å; S5-Y8 VanDerWaalsContact OG-CE1 3.26Å; S5-Y8 WeakPolarHBondContact OG-CE1 3.39Å; S5-K9 WeakPolarHBondContact O-CG 3.23Å; S5-K9 PolarHBondContact O-N 3.49Å
6C78.8Confident78.5Confident92 Ų9280.3 Ų80.362%0.62246%0.462SS*.Hα-helixtrans-64.2-41.8177.2-171.10000111.7A2 S3 K9 C10A2-C6 PolarHBondContact O-N 3.08Å; A2-C6 VanDerWaalsContact O-N 3.08Å; S3-C6 PolarHBondContact O-N 3.09Å; C6-K9 PolarHBondContact O-N 3.4Å; C6-C10 PolarHBondContact O-N 3.1Å; C6-C10 VanDerWaalsContact O-N 3.09Å
7G83.5Confident79.5Confident34 Ų3480.9 Ų80.935%0.35146%0.462SS..Hα-helixtrans-58.2-51.217800000112.5S3 S5 K9 C10 L11S3-G7 PolarHBondContact O-N 3.43Å; S3-G7 VanDerWaalsContact O-N 3.14Å; S5-G7 VanDerWaalsContact C-N 3.35Å; S5-G7 PolarHBondContact O-N 3.27Å; G7-K9 VanDerWaalsContact C-N 3.34Å; G7-K9 PolarHBondContact O-N 3.06Å; G7-C10 PolarHBondContact O-N 2.95Å; G7-L11 VanDerWaalsContact O-CG 3.31Å; G7-L11 WeakPolarHBondContact O-CG 3.43Å; G7-L11 PolarHBondContact O-N 2.94Å
8Y82.8Confident80.3Confident82 Ų8279.6 Ų79.632%0.32245%0.45SS..Hα-helixtrans-63.3-39.5-179.485.9-108.6000112.3L4 S5 C10 L11 Q12L4-Y8 WeakPolarHBondContact O-CD1 3.26Å; L4-Y8 PolarHBondContact O-N 3.35Å; L4-Y8 VanDerWaalsContact O-N 3.1Å; S5-Y8 WeakPolarHBondContact O-CD1 3.17Å; S5-Y8 WeakPolarHBondContact O-CE1 3.06Å; S5-Y8 VanDerWaalsContact OG-CE1 3.26Å; S5-Y8 WeakPolarHBondContact OG-CE1 3.39Å; Y8-C10 VanDerWaalsContact C-N 3.32Å; Y8-C10 PolarHBondContact O-N 3.16Å; Y8-L11 PolarHBondContact O-N 2.91Å; Y8-Q12 WeakPolarHBondContact O-CB 3.44Å; Y8-Q12 PolarHBondContact O-N 3.47Å
9K85.7Confident81.1Confident108 Ų10875.4 Ų75.447%0.4743%0.427SS..Hα-helixtrans-62.8-43179.5-71.9-174.7-176.1-176.10110.7S5 C6 G7 Q12 I13S5-K9 WeakPolarHBondContact O-CG 3.23Å; S5-K9 PolarHBondContact O-N 3.49Å; C6-K9 PolarHBondContact O-N 3.4Å; G7-K9 VanDerWaalsContact C-N 3.34Å; G7-K9 PolarHBondContact O-N 3.06Å; K9-Q12 PolarHBondContact O-N 2.96Å; K9-I13 VanDerWaalsContact O-CG1 3.23Å; K9-I13 WeakPolarHBondContact O-CG1 3.31Å; K9-I13 PolarHBondContact O-N 2.98Å
10C88.1Confident81.9Confident84 Ų8475.4 Ų75.457%0.56843%0.425SS*.Hα-helixtrans-60.3-47.2175.9-170.70000111.4C6 G7 Y8 Q12 I13 L14C6-C10 PolarHBondContact O-N 3.1Å; C6-C10 VanDerWaalsContact O-N 3.09Å; G7-C10 PolarHBondContact O-N 2.95Å; Y8-C10 VanDerWaalsContact C-N 3.32Å; Y8-C10 PolarHBondContact O-N 3.16Å; C10-Q12 PolarHBondContact O-N 3.12Å; C10-I13 PolarHBondContact O-N 3.23Å; C10-L14 WeakPolarHBondContact O-CB 3.36Å; C10-L14 PolarHBondContact O-N 3.32Å
11L87.1Confident82.6Confident51 Ų5177.2 Ų77.227%0.26743%0.433SS..Hα-helixtrans-62.3-42.6177.8-66.2175.4000112.6G7 Y8 L14 L15 F211G7-L11 VanDerWaalsContact O-CG 3.31Å; G7-L11 WeakPolarHBondContact O-CG 3.43Å; G7-L11 PolarHBondContact O-N 2.94Å; Y8-L11 PolarHBondContact O-N 2.91Å; L11-L14 PolarHBondContact O-N 3.4Å; L11-L15 WeakPolarHBondContact O-CB 3.49Å; L11-L15 PolarHBondContact O-N 3.28Å; L11-F211 HydrophobicContact CD1-CD1 4.48Å; L11-F211 HydrophobicContact CD2-CD1 3.62Å; L11-F211 HydrophobicContact CD2-CE1 3.4Å; L11-F211 HydrophobicContact CD2-CE2 4.36Å; L11-F211 HydrophobicContact CD2-CG 4.2Å; L11-F211 HydrophobicContact CD2-CZ 3.8Å; L11-F211 HydrophobicContact CG-CD1 4.46Å
12Q88.7Confident84.7Confident35 Ų3568.5 Ų68.516%0.16439%0.391CS..Hα-helixtrans-63.3-44.9177.8-174.3-176.4-4.600111.2Y8 K9 C10 L15 V16 A76 V215Y8-Q12 WeakPolarHBondContact O-CB 3.44Å; Y8-Q12 PolarHBondContact O-N 3.47Å; K9-Q12 PolarHBondContact O-N 2.96Å; C10-Q12 PolarHBondContact O-N 3.12Å; Q12-L15 PolarHBondContact O-N 3.36Å; Q12-V16 VanDerWaalsContact O-CG2 3.28Å; Q12-V16 WeakPolarHBondContact O-CG2 3.38Å; Q12-V16 PolarHBondContact O-N 3.48Å; Q12-A76 HydrophobicContact CG-CB 4.46Å; Q12-A76 PolarHBondContact NE2-O 2.94Å; Q12-V215 HydrophobicContact CB-CG2 4.23Å
13I91.6Very high86.9Confident105 Ų10567.2 Ų67.254%0.53837%0.37SS..Hα-helixtrans-63.5-44.2177.7-67.5168.2000110.6K9 C10 L15 V16 I17K9-I13 VanDerWaalsContact O-CG1 3.23Å; K9-I13 WeakPolarHBondContact O-CG1 3.31Å; K9-I13 PolarHBondContact O-N 2.98Å; C10-I13 PolarHBondContact O-N 3.23Å; I13-L15 PolarHBondContact O-N 3.04Å; I13-V16 PolarHBondContact O-N 3.29Å; I13-I17 HydrophobicContact CG2-CD1 3.79Å; I13-I17 HydrophobicContact CG2-CG1 4.42Å; I13-I17 WeakPolarHBondContact O-CG1 3.39Å; I13-I17 PolarHBondContact O-N 3.23Å
14L90.9Very high88.9Confident90 Ų9064.8 Ų64.847%0.47136%0.357SS..Hα-helixtrans-60.7-44.7177.2-174.270000111.6C10 L11 V16 I17 F18 F211C10-L14 WeakPolarHBondContact O-CB 3.36Å; C10-L14 PolarHBondContact O-N 3.32Å; L11-L14 PolarHBondContact O-N 3.4Å; L14-V16 VanDerWaalsContact C-N 3.34Å; L14-V16 PolarHBondContact O-N 3.39Å; L14-I17 PolarHBondContact O-N 2.85Å; L14-F18 WeakPolarHBondContact O-CB 3.43Å; L14-F18 PolarHBondContact O-N 2.85Å; L14-F211 HydrophobicContact CD2-CD2 4.32Å; L14-F211 HydrophobicContact CD2-CE2 3.53Å; L14-F211 HydrophobicContact CD2-CZ 4.14Å; L14-F211 HydrophobicContact CG-CE2 4.47Å
15L93.3Very high90.7Very high1 Ų161.3 Ų61.31%0.00534%0.343CS..Hα-helixtrans-61.3-42.3176.4-175.367.7000111.4L11 Q12 I13 N19 A76 L84 Y87 F211 A212L11-L15 WeakPolarHBondContact O-CB 3.49Å; L11-L15 PolarHBondContact O-N 3.28Å; Q12-L15 PolarHBondContact O-N 3.36Å; I13-L15 PolarHBondContact O-N 3.04Å; L15-N19 WeakPolarHBondContact CD1-ND2 3.29Å; L15-N19 WeakPolarHBondContact O-CB 3.28Å; L15-N19 PolarHBondContact O-N 3.39Å; L15-N19 PolarHBondContact O-ND2 3.46Å; L15-A76 HydrophobicContact CD2-CB 4.26Å; L15-L84 HydrophobicContact CD2-CD2 4.27Å; L15-Y87 HydrophobicContact CD1-CE1 4.12Å; L15-F211 HydrophobicContact CD1-CB 4.31Å; L15-A212 HydrophobicContact CD2-CB 4.48Å
16V95Very high91.9Very high25 Ų2559.3 Ų59.315%0.15233%0.329CS..Hα-helixtrans-61.7-49.7176.3165.60000111Q12 I13 L14 F18 N19 I20 F73 A76Q12-V16 VanDerWaalsContact O-CG2 3.28Å; Q12-V16 WeakPolarHBondContact O-CG2 3.38Å; Q12-V16 PolarHBondContact O-N 3.48Å; I13-V16 PolarHBondContact O-N 3.29Å; L14-V16 VanDerWaalsContact C-N 3.34Å; L14-V16 PolarHBondContact O-N 3.39Å; V16-F18 PolarHBondContact O-N 3.24Å; V16-N19 PolarHBondContact O-N 2.98Å; V16-I20 HydrophobicContact CG1-CD1 3.76Å; V16-I20 HydrophobicContact CG1-CG1 4.47Å; V16-I20 VanDerWaalsContact O-CG1 3.29Å; V16-I20 WeakPolarHBondContact O-CG1 3.44Å; V16-I20 PolarHBondContact O-N 3.14Å; V16-F73 HydrophobicContact CG1-CD2 4.01Å; V16-F73 HydrophobicContact CG1-CE2 4.15Å; V16-A76 HydrophobicContact CG2-CB 3.55Å
17I94.9Very high92.8Very high91 Ų9158.3 Ų58.347%0.46732%0.317SS..Hα-helixtrans-59.6-48.7179.9-67.8166.9000110.5I13 L14 N19 I20 L21I13-I17 HydrophobicContact CG2-CD1 3.79Å; I13-I17 HydrophobicContact CG2-CG1 4.42Å; I13-I17 WeakPolarHBondContact O-CG1 3.39Å; I13-I17 PolarHBondContact O-N 3.23Å; L14-I17 PolarHBondContact O-N 2.85Å; I17-N19 VanDerWaalsContact C-N 3.34Å; I17-N19 PolarHBondContact O-N 3.24Å; I17-I20 PolarHBondContact O-N 3.16Å; I17-L21 HydrophobicContact CG2-CD1 4.48Å; I17-L21 WeakPolarHBondContact O-CG 3.28Å; I17-L21 PolarHBondContact O-N 3.37Å; I17-L21 VanDerWaalsContact O-N 3.1Å
18F93.7Very high93.5Very high56 Ų5658.9 Ų58.925%0.24632%0.318CS..Hα-helixtrans-59-45.2179.1178.6-105.6000112L14 V16 I20 L21 V22 L204 S208L14-F18 WeakPolarHBondContact O-CB 3.43Å; L14-F18 PolarHBondContact O-N 2.85Å; V16-F18 PolarHBondContact O-N 3.24Å; F18-I20 PolarHBondContact O-N 3.22Å; F18-L21 WeakPolarHBondContact O-CB 3.35Å; F18-L21 PolarHBondContact O-N 2.94Å; F18-V22 HydrophobicContact CD1-CG2 4.29Å; F18-V22 HydrophobicContact CE1-CG2 3.87Å; F18-V22 HydrophobicContact CE2-CG2 4.25Å; F18-V22 HydrophobicContact CZ-CG2 3.85Å; F18-V22 WeakPolarHBondContact O-CG2 3.33Å; F18-V22 PolarHBondContact O-N 3.42Å; F18-L204 HydrophobicContact CE2-CB 4.34Å; F18-L204 HydrophobicContact CE2-CD1 4.21Å; F18-L204 HydrophobicContact CZ-CB 4.24Å; F18-S208 WeakPolarHBondContact CD1-OG 3.33Å; F18-S208 VanDerWaalsContact CE1-OG 3.27Å; F18-S208 WeakPolarHBondContact CE1-OG 3.21Å
19N95.7Very high94.3Very high1 Ų157 Ų571%0.00531%0.314CS..Hα-helixtrans-70.3-30.4-179.9-79.4-72.5000113.4L15 V16 I17 L21 V22 F23 G69 F73 Y87L15-N19 WeakPolarHBondContact CD1-ND2 3.29Å; L15-N19 WeakPolarHBondContact O-CB 3.28Å; L15-N19 PolarHBondContact O-N 3.39Å; L15-N19 PolarHBondContact O-ND2 3.46Å; V16-N19 PolarHBondContact O-N 2.98Å; I17-N19 VanDerWaalsContact C-N 3.34Å; I17-N19 PolarHBondContact O-N 3.24Å; N19-L21 VanDerWaalsContact C-N 3.34Å; N19-V22 PolarHBondContact O-N 2.92Å; N19-F23 WeakPolarHBondContact O-CB 3.48Å; N19-F23 PolarHBondContact O-N 2.95Å; N19-G69 WeakPolarHBondContact O-CA 3.48Å; N19-F73 HydrophobicContact CB-CB 4.35Å; N19-Y87 PolarHBondContact ND2-OH 3.5Å; N19-Y87 WeakPolarHBondContact OD1-CE2 3.44Å; N19-Y87 PolarHBondContact OD1-OH 3.04Å
20I96.7Very high94.9Very high74 Ų7454.1 Ų54.138%0.37930%0.303SS..Hα-helixtrans-63.4-41.8170.3-70.3167.4000110.6V16 I17 F18 F23 A24 F73V16-I20 HydrophobicContact CG1-CD1 3.76Å; V16-I20 HydrophobicContact CG1-CG1 4.47Å; V16-I20 VanDerWaalsContact O-CG1 3.29Å; V16-I20 WeakPolarHBondContact O-CG1 3.44Å; V16-I20 PolarHBondContact O-N 3.14Å; I17-I20 PolarHBondContact O-N 3.16Å; F18-I20 PolarHBondContact O-N 3.22Å; I20-F23 PolarHBondContact O-N 3.38Å; I20-A24 WeakPolarHBondContact O-CB 3.38Å; I20-A24 PolarHBondContact O-N 3.38Å; I20-F73 HydrophobicContact CD1-CD2 3.88Å; I20-F73 HydrophobicContact CD1-CE2 3.81Å; I20-F73 HydrophobicContact CG1-CD2 3.57Å; I20-F73 HydrophobicContact CG1-CE2 3.95Å; I20-F73 HydrophobicContact CG1-CG 4.31Å
21L96.5Very high95.3Very high115 Ų11553.5 Ų53.560%0.60230%0.296SS*.Hα-helixtrans-64.3-44.4176.5-65.8174.7000111.6I17 F18 N19 F23 A24 C25I17-L21 HydrophobicContact CG2-CD1 4.48Å; I17-L21 WeakPolarHBondContact O-CG 3.28Å; I17-L21 PolarHBondContact O-N 3.37Å; I17-L21 VanDerWaalsContact O-N 3.1Å; F18-L21 WeakPolarHBondContact O-CB 3.35Å; F18-L21 PolarHBondContact O-N 2.94Å; N19-L21 VanDerWaalsContact C-N 3.34Å; L21-F23 VanDerWaalsContact C-N 3.35Å; L21-A24 PolarHBondContact O-N 3.04Å; L21-C25 WeakPolarHBondContact O-CB 3.49Å; L21-C25 PolarHBondContact O-N 3.47Å
22V96.2Very high95.8Very high26 Ų2655.6 Ų55.616%0.15831%0.307CS..Hα-helixtrans-62-43.7175.81730000111.1F18 N19 C25 G26 L65F18-V22 HydrophobicContact CD1-CG2 4.29Å; F18-V22 HydrophobicContact CE1-CG2 3.87Å; F18-V22 HydrophobicContact CE2-CG2 4.25Å; F18-V22 HydrophobicContact CZ-CG2 3.85Å; F18-V22 WeakPolarHBondContact O-CG2 3.33Å; F18-V22 PolarHBondContact O-N 3.42Å; N19-V22 PolarHBondContact O-N 2.92Å; V22-C25 WeakPolarHBondContact O-CB 3.36Å; V22-C25 PolarHBondContact O-N 2.93Å; V22-G26 PolarHBondContact O-N 2.77Å; V22-L65 HydrophobicContact CG1-CB 4.19Å; V22-L65 HydrophobicContact CG1-CD2 4.16Å
23F97.3Very high96.2Very high56 Ų5653.9 Ų53.925%0.24630%0.299CS..Hα-helixtrans-59.9-48.1176.4177-102.2000112N19 I20 L21 C25 G26 I27 F66 F70N19-F23 WeakPolarHBondContact O-CB 3.48Å; N19-F23 PolarHBondContact O-N 2.95Å; I20-F23 PolarHBondContact O-N 3.38Å; L21-F23 VanDerWaalsContact C-N 3.35Å; F23-C25 VanDerWaalsContact C-N 3.33Å; F23-C25 PolarHBondContact O-N 2.97Å; F23-G26 PolarHBondContact O-N 3.41Å; F23-I27 HydrophobicContact CD1-CD1 4Å; F23-I27 HydrophobicContact CE1-CD1 3.46Å; F23-I27 VanDerWaalsContact CE1-CD1 3.46Å; F23-I27 HydrophobicContact CE1-CG1 4.47Å; F23-I27 HydrophobicContact CZ-CD1 3.76Å; F23-I27 PolarHBondContact O-N 2.96Å; F23-F66 AromaticContact CD2-CD2 3.82Å; F23-F66 HydrophobicContact CD2-CD2 3.82Å; F23-F66 HydrophobicContact CD2-CE2 4.04Å; F23-F66 HydrophobicContact CD2-CG 4.37Å; F23-F66 AromaticContact CE2-CD2 3.37Å; F23-F66 HydrophobicContact CE2-CD2 3.37Å; F23-F66 HydrophobicContact CE2-CE1 4.43Å; F23-F66 AromaticContact CE2-CE2 3.11Å; F23-F66 HydrophobicContact CE2-CE2 3.11Å; F23-F66 HydrophobicContact CE2-CG 4.16Å; F23-F66 AromaticContact CE2-CZ 3.7Å; F23-F66 HydrophobicContact CE2-CZ 3.7Å; F23-F66 HydrophobicContact CZ-CD2 4.03Å; F23-F66 AromaticContact CZ-CE2 3.51Å; F23-F66 HydrophobicContact CZ-CE2 3.51Å; F23-F66 HydrophobicContact CZ-CZ 4.24Å; F23-F70 HydrophobicContact CD2-CB 4.01Å; F23-F70 HydrophobicContact CE2-CB 4.04Å; F23-F70 HydrophobicContact CE2-CD2 4.13Å
24A97.8Very high96.3Very high52 Ų5251.3 Ų51.343%0.4329%0.29SS..Hα-helixtrans-62.3-40.3176.800000112I20 L21 G26 I27 A28I20-A24 WeakPolarHBondContact O-CB 3.38Å; I20-A24 PolarHBondContact O-N 3.38Å; L21-A24 PolarHBondContact O-N 3.04Å; A24-G26 VanDerWaalsContact C-N 3.35Å; A24-I27 PolarHBondContact O-N 3.48Å; A24-A28 PolarHBondContact O-N 3.25Å
25C97.2Very high96.4Very high67 Ų6752.5 Ų52.545%0.45330%0.296SS..Hα-helixtrans-62.5-41.9174.8-1560000111.3L21 V22 F23 I27 A28 L29L21-C25 WeakPolarHBondContact O-CB 3.49Å; L21-C25 PolarHBondContact O-N 3.47Å; V22-C25 WeakPolarHBondContact O-CB 3.36Å; V22-C25 PolarHBondContact O-N 2.93Å; F23-C25 VanDerWaalsContact C-N 3.33Å; F23-C25 PolarHBondContact O-N 2.97Å; C25-I27 PolarHBondContact O-N 2.89Å; C25-A28 PolarHBondContact O-N 3.32Å; C25-L29 WeakPolarHBondContact O-CG 3.33Å; C25-L29 PolarHBondContact O-N 3.37Å
26G98.4Very high96.3Very high0 Ų054.5 Ų54.50%031%0.31CS..Hα-helixtrans-57.6-48.1173.500000112.8V22 F23 A24 A28 L29 I30 G62V22-G26 PolarHBondContact O-N 2.77Å; F23-G26 PolarHBondContact O-N 3.41Å; A24-G26 VanDerWaalsContact C-N 3.35Å; G26-A28 VanDerWaalsContact C-N 3.34Å; G26-A28 PolarHBondContact O-N 3.4Å; G26-L29 PolarHBondContact O-N 2.94Å; G26-I30 WeakPolarHBondContact O-CD1 3.4Å; G26-I30 VanDerWaalsContact O-CG1 3.26Å; G26-I30 WeakPolarHBondContact O-CG1 3.08Å; G26-I30 PolarHBondContact O-N 3.41Å; G26-G62 WeakPolarHBondContact CA-O 3.41Å
27I98.3Very high96Very high72 Ų7256.2 Ų56.237%0.36932%0.317SS..Hα-helixtrans-58.5-46.5174.9-65.6175.1000110.8F23 A24 C25 L29 I30 V31 F66F23-I27 HydrophobicContact CD1-CD1 4Å; F23-I27 HydrophobicContact CE1-CD1 3.46Å; F23-I27 VanDerWaalsContact CE1-CD1 3.46Å; F23-I27 HydrophobicContact CE1-CG1 4.47Å; F23-I27 HydrophobicContact CZ-CD1 3.76Å; F23-I27 PolarHBondContact O-N 2.96Å; A24-I27 PolarHBondContact O-N 3.48Å; C25-I27 PolarHBondContact O-N 2.89Å; I27-L29 PolarHBondContact O-N 3.41Å; I27-I30 PolarHBondContact O-N 3.33Å; I27-V31 HydrophobicContact CG2-CG2 4.31Å; I27-V31 WeakPolarHBondContact O-CG2 3.36Å; I27-V31 PolarHBondContact O-N 3.47Å; I27-F66 HydrophobicContact CD1-CD2 4.46Å; I27-F66 HydrophobicContact CD1-CE2 4.42Å; I27-F66 HydrophobicContact CG1-CD2 3.8Å; I27-F66 HydrophobicContact CG1-CE2 4.16Å
28A98.3Very high95.7Very high45 Ų4555.8 Ų55.837%0.37232%0.318SS..Hα-helixtrans-59.6-44.5-179.800000112.1A24 C25 G26 V31 I32A24-A28 PolarHBondContact O-N 3.25Å; C25-A28 PolarHBondContact O-N 3.32Å; G26-A28 VanDerWaalsContact C-N 3.34Å; G26-A28 PolarHBondContact O-N 3.4Å; A28-V31 PolarHBondContact O-N 2.86Å; A28-I32 WeakPolarHBondContact O-CB 3.41Å; A28-I32 VanDerWaalsContact O-CG1 3.26Å; A28-I32 WeakPolarHBondContact O-CG1 3.2Å; A28-I32 PolarHBondContact O-N 3.42Å
29L98.2Very high95.3Very high43 Ų4355.2 Ų55.223%0.22532%0.324CS..Hα-helixtrans-64.5-40.4177-68.7-177.6000112.4C25 G26 I27 I32 G33 I58 L61 L65C25-L29 WeakPolarHBondContact O-CG 3.33Å; C25-L29 PolarHBondContact O-N 3.37Å; G26-L29 PolarHBondContact O-N 2.94Å; I27-L29 PolarHBondContact O-N 3.41Å; L29-I32 PolarHBondContact O-N 2.59Å; L29-G33 PolarHBondContact O-N 2.86Å; L29-I58 HydrophobicContact CB-CG2 4.29Å; L29-I58 HydrophobicContact CD2-CG2 4.27Å; L29-L61 HydrophobicContact CD1-CD2 4.26Å; L29-L61 HydrophobicContact CD1-CG 4.21Å; L29-L65 HydrophobicContact CD1-CD1 3.87Å
30I98.3Very high94.6Very high47 Ų4755.9 Ų55.924%0.24133%0.327CS..Hα-helixtrans-62.5-44.4176-65.7163.3000110.5G26 I27 S34 F66G26-I30 WeakPolarHBondContact O-CD1 3.4Å; G26-I30 VanDerWaalsContact O-CG1 3.26Å; G26-I30 WeakPolarHBondContact O-CG1 3.08Å; G26-I30 PolarHBondContact O-N 3.41Å; I27-I30 PolarHBondContact O-N 3.33Å; I30-S34 VanDerWaalsContact O-CB 3.25Å; I30-S34 WeakPolarHBondContact O-CB 3.4Å; I30-S34 PolarHBondContact O-N 3.25Å; I30-S34 PolarHBondContact O-OG 2.95Å; I30-F66 HydrophobicContact CD1-CB 4.07Å; I30-F66 HydrophobicContact CD1-CG 4.46Å
31V98.2Very high93.9Very high72 Ų7257.8 Ų57.844%0.43634%0.338SS..Hα-helixtrans-63.9-49.6178172.40000110.7I27 A28 G33 S34 L35I27-V31 HydrophobicContact CG2-CG2 4.31Å; I27-V31 WeakPolarHBondContact O-CG2 3.36Å; I27-V31 PolarHBondContact O-N 3.47Å; A28-V31 PolarHBondContact O-N 2.86Å; V31-G33 PolarHBondContact O-N 3.4Å; V31-S34 WeakPolarHBondContact CA-OG 3.38Å; V31-S34 PolarHBondContact O-N 2.84Å; V31-S34 PolarHBondContact O-OG 3.44Å; V31-L35 HydrophobicContact CG1-CD1 3.9Å; V31-L35 HydrophobicContact CG1-CG 4.39Å; V31-L35 WeakPolarHBondContact O-CB 3.49Å; V31-L35 VanDerWaalsContact O-CG 3.24Å; V31-L35 WeakPolarHBondContact O-CG 3.45Å; V31-L35 PolarHBondContact O-N 3.32Å
32I96.7Very high93.2Very high94 Ų9457.4 Ų57.448%0.48234%0.337SS..Hα-helixtrans-61.9-45.5179.3-67.9165.6000111.1A28 L29 S36A28-I32 WeakPolarHBondContact O-CB 3.41Å; A28-I32 VanDerWaalsContact O-CG1 3.26Å; A28-I32 WeakPolarHBondContact O-CG1 3.2Å; A28-I32 PolarHBondContact O-N 3.42Å; L29-I32 PolarHBondContact O-N 2.59Å; I32-S36 WeakPolarHBondContact O-CB 3.29Å; I32-S36 PolarHBondContact O-N 2.94Å; I32-S36 PolarHBondContact O-OG 2.81Å
33G96Very high91.9Very high0 Ų065.3 Ų65.30%037%0.365CS..Hα-helixtrans-63.3-45.8178.600000112.4L29 V31 S36 Q37 V55L29-G33 PolarHBondContact O-N 2.86Å; V31-G33 PolarHBondContact O-N 3.4Å; G33-S36 WeakPolarHBondContact O-CB 3.29Å; G33-S36 PolarHBondContact O-N 3.48Å; G33-Q37 WeakPolarHBondContact O-CB 3.29Å; G33-Q37 PolarHBondContact O-N 3.39Å; G33-V55 VanDerWaalsContact O-CG1 3.29Å; G33-V55 WeakPolarHBondContact O-CG1 3.14Å
34S95.4Very high90.3Very high51 Ų5163 Ų6336%0.35736%0.356SS..Hα-helixtrans-65.5-42.6178.2570000112.8I30 V31 S36 Q37 V38I30-S34 VanDerWaalsContact O-CB 3.25Å; I30-S34 WeakPolarHBondContact O-CB 3.4Å; I30-S34 PolarHBondContact O-N 3.25Å; I30-S34 PolarHBondContact O-OG 2.95Å; V31-S34 WeakPolarHBondContact CA-OG 3.38Å; V31-S34 PolarHBondContact O-N 2.84Å; V31-S34 PolarHBondContact O-OG 3.44Å; S34-S36 VanDerWaalsContact C-N 3.29Å; S34-S36 PolarHBondContact O-N 3.27Å; S34-Q37 PolarHBondContact O-N 3.39Å; S34-V38 WeakPolarHBondContact O-CG2 3.47Å; S34-V38 PolarHBondContact O-N 3.12Å
35L93.3Very high88.4Confident114 Ų11465.8 Ų65.860%0.59737%0.372SS*.Hα-helixtrans-60.2-41173-70.9175.7000111.5V31 V38 A39V31-L35 HydrophobicContact CG1-CD1 3.9Å; V31-L35 HydrophobicContact CG1-CG 4.39Å; V31-L35 WeakPolarHBondContact O-CB 3.49Å; V31-L35 VanDerWaalsContact O-CG 3.24Å; V31-L35 WeakPolarHBondContact O-CG 3.45Å; V31-L35 PolarHBondContact O-N 3.32Å; L35-V38 PolarHBondContact O-N 3.2Å; L35-A39 WeakPolarHBondContact O-CB 3.19Å; L35-A39 PolarHBondContact O-N 3.1Å
36S89.7Confident86.5Confident43 Ų4365.3 Ų65.330%0.30138%0.379SS..Hα-helixtrans-64.3-43.8176.1-57.10000111I32 G33 S34 V38 A39 I40I32-S36 WeakPolarHBondContact O-CB 3.29Å; I32-S36 PolarHBondContact O-N 2.94Å; I32-S36 PolarHBondContact O-OG 2.81Å; G33-S36 WeakPolarHBondContact O-CB 3.29Å; G33-S36 PolarHBondContact O-N 3.48Å; S34-S36 VanDerWaalsContact C-N 3.29Å; S34-S36 PolarHBondContact O-N 3.27Å; S36-V38 PolarHBondContact O-N 3.46Å; S36-A39 PolarHBondContact O-N 3.43Å; S36-I40 WeakPolarHBondContact O-CB 3.44Å; S36-I40 WeakPolarHBondContact O-CG1 3.45Å; S36-I40 PolarHBondContact O-N 3.24Å
37Q89.5Confident84.7Confident61 Ų6165.8 Ų65.829%0.28538%0.381SS..Hα-helixtrans-62.3-41.4178.5-173.662.424.300112.3G33 S34 I40 N41 V55 I59G33-Q37 WeakPolarHBondContact O-CB 3.29Å; G33-Q37 PolarHBondContact O-N 3.39Å; S34-Q37 PolarHBondContact O-N 3.39Å; Q37-I40 PolarHBondContact O-N 3.28Å; Q37-N41 WeakPolarHBondContact O-CB 3.46Å; Q37-N41 PolarHBondContact O-N 3.3Å; Q37-V55 HydrophobicContact CB-CG1 3.86Å; Q37-I59 HydrophobicContact CB-CD1 4.38Å
38V89.1Confident83Confident82 Ų8263.6 Ų63.650%0.49737%0.37SS..Hα-helixtrans-65.4-42.7176.2172.50000110.9S34 L35 S36 N41 N42S34-V38 WeakPolarHBondContact O-CG2 3.47Å; S34-V38 PolarHBondContact O-N 3.12Å; L35-V38 PolarHBondContact O-N 3.2Å; S36-V38 PolarHBondContact O-N 3.46Å; V38-N41 PolarHBondContact O-N 3.03Å; V38-N42 WeakPolarHBondContact CG1-ND2 3.45Å; V38-N42 WeakPolarHBondContact O-CB 3.42Å; V38-N42 PolarHBondContact O-N 2.85Å
39A84.8Confident81.8Confident45 Ų4565.7 Ų65.737%0.37238%0.382SS..Hα-helixtrans-61-45.6176.200000111.6L35 S36 N41 N42 Y43L35-A39 WeakPolarHBondContact O-CB 3.19Å; L35-A39 PolarHBondContact O-N 3.1Å; S36-A39 PolarHBondContact O-N 3.43Å; A39-N41 PolarHBondContact O-N 2.87Å; A39-N42 PolarHBondContact O-N 2.89Å; A39-Y43 WeakPolarHBondContact O-CD2 3.37Å; A39-Y43 PolarHBondContact O-N 3.17Å; A39-Y43 VanDerWaalsContact O-N 3.1Å
40I80.7Confident80.6Confident14 Ų1467 Ų677%0.07239%0.389CS..Hα-helixtrans-57.1-46.4175.5-75.3-176000111.6S36 Q37 S44 I47 I51 K52 V55S36-I40 WeakPolarHBondContact O-CB 3.44Å; S36-I40 WeakPolarHBondContact O-CG1 3.45Å; S36-I40 PolarHBondContact O-N 3.24Å; Q37-I40 PolarHBondContact O-N 3.28Å; I40-S44 CarbonylContact O-C 3.39Å; I40-S44 VanDerWaalsContact O-C 3.26Å; I40-S44 WeakPolarHBondContact O-CA 3.41Å; I40-S44 PolarHBondContact O-N 3.39Å; I40-S44 VanDerWaalsContact O-N 3.15Å; I40-I47 HydrophobicContact CB-CD1 3.56Å; I40-I47 HydrophobicContact CD1-CD1 4.21Å; I40-I47 HydrophobicContact CG1-CD1 3.48Å; I40-I47 VanDerWaalsContact CG1-CD1 3.48Å; I40-I47 HydrophobicContact CG2-CB 4.37Å; I40-I47 HydrophobicContact CG2-CD1 3.42Å; I40-I47 VanDerWaalsContact CG2-CD1 3.42Å; I40-I51 HydrophobicContact CD1-CG2 3.8Å; I40-K52 HydrophobicContact CG2-CG 4.13Å; I40-V55 HydrophobicContact CD1-CB 4.28Å; I40-V55 HydrophobicContact CD1-CG2 3.56Å
41N82.1Confident79.6Confident114 Ų11467 Ų6761%0.6139%0.389SS*.Hα-helixtrans-73.4-35.9-175.9-169.467.8000113.5Q37 V38 A39Q37-N41 WeakPolarHBondContact O-CB 3.46Å; Q37-N41 PolarHBondContact O-N 3.3Å; V38-N41 PolarHBondContact O-N 3.03Å; A39-N41 PolarHBondContact O-N 2.87Å
42N81.4Confident78.9Confident108 Ų10866.9 Ų66.958%0.57838%0.383SS*.Hα-helixtrans-82.4-33.9-175.7-71.6-14.3000113.4V38 A39V38-N42 WeakPolarHBondContact CG1-ND2 3.45Å; V38-N42 WeakPolarHBondContact O-CB 3.42Å; V38-N42 PolarHBondContact O-N 2.85Å; A39-N42 PolarHBondContact O-N 2.89Å
43Y69.6Low78.4Confident192 Ų19264.1 Ų64.175%0.75338%0.378SS*.Hα-helixtrans-106.2-19.7-172.5-64-75.5000113.6A39A39-Y43 WeakPolarHBondContact O-CD2 3.37Å; A39-Y43 PolarHBondContact O-N 3.17Å; A39-Y43 VanDerWaalsContact O-N 3.1Å
44S64.2Low78Confident6 Ų669 Ų694%0.04240%0.404CS..  trans-148.565.8-164.6-62.10000113I40 G46 I47 D132I40-S44 CarbonylContact O-C 3.39Å; I40-S44 VanDerWaalsContact O-C 3.26Å; I40-S44 WeakPolarHBondContact O-CA 3.41Å; I40-S44 PolarHBondContact O-N 3.39Å; I40-S44 VanDerWaalsContact O-N 3.15Å; S44-G46 PolarHBondContact O-N 2.99Å; S44-I47 VanDerWaalsContact CB-CG1 3.45Å; S44-I47 WeakPolarHBondContact O-CD1 3.35Å; S44-I47 WeakPolarHBondContact O-CG1 3.45Å; S44-I47 PolarHBondContact O-N 3.41Å; S44-D132 WeakPolarHBondContact CB-OD2 3.36Å; S44-D132 VanDerWaalsContact OG-CG 3.32Å; S44-D132 PolarHBondContact OG-OD2 3.36Å
45S57.6Low77.8Confident111 Ų11167.1 Ų67.178%0.77639%0.389SS*.THydrogen-bonded Turntrans-53.9-23.9177.130.90000114.1
46G56.1Low77.9Confident57 Ų5765.9 Ų65.959%0.58838%0.383SS*.THydrogen-bonded Turntrans-90.521.2175.300000116.9S44 D48 N130S44-G46 PolarHBondContact O-N 2.99Å; G46-D48 PolarHBondContact O-N 3.02Å; G46-N130 PolarHBondContact O-ND2 2.8Å
47I60Low78.1Confident10 Ų1069.8 Ų69.85%0.05139%0.394CS..  trans-64.8132179-70.9161.1000113.8I40 S44 I51 K52 N130 D132I40-I47 HydrophobicContact CB-CD1 3.56Å; I40-I47 HydrophobicContact CD1-CD1 4.21Å; I40-I47 HydrophobicContact CG1-CD1 3.48Å; I40-I47 VanDerWaalsContact CG1-CD1 3.48Å; I40-I47 HydrophobicContact CG2-CB 4.37Å; I40-I47 HydrophobicContact CG2-CD1 3.42Å; I40-I47 VanDerWaalsContact CG2-CD1 3.42Å; S44-I47 VanDerWaalsContact CB-CG1 3.45Å; S44-I47 WeakPolarHBondContact O-CD1 3.35Å; S44-I47 WeakPolarHBondContact O-CG1 3.45Å; S44-I47 PolarHBondContact O-N 3.41Å; I47-I51 HydrophobicContact CG2-CB 3.67Å; I47-I51 HydrophobicContact CG2-CD1 4.5Å; I47-I51 HydrophobicContact CG2-CG2 3.93Å; I47-K52 HydrophobicContact CB-CG 4.37Å; I47-K52 HydrophobicContact CG2-CG 3.91Å; I47-K52 VanDerWaalsContact O-CE 3.28Å; I47-K52 WeakPolarHBondContact O-CE 3.37Å; I47-K52 PolarHBondContact O-NZ 3.04Å; I47-N130 WeakPolarHBondContact CA-ND2 3.19Å; I47-N130 WeakPolarHBondContact CG1-ND2 3.27Å; I47-D132 WeakPolarHBondContact CD1-OD2 3.45Å
48D64.4Low78.4Confident27 Ų2769 Ų6914%0.14439%0.392CS..  trans-49.8138172-178.4-83.5000111.4G46 N50 I51 K52 I133G46-D48 PolarHBondContact O-N 3.02Å; D48-N50 PolarHBondContact O-N 2.88Å; D48-N50 WeakPolarHBondContact OD1-CA 3.27Å; D48-N50 WeakPolarHBondContact OD1-CB 3.44Å; D48-N50 PolarHBondContact OD1-N 3Å; D48-N50 PolarHBondContact OD1-ND2 3.28Å; D48-I51 PolarHBondContact O-N 2.75Å; D48-K52 PolarHBondContact O-N 2.93Å; D48-I133 HydrophobicContact CB-CD1 3.62Å
49S71.8Confident78.8Confident89 Ų8967.2 Ų67.262%0.62238%0.379SS*.Hα-helixtrans-55.9-26.5-177.447.10000113.1G53S49-G53 PolarHBondContact O-N 2.95Å
50N72.8Confident79.4Confident70 Ų7069.3 Ų69.337%0.37439%0.387SS..Hα-helixtrans-74.7-40.8-177.7-54.4-49.4000112.4D48 G53 L54 L119D48-N50 PolarHBondContact O-N 2.88Å; D48-N50 WeakPolarHBondContact OD1-CA 3.27Å; D48-N50 WeakPolarHBondContact OD1-CB 3.44Å; D48-N50 PolarHBondContact OD1-N 3Å; D48-N50 PolarHBondContact OD1-ND2 3.28Å; N50-G53 CarbonylContact O-C 3.3Å; N50-G53 PolarHBondContact O-N 3.31Å; N50-L54 PolarHBondContact O-N 3.48Å; N50-L119 HydrophobicContact CB-CD1 3.4Å; N50-L119 VanDerWaalsContact ND2-CD1 3.3Å; N50-L119 WeakPolarHBondContact ND2-CD1 3.45Å
51I77.6Confident80.2Confident47 Ų4771.9 Ų71.924%0.24140%0.4CS..Hα-helixtrans-66.7-43.2175.4-64.5-179.4000110I40 I47 D48 G53 L54 V55 I133I40-I51 HydrophobicContact CD1-CG2 3.8Å; I47-I51 HydrophobicContact CG2-CB 3.67Å; I47-I51 HydrophobicContact CG2-CD1 4.5Å; I47-I51 HydrophobicContact CG2-CG2 3.93Å; D48-I51 PolarHBondContact O-N 2.75Å; I51-G53 VanDerWaalsContact C-N 3.27Å; I51-G53 PolarHBondContact O-N 3.16Å; I51-L54 PolarHBondContact O-N 3.27Å; I51-V55 PolarHBondContact O-N 3.44Å; I51-I133 HydrophobicContact CD1-CD1 4.39Å; I51-I133 HydrophobicContact CD1-CG1 3.64Å
52K83.6Confident80.9Confident70 Ų7066.4 Ų66.430%0.30437%0.371SS..Hα-helixtrans-58.4-43.4172.6-70.5179.1-174.5172.60110.6I40 I47 D48 L54 V55 I56I40-K52 HydrophobicContact CG2-CG 4.13Å; I47-K52 HydrophobicContact CB-CG 4.37Å; I47-K52 HydrophobicContact CG2-CG 3.91Å; I47-K52 VanDerWaalsContact O-CE 3.28Å; I47-K52 WeakPolarHBondContact O-CE 3.37Å; I47-K52 PolarHBondContact O-NZ 3.04Å; D48-K52 PolarHBondContact O-N 2.93Å; K52-L54 PolarHBondContact O-N 3.42Å; K52-V55 PolarHBondContact O-N 2.9Å; K52-I56 WeakPolarHBondContact O-CB 3.37Å; K52-I56 WeakPolarHBondContact O-CD1 3.31Å; K52-I56 VanDerWaalsContact O-CG1 3.23Å; K52-I56 WeakPolarHBondContact O-CG1 3.34Å; K52-I56 PolarHBondContact O-N 3.48Å
53G87.2Confident81.7Confident36 Ų3663.9 Ų63.937%0.37136%0.361SS..Hα-helixtrans-57.5-44.8174.700000112.9S49 N50 I51 I56 F57S49-G53 PolarHBondContact O-N 2.95Å; N50-G53 CarbonylContact O-C 3.3Å; N50-G53 PolarHBondContact O-N 3.31Å; I51-G53 VanDerWaalsContact C-N 3.27Å; I51-G53 PolarHBondContact O-N 3.16Å; G53-I56 PolarHBondContact O-N 3.27Å; G53-F57 WeakPolarHBondContact O-CB 3.46Å; G53-F57 PolarHBondContact O-N 2.88Å
54L87.1Confident83Confident103 Ų10357.3 Ų57.354%0.53934%0.337SS..Hα-helixtrans-63.4-44.6177.2-177.467.1000112.1N50 I51 K52 F57 I58N50-L54 PolarHBondContact O-N 3.48Å; I51-L54 PolarHBondContact O-N 3.27Å; K52-L54 PolarHBondContact O-N 3.42Å; L54-F57 WeakPolarHBondContact O-CB 3.36Å; L54-F57 PolarHBondContact O-N 3.23Å; L54-I58 HydrophobicContact CG-CD1 4.34Å; L54-I58 WeakPolarHBondContact O-CG1 3.37Å; L54-I58 PolarHBondContact O-N 3.03Å
55V91.8Very high84.6Confident10 Ų1058.9 Ų58.96%0.06135%0.345CS..Hα-helixtrans-64.3-43.5178.2171.80000111.3G33 Q37 I40 I51 K52 F57 I58 I59G33-V55 VanDerWaalsContact O-CG1 3.29Å; G33-V55 WeakPolarHBondContact O-CG1 3.14Å; Q37-V55 HydrophobicContact CB-CG1 3.86Å; I40-V55 HydrophobicContact CD1-CB 4.28Å; I40-V55 HydrophobicContact CD1-CG2 3.56Å; I51-V55 PolarHBondContact O-N 3.44Å; K52-V55 PolarHBondContact O-N 2.9Å; V55-F57 VanDerWaalsContact C-N 3.32Å; V55-F57 PolarHBondContact O-N 2.98Å; V55-I58 PolarHBondContact O-N 2.92Å; V55-I59 HydrophobicContact CG1-CD1 4.23Å; V55-I59 WeakPolarHBondContact O-CG1 3.22Å; V55-I59 PolarHBondContact O-N 3.19Å; V55-I59 VanDerWaalsContact O-N 3.11Å
56I93.7Very high86.5Confident89 Ų8956.9 Ų56.946%0.45632%0.322SS..Hα-helixtrans-61-43.8174.6-67.5165000110.5K52 G53 I58 I59 V60K52-I56 WeakPolarHBondContact O-CB 3.37Å; K52-I56 WeakPolarHBondContact O-CD1 3.31Å; K52-I56 VanDerWaalsContact O-CG1 3.23Å; K52-I56 WeakPolarHBondContact O-CG1 3.34Å; K52-I56 PolarHBondContact O-N 3.48Å; G53-I56 PolarHBondContact O-N 3.27Å; I56-I58 PolarHBondContact O-N 3.38Å; I56-I59 PolarHBondContact O-N 3.02Å; I56-V60 HydrophobicContact CG2-CG2 4.24Å; I56-V60 WeakPolarHBondContact O-CG2 3.32Å; I56-V60 PolarHBondContact O-N 3.3Å
57F94.4Very high88.4Confident124 Ų12458.7 Ų58.754%0.54432%0.318SS..Hα-helixtrans-58.1-44.9176.7174.8-97.5000112.1G53 L54 V55 I59 V60 L61G53-F57 WeakPolarHBondContact O-CB 3.46Å; G53-F57 PolarHBondContact O-N 2.88Å; L54-F57 WeakPolarHBondContact O-CB 3.36Å; L54-F57 PolarHBondContact O-N 3.23Å; V55-F57 VanDerWaalsContact C-N 3.32Å; V55-F57 PolarHBondContact O-N 2.98Å; F57-I59 VanDerWaalsContact C-N 3.32Å; F57-I59 PolarHBondContact O-N 3.47Å; F57-V60 PolarHBondContact O-N 2.92Å; F57-L61 HydrophobicContact CE1-CD2 4.2Å; F57-L61 HydrophobicContact CZ-CD2 4.46Å; F57-L61 VanDerWaalsContact O-CB 3.3Å; F57-L61 WeakPolarHBondContact O-CB 3.45Å; F57-L61 PolarHBondContact O-N 2.9Å
58I96.1Very high90.1Very high45 Ų4558.6 Ų58.623%0.23132%0.317CS..Hα-helixtrans-59.5-43.1176.3-68.6168.4000111.2L29 L54 V55 I56 G62L29-I58 HydrophobicContact CB-CG2 4.29Å; L29-I58 HydrophobicContact CD2-CG2 4.27Å; L54-I58 HydrophobicContact CG-CD1 4.34Å; L54-I58 WeakPolarHBondContact O-CG1 3.37Å; L54-I58 PolarHBondContact O-N 3.03Å; V55-I58 PolarHBondContact O-N 2.92Å; I56-I58 PolarHBondContact O-N 3.38Å; I58-G62 PolarHBondContact O-N 3.03Å
59I97.7Very high91.7Very high44 Ų4457.3 Ų57.323%0.22631%0.31CS..Hα-helixtrans-64.8-47.9178.1-64.4168.3000110.7Q37 V55 I56 F57 L61 G62 C63Q37-I59 HydrophobicContact CB-CD1 4.38Å; V55-I59 HydrophobicContact CG1-CD1 4.23Å; V55-I59 WeakPolarHBondContact O-CG1 3.22Å; V55-I59 PolarHBondContact O-N 3.19Å; V55-I59 VanDerWaalsContact O-N 3.11Å; I56-I59 PolarHBondContact O-N 3.02Å; F57-I59 VanDerWaalsContact C-N 3.32Å; F57-I59 PolarHBondContact O-N 3.47Å; I59-L61 VanDerWaalsContact C-N 3.34Å; I59-L61 PolarHBondContact O-N 2.99Å; I59-G62 PolarHBondContact O-N 3.34Å; I59-C63 PolarHBondContact O-N 2.89Å; I59-C63 PolarHBondContact O-SG 3.46Å; I59-C63 VanDerWaalsContact O-SG 3.37Å
60V97.5Very high92.8Very high90 Ų9057.6 Ų57.655%0.54530%0.3SS..Hα-helixtrans-60.6-45.1179.5171.10000110.8I56 F57 G62 C63 F64I56-V60 HydrophobicContact CG2-CG2 4.24Å; I56-V60 WeakPolarHBondContact O-CG2 3.32Å; I56-V60 PolarHBondContact O-N 3.3Å; F57-V60 PolarHBondContact O-N 2.92Å; V60-G62 VanDerWaalsContact C-N 3.34Å; V60-G62 PolarHBondContact O-N 3.21Å; V60-C63 PolarHBondContact O-N 3.42Å; V60-F64 WeakPolarHBondContact O-CB 3.17Å; V60-F64 PolarHBondContact O-N 3.46Å
61L96.6Very high94Very high67 Ų6755.7 Ų55.735%0.35129%0.29SS..Hα-helixtrans-60.6-43.9175.1-178.361.5000111.3L29 F57 I59 F64 L65L29-L61 HydrophobicContact CD1-CD2 4.26Å; L29-L61 HydrophobicContact CD1-CG 4.21Å; F57-L61 HydrophobicContact CE1-CD2 4.2Å; F57-L61 HydrophobicContact CZ-CD2 4.46Å; F57-L61 VanDerWaalsContact O-CB 3.3Å; F57-L61 WeakPolarHBondContact O-CB 3.45Å; F57-L61 PolarHBondContact O-N 2.9Å; I59-L61 VanDerWaalsContact C-N 3.34Å; I59-L61 PolarHBondContact O-N 2.99Å; L61-F64 WeakPolarHBondContact O-CB 3.22Å; L61-F64 PolarHBondContact O-N 3.4Å; L61-L65 HydrophobicContact CD1-CG 4.49Å; L61-L65 WeakPolarHBondContact O-CG 3.35Å; L61-L65 PolarHBondContact O-N 3.5Å
62G98.3Very high94.9Very high0 Ų053.5 Ų53.50%028%0.279CS..Hα-helixtrans-60-45.7175.700000113.2G26 I58 I59 V60 F64 L65 F66G26-G62 WeakPolarHBondContact CA-O 3.41Å; I58-G62 PolarHBondContact O-N 3.03Å; I59-G62 PolarHBondContact O-N 3.34Å; V60-G62 VanDerWaalsContact C-N 3.34Å; V60-G62 PolarHBondContact O-N 3.21Å; G62-F64 VanDerWaalsContact C-N 3.31Å; G62-F64 PolarHBondContact O-N 3.4Å; G62-L65 PolarHBondContact O-N 2.84Å; G62-F66 WeakPolarHBondContact O-CB 3.33Å; G62-F66 PolarHBondContact O-N 2.87Å
63C98Very high95.4Very high54 Ų5453.8 Ų53.837%0.36528%0.28SS..Hα-helixtrans-59.7-41.8174.4-71.20000111.9I59 V60 F66 L67I59-C63 PolarHBondContact O-N 2.89Å; I59-C63 PolarHBondContact O-SG 3.46Å; I59-C63 VanDerWaalsContact O-SG 3.37Å; V60-C63 PolarHBondContact O-N 3.42Å; C63-F66 PolarHBondContact O-N 3.44Å; C63-L67 WeakPolarHBondContact O-CG 3.38Å; C63-L67 PolarHBondContact O-N 3.37Å
64F96.2Very high95.7Very high54 Ų5453.3 Ų53.324%0.23727%0.271CS..Hα-helixtrans-64.1-47.2177.8-178.9-102.8000112.1V60 L61 G62 F66 L67 L68 M94V60-F64 WeakPolarHBondContact O-CB 3.17Å; V60-F64 PolarHBondContact O-N 3.46Å; L61-F64 WeakPolarHBondContact O-CB 3.22Å; L61-F64 PolarHBondContact O-N 3.4Å; G62-F64 VanDerWaalsContact C-N 3.31Å; G62-F64 PolarHBondContact O-N 3.4Å; F64-F66 PolarHBondContact O-N 2.96Å; F64-L67 PolarHBondContact O-N 2.93Å; F64-L68 HydrophobicContact CD1-CD1 3.93Å; F64-L68 HydrophobicContact CD1-CG 4.4Å; F64-L68 HydrophobicContact CE1-CD1 3.17Å; F64-L68 HydrophobicContact CE1-CG 3.85Å; F64-L68 HydrophobicContact CE2-CD1 4.4Å; F64-L68 HydrophobicContact CE2-CG 4.25Å; F64-L68 HydrophobicContact CZ-CD1 3.44Å; F64-L68 VanDerWaalsContact CZ-CD1 3.44Å; F64-L68 HydrophobicContact CZ-CD2 4.11Å; F64-L68 HydrophobicContact CZ-CG 3.73Å; F64-L68 PolarHBondContact O-N 2.91Å; F64-M94 HydrophobicContact CD1-SD 4.2Å; F64-M94 HydrophobicContact CE1-CE 4.45Å; F64-M94 HydrophobicContact CE1-CG 3.44Å; F64-M94 VanDerWaalsContact CE1-CG 3.44Å; F64-M94 HydrophobicContact CE1-SD 3.27Å; F64-M94 WeakPolarHBondContact CE1-SD 3.44Å; F64-M94 HydrophobicContact CE2-CE 4.48Å; F64-M94 HydrophobicContact CE2-CG 4.4Å; F64-M94 HydrophobicContact CE2-SD 4.26Å; F64-M94 HydrophobicContact CZ-CE 4.02Å; F64-M94 HydrophobicContact CZ-CG 3.22Å; F64-M94 HydrophobicContact CZ-SD 3.33Å; F64-M94 WeakPolarHBondContact CZ-SD 3.42Å
65L97.2Very high96.1Very high40 Ų4048.4 Ų48.421%0.20925%0.245CC..Hα-helixtrans-64.3-39.2176.2-66.6-176.2000112.4V22 L29 L61 G62 L67 L68 G69V22-L65 HydrophobicContact CG1-CB 4.19Å; V22-L65 HydrophobicContact CG1-CD2 4.16Å; L29-L65 HydrophobicContact CD1-CD1 3.87Å; L61-L65 HydrophobicContact CD1-CG 4.49Å; L61-L65 WeakPolarHBondContact O-CG 3.35Å; L61-L65 PolarHBondContact O-N 3.5Å; G62-L65 PolarHBondContact O-N 2.84Å; L65-L67 PolarHBondContact O-N 3.44Å; L65-L68 PolarHBondContact O-N 3.41Å; L65-G69 PolarHBondContact O-N 2.99Å
66F97.8Very high96.1Very high69 Ų6948 Ų4830%0.30324%0.243SC..Hα-helixtrans-56.9-49.9173.5172.4-87.7000111F23 I27 I30 G62 C63 F64 G69 F70F23-F66 AromaticContact CD2-CD2 3.82Å; F23-F66 HydrophobicContact CD2-CD2 3.82Å; F23-F66 HydrophobicContact CD2-CE2 4.04Å; F23-F66 HydrophobicContact CD2-CG 4.37Å; F23-F66 AromaticContact CE2-CD2 3.37Å; F23-F66 HydrophobicContact CE2-CD2 3.37Å; F23-F66 HydrophobicContact CE2-CE1 4.43Å; F23-F66 AromaticContact CE2-CE2 3.11Å; F23-F66 HydrophobicContact CE2-CE2 3.11Å; F23-F66 HydrophobicContact CE2-CG 4.16Å; F23-F66 AromaticContact CE2-CZ 3.7Å; F23-F66 HydrophobicContact CE2-CZ 3.7Å; F23-F66 HydrophobicContact CZ-CD2 4.03Å; F23-F66 AromaticContact CZ-CE2 3.51Å; F23-F66 HydrophobicContact CZ-CE2 3.51Å; F23-F66 HydrophobicContact CZ-CZ 4.24Å; I27-F66 HydrophobicContact CD1-CD2 4.46Å; I27-F66 HydrophobicContact CD1-CE2 4.42Å; I27-F66 HydrophobicContact CG1-CD2 3.8Å; I27-F66 HydrophobicContact CG1-CE2 4.16Å; I30-F66 HydrophobicContact CD1-CB 4.07Å; I30-F66 HydrophobicContact CD1-CG 4.46Å; G62-F66 WeakPolarHBondContact O-CB 3.33Å; G62-F66 PolarHBondContact O-N 2.87Å; C63-F66 PolarHBondContact O-N 3.44Å; F64-F66 PolarHBondContact O-N 2.96Å; F66-G69 PolarHBondContact O-N 3.25Å; F66-F70 VanDerWaalsContact O-CB 3.22Å; F66-F70 WeakPolarHBondContact O-CB 3.35Å; F66-F70 PolarHBondContact O-N 2.89Å
67L96.7Very high96Very high94 Ų9446.7 Ų46.749%0.49224%0.241SC..Hα-helixtrans-64.4-45.3179.7-71.7174.4000112.1C63 F64 L65 F70 L71C63-L67 WeakPolarHBondContact O-CG 3.38Å; C63-L67 PolarHBondContact O-N 3.37Å; F64-L67 PolarHBondContact O-N 2.93Å; L65-L67 PolarHBondContact O-N 3.44Å; L67-F70 PolarHBondContact O-N 3.47Å; L67-L71 WeakPolarHBondContact O-CB 3.39Å; L67-L71 VanDerWaalsContact O-CG 3.28Å; L67-L71 WeakPolarHBondContact O-CG 3.3Å; L67-L71 PolarHBondContact O-N 2.92Å
68L96.3Very high95.9Very high9 Ų945.2 Ų45.25%0.04724%0.242CC..Hα-helixtrans-59.1-51176.5-80.2-174.1000111.9F64 L65 F70 L71 G72 Y87 L90 L91F64-L68 HydrophobicContact CD1-CD1 3.93Å; F64-L68 HydrophobicContact CD1-CG 4.4Å; F64-L68 HydrophobicContact CE1-CD1 3.17Å; F64-L68 HydrophobicContact CE1-CG 3.85Å; F64-L68 HydrophobicContact CE2-CD1 4.4Å; F64-L68 HydrophobicContact CE2-CG 4.25Å; F64-L68 HydrophobicContact CZ-CD1 3.44Å; F64-L68 VanDerWaalsContact CZ-CD1 3.44Å; F64-L68 HydrophobicContact CZ-CD2 4.11Å; F64-L68 HydrophobicContact CZ-CG 3.73Å; F64-L68 PolarHBondContact O-N 2.91Å; L65-L68 PolarHBondContact O-N 3.41Å; L68-F70 VanDerWaalsContact C-N 3.34Å; L68-F70 PolarHBondContact O-N 3.35Å; L68-L71 PolarHBondContact O-N 2.93Å; L68-G72 PolarHBondContact O-N 3.49Å; L68-Y87 HydrophobicContact CD2-CD2 4.42Å; L68-Y87 WeakPolarHBondContact O-CD2 3.49Å; L68-L90 HydrophobicContact CD2-CB 3.56Å; L68-L90 HydrophobicContact CD2-CD1 4.12Å; L68-L91 HydrophobicContact CD1-CD2 3.95Å; L68-L91 HydrophobicContact CD2-CD2 4.39Å; L68-L91 HydrophobicContact CD2-CG 4.42Å
69G97Very high95.6Very high0 Ų049.1 Ų49.10%026%0.257CS..Hα-helixtrans-62.2-41.6179.700000111.9N19 L65 F66 F73N19-G69 WeakPolarHBondContact O-CA 3.48Å; L65-G69 PolarHBondContact O-N 2.99Å; F66-G69 PolarHBondContact O-N 3.25Å; G69-F73 WeakPolarHBondContact O-CB 3.36Å; G69-F73 PolarHBondContact O-N 3.23Å
70F95.9Very high95.4Very high94 Ų9450.3 Ų50.341%0.41227%0.265SS..Hα-helixtrans-63.4-47.3176.5-177.3-101.6000112.1F23 F66 L67 L68 F73 C74F23-F70 HydrophobicContact CD2-CB 4.01Å; F23-F70 HydrophobicContact CE2-CB 4.04Å; F23-F70 HydrophobicContact CE2-CD2 4.13Å; F66-F70 VanDerWaalsContact O-CB 3.22Å; F66-F70 WeakPolarHBondContact O-CB 3.35Å; F66-F70 PolarHBondContact O-N 2.89Å; L67-F70 PolarHBondContact O-N 3.47Å; L68-F70 VanDerWaalsContact C-N 3.34Å; L68-F70 PolarHBondContact O-N 3.35Å; F70-F73 PolarHBondContact O-N 3.35Å; F70-C74 WeakPolarHBondContact CE2-SG 3.1Å; F70-C74 WeakPolarHBondContact CZ-SG 3.39Å; F70-C74 VanDerWaalsContact O-CB 3.22Å; F70-C74 WeakPolarHBondContact O-CB 3.07Å; F70-C74 PolarHBondContact O-N 3.5Å; F70-C74 PolarHBondContact O-SG 2.96Å
71L96.8Very high95.2Very high31 Ų3147.3 Ų47.316%0.16225%0.246CC..Hα-helixtrans-63.4-43178.7-72172.3000112.1L67 L68 G75 L86 L90L67-L71 WeakPolarHBondContact O-CB 3.39Å; L67-L71 VanDerWaalsContact O-CG 3.28Å; L67-L71 WeakPolarHBondContact O-CG 3.3Å; L67-L71 PolarHBondContact O-N 2.92Å; L68-L71 PolarHBondContact O-N 2.93Å; L71-G75 WeakPolarHBondContact O-CA 3.39Å; L71-G75 PolarHBondContact O-N 2.89Å; L71-L86 HydrophobicContact CD1-CB 4.48Å; L71-L90 HydrophobicContact CD1-CD1 3.66Å
72G96Very high95.2Very high0 Ų047.8 Ų47.80%026%0.255CS..Hα-helixtrans-65.6-45.1176.700000112.3L68 A76L68-G72 PolarHBondContact O-N 3.49Å; G72-A76 WeakPolarHBondContact O-CB 3.42Å; G72-A76 PolarHBondContact O-N 3.32Å
73F95.1Very high95Very high77 Ų7749.1 Ų49.134%0.33826%0.263SS..Hα-helixtrans-63.2-56.4176.8170.6-108.4000112.2V16 N19 I20 G69 F70 A76 C77V16-F73 HydrophobicContact CG1-CD2 4.01Å; V16-F73 HydrophobicContact CG1-CE2 4.15Å; N19-F73 HydrophobicContact CB-CB 4.35Å; I20-F73 HydrophobicContact CD1-CD2 3.88Å; I20-F73 HydrophobicContact CD1-CE2 3.81Å; I20-F73 HydrophobicContact CG1-CD2 3.57Å; I20-F73 HydrophobicContact CG1-CE2 3.95Å; I20-F73 HydrophobicContact CG1-CG 4.31Å; G69-F73 WeakPolarHBondContact O-CB 3.36Å; G69-F73 PolarHBondContact O-N 3.23Å; F70-F73 PolarHBondContact O-N 3.35Å; F73-A76 PolarHBondContact O-N 2.96Å; F73-C77 WeakPolarHBondContact CE2-SG 3.49Å; F73-C77 WeakPolarHBondContact O-CB 3.26Å; F73-C77 PolarHBondContact O-N 3.39Å; F73-C77 PolarHBondContact O-SG 3.42Å
74C94.2Very high94.9Very high26 Ų2646.5 Ų46.518%0.17625%0.246CC..Hα-helixtrans-63.4-45-179.2-73.30000111.1F70 A76 C77 T78F70-C74 WeakPolarHBondContact CE2-SG 3.1Å; F70-C74 WeakPolarHBondContact CZ-SG 3.39Å; F70-C74 VanDerWaalsContact O-CB 3.22Å; F70-C74 WeakPolarHBondContact O-CB 3.07Å; F70-C74 PolarHBondContact O-N 3.5Å; F70-C74 PolarHBondContact O-SG 2.96Å; C74-A76 VanDerWaalsContact C-N 3.35Å; C74-A76 PolarHBondContact O-N 3.44Å; C74-C77 PolarHBondContact O-N 3.36Å; C74-T78 VanDerWaalsContact O-CB 3.29Å; C74-T78 WeakPolarHBondContact O-CB 3.36Å; C74-T78 WeakPolarHBondContact O-CG2 3.49Å; C74-T78 PolarHBondContact O-N 3.13Å; C74-T78 PolarHBondContact O-OG1 2.69Å
75G93.9Very high94.9Very high0 Ų047 Ų470%025%0.25CS..Hα-helixtrans-58.3-45.1177.900000112.5L71 K79 N80L71-G75 WeakPolarHBondContact O-CA 3.39Å; L71-G75 PolarHBondContact O-N 2.89Å; G75-K79 CarbonylContact O-C 3.6Å; G75-K79 WeakPolarHBondContact O-CA 3.26Å; G75-K79 PolarHBondContact O-N 2.91Å; G75-K79 VanDerWaalsContact O-N 3.14Å; G75-N80 PolarHBondContact O-N 2.94Å; G75-N80 VanDerWaalsContact O-N 3.12Å
76A93Very high94.9Very high0 Ų049.2 Ų49.20%026%0.262CS..Hα-helixtrans-71.6-39.9178.800000113Q12 L15 V16 G72 F73 C74 L84Q12-A76 HydrophobicContact CG-CB 4.46Å; Q12-A76 PolarHBondContact NE2-O 2.94Å; L15-A76 HydrophobicContact CD2-CB 4.26Å; V16-A76 HydrophobicContact CG2-CB 3.55Å; G72-A76 WeakPolarHBondContact O-CB 3.42Å; G72-A76 PolarHBondContact O-N 3.32Å; F73-A76 PolarHBondContact O-N 2.96Å; C74-A76 VanDerWaalsContact C-N 3.35Å; C74-A76 PolarHBondContact O-N 3.44Å; A76-L84 HydrophobicContact CB-CD2 4.47Å
77C91.7Very high94.9Very high63 Ų6346 Ų4643%0.42625%0.247SC..Hα-helixtrans-75-44.2-178.4-66.30000112.6F73 C74 K79F73-C77 WeakPolarHBondContact CE2-SG 3.49Å; F73-C77 WeakPolarHBondContact O-CB 3.26Å; F73-C77 PolarHBondContact O-N 3.39Å; F73-C77 PolarHBondContact O-SG 3.42Å; C74-C77 PolarHBondContact O-N 3.36Å; C77-K79 PolarHBondContact O-N 2.96Å
78T92.6Very high94.9Very high93 Ų9342 Ų4257%0.57123%0.228SC*.Hα-helixtrans-81.8-4-179.265.70000112.7C74 N80C74-T78 VanDerWaalsContact O-CB 3.29Å; C74-T78 WeakPolarHBondContact O-CB 3.36Å; C74-T78 WeakPolarHBondContact O-CG2 3.49Å; C74-T78 PolarHBondContact O-N 3.13Å; C74-T78 PolarHBondContact O-OG1 2.69Å; T78-N80 PolarHBondContact O-N 3.45Å; T78-N80 VanDerWaalsContact O-N 3.16Å; T78-N80 WeakPolarHBondContact OG1-CB 3.38Å; T78-N80 PolarHBondContact OG1-N 3.4Å
79K89.4Confident94.9Very high126 Ų12646 Ų4655%0.54825%0.249SC..THydrogen-bonded Turntrans52.530.4-170.7-59177.8178.1177.20112.1G75 C77 T81 I219G75-K79 CarbonylContact O-C 3.6Å; G75-K79 WeakPolarHBondContact O-CA 3.26Å; G75-K79 PolarHBondContact O-N 2.91Å; G75-K79 VanDerWaalsContact O-N 3.14Å; C77-K79 PolarHBondContact O-N 2.96Å; K79-T81 PolarHBondContact O-N 3.2Å; K79-I219 HydrophobicContact CB-CD1 3.82Å; K79-I219 HydrophobicContact CB-CG1 4.14Å; K79-I219 HydrophobicContact CG-CD1 4.38Å
80N93.3Very high94.9Very high70 Ų7049 Ų4937%0.37427%0.265SS..  trans-82.1102.7178.7-173.5-23.5000110G75 T78 C82 C83 L84G75-N80 PolarHBondContact O-N 2.94Å; G75-N80 VanDerWaalsContact O-N 3.12Å; T78-N80 PolarHBondContact O-N 3.45Å; T78-N80 VanDerWaalsContact O-N 3.16Å; T78-N80 WeakPolarHBondContact OG1-CB 3.38Å; T78-N80 PolarHBondContact OG1-N 3.4Å; N80-C82 VanDerWaalsContact C-N 3.26Å; N80-C82 PolarHBondContact O-N 3.33Å; N80-C82 VanDerWaalsContact OD1-CB 3.29Å; N80-C82 WeakPolarHBondContact OD1-CB 3.32Å; N80-C82 PolarHBondContact OD1-N 3.4Å; N80-C83 HydrophobicContact CB-CB 4.29Å; N80-C83 PolarHBondContact O-N 2.93Å; N80-C83 PolarHBondContact OD1-N 3.29Å; N80-L84 PolarHBondContact O-N 2.89Å; N80-L84 VanDerWaalsContact O-N 3.17Å
81T94.1Very high94.9Very high26 Ų2644.9 Ų44.916%0.1625%0.247CC..Hα-helixtrans-57.7-34.6179-63.60000113.1K79 L84 I85 I216K79-T81 PolarHBondContact O-N 3.2Å; T81-L84 PolarHBondContact O-N 3.44Å; T81-I85 HydrophobicContact CG2-CD1 3.66Å; T81-I85 HydrophobicContact CG2-CG1 4.19Å; T81-I85 WeakPolarHBondContact O-CB 3.28Å; T81-I85 WeakPolarHBondContact O-CG1 3.45Å; T81-I85 PolarHBondContact O-N 2.99Å; T81-I216 HydrophobicContact CG2-CG1 4.34Å; T81-I216 HydrophobicContact CG2-CG2 3.75Å
82C95.3Very high94.9Very high78 Ų7846.1 Ų46.153%0.52726%0.258SS..Hα-helixtrans-64-46.7178.3-175.70000111.4N80 L84 I85 L86N80-C82 VanDerWaalsContact C-N 3.26Å; N80-C82 PolarHBondContact O-N 3.33Å; N80-C82 VanDerWaalsContact OD1-CB 3.29Å; N80-C82 WeakPolarHBondContact OD1-CB 3.32Å; N80-C82 PolarHBondContact OD1-N 3.4Å; C82-L84 VanDerWaalsContact C-N 3.35Å; C82-L84 PolarHBondContact O-N 3.34Å; C82-I85 PolarHBondContact O-N 3.41Å; C82-L86 WeakPolarHBondContact O-CG 3.4Å; C82-L86 PolarHBondContact O-N 2.94Å
83C95.1Very high94.9Very high27 Ų2750.1 Ų50.118%0.18228%0.282CS..Hα-helixtrans-61-42.4176.1-65.80000112.1N80 L86 Y87N80-C83 HydrophobicContact CB-CB 4.29Å; N80-C83 PolarHBondContact O-N 2.93Å; N80-C83 PolarHBondContact OD1-N 3.29Å; C83-L86 PolarHBondContact O-N 3.43Å; C83-Y87 WeakPolarHBondContact O-CB 3.33Å; C83-Y87 PolarHBondContact O-N 2.97Å
84L95.2Very high94.8Very high0 Ų048.9 Ų48.90%028%0.278CS..Hα-helixtrans-66.1-36.6177-74.3168.7000112.7L15 A76 N80 T81 C82 Y87 A88 A212 V215 I216 I219L15-L84 HydrophobicContact CD2-CD2 4.27Å; A76-L84 HydrophobicContact CB-CD2 4.47Å; N80-L84 PolarHBondContact O-N 2.89Å; N80-L84 VanDerWaalsContact O-N 3.17Å; T81-L84 PolarHBondContact O-N 3.44Å; C82-L84 VanDerWaalsContact C-N 3.35Å; C82-L84 PolarHBondContact O-N 3.34Å; L84-Y87 PolarHBondContact O-N 3.23Å; L84-A88 WeakPolarHBondContact O-CB 3.46Å; L84-A88 PolarHBondContact O-N 3.01Å; L84-A212 HydrophobicContact CD2-CB 4.49Å; L84-V215 HydrophobicContact CD1-CB 4.37Å; L84-V215 HydrophobicContact CD1-CG1 3.65Å; L84-I216 HydrophobicContact CB-CD1 3.74Å; L84-I216 HydrophobicContact CB-CG1 3.53Å; L84-I216 HydrophobicContact CD1-CG1 4.04Å; L84-I216 HydrophobicContact CG-CG1 4.42Å; L84-I219 HydrophobicContact CD1-CD1 3.94Å
85I97Very high94.8Very high65 Ų6548.7 Ų48.733%0.33328%0.276SS..Hα-helixtrans-64.4-48.3175-72.3165.9000110T81 C82 Y87 A88 I89 I216T81-I85 HydrophobicContact CG2-CD1 3.66Å; T81-I85 HydrophobicContact CG2-CG1 4.19Å; T81-I85 WeakPolarHBondContact O-CB 3.28Å; T81-I85 WeakPolarHBondContact O-CG1 3.45Å; T81-I85 PolarHBondContact O-N 2.99Å; C82-I85 PolarHBondContact O-N 3.41Å; I85-Y87 VanDerWaalsContact C-N 3.33Å; I85-Y87 PolarHBondContact O-N 3.44Å; I85-A88 PolarHBondContact O-N 3.5Å; I85-I89 HydrophobicContact CG2-CD1 3.72Å; I85-I89 HydrophobicContact CG2-CG1 4.4Å; I85-I89 VanDerWaalsContact O-CG1 3.3Å; I85-I89 WeakPolarHBondContact O-CG1 3.31Å; I85-I89 PolarHBondContact O-N 3.49Å; I85-I216 HydrophobicContact CG1-CD1 3.84Å
86L96.9Very high94.9Very high85 Ų8551.6 Ų51.645%0.44530%0.3SS..Hα-helixtrans-59.5-44.6176.7-71.3175.1000111.6L71 C82 C83 A88 I89 L90L71-L86 HydrophobicContact CD1-CB 4.48Å; C82-L86 WeakPolarHBondContact O-CG 3.4Å; C82-L86 PolarHBondContact O-N 2.94Å; C83-L86 PolarHBondContact O-N 3.43Å; L86-A88 PolarHBondContact O-N 3.3Å; L86-I89 PolarHBondContact O-N 2.86Å; L86-L90 WeakPolarHBondContact O-CB 3.47Å; L86-L90 VanDerWaalsContact O-CG 3.31Å; L86-L90 WeakPolarHBondContact O-CG 3.44Å; L86-L90 PolarHBondContact O-N 2.95Å
87Y97.1Very high95Very high1 Ų154 Ų540%0.00432%0.32CS..Hα-helixtrans-55.4-50173.6170.8-105.2000112.3L15 N19 L68 C83 L84 I85 I89 L90 L91 S208 A212L15-Y87 HydrophobicContact CD1-CE1 4.12Å; N19-Y87 PolarHBondContact ND2-OH 3.5Å; N19-Y87 WeakPolarHBondContact OD1-CE2 3.44Å; N19-Y87 PolarHBondContact OD1-OH 3.04Å; L68-Y87 HydrophobicContact CD2-CD2 4.42Å; L68-Y87 WeakPolarHBondContact O-CD2 3.49Å; C83-Y87 WeakPolarHBondContact O-CB 3.33Å; C83-Y87 PolarHBondContact O-N 2.97Å; L84-Y87 PolarHBondContact O-N 3.23Å; I85-Y87 VanDerWaalsContact C-N 3.33Å; I85-Y87 PolarHBondContact O-N 3.44Å; Y87-I89 PolarHBondContact O-N 3.44Å; Y87-L90 PolarHBondContact O-N 2.95Å; Y87-L91 HydrophobicContact CD1-CD1 4.18Å; Y87-L91 HydrophobicContact CD2-CD1 4.34Å; Y87-L91 HydrophobicContact CD2-CG 4.43Å; Y87-L91 HydrophobicContact CE1-CD1 3.49Å; Y87-L91 VanDerWaalsContact CE1-CD1 3.49Å; Y87-L91 HydrophobicContact CE1-CG 4.49Å; Y87-L91 HydrophobicContact CE2-CD1 3.69Å; Y87-L91 HydrophobicContact CE2-CG 4.05Å; Y87-L91 PolarHBondContact O-N 3.25Å; Y87-L91 WeakPolarHBondContact OH-CD1 3.5Å; Y87-S208 WeakPolarHBondContact OH-CB 3.27Å; Y87-A212 HydrophobicContact CD1-CB 3.86Å; Y87-A212 HydrophobicContact CE1-CB 3.97Å
88A96.7Very high95.1Very high11 Ų1154.7 Ų54.79%0.09132%0.317CS..Hα-helixtrans-64.5-38.7-18000000112.6L84 I85 L86 S92 A212L84-A88 WeakPolarHBondContact O-CB 3.46Å; L84-A88 PolarHBondContact O-N 3.01Å; I85-A88 PolarHBondContact O-N 3.5Å; L86-A88 PolarHBondContact O-N 3.3Å; A88-S92 WeakPolarHBondContact O-CB 3.48Å; A88-S92 PolarHBondContact O-N 3.46Å; A88-S92 PolarHBondContact O-OG 3.34Å; A88-A212 HydrophobicContact CB-CB 4.39Å
89I97.2Very high95.1Very high92 Ų9255.1 Ų55.147%0.47232%0.315SS..Hα-helixtrans-63.1-50.3175.1-69167.7000110.2I85 L86 Y87 L91 S92 V93I85-I89 HydrophobicContact CG2-CD1 3.72Å; I85-I89 HydrophobicContact CG2-CG1 4.4Å; I85-I89 VanDerWaalsContact O-CG1 3.3Å; I85-I89 WeakPolarHBondContact O-CG1 3.31Å; I85-I89 PolarHBondContact O-N 3.49Å; L86-I89 PolarHBondContact O-N 2.86Å; Y87-I89 PolarHBondContact O-N 3.44Å; I89-L91 PolarHBondContact O-N 3.16Å; I89-S92 WeakPolarHBondContact O-CB 3.45Å; I89-S92 PolarHBondContact O-N 3.47Å; I89-S92 VanDerWaalsContact O-N 3.13Å; I89-V93 WeakPolarHBondContact O-CG2 3.44Å; I89-V93 PolarHBondContact O-N 3.49Å
90L96.3Very high95.4Very high64 Ų6451 Ų5134%0.33531%0.307SS..Hα-helixtrans-62-42.7-179.1-70.3171.5000112L68 L71 L86 Y87 S92 V93 M94L68-L90 HydrophobicContact CD2-CB 3.56Å; L68-L90 HydrophobicContact CD2-CD1 4.12Å; L71-L90 HydrophobicContact CD1-CD1 3.66Å; L86-L90 WeakPolarHBondContact O-CB 3.47Å; L86-L90 VanDerWaalsContact O-CG 3.31Å; L86-L90 WeakPolarHBondContact O-CG 3.44Å; L86-L90 PolarHBondContact O-N 2.95Å; Y87-L90 PolarHBondContact O-N 2.95Å; L90-S92 VanDerWaalsContact C-N 3.34Å; L90-S92 PolarHBondContact O-N 2.94Å; L90-V93 PolarHBondContact O-N 2.95Å; L90-M94 WeakPolarHBondContact O-CG 3.27Å; L90-M94 PolarHBondContact O-N 2.97Å
91L95.8Very high95.4Very high8 Ų850.5 Ų50.54%0.04231%0.313CS..Hα-helixtrans-62.7-39.5173.4-80.7-175.4000112.5L68 Y87 I89 V93 M94 V95 Q205 I209L68-L91 HydrophobicContact CD1-CD2 3.95Å; L68-L91 HydrophobicContact CD2-CD2 4.39Å; L68-L91 HydrophobicContact CD2-CG 4.42Å; Y87-L91 HydrophobicContact CD1-CD1 4.18Å; Y87-L91 HydrophobicContact CD2-CD1 4.34Å; Y87-L91 HydrophobicContact CD2-CG 4.43Å; Y87-L91 HydrophobicContact CE1-CD1 3.49Å; Y87-L91 VanDerWaalsContact CE1-CD1 3.49Å; Y87-L91 HydrophobicContact CE1-CG 4.49Å; Y87-L91 HydrophobicContact CE2-CD1 3.69Å; Y87-L91 HydrophobicContact CE2-CG 4.05Å; Y87-L91 PolarHBondContact O-N 3.25Å; Y87-L91 WeakPolarHBondContact OH-CD1 3.5Å; I89-L91 PolarHBondContact O-N 3.16Å; L91-V93 VanDerWaalsContact C-N 3.32Å; L91-V93 PolarHBondContact O-N 3.03Å; L91-M94 WeakPolarHBondContact O-CB 3.27Å; L91-M94 PolarHBondContact O-N 3.13Å; L91-M94 VanDerWaalsContact O-N 3.16Å; L91-V95 WeakPolarHBondContact O-CG2 3.42Å; L91-V95 PolarHBondContact O-N 2.95Å; L91-Q205 HydrophobicContact CD2-CG 4.49Å; L91-I209 HydrophobicContact CB-CD1 4.09Å; L91-I209 HydrophobicContact CB-CG1 3.78Å; L91-I209 HydrophobicContact CD1-CG1 4.14Å
92S96.1Very high95.4Very high56 Ų5651.3 Ų51.339%0.39233%0.327SS..Hα-helixtrans-64.1-39.5177.8-58.10000111.5A88 I89 L90 M94 V95 A96A88-S92 WeakPolarHBondContact O-CB 3.48Å; A88-S92 PolarHBondContact O-N 3.46Å; A88-S92 PolarHBondContact O-OG 3.34Å; I89-S92 WeakPolarHBondContact O-CB 3.45Å; I89-S92 PolarHBondContact O-N 3.47Å; I89-S92 VanDerWaalsContact O-N 3.13Å; L90-S92 VanDerWaalsContact C-N 3.34Å; L90-S92 PolarHBondContact O-N 2.94Å; S92-M94 VanDerWaalsContact C-N 3.32Å; S92-V95 PolarHBondContact O-N 2.82Å; S92-A96 PolarHBondContact O-N 3.07Å; S92-A96 VanDerWaalsContact O-N 3.11Å
93V96.1Very high95.4Very high85 Ų8552.5 Ų52.552%0.51533%0.327SS..Hα-helixtrans-63.3-38.8173.3172.60000111.1I89 L90 L91 A96 A97I89-V93 WeakPolarHBondContact O-CG2 3.44Å; I89-V93 PolarHBondContact O-N 3.49Å; L90-V93 PolarHBondContact O-N 2.95Å; L91-V93 VanDerWaalsContact C-N 3.32Å; L91-V93 PolarHBondContact O-N 3.03Å; V93-A96 PolarHBondContact O-N 3.32Å; V93-A97 WeakPolarHBondContact O-CB 3.43Å; V93-A97 PolarHBondContact O-N 3.11Å
94M93.9Very high95.4Very high51 Ų5153.3 Ų53.325%0.25134%0.336SS..Hα-helixtrans-65.2-46175.7-72.9-66.695.500113.3F64 L90 L91 S92 A96 A97 E98F64-M94 HydrophobicContact CD1-SD 4.2Å; F64-M94 HydrophobicContact CE1-CE 4.45Å; F64-M94 HydrophobicContact CE1-CG 3.44Å; F64-M94 VanDerWaalsContact CE1-CG 3.44Å; F64-M94 HydrophobicContact CE1-SD 3.27Å; F64-M94 WeakPolarHBondContact CE1-SD 3.44Å; F64-M94 HydrophobicContact CE2-CE 4.48Å; F64-M94 HydrophobicContact CE2-CG 4.4Å; F64-M94 HydrophobicContact CE2-SD 4.26Å; F64-M94 HydrophobicContact CZ-CE 4.02Å; F64-M94 HydrophobicContact CZ-CG 3.22Å; F64-M94 HydrophobicContact CZ-SD 3.33Å; F64-M94 WeakPolarHBondContact CZ-SD 3.42Å; L90-M94 WeakPolarHBondContact O-CG 3.27Å; L90-M94 PolarHBondContact O-N 2.97Å; L91-M94 WeakPolarHBondContact O-CB 3.27Å; L91-M94 PolarHBondContact O-N 3.13Å; L91-M94 VanDerWaalsContact O-N 3.16Å; S92-M94 VanDerWaalsContact C-N 3.32Å; M94-A96 PolarHBondContact O-N 3.44Å; M94-A97 HydrophobicContact CE-CB 4.2Å; M94-A97 CarbonylContact O-C 3.57Å; M94-A97 PolarHBondContact O-N 2.7Å; M94-A97 VanDerWaalsContact O-N 3.07Å; M94-E98 WeakPolarHBondContact O-CG 3.33Å; M94-E98 PolarHBondContact O-N 3.47Å
95V95Very high95.3Very high21 Ų2155.8 Ų55.813%0.12736%0.356CS..Hα-helixtrans-56.7-44.2175.4172.70000110.2L91 S92 E98 I99 Q205 L206 I209L91-V95 WeakPolarHBondContact O-CG2 3.42Å; L91-V95 PolarHBondContact O-N 2.95Å; S92-V95 PolarHBondContact O-N 2.82Å; V95-E98 PolarHBondContact O-N 3.4Å; V95-I99 HydrophobicContact CG1-CD1 3.92Å; V95-I99 VanDerWaalsContact O-CG1 3.27Å; V95-I99 WeakPolarHBondContact O-CG1 3.35Å; V95-I99 PolarHBondContact O-N 3.25Å; V95-Q205 HydrophobicContact CG2-CB 3.74Å; V95-L206 HydrophobicContact CG1-CD2 4.42Å; V95-I209 HydrophobicContact CG2-CD1 4.08Å
96A95.4Very high95.1Very high62 Ų6255.8 Ų55.851%0.51237%0.366SS..Hα-helixtrans-63.8-41.3176.400000112.5S92 V93 M94 G100S92-A96 PolarHBondContact O-N 3.07Å; S92-A96 VanDerWaalsContact O-N 3.11Å; V93-A96 PolarHBondContact O-N 3.32Å; M94-A96 PolarHBondContact O-N 3.44Å; A96-G100 PolarHBondContact O-N 3.04Å
97A94.9Very high95.1Very high49 Ų4957.1 Ų57.141%0.40538%0.377SS..Hα-helixtrans-65.4-39.9177.100000112.4V93 M94 G100 A101V93-A97 WeakPolarHBondContact O-CB 3.43Å; V93-A97 PolarHBondContact O-N 3.11Å; M94-A97 HydrophobicContact CE-CB 4.2Å; M94-A97 CarbonylContact O-C 3.57Å; M94-A97 PolarHBondContact O-N 2.7Å; M94-A97 VanDerWaalsContact O-N 3.07Å; A97-G100 PolarHBondContact O-N 2.71Å; A97-A101 VanDerWaalsContact O-CB 3.27Å; A97-A101 WeakPolarHBondContact O-CB 3.36Å; A97-A101 PolarHBondContact O-N 3.16Å
98E92.9Very high95Very high79 Ų7960.9 Ų60.937%0.36940%0.397SS..Hα-helixtrans-66.1-43.6176.6-74.5178.8-171.600112M94 V95 G100 A101 G102 Q205M94-E98 WeakPolarHBondContact O-CG 3.33Å; M94-E98 PolarHBondContact O-N 3.47Å; V95-E98 PolarHBondContact O-N 3.4Å; E98-G100 VanDerWaalsContact C-N 3.34Å; E98-A101 PolarHBondContact O-N 2.89Å; E98-G102 PolarHBondContact O-N 2.91Å; E98-Q205 PolarHBondContact OE1-NE2 2.83Å; E98-Q205 PolarHBondContact OE2-OE1 2.88Å; E98-Q205 VanDerWaalsContact OE2-OE1 3.13Å
99I93.6Very high94.8Very high102 Ų10268.6 Ų68.652%0.52342%0.423SS..Hα-helixtrans-61.2-46.4173.9-67.1166.7000109.9V95 G102 I103V95-I99 HydrophobicContact CG1-CD1 3.92Å; V95-I99 VanDerWaalsContact O-CG1 3.27Å; V95-I99 WeakPolarHBondContact O-CG1 3.35Å; V95-I99 PolarHBondContact O-N 3.25Å; I99-G102 PolarHBondContact O-N 2.96Å; I99-I103 HydrophobicContact CG2-CD1 3.82Å; I99-I103 VanDerWaalsContact O-CG1 3.29Å; I99-I103 WeakPolarHBondContact O-CG1 3.32Å; I99-I103 PolarHBondContact O-N 3.07Å
100G95.9Very high94.6Very high38 Ų3870.6 Ų70.639%0.39243%0.431SS..Hα-helixtrans-60.2-45.517700000112.8A96 A97 E98 I103 A104A96-G100 PolarHBondContact O-N 3.04Å; A97-G100 PolarHBondContact O-N 2.71Å; E98-G100 VanDerWaalsContact C-N 3.34Å; G100-I103 PolarHBondContact O-N 3.23Å; G100-A104 WeakPolarHBondContact O-CB 3.23Å; G100-A104 PolarHBondContact O-N 3.06Å
101A93.6Very high94.5Very high60 Ų6071.9 Ų71.950%0.49644%0.438SS..Hα-helixtrans-64.4-40.1176.600000112A97 E98 A104 A105A97-A101 VanDerWaalsContact O-CB 3.27Å; A97-A101 WeakPolarHBondContact O-CB 3.36Å; A97-A101 PolarHBondContact O-N 3.16Å; E98-A101 PolarHBondContact O-N 2.89Å; A101-A104 PolarHBondContact O-N 3.05Å; A101-A105 VanDerWaalsContact O-CB 3.28Å; A101-A105 WeakPolarHBondContact O-CB 3.26Å; A101-A105 PolarHBondContact O-N 3.48Å
102G93Very high94.2Very high43 Ų4375.4 Ų75.444%0.44346%0.46SS..Hα-helixtrans-63.2-44.4175.400000112.6E98 I99 A105 A106E98-G102 PolarHBondContact O-N 2.91Å; I99-G102 PolarHBondContact O-N 2.96Å; G102-A105 PolarHBondContact O-N 3.42Å; G102-A106 WeakPolarHBondContact O-CB 3.4Å; G102-A106 PolarHBondContact O-N 3.46Å
103I95.5Very high94Very high103 Ų10378 Ų7853%0.52846%0.464SS..Hα-helixtrans-63.4-47.3174.6-66165.5000110.3I99 G100 A105 A106 V107I99-I103 HydrophobicContact CG2-CD1 3.82Å; I99-I103 VanDerWaalsContact O-CG1 3.29Å; I99-I103 WeakPolarHBondContact O-CG1 3.32Å; I99-I103 PolarHBondContact O-N 3.07Å; G100-I103 PolarHBondContact O-N 3.23Å; I103-A105 PolarHBondContact O-N 2.88Å; I103-A106 PolarHBondContact O-N 3.43Å; I103-V107 HydrophobicContact CG2-CG2 4.31Å; I103-V107 WeakPolarHBondContact O-CG2 3.47Å; I103-V107 PolarHBondContact O-N 3.35Å
104A96.2Very high93.8Very high45 Ų4577.8 Ų77.837%0.37246%0.463SS..Hα-helixtrans-60.1-45178.500000111.6G100 A101 A106 V107 L108G100-A104 WeakPolarHBondContact O-CB 3.23Å; G100-A104 PolarHBondContact O-N 3.06Å; A101-A104 PolarHBondContact O-N 3.05Å; A104-A106 VanDerWaalsContact C-N 3.29Å; A104-A106 PolarHBondContact O-N 3.36Å; A104-V107 PolarHBondContact O-N 2.87Å; A104-L108 HydrophobicContact CB-CD1 4.45Å; A104-L108 VanDerWaalsContact O-CB 3.3Å; A104-L108 WeakPolarHBondContact O-CB 3.34Å; A104-L108 WeakPolarHBondContact O-CD1 3.49Å; A104-L108 PolarHBondContact O-N 2.82Å
105A92.4Very high93.7Very high51 Ų5181.6 Ų81.642%0.42148%0.48SS..Hα-helixtrans-62.8-34.8176.700000112.7A101 G102 I103 R109A101-A105 VanDerWaalsContact O-CB 3.28Å; A101-A105 WeakPolarHBondContact O-CB 3.26Å; A101-A105 PolarHBondContact O-N 3.48Å; G102-A105 PolarHBondContact O-N 3.42Å; I103-A105 PolarHBondContact O-N 2.88Å; A105-R109 WeakPolarHBondContact O-CA 3.3Å; A105-R109 PolarHBondContact O-N 3.34Å
106A92Very high93.4Very high66 Ų6683.5 Ų83.555%0.54549%0.487SS..Hα-helixtrans-71.9-42.5176.900000112.6G102 I103 A104G102-A106 WeakPolarHBondContact O-CB 3.4Å; G102-A106 PolarHBondContact O-N 3.46Å; I103-A106 PolarHBondContact O-N 3.43Å; A104-A106 VanDerWaalsContact C-N 3.29Å; A104-A106 PolarHBondContact O-N 3.36Å
107V97.3Very high93.2Very high113 Ų11382.7 Ų82.769%0.68547%0.474SS*.Hα-helixtrans-73.6-42179.8173.90000111.2I103 A104 R109I103-V107 HydrophobicContact CG2-CG2 4.31Å; I103-V107 WeakPolarHBondContact O-CG2 3.47Å; I103-V107 PolarHBondContact O-N 3.35Å; A104-V107 PolarHBondContact O-N 2.87Å; V107-R109 PolarHBondContact O-N 3.37Å
108L95.5Very high93Very high79 Ų7983.5 Ų83.541%0.41447%0.474SS..THydrogen-bonded Turntrans-97.630-177.6-68.286000112.3A104 E110 D111 V112A104-L108 HydrophobicContact CB-CD1 4.45Å; A104-L108 VanDerWaalsContact O-CB 3.3Å; A104-L108 WeakPolarHBondContact O-CB 3.34Å; A104-L108 WeakPolarHBondContact O-CD1 3.49Å; A104-L108 PolarHBondContact O-N 2.82Å; L108-E110 PolarHBondContact O-N 3.18Å; L108-D111 HydrophobicContact CB-CB 4.23Å; L108-D111 PolarHBondContact O-N 3.46Å; L108-D111 VanDerWaalsContact O-N 3.12Å; L108-V112 WeakPolarHBondContact O-CG2 3.47Å; L108-V112 PolarHBondContact O-N 3.24Å
109R92.1Very high92.8Very high173 Ų17383 Ų8365%0.65347%0.473SS*.Hα-helixtrans-56.6-36.4-175.769.3-173.3-176.5-168.1-1.8113.6A105 V107 K113A105-R109 WeakPolarHBondContact O-CA 3.3Å; A105-R109 PolarHBondContact O-N 3.34Å; V107-R109 PolarHBondContact O-N 3.37Å; R109-K113 WeakPolarHBondContact O-CB 3.38Å; R109-K113 PolarHBondContact O-N 2.97Å; R109-K113 VanDerWaalsContact O-N 3.08Å
110E93.4Very high92.6Very high134 Ų13479 Ų7963%0.62645%0.454SS*.Hα-helixtrans-72.9-39.1179.7-67.9-179.3-169.500111.3L108 K113 T114L108-E110 PolarHBondContact O-N 3.18Å; E110-K113 PolarHBondContact O-N 3.43Å; E110-T114 WeakPolarHBondContact O-CB 3.28Å; E110-T114 PolarHBondContact O-N 2.83Å; E110-T114 PolarHBondContact O-OG1 2.9Å
111D94.2Very high92.4Very high92 Ų9284.4 Ų84.449%0.49246%0.462SS..Hα-helixtrans-66.3-45174.8-63.3-34.6000110.7L108 K113 T114 Q115L108-D111 HydrophobicContact CB-CB 4.23Å; L108-D111 PolarHBondContact O-N 3.46Å; L108-D111 VanDerWaalsContact O-N 3.12Å; D111-K113 VanDerWaalsContact C-N 3.3Å; D111-K113 PolarHBondContact O-N 2.89Å; D111-T114 PolarHBondContact O-N 2.83Å; D111-T114 VanDerWaalsContact O-N 3.12Å; D111-Q115 WeakPolarHBondContact O-CB 3.27Å; D111-Q115 WeakPolarHBondContact O-CG 3.33Å; D111-Q115 PolarHBondContact O-N 3.49Å
112V90Very high92.1Very high82 Ų8283.6 Ų83.650%0.49745%0.453SS..Hα-helixtrans-57.3-45.3176.1172.20000110.7L108 Q115 F116L108-V112 WeakPolarHBondContact O-CG2 3.47Å; L108-V112 PolarHBondContact O-N 3.24Å; V112-Q115 PolarHBondContact O-N 2.88Å; V112-F116 WeakPolarHBondContact O-CB 3.29Å; V112-F116 PolarHBondContact O-N 3.39Å
113K90.2Very high91.9Very high111 Ų11182.3 Ų82.348%0.48344%0.437SS..Hα-helixtrans-61.2-46.5175.1-176.9176.4177.7175.50111.3R109 E110 D111 Q115 F116 L117 I184R109-K113 WeakPolarHBondContact O-CB 3.38Å; R109-K113 PolarHBondContact O-N 2.97Å; R109-K113 VanDerWaalsContact O-N 3.08Å; E110-K113 PolarHBondContact O-N 3.43Å; D111-K113 VanDerWaalsContact C-N 3.3Å; D111-K113 PolarHBondContact O-N 2.89Å; K113-Q115 PolarHBondContact O-N 3.31Å; K113-F116 WeakPolarHBondContact O-CB 3.36Å; K113-F116 PolarHBondContact O-N 2.8Å; K113-L117 HydrophobicContact CG-CD1 4.48Å; K113-L117 WeakPolarHBondContact O-CG 3.48Å; K113-L117 PolarHBondContact O-N 2.94Å; K113-I184 HydrophobicContact CG-CD1 4.39Å
114T93.4Very high91.7Very high79 Ų7977.5 Ų77.549%0.48541%0.413SS..Hα-helixtrans-65.9-38.6-178.4-56.90000112.3E110 D111 L117 T118E110-T114 WeakPolarHBondContact O-CB 3.28Å; E110-T114 PolarHBondContact O-N 2.83Å; E110-T114 PolarHBondContact O-OG1 2.9Å; D111-T114 PolarHBondContact O-N 2.83Å; D111-T114 VanDerWaalsContact O-N 3.12Å; T114-L117 PolarHBondContact O-N 2.94Å; T114-T118 WeakPolarHBondContact O-CB 3.47Å; T114-T118 PolarHBondContact O-N 2.96Å; T114-T118 PolarHBondContact O-OG1 3.48Å
115Q90.4Very high91.4Very high132 Ų13277.5 Ų77.562%0.61741%0.41SS*.Hα-helixtrans-64-42.9174.2-71.1-66-22.500110.9D111 V112 K113 T118 L119D111-Q115 WeakPolarHBondContact O-CB 3.27Å; D111-Q115 WeakPolarHBondContact O-CG 3.33Å; D111-Q115 PolarHBondContact O-N 3.49Å; V112-Q115 PolarHBondContact O-N 2.88Å; K113-Q115 PolarHBondContact O-N 3.31Å; Q115-T118 PolarHBondContact O-N 3.41Å; Q115-L119 WeakPolarHBondContact O-CB 3.41Å; Q115-L119 PolarHBondContact O-N 2.79Å
116F89.7Confident91Very high61 Ų6177.2 Ų77.227%0.26840%0.4SS..Hα-helixtrans-60.8-47173.8177.8-96.7000112V112 K113 T118 L119 V120 V183 I184V112-F116 WeakPolarHBondContact O-CB 3.29Å; V112-F116 PolarHBondContact O-N 3.39Å; K113-F116 WeakPolarHBondContact O-CB 3.36Å; K113-F116 PolarHBondContact O-N 2.8Å; F116-T118 VanDerWaalsContact C-N 3.32Å; F116-T118 PolarHBondContact O-N 2.89Å; F116-L119 WeakPolarHBondContact O-CB 3.43Å; F116-L119 PolarHBondContact O-N 3.41Å; F116-V120 HydrophobicContact CD1-CG2 4.36Å; F116-V120 HydrophobicContact CE1-CG2 3.83Å; F116-V120 HydrophobicContact CE2-CG2 4.15Å; F116-V120 HydrophobicContact CZ-CG2 3.69Å; F116-V120 WeakPolarHBondContact O-CG2 3.49Å; F116-V120 PolarHBondContact O-N 3.38Å; F116-V183 HydrophobicContact CE1-CB 4.47Å; F116-V183 HydrophobicContact CE1-CG1 4.27Å; F116-V183 HydrophobicContact CE2-CG1 4.31Å; F116-V183 HydrophobicContact CZ-CB 4.05Å; F116-V183 HydrophobicContact CZ-CG1 3.53Å; F116-I184 HydrophobicContact CD1-CD1 4.3Å; F116-I184 HydrophobicContact CD1-CG1 4.22Å; F116-I184 HydrophobicContact CE1-CD1 4.42Å; F116-I184 HydrophobicContact CE1-CG1 4.07Å
117L91.3Very high90.9Very high44 Ų4474.8 Ų74.823%0.2338%0.376CS..Hα-helixtrans-60.2-42.3176.6-67.5179.7000112K113 T114 L119 V120 R121 I184K113-L117 HydrophobicContact CG-CD1 4.48Å; K113-L117 WeakPolarHBondContact O-CG 3.48Å; K113-L117 PolarHBondContact O-N 2.94Å; T114-L117 PolarHBondContact O-N 2.94Å; L117-L119 VanDerWaalsContact C-N 3.35Å; L117-V120 PolarHBondContact O-N 3.31Å; L117-R121 VanDerWaalsContact O-CB 3.31Å; L117-R121 WeakPolarHBondContact O-CB 3.25Å; L117-R121 PolarHBondContact O-N 3.21Å; L117-I184 HydrophobicContact CD2-CD1 4.11Å
118T90.8Very high90.4Very high67 Ų6773 Ų7341%0.41137%0.369SS..Hα-helixtrans-61.3-44.6175.9-58.40000110.9T114 Q115 F116 V120 R121 S122T114-T118 WeakPolarHBondContact O-CB 3.47Å; T114-T118 PolarHBondContact O-N 2.96Å; T114-T118 PolarHBondContact O-OG1 3.48Å; Q115-T118 PolarHBondContact O-N 3.41Å; F116-T118 VanDerWaalsContact C-N 3.32Å; F116-T118 PolarHBondContact O-N 2.89Å; T118-V120 PolarHBondContact O-N 3.06Å; T118-R121 PolarHBondContact O-N 3.05Å; T118-S122 WeakPolarHBondContact O-CB 3.49Å; T118-S122 PolarHBondContact O-N 3.29Å; T118-S122 PolarHBondContact O-OG 3.34Å
119L87.9Confident89.9Confident67 Ų6776.2 Ų76.235%0.35138%0.38SS..Hα-helixtrans-60.4-45.8177.9176.663.9000112.5N50 Q115 F116 L117 S122 S123N50-L119 HydrophobicContact CB-CD1 3.4Å; N50-L119 VanDerWaalsContact ND2-CD1 3.3Å; N50-L119 WeakPolarHBondContact ND2-CD1 3.45Å; Q115-L119 WeakPolarHBondContact O-CB 3.41Å; Q115-L119 PolarHBondContact O-N 2.79Å; F116-L119 WeakPolarHBondContact O-CB 3.43Å; F116-L119 PolarHBondContact O-N 3.41Å; L117-L119 VanDerWaalsContact C-N 3.35Å; L119-S122 PolarHBondContact O-N 3.48Å; L119-S123 PolarHBondContact O-N 2.96Å; L119-S123 PolarHBondContact O-OG 2.97Å
120V90.3Very high89.2Confident20 Ų2068.2 Ų68.212%0.12135%0.35CS..Hα-helixtrans-65.1-42.7177-179.60000110.4F116 L117 T118 S122 S123 V124 S180F116-V120 HydrophobicContact CD1-CG2 4.36Å; F116-V120 HydrophobicContact CE1-CG2 3.83Å; F116-V120 HydrophobicContact CE2-CG2 4.15Å; F116-V120 HydrophobicContact CZ-CG2 3.69Å; F116-V120 WeakPolarHBondContact O-CG2 3.49Å; F116-V120 PolarHBondContact O-N 3.38Å; L117-V120 PolarHBondContact O-N 3.31Å; T118-V120 PolarHBondContact O-N 3.06Å; V120-S122 PolarHBondContact O-N 2.92Å; V120-S123 WeakPolarHBondContact O-CB 3.35Å; V120-S123 PolarHBondContact O-N 3.42Å; V120-V124 WeakPolarHBondContact O-CG2 3.39Å; V120-V124 PolarHBondContact O-N 3.23Å; V120-S180 WeakPolarHBondContact CB-OG 3.36Å; V120-S180 WeakPolarHBondContact CG1-OG 3.24Å
121R91.3Very high88.7Confident151 Ų15165.7 Ų65.757%0.5735%0.345SS*.Hα-helixtrans-61.9-43.9177.3-172174.9-177.71570.1112.5L117 T118 S123 V124 S125 E150L117-R121 VanDerWaalsContact O-CB 3.31Å; L117-R121 WeakPolarHBondContact O-CB 3.25Å; L117-R121 PolarHBondContact O-N 3.21Å; T118-R121 PolarHBondContact O-N 3.05Å; R121-S123 VanDerWaalsContact C-N 3.32Å; R121-S123 PolarHBondContact O-N 2.96Å; R121-V124 PolarHBondContact O-N 2.72Å; R121-S125 PolarHBondContact O-N 2.85Å; R121-E150 IonicContact NH1-OE2 2.84Å
122S88Confident87.9Confident42 Ų4263.9 Ų63.929%0.29434%0.335SS..Hα-helixtrans-60.3-43.2173.7-68.90000111.3T118 L119 V120 V124 S125 E126T118-S122 WeakPolarHBondContact O-CB 3.49Å; T118-S122 PolarHBondContact O-N 3.29Å; T118-S122 PolarHBondContact O-OG 3.34Å; L119-S122 PolarHBondContact O-N 3.48Å; V120-S122 PolarHBondContact O-N 2.92Å; S122-V124 VanDerWaalsContact C-N 3.34Å; S122-V124 PolarHBondContact O-N 3.49Å; S122-S125 PolarHBondContact O-N 2.77Å; S122-S125 PolarHBondContact O-OG 3.3Å; S122-E126 PolarHBondContact O-N 3.47Å; S122-E126 VanDerWaalsContact O-N 3.1Å
123S88.1Confident87.6Confident16 Ų1660 Ų6011%0.11231%0.312CS..Hα-helixtrans-60.2-43.7176.3-56.80000111.7L119 V120 R121 S125 E126 Y127 I133 L137L119-S123 PolarHBondContact O-N 2.96Å; L119-S123 PolarHBondContact O-OG 2.97Å; V120-S123 WeakPolarHBondContact O-CB 3.35Å; V120-S123 PolarHBondContact O-N 3.42Å; R121-S123 VanDerWaalsContact C-N 3.32Å; R121-S123 PolarHBondContact O-N 2.96Å; S123-S125 VanDerWaalsContact C-N 3.35Å; S123-S125 PolarHBondContact O-N 3.25Å; S123-E126 PolarHBondContact O-N 3.03Å; S123-Y127 PolarHBondContact O-N 3.46Å; S123-I133 WeakPolarHBondContact O-CG2 3.34Å; S123-L137 WeakPolarHBondContact O-CD1 3.19Å
124V91.1Very high87.5Confident3 Ų359.2 Ų59.22%0.01831%0.308CS..Hα-helixtrans-63.8-40.1176.5171.50000111.4V120 R121 S122 E126 Y127 L137 D154 Y155V120-V124 WeakPolarHBondContact O-CG2 3.39Å; V120-V124 PolarHBondContact O-N 3.23Å; R121-V124 PolarHBondContact O-N 2.72Å; S122-V124 VanDerWaalsContact C-N 3.34Å; S122-V124 PolarHBondContact O-N 3.49Å; V124-E126 PolarHBondContact O-N 3.32Å; V124-Y127 WeakPolarHBondContact O-CB 3.29Å; V124-Y127 PolarHBondContact O-N 3.42Å; V124-Y127 VanDerWaalsContact O-N 3.12Å; V124-L137 HydrophobicContact CG2-CD1 4.14Å; V124-D154 HydrophobicContact CG1-CB 3.95Å; V124-Y155 HydrophobicContact CG1-CD1 4.11Å; V124-Y155 HydrophobicContact CG1-CE1 3.75Å; V124-Y155 HydrophobicContact CG1-CE2 4.41Å
125S89.2Confident87.2Confident45 Ų4561.7 Ų61.732%0.31531%0.312SS..Hα-helixtrans-62.9-31.2177.3770000113.1R121 S122 S123 Q160R121-S125 PolarHBondContact O-N 2.85Å; S122-S125 PolarHBondContact O-N 2.77Å; S122-S125 PolarHBondContact O-OG 3.3Å; S123-S125 VanDerWaalsContact C-N 3.35Å; S123-S125 PolarHBondContact O-N 3.25Å; S125-Q160 PolarHBondContact O-NE2 3.11Å; S125-Q160 VanDerWaalsContact O-NE2 3.07Å
126E85.7Confident87Confident44 Ų4461 Ų6121%0.20631%0.308CS..THydrogen-bonded Turntrans-89.10.2178.2-70.4-62.3124.500113.7S122 S123 V124 S128 K129 N130 I133S122-E126 PolarHBondContact O-N 3.47Å; S122-E126 VanDerWaalsContact O-N 3.1Å; S123-E126 PolarHBondContact O-N 3.03Å; V124-E126 PolarHBondContact O-N 3.32Å; E126-S128 PolarHBondContact O-N 2.91Å; E126-K129 PolarHBondContact O-N 3.19Å; E126-K129 VanDerWaalsContact OE1-CD 3.28Å; E126-K129 WeakPolarHBondContact OE1-CD 3.46Å; E126-K129 IonicContact OE1-NZ 3.9Å; E126-K129 PolarHBondContact OE1-NZ 2.97Å; E126-K129 WeakPolarHBondContact OE2-CD 3.47Å; E126-N130 PolarHBondContact O-N 2.86Å; E126-I133 HydrophobicContact CB-CD1 3.74Å
127Y88.9Confident87.1Confident15 Ų1558.3 Ų58.36%0.05930%0.296CS..THydrogen-bonded Turntrans-50.6-51.7-176.7176.9-89.6000113.2S123 V124 K129 K134 L137 D138 Y155 P163S123-Y127 PolarHBondContact O-N 3.46Å; V124-Y127 WeakPolarHBondContact O-CB 3.29Å; V124-Y127 PolarHBondContact O-N 3.42Å; V124-Y127 VanDerWaalsContact O-N 3.12Å; Y127-K129 VanDerWaalsContact C-N 3.31Å; Y127-K129 PolarHBondContact O-N 3.43Å; Y127-K134 HydrophobicContact CD2-CB 4.35Å; Y127-K134 HydrophobicContact CD2-CG 4.45Å; Y127-K134 HydrophobicContact CE1-CD 4.26Å; Y127-K134 HydrophobicContact CE1-CG 4.24Å; Y127-K134 HydrophobicContact CE2-CB 4.15Å; Y127-K134 HydrophobicContact CE2-CG 3.79Å; Y127-K134 WeakPolarHBondContact OH-CE 3.42Å; Y127-L137 HydrophobicContact CD2-CB 3.93Å; Y127-L137 HydrophobicContact CD2-CD1 3.83Å; Y127-L137 HydrophobicContact CE2-CB 4.21Å; Y127-D138 VanDerWaalsContact CE2-OD1 3.29Å; Y127-D138 WeakPolarHBondContact CE2-OD1 3.39Å; Y127-D138 PolarHBondContact OH-OD1 3.37Å; Y127-D138 PolarHBondContact OH-OD2 3.19Å; Y127-Y155 AromaticContact CD1-CE1 3.87Å; Y127-Y155 HydrophobicContact CD1-CE1 3.87Å; Y127-Y155 HydrophobicContact CD2-CE1 4.04Å; Y127-Y155 AromaticContact CG-CE1 3.6Å; Y127-Y155 HydrophobicContact CG-CE1 3.6Å; Y127-P163 HydrophobicContact CD1-CG 4.18Å; Y127-P163 HydrophobicContact CD2-CG 4.49Å; Y127-P163 HydrophobicContact CE1-CB 4.24Å; Y127-P163 HydrophobicContact CE1-CG 3.54Å; Y127-P163 HydrophobicContact CE2-CB 4.36Å; Y127-P163 HydrophobicContact CE2-CG 3.88Å; Y127-P163 WeakPolarHBondContact OH-CB 3.41Å
128S86.9Confident87.2Confident75 Ų7557.9 Ų57.952%0.52429%0.294SS..THydrogen-bonded Turntrans-75.6-17.8-177.8-65.10000114.2E126 Q160E126-S128 PolarHBondContact O-N 2.91Å; S128-Q160 PolarHBondContact OG-OE1 2.79Å
129K84.8Confident87.3Confident148 Ų14861.1 Ų61.164%0.64330%0.302SS*.THydrogen-bonded Turntrans-90.7-25.9-176-65.2168.6-177.2175.20112E126 Y127E126-K129 PolarHBondContact O-N 3.19Å; E126-K129 VanDerWaalsContact OE1-CD 3.28Å; E126-K129 WeakPolarHBondContact OE1-CD 3.46Å; E126-K129 IonicContact OE1-NZ 3.9Å; E126-K129 PolarHBondContact OE1-NZ 2.97Å; E126-K129 WeakPolarHBondContact OE2-CD 3.47Å; Y127-K129 VanDerWaalsContact C-N 3.31Å; Y127-K129 PolarHBondContact O-N 3.43Å
130N78Confident87.6Confident4 Ų459.3 Ų59.32%0.02129%0.293CS..  trans-126.8117.8-169.5-173.8-54.3000112.6G46 I47 E126 D132 I133 K134G46-N130 PolarHBondContact O-ND2 2.8Å; I47-N130 WeakPolarHBondContact CA-ND2 3.19Å; I47-N130 WeakPolarHBondContact CG1-ND2 3.27Å; E126-N130 PolarHBondContact O-N 2.86Å; N130-D132 PolarHBondContact O-N 3.24Å; N130-D132 WeakPolarHBondContact OD1-CA 3.35Å; N130-D132 WeakPolarHBondContact OD1-CB 3.4Å; N130-D132 PolarHBondContact OD1-N 2.86Å; N130-I133 HydrophobicContact CB-CB 3.93Å; N130-I133 HydrophobicContact CB-CD1 3.79Å; N130-I133 HydrophobicContact CB-CG1 3.97Å; N130-I133 PolarHBondContact O-N 3.27Å; N130-I133 PolarHBondContact OD1-N 2.88Å; N130-K134 VanDerWaalsContact O-CB 3.25Å; N130-K134 WeakPolarHBondContact O-CB 3.47Å; N130-K134 PolarHBondContact O-N 3.12Å
131P82.2Confident87.9Confident82 Ų8258.4 Ų58.453%0.53229%0.287SS..Hα-helixtrans-67.4-29.7-177.327.4-34.6000114.1K135P131-K135 WeakPolarHBondContact O-CB 3.46Å; P131-K135 PolarHBondContact O-N 2.91Å
132D77.4Confident88.1Confident53 Ų5356.4 Ų56.428%0.28328%0.284SS..Hα-helixtrans-77.4-42.2177.7-74.5-40.3000112S44 I47 N130 K134 K135 F136S44-D132 WeakPolarHBondContact CB-OD2 3.36Å; S44-D132 VanDerWaalsContact OG-CG 3.32Å; S44-D132 PolarHBondContact OG-OD2 3.36Å; I47-D132 WeakPolarHBondContact CD1-OD2 3.45Å; N130-D132 PolarHBondContact O-N 3.24Å; N130-D132 WeakPolarHBondContact OD1-CA 3.35Å; N130-D132 WeakPolarHBondContact OD1-CB 3.4Å; N130-D132 PolarHBondContact OD1-N 2.86Å; D132-K134 VanDerWaalsContact C-N 3.29Å; D132-K135 PolarHBondContact O-N 3.47Å; D132-F136 VanDerWaalsContact O-CB 3.3Å; D132-F136 WeakPolarHBondContact O-CB 3.37Å; D132-F136 PolarHBondContact O-N 2.86Å
133I83.5Confident88.4Confident1 Ų162 Ų621%0.00531%0.306CS..Hα-helixtrans-61.6-43.7171.9-65.1175.3000109.2D48 I51 S123 E126 N130 K135 F136 L137D48-I133 HydrophobicContact CB-CD1 3.62Å; I51-I133 HydrophobicContact CD1-CD1 4.39Å; I51-I133 HydrophobicContact CD1-CG1 3.64Å; S123-I133 WeakPolarHBondContact O-CG2 3.34Å; E126-I133 HydrophobicContact CB-CD1 3.74Å; N130-I133 HydrophobicContact CB-CB 3.93Å; N130-I133 HydrophobicContact CB-CD1 3.79Å; N130-I133 HydrophobicContact CB-CG1 3.97Å; N130-I133 PolarHBondContact O-N 3.27Å; N130-I133 PolarHBondContact OD1-N 2.88Å; I133-K135 PolarHBondContact O-N 3.15Å; I133-F136 PolarHBondContact O-N 3.43Å; I133-L137 HydrophobicContact CG2-CD1 3.71Å; I133-L137 HydrophobicContact CG2-CG 4.11Å; I133-L137 VanDerWaalsContact O-CB 3.28Å; I133-L137 WeakPolarHBondContact O-CB 3.23Å; I133-L137 WeakPolarHBondContact O-CG 3.4Å; I133-L137 PolarHBondContact O-N 3.36Å
134K88.6Confident88.7Confident94 Ų9464 Ų6441%0.40931%0.313SS..Hα-helixtrans-54.5-52171.9174.6167.4-176.3-178.90111.6Y127 N130 D132 F136 L137 D138Y127-K134 HydrophobicContact CD2-CB 4.35Å; Y127-K134 HydrophobicContact CD2-CG 4.45Å; Y127-K134 HydrophobicContact CE1-CD 4.26Å; Y127-K134 HydrophobicContact CE1-CG 4.24Å; Y127-K134 HydrophobicContact CE2-CB 4.15Å; Y127-K134 HydrophobicContact CE2-CG 3.79Å; Y127-K134 WeakPolarHBondContact OH-CE 3.42Å; N130-K134 VanDerWaalsContact O-CB 3.25Å; N130-K134 WeakPolarHBondContact O-CB 3.47Å; N130-K134 PolarHBondContact O-N 3.12Å; D132-K134 VanDerWaalsContact C-N 3.29Å; K134-F136 VanDerWaalsContact C-N 3.35Å; K134-F136 PolarHBondContact O-N 2.96Å; K134-L137 PolarHBondContact O-N 2.89Å; K134-D138 WeakPolarHBondContact CG-OD2 3.37Å; K134-D138 WeakPolarHBondContact O-CB 3.23Å; K134-D138 PolarHBondContact O-N 3.44Å
135K86.8Confident89Confident131 Ų13169 Ų6957%0.5734%0.336SS*.Hα-helixtrans-63.5-39.2-179.6-173.3179.2-176.9179.50112.5P131 D132 I133 K139P131-K135 WeakPolarHBondContact O-CB 3.46Å; P131-K135 PolarHBondContact O-N 2.91Å; D132-K135 PolarHBondContact O-N 3.47Å; I133-K135 PolarHBondContact O-N 3.15Å; K135-K139 WeakPolarHBondContact O-CG 3.3Å; K135-K139 PolarHBondContact O-N 3.39Å; K135-K139 VanDerWaalsContact O-N 3.15Å
136F86.3Confident89.3Confident119 Ų11966.9 Ų66.952%0.52232%0.321SS..Hα-helixtrans-66.4-50.7176.4173.8-102.8000111.2D132 I133 K134 K139 L140D132-F136 VanDerWaalsContact O-CB 3.3Å; D132-F136 WeakPolarHBondContact O-CB 3.37Å; D132-F136 PolarHBondContact O-N 2.86Å; I133-F136 PolarHBondContact O-N 3.43Å; K134-F136 VanDerWaalsContact C-N 3.35Å; K134-F136 PolarHBondContact O-N 2.96Å; F136-K139 PolarHBondContact O-N 3.25Å; F136-L140 HydrophobicContact CE1-CD1 3.8Å; F136-L140 HydrophobicContact CZ-CD1 3.75Å; F136-L140 WeakPolarHBondContact O-CB 3.22Å; F136-L140 PolarHBondContact O-N 2.71Å
137L91.4Very high89.9Confident3 Ų364.8 Ų64.82%0.01631%0.311CS..Hα-helixtrans-65.2-38.4177.4-73.3179.7000111.9S123 V124 Y127 I133 K134 K139 L140 Q141S123-L137 WeakPolarHBondContact O-CD1 3.19Å; V124-L137 HydrophobicContact CG2-CD1 4.14Å; Y127-L137 HydrophobicContact CD2-CB 3.93Å; Y127-L137 HydrophobicContact CD2-CD1 3.83Å; Y127-L137 HydrophobicContact CE2-CB 4.21Å; I133-L137 HydrophobicContact CG2-CD1 3.71Å; I133-L137 HydrophobicContact CG2-CG 4.11Å; I133-L137 VanDerWaalsContact O-CB 3.28Å; I133-L137 WeakPolarHBondContact O-CB 3.23Å; I133-L137 WeakPolarHBondContact O-CG 3.4Å; I133-L137 PolarHBondContact O-N 3.36Å; K134-L137 PolarHBondContact O-N 2.89Å; L137-K139 VanDerWaalsContact C-N 3.32Å; L137-K139 PolarHBondContact O-N 3.46Å; L137-L140 PolarHBondContact O-N 2.83Å; L137-Q141 VanDerWaalsContact O-CB 3.23Å; L137-Q141 WeakPolarHBondContact O-CB 3.17Å; L137-Q141 WeakPolarHBondContact O-CG 3.39Å; L137-Q141 PolarHBondContact O-N 3.3Å
138D94.4Very high90.2Very high35 Ų3564.1 Ų64.119%0.18731%0.308CS..Hα-helixtrans-59.8-44.8175.6-77.3-19.6000111Y127 K134 Q142 S165Y127-D138 VanDerWaalsContact CE2-OD1 3.29Å; Y127-D138 WeakPolarHBondContact CE2-OD1 3.39Å; Y127-D138 PolarHBondContact OH-OD1 3.37Å; Y127-D138 PolarHBondContact OH-OD2 3.19Å; K134-D138 WeakPolarHBondContact CG-OD2 3.37Å; K134-D138 WeakPolarHBondContact O-CB 3.23Å; K134-D138 PolarHBondContact O-N 3.44Å; D138-Q142 WeakPolarHBondContact O-CB 2.95Å; D138-Q142 VanDerWaalsContact O-CG 3.29Å; D138-Q142 WeakPolarHBondContact O-CG 3.42Å; D138-Q142 PolarHBondContact O-N 2.91Å; D138-Q142 VanDerWaalsContact O-N 3.11Å; D138-S165 WeakPolarHBondContact O-CB 3.08Å; D138-S165 VanDerWaalsContact OD1-CB 3.26Å; D138-S165 WeakPolarHBondContact OD1-CB 3.32Å; D138-S165 PolarHBondContact OD1-OG 3.05Å
139K92.5Very high90.6Very high135 Ų13560.6 Ų60.659%0.58728%0.284SS*.Hα-helixtrans-65-46.1174.2-77.3-175.2174.2-166.50112K135 F136 L137 Q141 Q142 E143K135-K139 WeakPolarHBondContact O-CG 3.3Å; K135-K139 PolarHBondContact O-N 3.39Å; K135-K139 VanDerWaalsContact O-N 3.15Å; F136-K139 PolarHBondContact O-N 3.25Å; L137-K139 VanDerWaalsContact C-N 3.32Å; L137-K139 PolarHBondContact O-N 3.46Å; K139-Q141 VanDerWaalsContact C-N 3.34Å; K139-Q141 PolarHBondContact O-N 2.81Å; K139-Q142 PolarHBondContact O-N 3.36Å; K139-E143 VanDerWaalsContact O-CB 3.23Å; K139-E143 WeakPolarHBondContact O-CB 3.36Å; K139-E143 PolarHBondContact O-N 2.94Å
140L94Very high91Very high30 Ų3058.5 Ų58.516%0.15728%0.276CS..Hα-helixtrans-61.3-44.8-178.9-168.4153.7000110.8F136 L137 E143 F144 C179 V183F136-L140 HydrophobicContact CE1-CD1 3.8Å; F136-L140 HydrophobicContact CZ-CD1 3.75Å; F136-L140 WeakPolarHBondContact O-CB 3.22Å; F136-L140 PolarHBondContact O-N 2.71Å; L137-L140 PolarHBondContact O-N 2.83Å; L140-E143 PolarHBondContact O-N 3Å; L140-F144 HydrophobicContact CD2-CD2 4.35Å; L140-F144 HydrophobicContact CG-CD2 4.07Å; L140-F144 WeakPolarHBondContact O-CB 3.38Å; L140-F144 WeakPolarHBondContact O-CD2 3.4Å; L140-F144 PolarHBondContact O-N 3.33Å; L140-C179 HydrophobicContact CD2-CB 3.51Å; L140-C179 VanDerWaalsContact CD2-SG 3.57Å; L140-V183 HydrophobicContact CD1-CG2 4.5Å; L140-V183 HydrophobicContact CD2-CG2 4.29Å
141Q96.4Very high91.9Very high0 Ų059.8 Ų59.80%029%0.286CS..Hα-helixtrans-63.9-41.3178.6-73177159.500112.6L137 K139 Q145 C146 G148 Y155 S165 C166L137-Q141 VanDerWaalsContact O-CB 3.23Å; L137-Q141 WeakPolarHBondContact O-CB 3.17Å; L137-Q141 WeakPolarHBondContact O-CG 3.39Å; L137-Q141 PolarHBondContact O-N 3.3Å; K139-Q141 VanDerWaalsContact C-N 3.34Å; K139-Q141 PolarHBondContact O-N 2.81Å; Q141-Q145 WeakPolarHBondContact O-CA 3.4Å; Q141-Q145 PolarHBondContact O-N 2.89Å; Q141-C146 WeakPolarHBondContact CA-O 3.38Å; Q141-C146 VanDerWaalsContact CB-O 3.26Å; Q141-C146 WeakPolarHBondContact CB-O 3.39Å; Q141-C146 WeakPolarHBondContact CG-O 3.44Å; Q141-C146 PolarHBondContact O-N 3.48Å; Q141-C146 VanDerWaalsContact O-N 3.07Å; Q141-G148 VanDerWaalsContact OE1-N 3.16Å; Q141-Y155 VanDerWaalsContact OE1-CE2 3.3Å; Q141-Y155 PolarHBondContact OE1-OH 3.23Å; Q141-S165 PolarHBondContact NE2-OG 3.48Å; Q141-C166 PolarHBondContact NE2-SG 2.97Å; Q141-C166 VanDerWaalsContact NE2-SG 3.38Å; Q141-C166 PolarHBondContact OE1-SG 3.07Å; Q141-C166 VanDerWaalsContact OE1-SG 3.41Å
142Q95.5Very high92.4Very high110 Ų11056.9 Ų56.951%0.51427%0.268SS..Hα-helixtrans-69-45.6175.9-73.4174.6-0.400112.2D138 K139D138-Q142 WeakPolarHBondContact O-CB 2.95Å; D138-Q142 VanDerWaalsContact O-CG 3.29Å; D138-Q142 WeakPolarHBondContact O-CG 3.42Å; D138-Q142 PolarHBondContact O-N 2.91Å; D138-Q142 VanDerWaalsContact O-N 3.11Å; K139-Q142 PolarHBondContact O-N 3.36Å
143E94.3Very high93.2Very high159 Ų15958.9 Ų58.974%0.74328%0.278SS*.Hα-helixtrans-67.4-44.7-176.7-170.468.3-153.500111.7K139 L140K139-E143 VanDerWaalsContact O-CB 3.23Å; K139-E143 WeakPolarHBondContact O-CB 3.36Å; K139-E143 PolarHBondContact O-N 2.94Å; L140-E143 PolarHBondContact O-N 3Å
144F95.2Very high93.6Very high58 Ų5860.1 Ų60.125%0.25429%0.285SS..Hα-helixtrans-93.20.3-178.4-72.3-87.7000113.9L140 C146 K182 F186L140-F144 HydrophobicContact CD2-CD2 4.35Å; L140-F144 HydrophobicContact CG-CD2 4.07Å; L140-F144 WeakPolarHBondContact O-CB 3.38Å; L140-F144 WeakPolarHBondContact O-CD2 3.4Å; L140-F144 PolarHBondContact O-N 3.33Å; F144-C146 VanDerWaalsContact C-N 3.33Å; F144-C146 HydrophobicContact CB-CB 4.5Å; F144-C146 PolarHBondContact O-N 3.1Å; F144-K182 HydrophobicContact CB-CB 4.2Å; F144-K182 HydrophobicContact CD1-CB 4.43Å; F144-F186 HydrophobicContact CE1-CB 3.8Å; F144-F186 HydrophobicContact CE1-CD1 4.39Å; F144-F186 AromaticContact CE1-CD2 3.69Å; F144-F186 HydrophobicContact CE1-CD2 3.69Å; F144-F186 HydrophobicContact CE1-CE2 4.33Å; F144-F186 AromaticContact CE1-CG 3.72Å; F144-F186 HydrophobicContact CE1-CG 3.72Å; F144-F186 HydrophobicContact CZ-CD2 4.31Å; F144-F186 HydrophobicContact CZ-CG 4.29Å
145Q96.3Very high93.9Very high109 Ų10955.6 Ų55.651%0.50927%0.265SS..THydrogen-bonded Turntrans50.453.7-179.4-60-176.6-28.800111.6Q141 Y175Q141-Q145 WeakPolarHBondContact O-CA 3.4Å; Q141-Q145 PolarHBondContact O-N 2.89Å; Q145-Y175 VanDerWaalsContact C-CG 3.41Å; Q145-Y175 HydrophobicContact CB-CD1 3.9Å; Q145-Y175 HydrophobicContact CB-CE1 3.6Å; Q145-Y175 HydrophobicContact CB-CE2 4.39Å; Q145-Y175 HydrophobicContact CB-CG 4.4Å; Q145-Y175 HydrophobicContact CG-CE1 4.01Å
146C97.1Very high94.1Very high0 Ų052.6 Ų52.60%026%0.258CS..  trans-133.7166.6-173.864.60000111Q141 F144 D177 C179 K182Q141-C146 WeakPolarHBondContact CA-O 3.38Å; Q141-C146 VanDerWaalsContact CB-O 3.26Å; Q141-C146 WeakPolarHBondContact CB-O 3.39Å; Q141-C146 WeakPolarHBondContact CG-O 3.44Å; Q141-C146 PolarHBondContact O-N 3.48Å; Q141-C146 VanDerWaalsContact O-N 3.07Å; F144-C146 VanDerWaalsContact C-N 3.33Å; F144-C146 HydrophobicContact CB-CB 4.5Å; F144-C146 PolarHBondContact O-N 3.1Å; C146-D177 CarbonylContact C-O 3.59Å; C146-D177 WeakPolarHBondContact CA-O 3.32Å; C146-D177 WeakPolarHBondContact CB-O 3.2Å; C146-C179 VanDerWaalsContact C-SG 3.59Å; C146-C179 HydrophobicContact CB-CB 3.9Å; C146-C179 WeakPolarHBondContact CB-SG 3.47Å; C146-C179 WeakPolarHBondContact SG-CA 3.22Å; C146-C179 WeakPolarHBondContact SG-CB 3.46Å; C146-C179 CovalentContact SG-SG 2.04Å; C146-C179 PolarHBondContact SG-SG 3.25Å; C146-K182 HydrophobicContact CB-CB 4.33Å; C146-K182 HydrophobicContact CB-CG 3.92Å
147C97Very high94.3Very high0 Ų051.7 Ų51.70%027%0.266CS..  trans-142.3131.4175.9-168.50000112.3S151 S152 C166 Y175 D177C147-S151 CarbonylContact O-C 3.37Å; C147-S151 WeakPolarHBondContact O-CA 3.23Å; C147-S152 PolarHBondContact O-N 3.26Å; C147-S152 VanDerWaalsContact SG-CB 3.58Å; C147-C166 WeakPolarHBondContact CA-SG 3.12Å; C147-C166 HydrophobicContact CB-CB 3.58Å; C147-C166 WeakPolarHBondContact CB-SG 3.45Å; C147-C166 WeakPolarHBondContact SG-CB 3.38Å; C147-C166 CovalentContact SG-SG 2.04Å; C147-C166 PolarHBondContact SG-SG 2.04Å; C147-Y175 WeakPolarHBondContact CB-O 3.32Å; C147-D177 PolarHBondContact N-O 2.88Å
148G95.5Very high94Very high0 Ų054.7 Ų54.70%029%0.288CS..SBendtrans67.2-166.1-179.100000112.5Q141 C179Q141-G148 VanDerWaalsContact OE1-N 3.16Å; G148-C179 WeakPolarHBondContact O-CB 3.35Å; G148-C179 PolarHBondContact O-N 3.01Å; G148-C179 PolarHBondContact O-SG 2.94Å
149S94.5Very high93.7Very high1 Ų156.6 Ų56.61%0.00732%0.315CS..SBendtrans-81.2-59.3178.2-179.20000109.8D154 G178 C179 S180S149-D154 WeakPolarHBondContact CA-OD2 3.26Å; S149-D154 WeakPolarHBondContact CB-OD2 3.29Å; S149-D154 PolarHBondContact N-OD2 3.47Å; S149-G178 CarbonylContact O-C 3.07Å; S149-G178 VanDerWaalsContact O-C 3.3Å; S149-G178 WeakPolarHBondContact O-CA 3.44Å; S149-C179 PolarHBondContact O-N 2.95Å; S149-C179 VanDerWaalsContact O-N 3.12Å; S149-S180 WeakPolarHBondContact O-CB 3.48Å; S149-S180 PolarHBondContact O-N 3.36Å; S149-S180 PolarHBondContact O-OG 3.01Å; S149-S180 PolarHBondContact OG-OG 2.89Å
150E95.1Very high93.6Very high104 Ų10451.4 Ų51.449%0.48629%0.293SS..SBendtrans-105.5-32.4-179.5-61.7-174.381.900111.2R121 D154 G178R121-E150 IonicContact NH1-OE2 2.84Å; E150-D154 PolarHBondContact N-OD2 3.44Å; E150-G178 WeakPolarHBondContact O-CA 3.18Å; E150-G178 PolarHBondContact O-N 3.12Å
151S95.1Very high93.5Very high31 Ų3155.7 Ų55.722%0.21732%0.32CS..  trans-162.8171.117670.40000112.7C147 N153 D154C147-S151 CarbonylContact O-C 3.37Å; C147-S151 WeakPolarHBondContact O-CA 3.23Å; S151-N153 PolarHBondContact O-N 3.45Å; S151-N153 VanDerWaalsContact O-N 3.09Å; S151-N153 WeakPolarHBondContact OG-CB 3.3Å; S151-N153 PolarHBondContact OG-N 3.44Å; S151-D154 PolarHBondContact N-OD2 3.44Å; S151-D154 WeakPolarHBondContact O-CB 3.48Å; S151-D154 PolarHBondContact O-N 2.92Å; S151-D154 VanDerWaalsContact O-N 3.09Å
152S93.4Very high93.4Very high22 Ų2257.9 Ų57.915%0.15433%0.332CS..THydrogen-bonded Turntrans-58.9-20.5171.662.60000114C147 D154 Y155C147-S152 PolarHBondContact O-N 3.26Å; C147-S152 VanDerWaalsContact SG-CB 3.58Å; S152-D154 PolarHBondContact O-N 3.01Å; S152-Y155 PolarHBondContact O-N 3.32Å
153N93.4Very high93.4Very high95 Ų9553 Ų5351%0.50831%0.309SS..Hα-helixtrans-69.9-14.5178.2-66.2-24.9000112.8S151 Y155 T156 S157S151-N153 PolarHBondContact O-N 3.45Å; S151-N153 VanDerWaalsContact O-N 3.09Å; S151-N153 WeakPolarHBondContact OG-CB 3.3Å; S151-N153 PolarHBondContact OG-N 3.44Å; N153-Y155 PolarHBondContact O-N 2.8Å; N153-T156 WeakPolarHBondContact CA-OG1 3.32Å; N153-T156 PolarHBondContact O-N 2.98Å; N153-T156 PolarHBondContact O-OG1 2.95Å; N153-T156 VanDerWaalsContact O-OG1 3.13Å; N153-S157 WeakPolarHBondContact O-CB 3.49Å; N153-S157 PolarHBondContact O-N 3.43Å; N153-S157 PolarHBondContact O-OG 3.33Å
154D93.4Very high93.4Very high26 Ų2651.2 Ų51.214%0.13931%0.305CS..Hα-helixtrans-63.6-34.4178.9-63.3-16.9000111.6V124 S149 E150 S151 S152 S158V124-D154 HydrophobicContact CG1-CB 3.95Å; S149-D154 WeakPolarHBondContact CA-OD2 3.26Å; S149-D154 WeakPolarHBondContact CB-OD2 3.29Å; S149-D154 PolarHBondContact N-OD2 3.47Å; E150-D154 PolarHBondContact N-OD2 3.44Å; S151-D154 PolarHBondContact N-OD2 3.44Å; S151-D154 WeakPolarHBondContact O-CB 3.48Å; S151-D154 PolarHBondContact O-N 2.92Å; S151-D154 VanDerWaalsContact O-N 3.09Å; S152-D154 PolarHBondContact O-N 3.01Å; D154-S158 WeakPolarHBondContact O-CB 3.14Å; D154-S158 PolarHBondContact O-N 3.21Å; D154-S158 PolarHBondContact O-OG 3.24Å
155Y94.3Very high93.5Very high0 Ų048.7 Ų48.70%030%0.295CS..Hα-helixtrans-68.8-53.6173.3-70.1-66.3000111.2V124 Y127 Q141 S152 N153 S157 S158 G159 Q160 P163V124-Y155 HydrophobicContact CG1-CD1 4.11Å; V124-Y155 HydrophobicContact CG1-CE1 3.75Å; V124-Y155 HydrophobicContact CG1-CE2 4.41Å; Y127-Y155 AromaticContact CD1-CE1 3.87Å; Y127-Y155 HydrophobicContact CD1-CE1 3.87Å; Y127-Y155 HydrophobicContact CD2-CE1 4.04Å; Y127-Y155 AromaticContact CG-CE1 3.6Å; Y127-Y155 HydrophobicContact CG-CE1 3.6Å; Q141-Y155 VanDerWaalsContact OE1-CE2 3.3Å; Q141-Y155 PolarHBondContact OE1-OH 3.23Å; S152-Y155 PolarHBondContact O-N 3.32Å; N153-Y155 PolarHBondContact O-N 2.8Å; Y155-S157 VanDerWaalsContact C-N 3.33Å; Y155-S157 PolarHBondContact O-N 3.15Å; Y155-S158 CarbonylContact O-C 3.49Å; Y155-S158 WeakPolarHBondContact O-CA 3.34Å; Y155-S158 PolarHBondContact O-N 2.85Å; Y155-G159 PolarHBondContact O-N 2.83Å; Y155-Q160 CarbonylContact C-O 3.54Å; Y155-Q160 HydrophobicContact CD1-CB 4.26Å; Y155-Q160 WeakPolarHBondContact O-CA 3.23Å; Y155-Q160 WeakPolarHBondContact O-CB 3.41Å; Y155-Q160 PolarHBondContact O-N 3.43Å; Y155-P163 HydrophobicContact CD1-CG 4.26Å; Y155-P163 VanDerWaalsContact CD2-CD 3.48Å; Y155-P163 HydrophobicContact CD2-CG 4.24Å; Y155-P163 HydrophobicContact CE1-CG 3.85Å; Y155-P163 HydrophobicContact CE2-CG 3.8Å; Y155-P163 HydrophobicContact CG-CG 4.45Å
156T91.6Very high93.5Very high67 Ų6743.5 Ų43.541%0.41127%0.27SS..Hα-helixtrans-65.9-36.1-175.8570000112.4N153 S158 G159 Q160 I162N153-T156 WeakPolarHBondContact CA-OG1 3.32Å; N153-T156 PolarHBondContact O-N 2.98Å; N153-T156 PolarHBondContact O-OG1 2.95Å; N153-T156 VanDerWaalsContact O-OG1 3.13Å; T156-S158 PolarHBondContact O-N 3.42Å; T156-G159 PolarHBondContact O-N 3.11Å; T156-Q160 WeakPolarHBondContact CA-O 3.22Å; T156-I162 HydrophobicContact CG2-CD1 4.17Å; T156-I162 HydrophobicContact CG2-CG1 3.93Å
157S89.8Confident93.4Very high100 Ų10046.5 Ų46.570%0.69928%0.283SS*.Hα-helixtrans-64.3-26.5173.9-56.70000112.4N153 Y155 G159N153-S157 WeakPolarHBondContact O-CB 3.49Å; N153-S157 PolarHBondContact O-N 3.43Å; N153-S157 PolarHBondContact O-OG 3.33Å; Y155-S157 VanDerWaalsContact C-N 3.33Å; Y155-S157 PolarHBondContact O-N 3.15Å; S157-G159 VanDerWaalsContact C-N 3.32Å
158S86.1Confident93.3Very high67 Ų6748.2 Ų48.247%0.46929%0.293SS..THydrogen-bonded Turntrans-91.18.5175.3-54.40000112.9D154 Y155 T156 Q160D154-S158 WeakPolarHBondContact O-CB 3.14Å; D154-S158 PolarHBondContact O-N 3.21Å; D154-S158 PolarHBondContact O-OG 3.24Å; Y155-S158 CarbonylContact O-C 3.49Å; Y155-S158 WeakPolarHBondContact O-CA 3.34Å; Y155-S158 PolarHBondContact O-N 2.85Å; T156-S158 PolarHBondContact O-N 3.42Å; S158-Q160 PolarHBondContact O-N 3.32Å
159G88.1Confident93.1Very high74 Ų7452.2 Ų52.276%0.76332%0.319SS*.THydrogen-bonded Turntrans70.315.3-175.900000114.2Y155 T156 S157Y155-G159 PolarHBondContact O-N 2.83Å; T156-G159 PolarHBondContact O-N 3.11Å; S157-G159 VanDerWaalsContact C-N 3.32Å
160Q89.6Confident93Very high27 Ų2759.3 Ų59.313%0.12636%0.356CS..PPolyproline II helixtrans-95.8152.3178.4-57-177.40.900110.6S125 S128 Y155 T156 S158S125-Q160 PolarHBondContact O-NE2 3.11Å; S125-Q160 VanDerWaalsContact O-NE2 3.07Å; S128-Q160 PolarHBondContact OG-OE1 2.79Å; Y155-Q160 CarbonylContact C-O 3.54Å; Y155-Q160 HydrophobicContact CD1-CB 4.26Å; Y155-Q160 WeakPolarHBondContact O-CA 3.23Å; Y155-Q160 WeakPolarHBondContact O-CB 3.41Å; Y155-Q160 PolarHBondContact O-N 3.43Å; T156-Q160 WeakPolarHBondContact CA-O 3.22Å; S158-Q160 PolarHBondContact O-N 3.32Å
161T92.8Very high93Very high119 Ų11958.6 Ų58.673%0.7336%0.359SS*.PPolyproline II helixtrans-78.5146.8170.751.60000110.3P163T161-P163 WeakPolarHBondContact O-CD 3.21Å
162I93.9Very high92.8Very high46 Ų4663.9 Ų63.924%0.23638%0.379CS..PPolyproline II helixtrans-64.8123.5176.1-61.7173000108.8T156 C166 T174T156-I162 HydrophobicContact CG2-CD1 4.17Å; T156-I162 HydrophobicContact CG2-CG1 3.93Å; I162-C166 HydrophobicContact CG2-CB 3.75Å; I162-T174 HydrophobicContact CG2-CG2 3.9Å
163P95Very high92.9Very high7 Ų767.2 Ų67.25%0.04540%0.398CS..PPolyproline II helixtrans-57.6149.5178.2-30.339000113.9Y127 Y155 T161 S165 C166Y127-P163 HydrophobicContact CD1-CG 4.18Å; Y127-P163 HydrophobicContact CD2-CG 4.49Å; Y127-P163 HydrophobicContact CE1-CB 4.24Å; Y127-P163 HydrophobicContact CE1-CG 3.54Å; Y127-P163 HydrophobicContact CE2-CB 4.36Å; Y127-P163 HydrophobicContact CE2-CG 3.88Å; Y127-P163 WeakPolarHBondContact OH-CB 3.41Å; Y155-P163 HydrophobicContact CD1-CG 4.26Å; Y155-P163 VanDerWaalsContact CD2-CD 3.48Å; Y155-P163 HydrophobicContact CD2-CG 4.24Å; Y155-P163 HydrophobicContact CE1-CG 3.85Å; Y155-P163 HydrophobicContact CE2-CG 3.8Å; Y155-P163 HydrophobicContact CG-CG 4.45Å; T161-P163 WeakPolarHBondContact O-CD 3.21Å; P163-S165 VanDerWaalsContact CB-OG 3.28Å; P163-S165 WeakPolarHBondContact CB-OG 3.02Å; P163-S165 PolarHBondContact O-N 2.88Å; P163-C166 VanDerWaalsContact O-CB 3.29Å; P163-C166 WeakPolarHBondContact O-CB 3.26Å; P163-C166 PolarHBondContact O-N 3.3Å; P163-C166 VanDerWaalsContact O-N 3.09Å
164D94.7Very high93Very high122 Ų12265 Ų6565%0.65239%0.388SS*.G310 helixtrans-68-23.5172.1-71.7-35.1000112.7C166 K167D164-C166 PolarHBondContact O-N 2.78Å; D164-K167 PolarHBondContact O-N 3.31Å; D164-K167 IonicContact OD1-NZ 2.72Å; D164-K167 PolarHBondContact OD1-NZ 2.88Å
165S95.9Very high93Very high5 Ų565.2 Ų65.24%0.03539%0.387CS..G310 helixtrans-65.1-1917155.50000113.6D138 Q141 P163 K167D138-S165 WeakPolarHBondContact O-CB 3.08Å; D138-S165 VanDerWaalsContact OD1-CB 3.26Å; D138-S165 WeakPolarHBondContact OD1-CB 3.32Å; D138-S165 PolarHBondContact OD1-OG 3.05Å; Q141-S165 PolarHBondContact NE2-OG 3.48Å; P163-S165 VanDerWaalsContact CB-OG 3.28Å; P163-S165 WeakPolarHBondContact CB-OG 3.02Å; P163-S165 PolarHBondContact O-N 2.88Å; S165-K167 VanDerWaalsContact C-N 3.25Å; S165-K167 PolarHBondContact O-N 3.01Å
166C96.6Very high92.9Very high0 Ų069.7 Ų69.70%042%0.418CS..G310 helixtrans-79.4-2.9171.2-74.80000113.6Q141 C147 I162 P163 D164 T174 Y175Q141-C166 PolarHBondContact NE2-SG 2.97Å; Q141-C166 VanDerWaalsContact NE2-SG 3.38Å; Q141-C166 PolarHBondContact OE1-SG 3.07Å; Q141-C166 VanDerWaalsContact OE1-SG 3.41Å; C147-C166 WeakPolarHBondContact CA-SG 3.12Å; C147-C166 HydrophobicContact CB-CB 3.58Å; C147-C166 WeakPolarHBondContact CB-SG 3.45Å; C147-C166 WeakPolarHBondContact SG-CB 3.38Å; C147-C166 CovalentContact SG-SG 2.04Å; C147-C166 PolarHBondContact SG-SG 2.04Å; I162-C166 HydrophobicContact CG2-CB 3.75Å; P163-C166 VanDerWaalsContact O-CB 3.29Å; P163-C166 WeakPolarHBondContact O-CB 3.26Å; P163-C166 PolarHBondContact O-N 3.3Å; P163-C166 VanDerWaalsContact O-N 3.09Å; D164-C166 PolarHBondContact O-N 2.78Å; C166-T174 HydrophobicContact CB-CG2 4.2Å; C166-T174 CarbonylContact O-C 3.26Å; C166-T174 WeakPolarHBondContact O-CA 3.48Å; C166-Y175 WeakPolarHBondContact O-CD2 3.17Å; C166-Y175 PolarHBondContact O-N 3.35Å
167K95.9Very high93.1Very high63 Ų6370 Ų7027%0.27442%0.418SS..BIsolated β-bridgetrans-110.4139.7-175.7-60.9173.4-167154.60110.3D164 S165 V173D164-K167 PolarHBondContact O-N 3.31Å; D164-K167 IonicContact OD1-NZ 2.72Å; D164-K167 PolarHBondContact OD1-NZ 2.88Å; S165-K167 VanDerWaalsContact C-N 3.25Å; S165-K167 PolarHBondContact O-N 3.01Å; K167-V173 WeakPolarHBondContact CA-O 3.43Å
168N95Very high93.3Very high37 Ų3765.4 Ų65.420%0.19839%0.385CS..  trans-58.5128.3170.7-176.6-64.2000109.9N170 T171 K172 V173 Y175N168-N170 PolarHBondContact O-N 3.42Å; N168-N170 VanDerWaalsContact O-N 3.12Å; N168-N170 WeakPolarHBondContact OD1-CB 3.31Å; N168-N170 PolarHBondContact OD1-N 3.06Å; N168-T171 VanDerWaalsContact CB-OG1 3.31Å; N168-T171 WeakPolarHBondContact CB-OG1 2.99Å; N168-T171 PolarHBondContact OD1-N 3.41Å; N168-T171 VanDerWaalsContact OD1-N 3.15Å; N168-K172 VanDerWaalsContact O-CA 3.22Å; N168-K172 WeakPolarHBondContact O-CA 3.39Å; N168-K172 PolarHBondContact O-N 3.2Å; N168-V173 PolarHBondContact N-O 3.44Å; N168-Y175 HydrophobicContact CB-CE1 4.28Å
169P91.7Very high93.8Very high84 Ų8462.2 Ų62.255%0.54536%0.363SS..THydrogen-bonded Turntrans-57.2-31.6-176.4-27.935000114.3K172P169-K172 WeakPolarHBondContact O-CE 3.34Å; P169-K172 PolarHBondContact O-NZ 2.91Å
170N92.4Very high94.1Very high149 Ų14958.7 Ų58.780%0.79733%0.327SS*.THydrogen-bonded Turntrans-90.4-54.3-175.5-59-41.4000112N168N168-N170 PolarHBondContact O-N 3.42Å; N168-N170 VanDerWaalsContact O-N 3.12Å; N168-N170 WeakPolarHBondContact OD1-CB 3.31Å; N168-N170 PolarHBondContact OD1-N 3.06Å
171T94.2Very high94.3Very high89 Ų8962.1 Ų62.155%0.54635%0.346SS..THydrogen-bonded Turntrans-86.1-14.1-174.365.30000113.2N168 V173N168-T171 VanDerWaalsContact CB-OG1 3.31Å; N168-T171 WeakPolarHBondContact CB-OG1 2.99Å; N168-T171 PolarHBondContact OD1-N 3.41Å; N168-T171 VanDerWaalsContact OD1-N 3.15Å; T171-V173 PolarHBondContact O-N 2.84Å; T171-V173 PolarHBondContact OG1-N 2.85Å
172K91.8Very high94.4Very high143 Ų14359.4 Ų59.462%0.62232%0.324SS*.  trans57.711.9-172-53.9-56.4-172.1-163.50114.6N168 P169N168-K172 VanDerWaalsContact O-CA 3.22Å; N168-K172 WeakPolarHBondContact O-CA 3.39Å; N168-K172 PolarHBondContact O-N 3.2Å; P169-K172 WeakPolarHBondContact O-CE 3.34Å; P169-K172 PolarHBondContact O-NZ 2.91Å
173V94.5Very high94.3Very high92 Ų9258 Ų5856%0.55832%0.318SS*.PPolyproline II helixtrans-75131.2176.1178.10000109.3K167 N168 T171K167-V173 WeakPolarHBondContact CA-O 3.43Å; N168-V173 PolarHBondContact N-O 3.44Å; T171-V173 PolarHBondContact O-N 2.84Å; T171-V173 PolarHBondContact OG1-N 2.85Å
174T95Very high94.1Very high49 Ų4959 Ų5930%0.30132%0.322SS..BIsolated β-bridgetrans-69.4135.7175.3-53.60000110.7I162 C166 S176I162-T174 HydrophobicContact CG2-CG2 3.9Å; C166-T174 HydrophobicContact CB-CG2 4.2Å; C166-T174 CarbonylContact O-C 3.26Å; C166-T174 WeakPolarHBondContact O-CA 3.48Å; T174-S176 PolarHBondContact O-N 3.34Å
175Y95.1Very high94Very high29 Ų2955.9 Ų55.911%0.11431%0.31CS..PPolyproline II helixtrans-64.4131.1173-58-58.5000111Q145 C147 C166 N168Q145-Y175 VanDerWaalsContact C-CG 3.41Å; Q145-Y175 HydrophobicContact CB-CD1 3.9Å; Q145-Y175 HydrophobicContact CB-CE1 3.6Å; Q145-Y175 HydrophobicContact CB-CE2 4.39Å; Q145-Y175 HydrophobicContact CB-CG 4.4Å; Q145-Y175 HydrophobicContact CG-CE1 4.01Å; C147-Y175 WeakPolarHBondContact CB-O 3.32Å; C166-Y175 WeakPolarHBondContact O-CD2 3.17Å; C166-Y175 PolarHBondContact O-N 3.35Å; N168-Y175 HydrophobicContact CB-CE1 4.28Å
176S91.2Very high93.8Very high95 Ų9559.9 Ų59.966%0.66433%0.327SS*.  trans-80.5-29.3179.153.50000113.2T174T174-S176 PolarHBondContact O-N 3.34Å
177D94.8Very high93.4Very high74 Ų7465.1 Ų65.140%0.39635%0.35SS..SBendtrans-81.9134.1-171.1-61.7-24.3000111.3C146 C147 K182C146-D177 CarbonylContact C-O 3.59Å; C146-D177 WeakPolarHBondContact CA-O 3.32Å; C146-D177 WeakPolarHBondContact CB-O 3.2Å; C147-D177 PolarHBondContact N-O 2.88Å; D177-K182 HydrophobicContact CB-CD 4.49Å; D177-K182 HydrophobicContact CB-CG 4.22Å; D177-K182 WeakPolarHBondContact OD2-CE 3.5Å; D177-K182 IonicContact OD2-NZ 2.71Å; D177-K182 PolarHBondContact OD2-NZ 2.89Å
178G95.9Very high93.1Very high2 Ų268.5 Ų68.52%0.02137%0.367CS..  trans-67.5143.2170.600000113.1S149 E150 S180 N181 K182S149-G178 CarbonylContact O-C 3.07Å; S149-G178 VanDerWaalsContact O-C 3.3Å; S149-G178 WeakPolarHBondContact O-CA 3.44Å; E150-G178 WeakPolarHBondContact O-CA 3.18Å; E150-G178 PolarHBondContact O-N 3.12Å; G178-S180 VanDerWaalsContact C-N 3.28Å; G178-S180 PolarHBondContact O-N 3.27Å; G178-N181 PolarHBondContact O-N 3.12Å; G178-K182 PolarHBondContact O-N 3.37Å
179C95.7Very high93Very high1 Ų174.4 Ų74.41%0.00739%0.39CS..Hα-helixtrans-65.8-30.2-179.4-66.10000113.4L140 C146 G148 S149 N181 K182 V183L140-C179 HydrophobicContact CD2-CB 3.51Å; L140-C179 VanDerWaalsContact CD2-SG 3.57Å; C146-C179 VanDerWaalsContact C-SG 3.59Å; C146-C179 HydrophobicContact CB-CB 3.9Å; C146-C179 WeakPolarHBondContact CB-SG 3.47Å; C146-C179 WeakPolarHBondContact SG-CA 3.22Å; C146-C179 WeakPolarHBondContact SG-CB 3.46Å; C146-C179 CovalentContact SG-SG 2.04Å; C146-C179 PolarHBondContact SG-SG 3.25Å; G148-C179 WeakPolarHBondContact O-CB 3.35Å; G148-C179 PolarHBondContact O-N 3.01Å; G148-C179 PolarHBondContact O-SG 2.94Å; S149-C179 PolarHBondContact O-N 2.95Å; S149-C179 VanDerWaalsContact O-N 3.12Å; C179-N181 PolarHBondContact O-N 3.49Å; C179-K182 PolarHBondContact O-N 3.41Å; C179-V183 WeakPolarHBondContact O-CB 3.01Å; C179-V183 VanDerWaalsContact O-CG2 3.23Å; C179-V183 WeakPolarHBondContact O-CG2 3.49Å; C179-V183 PolarHBondContact O-N 2.78Å
180S94.6Very high93.1Very high0 Ų075.4 Ų75.40%038%0.384CS..Hα-helixtrans-58.4-47.3176-71.80000112.1V120 S149 G178 V183 I184V120-S180 WeakPolarHBondContact CB-OG 3.36Å; V120-S180 WeakPolarHBondContact CG1-OG 3.24Å; S149-S180 WeakPolarHBondContact O-CB 3.48Å; S149-S180 PolarHBondContact O-N 3.36Å; S149-S180 PolarHBondContact O-OG 3.01Å; S149-S180 PolarHBondContact OG-OG 2.89Å; G178-S180 VanDerWaalsContact C-N 3.28Å; G178-S180 PolarHBondContact O-N 3.27Å; S180-V183 PolarHBondContact O-N 3.12Å; S180-I184 WeakPolarHBondContact O-CB 3.5Å; S180-I184 WeakPolarHBondContact O-CD1 3.22Å; S180-I184 WeakPolarHBondContact O-CG1 3.37Å; S180-I184 PolarHBondContact O-N 3.19Å
181N92.8Very high93Very high98 Ų9872.1 Ų72.152%0.52437%0.366SS..Hα-helixtrans-69.9-37.4-179.9-71.8-23000112.2G178 C179 S185G178-N181 PolarHBondContact O-N 3.12Å; C179-N181 PolarHBondContact O-N 3.49Å; N181-S185 WeakPolarHBondContact O-CB 3.47Å; N181-S185 PolarHBondContact O-N 3.49Å; N181-S185 PolarHBondContact O-OG 3.48Å
182K94.7Very high93Very high63 Ų6372.7 Ų72.727%0.27437%0.369SS..Hα-helixtrans-64.6-42.4174-72.7-71.2-167.5-168.60112.4F144 C146 D177 G178 C179 S185 F186F144-K182 HydrophobicContact CB-CB 4.2Å; F144-K182 HydrophobicContact CD1-CB 4.43Å; C146-K182 HydrophobicContact CB-CB 4.33Å; C146-K182 HydrophobicContact CB-CG 3.92Å; D177-K182 HydrophobicContact CB-CD 4.49Å; D177-K182 HydrophobicContact CB-CG 4.22Å; D177-K182 WeakPolarHBondContact OD2-CE 3.5Å; D177-K182 IonicContact OD2-NZ 2.71Å; D177-K182 PolarHBondContact OD2-NZ 2.89Å; G178-K182 PolarHBondContact O-N 3.37Å; C179-K182 PolarHBondContact O-N 3.41Å; K182-S185 WeakPolarHBondContact CA-OG 3.48Å; K182-S185 PolarHBondContact O-OG 3.08Å; K182-F186 WeakPolarHBondContact O-CB 3.23Å; K182-F186 PolarHBondContact O-N 3.23Å
183V92.4Very high93.1Very high16 Ų1668.7 Ų68.710%0.09736%0.362CS..Hα-helixtrans-68.4-42.6177.6174.40000110.7F116 L140 C179 S180 F186 F187F116-V183 HydrophobicContact CE1-CB 4.47Å; F116-V183 HydrophobicContact CE1-CG1 4.27Å; F116-V183 HydrophobicContact CE2-CG1 4.31Å; F116-V183 HydrophobicContact CZ-CB 4.05Å; F116-V183 HydrophobicContact CZ-CG1 3.53Å; L140-V183 HydrophobicContact CD1-CG2 4.5Å; L140-V183 HydrophobicContact CD2-CG2 4.29Å; C179-V183 WeakPolarHBondContact O-CB 3.01Å; C179-V183 VanDerWaalsContact O-CG2 3.23Å; C179-V183 WeakPolarHBondContact O-CG2 3.49Å; C179-V183 PolarHBondContact O-N 2.78Å; S180-V183 PolarHBondContact O-N 3.12Å; V183-F186 WeakPolarHBondContact O-CB 3.28Å; V183-F186 PolarHBondContact O-N 2.78Å; V183-F187 HydrophobicContact CG1-CD2 3.62Å; V183-F187 HydrophobicContact CG1-CE2 3.42Å; V183-F187 VanDerWaalsContact CG1-CE2 3.42Å; V183-F187 WeakPolarHBondContact O-CD2 3.19Å; V183-F187 PolarHBondContact O-N 2.49Å
184I91.8Very high93Very high29 Ų2968 Ų6815%0.14936%0.358CS..Hα-helixtrans-60.9-49.1175.4-71165.4000111K113 F116 L117 S180 F186 F187 E188K113-I184 HydrophobicContact CG-CD1 4.39Å; F116-I184 HydrophobicContact CD1-CD1 4.3Å; F116-I184 HydrophobicContact CD1-CG1 4.22Å; F116-I184 HydrophobicContact CE1-CD1 4.42Å; F116-I184 HydrophobicContact CE1-CG1 4.07Å; L117-I184 HydrophobicContact CD2-CD1 4.11Å; S180-I184 WeakPolarHBondContact O-CB 3.5Å; S180-I184 WeakPolarHBondContact O-CD1 3.22Å; S180-I184 WeakPolarHBondContact O-CG1 3.37Å; S180-I184 PolarHBondContact O-N 3.19Å; I184-F186 VanDerWaalsContact C-N 3.27Å; I184-F186 PolarHBondContact O-N 3.49Å; I184-F187 CarbonylContact O-C 3.49Å; I184-F187 WeakPolarHBondContact O-CA 3.43Å; I184-F187 WeakPolarHBondContact O-CB 3.37Å; I184-F187 PolarHBondContact O-N 2.87Å; I184-E188 HydrophobicContact CG2-CG 4.31Å; I184-E188 WeakPolarHBondContact O-CG 3.47Å; I184-E188 PolarHBondContact O-N 3.06Å
185S92.2Very high92.8Very high56 Ų5670.9 Ų70.939%0.39237%0.371SS..Hα-helixtrans-63.5-32.6178.1550000113N181 K182 E188 K189N181-S185 WeakPolarHBondContact O-CB 3.47Å; N181-S185 PolarHBondContact O-N 3.49Å; N181-S185 PolarHBondContact O-OG 3.48Å; K182-S185 WeakPolarHBondContact CA-OG 3.48Å; K182-S185 PolarHBondContact O-OG 3.08Å; S185-E188 PolarHBondContact O-N 3Å; S185-K189 PolarHBondContact O-N 2.91Å
186F91Very high92.8Very high88 Ų8873.6 Ų73.639%0.38639%0.391SS..Hα-helixtrans-63.2-47.5169.6-179.9-87.8000111.3F144 K182 V183 I184 E188 K189 Y190F144-F186 HydrophobicContact CE1-CB 3.8Å; F144-F186 HydrophobicContact CE1-CD1 4.39Å; F144-F186 AromaticContact CE1-CD2 3.69Å; F144-F186 HydrophobicContact CE1-CD2 3.69Å; F144-F186 HydrophobicContact CE1-CE2 4.33Å; F144-F186 AromaticContact CE1-CG 3.72Å; F144-F186 HydrophobicContact CE1-CG 3.72Å; F144-F186 HydrophobicContact CZ-CD2 4.31Å; F144-F186 HydrophobicContact CZ-CG 4.29Å; K182-F186 WeakPolarHBondContact O-CB 3.23Å; K182-F186 PolarHBondContact O-N 3.23Å; V183-F186 WeakPolarHBondContact O-CB 3.28Å; V183-F186 PolarHBondContact O-N 2.78Å; I184-F186 VanDerWaalsContact C-N 3.27Å; I184-F186 PolarHBondContact O-N 3.49Å; F186-E188 PolarHBondContact O-N 3.44Å; F186-K189 WeakPolarHBondContact O-CB 3.04Å; F186-K189 PolarHBondContact O-N 3.15Å; F186-Y190 AromaticContact CD1-CD2 3.97Å; F186-Y190 HydrophobicContact CD1-CD2 3.97Å; F186-Y190 HydrophobicContact CD1-CE2 4.43Å; F186-Y190 HydrophobicContact CD2-CD2 4.12Å; F186-Y190 AromaticContact CD2-CE2 3.8Å; F186-Y190 HydrophobicContact CD2-CE2 3.8Å; F186-Y190 AromaticContact CE1-CD2 3.67Å; F186-Y190 HydrophobicContact CE1-CD2 3.67Å; F186-Y190 HydrophobicContact CE1-CE2 4.01Å; F186-Y190 AromaticContact CE2-CD2 3.87Å; F186-Y190 HydrophobicContact CE2-CD2 3.87Å; F186-Y190 AromaticContact CE2-CE2 3.34Å; F186-Y190 HydrophobicContact CE2-CE2 3.34Å; F186-Y190 HydrophobicContact CG-CD2 4.18Å; F186-Y190 HydrophobicContact CG-CE2 4.33Å; F186-Y190 AromaticContact CZ-CD2 3.62Å; F186-Y190 HydrophobicContact CZ-CD2 3.62Å; F186-Y190 AromaticContact CZ-CE2 3.44Å; F186-Y190 HydrophobicContact CZ-CE2 3.44Å; F186-Y190 VanDerWaalsContact CZ-CE2 3.44Å; F186-Y190 VanDerWaalsContact O-CD2 3.27Å; F186-Y190 WeakPolarHBondContact O-CD2 3.42Å; F186-Y190 PolarHBondContact O-N 3.47Å; F186-Y190 VanDerWaalsContact O-N 3.16Å
187F89.1Confident92.9Very high111 Ų11171.1 Ų71.149%0.48738%0.376SS..Hα-helixtrans-61.8-41.6175.1-81-66.4000112.2V183 I184 K189 Y190 I191V183-F187 HydrophobicContact CG1-CD2 3.62Å; V183-F187 HydrophobicContact CG1-CE2 3.42Å; V183-F187 VanDerWaalsContact CG1-CE2 3.42Å; V183-F187 WeakPolarHBondContact O-CD2 3.19Å; V183-F187 PolarHBondContact O-N 2.49Å; I184-F187 CarbonylContact O-C 3.49Å; I184-F187 WeakPolarHBondContact O-CA 3.43Å; I184-F187 WeakPolarHBondContact O-CB 3.37Å; I184-F187 PolarHBondContact O-N 2.87Å; F187-K189 PolarHBondContact O-N 3.4Å; F187-Y190 CarbonylContact O-C 3.55Å; F187-Y190 PolarHBondContact O-N 2.74Å; F187-I191 WeakPolarHBondContact O-CA 3.28Å; F187-I191 VanDerWaalsContact O-CB 3.32Å; F187-I191 WeakPolarHBondContact O-CB 3.35Å; F187-I191 PolarHBondContact O-N 2.88Å
188E90.2Very high92.8Very high134 Ų13470.1 Ų70.163%0.62638%0.378SS*.Hα-helixtrans-60.1-34.9175.6-73176.2167.800112.2I184 S185 F186 I191I184-E188 HydrophobicContact CG2-CG 4.31Å; I184-E188 WeakPolarHBondContact O-CG 3.47Å; I184-E188 PolarHBondContact O-N 3.06Å; S185-E188 PolarHBondContact O-N 3Å; F186-E188 PolarHBondContact O-N 3.44Å; E188-I191 VanDerWaalsContact O-CG2 3.23Å; E188-I191 WeakPolarHBondContact O-CG2 3.25Å
189K92.7Very high92.6Very high160 Ų16076.6 Ų76.670%0.69641%0.406SS*.Hα-helixtrans-67.6-37.1173.8-174.9178.1178.5-179.70112.6S185 F186 F187S185-K189 PolarHBondContact O-N 2.91Å; F186-K189 WeakPolarHBondContact O-CB 3.04Å; F186-K189 PolarHBondContact O-N 3.15Å; F187-K189 PolarHBondContact O-N 3.4Å
190Y93Very high92.6Very high105 Ų10580 Ų8041%0.41243%0.426SS..Hα-helixtrans-100.92.3-177.3-68.4-74.6000114.3F186 F187 V192 A193 V194F186-Y190 AromaticContact CD1-CD2 3.97Å; F186-Y190 HydrophobicContact CD1-CD2 3.97Å; F186-Y190 HydrophobicContact CD1-CE2 4.43Å; F186-Y190 HydrophobicContact CD2-CD2 4.12Å; F186-Y190 AromaticContact CD2-CE2 3.8Å; F186-Y190 HydrophobicContact CD2-CE2 3.8Å; F186-Y190 AromaticContact CE1-CD2 3.67Å; F186-Y190 HydrophobicContact CE1-CD2 3.67Å; F186-Y190 HydrophobicContact CE1-CE2 4.01Å; F186-Y190 AromaticContact CE2-CD2 3.87Å; F186-Y190 HydrophobicContact CE2-CD2 3.87Å; F186-Y190 AromaticContact CE2-CE2 3.34Å; F186-Y190 HydrophobicContact CE2-CE2 3.34Å; F186-Y190 HydrophobicContact CG-CD2 4.18Å; F186-Y190 HydrophobicContact CG-CE2 4.33Å; F186-Y190 AromaticContact CZ-CD2 3.62Å; F186-Y190 HydrophobicContact CZ-CD2 3.62Å; F186-Y190 AromaticContact CZ-CE2 3.44Å; F186-Y190 HydrophobicContact CZ-CE2 3.44Å; F186-Y190 VanDerWaalsContact CZ-CE2 3.44Å; F186-Y190 VanDerWaalsContact O-CD2 3.27Å; F186-Y190 WeakPolarHBondContact O-CD2 3.42Å; F186-Y190 PolarHBondContact O-N 3.47Å; F186-Y190 VanDerWaalsContact O-N 3.16Å; F187-Y190 CarbonylContact O-C 3.55Å; F187-Y190 PolarHBondContact O-N 2.74Å; Y190-V192 PolarHBondContact O-N 3.42Å; Y190-A193 WeakPolarHBondContact O-CB 3.28Å; Y190-A193 PolarHBondContact O-N 2.75Å; Y190-V194 PolarHBondContact O-N 3.05Å; Y190-V194 VanDerWaalsContact O-N 3.07Å
191I91.1Very high92.5Very high80 Ų8085.9 Ų85.941%0.4145%0.452SS..Hα-helixtrans-60.9-37.1-173.6-166.861.2000111.5F187 E188 A193 V194 L195F187-I191 WeakPolarHBondContact O-CA 3.28Å; F187-I191 VanDerWaalsContact O-CB 3.32Å; F187-I191 WeakPolarHBondContact O-CB 3.35Å; F187-I191 PolarHBondContact O-N 2.88Å; E188-I191 VanDerWaalsContact O-CG2 3.23Å; E188-I191 WeakPolarHBondContact O-CG2 3.25Å; I191-A193 VanDerWaalsContact C-N 3.33Å; I191-A193 PolarHBondContact O-N 2.79Å; I191-V194 PolarHBondContact O-N 2.84Å; I191-L195 HydrophobicContact CG1-CD1 4.39Å; I191-L195 HydrophobicContact CG1-CG 4.49Å; I191-L195 WeakPolarHBondContact O-CG 3.29Å; I191-L195 PolarHBondContact O-N 2.55Å
192V93.3Very high92.5Very high101 Ų10182.6 Ų82.661%0.61244%0.439SS*.Hα-helixtrans-62.1-41.8176.5178.80000110.8Y190 L195 V196Y190-V192 PolarHBondContact O-N 3.42Å; V192-L195 PolarHBondContact O-N 3.48Å; V192-V196 WeakPolarHBondContact O-CB 3.4Å; V192-V196 VanDerWaalsContact O-CG2 3.26Å; V192-V196 WeakPolarHBondContact O-CG2 3.38Å; V192-V196 PolarHBondContact O-N 2.94Å
193A94.6Very high92.5Very high59 Ų5983 Ų8349%0.48844%0.443SS..Hα-helixtrans-66.6-39.2177.600000111.8Y190 I191 V196 A197Y190-A193 WeakPolarHBondContact O-CB 3.28Å; Y190-A193 PolarHBondContact O-N 2.75Å; I191-A193 VanDerWaalsContact C-N 3.33Å; I191-A193 PolarHBondContact O-N 2.79Å; A193-V196 PolarHBondContact O-N 3.34Å; A193-A197 WeakPolarHBondContact O-CB 3.17Å; A193-A197 PolarHBondContact O-N 3.22Å
194V91.4Very high92.6Very high78 Ų7885.1 Ų85.147%0.47345%0.453SS..Hα-helixtrans-64.2-44.2175.5176.70000111.1Y190 I191 A197 A198Y190-V194 PolarHBondContact O-N 3.05Å; Y190-V194 VanDerWaalsContact O-N 3.07Å; I191-V194 PolarHBondContact O-N 2.84Å; V194-A197 PolarHBondContact O-N 2.84Å; V194-A198 WeakPolarHBondContact O-CB 3.39Å; V194-A198 PolarHBondContact O-N 3.34Å
195L91.8Very high92.7Very high109 Ų10985 Ų8557%0.57145%0.452SS*.Hα-helixtrans-63.5-42.7176.6-71.3175000112I191 V192 A198 F199I191-L195 HydrophobicContact CG1-CD1 4.39Å; I191-L195 HydrophobicContact CG1-CG 4.49Å; I191-L195 WeakPolarHBondContact O-CG 3.29Å; I191-L195 PolarHBondContact O-N 2.55Å; V192-L195 PolarHBondContact O-N 3.48Å; L195-A198 PolarHBondContact O-N 2.61Å; L195-F199 WeakPolarHBondContact O-CB 3.3Å; L195-F199 PolarHBondContact O-N 3.2Å
196V94.9Very high92.8Very high87 Ų8786.8 Ų86.853%0.52746%0.457SS..Hα-helixtrans-61.3-45.2174.4169.60000110.6V192 A193 F199 V200V192-V196 WeakPolarHBondContact O-CB 3.4Å; V192-V196 VanDerWaalsContact O-CG2 3.26Å; V192-V196 WeakPolarHBondContact O-CG2 3.38Å; V192-V196 PolarHBondContact O-N 2.94Å; A193-V196 PolarHBondContact O-N 3.34Å; V196-F199 PolarHBondContact O-N 3.25Å; V196-V200 HydrophobicContact CG1-CG2 4.49Å; V196-V200 WeakPolarHBondContact O-CG2 3.02Å; V196-V200 PolarHBondContact O-N 2.84Å
197A92.9Very high93Very high42 Ų4286.1 Ų86.135%0.34746%0.457SS..Hα-helixtrans-60.6-47.8177.100000111.6A193 V194 F199 V200 F201A193-A197 WeakPolarHBondContact O-CB 3.17Å; A193-A197 PolarHBondContact O-N 3.22Å; V194-A197 PolarHBondContact O-N 2.84Å; A197-F199 VanDerWaalsContact C-N 3.32Å; A197-F199 PolarHBondContact O-N 3.49Å; A197-V200 PolarHBondContact O-N 3.48Å; A197-F201 HydrophobicContact CB-CE2 4.49Å; A197-F201 WeakPolarHBondContact O-CD2 3.47Å; A197-F201 PolarHBondContact O-N 2.04Å
198A92.5Very high93.3Very high53 Ų5381.1 Ų81.144%0.43844%0.436SS..Hα-helixtrans-58.8-42.417700000112.1V194 L195 F201 A202V194-A198 WeakPolarHBondContact O-CB 3.39Å; V194-A198 PolarHBondContact O-N 3.34Å; L195-A198 PolarHBondContact O-N 2.61Å; A198-F201 PolarHBondContact O-N 3.41Å; A198-A202 PolarHBondContact O-N 3.09Å
199F92.9Very high93.5Very high139 Ų13976 Ų7661%0.6141%0.413SS*.Hα-helixtrans-64.1-41.8176-176.5-107000112.6L195 V196 A197 A202 I203L195-F199 WeakPolarHBondContact O-CB 3.3Å; L195-F199 PolarHBondContact O-N 3.2Å; V196-F199 PolarHBondContact O-N 3.25Å; A197-F199 VanDerWaalsContact C-N 3.32Å; A197-F199 PolarHBondContact O-N 3.49Å; F199-A202 PolarHBondContact O-N 2.63Å; F199-I203 HydrophobicContact CD1-CD1 3.79Å; F199-I203 HydrophobicContact CE1-CD1 3.3Å; F199-I203 HydrophobicContact CE1-CG1 4.31Å; F199-I203 HydrophobicContact CE2-CD1 4.43Å; F199-I203 HydrophobicContact CZ-CD1 3.67Å; F199-I203 HydrophobicContact CZ-CG1 4.35Å; F199-I203 WeakPolarHBondContact O-CG1 3.29Å; F199-I203 PolarHBondContact O-N 3.28Å
200V94.8Very high93.6Very high71 Ų7172.1 Ų72.143%0.4340%0.402SS..Hα-helixtrans-62.5-43.9174.3170.60000110.9V196 A197 A202 I203 L204V196-V200 HydrophobicContact CG1-CG2 4.49Å; V196-V200 WeakPolarHBondContact O-CG2 3.02Å; V196-V200 PolarHBondContact O-N 2.84Å; A197-V200 PolarHBondContact O-N 3.48Å; V200-A202 PolarHBondContact O-N 3.2Å; V200-I203 PolarHBondContact O-N 2.99Å; V200-L204 HydrophobicContact CG1-CD1 4Å; V200-L204 HydrophobicContact CG1-CG 4.34Å; V200-L204 VanDerWaalsContact O-CG 3.31Å; V200-L204 WeakPolarHBondContact O-CG 3.33Å; V200-L204 PolarHBondContact O-N 3.27Å
201F92.2Very high93.7Very high124 Ų12468.7 Ų68.754%0.54439%0.389SS..Hα-helixtrans-59.3-45.2175.4-79.9-65.3000112A197 A198 I203 L204 Q205A197-F201 HydrophobicContact CB-CE2 4.49Å; A197-F201 WeakPolarHBondContact O-CD2 3.47Å; A197-F201 PolarHBondContact O-N 2.04Å; A198-F201 PolarHBondContact O-N 3.41Å; F201-I203 VanDerWaalsContact C-N 3.35Å; F201-I203 PolarHBondContact O-N 3.38Å; F201-L204 PolarHBondContact O-N 2.94Å; F201-Q205 WeakPolarHBondContact O-CG 3.44Å; F201-Q205 PolarHBondContact O-N 3.42Å
202A93.5Very high93.8Very high30 Ų3064.9 Ų64.925%0.24837%0.37CS..Hα-helixtrans-60.3-42.2176.300000112.3A198 F199 V200 Q205 L206A198-A202 PolarHBondContact O-N 3.09Å; F199-A202 PolarHBondContact O-N 2.63Å; V200-A202 PolarHBondContact O-N 3.2Å; A202-Q205 PolarHBondContact O-N 3.48Å; A202-L206 WeakPolarHBondContact O-CG 3.39Å; A202-L206 PolarHBondContact O-N 3.34Å
203I93.8Very high93.9Very high70 Ų7062.5 Ų62.536%0.35936%0.356SS..Hα-helixtrans-62.3-46174.3-70.6172.5000111F199 V200 F201 Q205 L206 L207F199-I203 HydrophobicContact CD1-CD1 3.79Å; F199-I203 HydrophobicContact CE1-CD1 3.3Å; F199-I203 HydrophobicContact CE1-CG1 4.31Å; F199-I203 HydrophobicContact CE2-CD1 4.43Å; F199-I203 HydrophobicContact CZ-CD1 3.67Å; F199-I203 HydrophobicContact CZ-CG1 4.35Å; F199-I203 WeakPolarHBondContact O-CG1 3.29Å; F199-I203 PolarHBondContact O-N 3.28Å; V200-I203 PolarHBondContact O-N 2.99Å; F201-I203 VanDerWaalsContact C-N 3.35Å; F201-I203 PolarHBondContact O-N 3.38Å; I203-Q205 VanDerWaalsContact C-N 3.28Å; I203-Q205 PolarHBondContact O-N 2.94Å; I203-L206 PolarHBondContact O-N 3.39Å; I203-L207 HydrophobicContact CG2-CD1 3.9Å; I203-L207 HydrophobicContact CG2-CG 4.2Å; I203-L207 WeakPolarHBondContact O-CB 3.4Å; I203-L207 WeakPolarHBondContact O-CG 3.21Å; I203-L207 PolarHBondContact O-N 3.09Å
204L93.9Very high93.8Very high61 Ų6162.4 Ų62.432%0.31935%0.351SS..Hα-helixtrans-61.6-37.3179.5-71173000112.1F18 V200 F201 S208F18-L204 HydrophobicContact CE2-CB 4.34Å; F18-L204 HydrophobicContact CE2-CD1 4.21Å; F18-L204 HydrophobicContact CZ-CB 4.24Å; V200-L204 HydrophobicContact CG1-CD1 4Å; V200-L204 HydrophobicContact CG1-CG 4.34Å; V200-L204 VanDerWaalsContact O-CG 3.31Å; V200-L204 WeakPolarHBondContact O-CG 3.33Å; V200-L204 PolarHBondContact O-N 3.27Å; F201-L204 PolarHBondContact O-N 2.94Å; L204-S208 WeakPolarHBondContact O-CB 2.93Å; L204-S208 PolarHBondContact O-N 3.5Å; L204-S208 PolarHBondContact O-OG 3.49Å
205Q94.8Very high93.8Very high26 Ų2659 Ų5912%0.12133%0.33CS..Hα-helixtrans-64.9-47.8173.8-71.4176.4-5.500111.8L91 V95 E98 F201 A202 I203 L207 S208 I209L91-Q205 HydrophobicContact CD2-CG 4.49Å; V95-Q205 HydrophobicContact CG2-CB 3.74Å; E98-Q205 PolarHBondContact OE1-NE2 2.83Å; E98-Q205 PolarHBondContact OE2-OE1 2.88Å; E98-Q205 VanDerWaalsContact OE2-OE1 3.13Å; F201-Q205 WeakPolarHBondContact O-CG 3.44Å; F201-Q205 PolarHBondContact O-N 3.42Å; A202-Q205 PolarHBondContact O-N 3.48Å; I203-Q205 VanDerWaalsContact C-N 3.28Å; I203-Q205 PolarHBondContact O-N 2.94Å; Q205-L207 VanDerWaalsContact C-N 3.34Å; Q205-L207 PolarHBondContact O-N 3.17Å; Q205-S208 WeakPolarHBondContact O-CB 3.5Å; Q205-S208 PolarHBondContact O-N 3.31Å; Q205-S208 VanDerWaalsContact O-N 3.16Å; Q205-I209 WeakPolarHBondContact O-CG1 3.4Å; Q205-I209 PolarHBondContact O-N 2.76Å
206L94.9Very high93.9Very high95 Ų9554.7 Ų54.750%0.49731%0.307SS..Hα-helixtrans-60-44.1177.1-71173.5000111.7V95 A202 I203 S208 I209 V210V95-L206 HydrophobicContact CG1-CD2 4.42Å; A202-L206 WeakPolarHBondContact O-CG 3.39Å; A202-L206 PolarHBondContact O-N 3.34Å; I203-L206 PolarHBondContact O-N 3.39Å; L206-S208 VanDerWaalsContact C-N 3.34Å; L206-S208 PolarHBondContact O-N 2.77Å; L206-I209 PolarHBondContact O-N 2.81Å; L206-V210 WeakPolarHBondContact O-CG2 3.46Å; L206-V210 PolarHBondContact O-N 3.38Å
207L94.2Very high93.7Very high73 Ų7359.2 Ų59.238%0.38232%0.315SS..Hα-helixtrans-61.1-43.1174.8-70.7177.3000111.5I203 Q205 I209 V210 F211I203-L207 HydrophobicContact CG2-CD1 3.9Å; I203-L207 HydrophobicContact CG2-CG 4.2Å; I203-L207 WeakPolarHBondContact O-CB 3.4Å; I203-L207 WeakPolarHBondContact O-CG 3.21Å; I203-L207 PolarHBondContact O-N 3.09Å; Q205-L207 VanDerWaalsContact C-N 3.34Å; Q205-L207 PolarHBondContact O-N 3.17Å; L207-I209 VanDerWaalsContact C-N 3.33Å; L207-I209 PolarHBondContact O-N 2.89Å; L207-V210 PolarHBondContact O-N 3.09Å; L207-F211 HydrophobicContact CB-CE2 4.06Å; L207-F211 HydrophobicContact CB-CZ 4.15Å; L207-F211 HydrophobicContact CD2-CE1 4.45Å; L207-F211 HydrophobicContact CD2-CZ 4.16Å; L207-F211 WeakPolarHBondContact O-CB 3.48Å; L207-F211 WeakPolarHBondContact O-CD1 3.33Å; L207-F211 WeakPolarHBondContact O-CD2 3.38Å; L207-F211 WeakPolarHBondContact O-CG 3.33Å; L207-F211 PolarHBondContact O-N 3.03Å
208S95.1Very high93.6Very high6 Ų659 Ų594%0.04231%0.313CS..Hα-helixtrans-61.9-39.3177.6-61.80000112.4F18 Y87 L204 Q205 L206 A212F18-S208 WeakPolarHBondContact CD1-OG 3.33Å; F18-S208 VanDerWaalsContact CE1-OG 3.27Å; F18-S208 WeakPolarHBondContact CE1-OG 3.21Å; Y87-S208 WeakPolarHBondContact OH-CB 3.27Å; L204-S208 WeakPolarHBondContact O-CB 2.93Å; L204-S208 PolarHBondContact O-N 3.5Å; L204-S208 PolarHBondContact O-OG 3.49Å; Q205-S208 WeakPolarHBondContact O-CB 3.5Å; Q205-S208 PolarHBondContact O-N 3.31Å; Q205-S208 VanDerWaalsContact O-N 3.16Å; L206-S208 VanDerWaalsContact C-N 3.34Å; L206-S208 PolarHBondContact O-N 2.77Å; S208-A212 VanDerWaalsContact O-CB 3.27Å; S208-A212 WeakPolarHBondContact O-CB 3.18Å; S208-A212 PolarHBondContact O-N 3.29Å
209I96.1Very high93.4Very high27 Ų2757.5 Ų57.514%0.13830%0.297CS..Hα-helixtrans-64.4-49.5174.3-66.5164.6000110.3L91 V95 Q205 L206 L207 F211 A212 V213L91-I209 HydrophobicContact CB-CD1 4.09Å; L91-I209 HydrophobicContact CB-CG1 3.78Å; L91-I209 HydrophobicContact CD1-CG1 4.14Å; V95-I209 HydrophobicContact CG2-CD1 4.08Å; Q205-I209 WeakPolarHBondContact O-CG1 3.4Å; Q205-I209 PolarHBondContact O-N 2.76Å; L206-I209 PolarHBondContact O-N 2.81Å; L207-I209 VanDerWaalsContact C-N 3.33Å; L207-I209 PolarHBondContact O-N 2.89Å; I209-F211 VanDerWaalsContact C-N 3.31Å; I209-F211 PolarHBondContact O-N 3.42Å; I209-A212 PolarHBondContact O-N 3.44Å; I209-V213 HydrophobicContact CG2-CG2 4.44Å; I209-V213 WeakPolarHBondContact O-CG2 3.41Å; I209-V213 PolarHBondContact O-N 3.12Å
210V94.9Very high93.3Very high79 Ų7956.2 Ų56.248%0.47929%0.292SS..Hα-helixtrans-57.8-46.6178.5171.50000110.3L206 L207 V213 C214L206-V210 WeakPolarHBondContact O-CG2 3.46Å; L206-V210 PolarHBondContact O-N 3.38Å; L207-V210 PolarHBondContact O-N 3.09Å; V210-V213 PolarHBondContact O-N 3.47Å; V210-C214 WeakPolarHBondContact O-CB 3.18Å; V210-C214 PolarHBondContact O-N 3.29Å; V210-C214 PolarHBondContact O-SG 3.1Å
211F93.5Very high92.9Very high32 Ų3256 Ų5614%0.1429%0.293CS..Hα-helixtrans-65.3-42.6179.4-61.2-14.8000112L11 L14 L15 L207 I209 V213 C214 V215L11-F211 HydrophobicContact CD1-CD1 4.48Å; L11-F211 HydrophobicContact CD2-CD1 3.62Å; L11-F211 HydrophobicContact CD2-CE1 3.4Å; L11-F211 HydrophobicContact CD2-CE2 4.36Å; L11-F211 HydrophobicContact CD2-CG 4.2Å; L11-F211 HydrophobicContact CD2-CZ 3.8Å; L11-F211 HydrophobicContact CG-CD1 4.46Å; L14-F211 HydrophobicContact CD2-CD2 4.32Å; L14-F211 HydrophobicContact CD2-CE2 3.53Å; L14-F211 HydrophobicContact CD2-CZ 4.14Å; L14-F211 HydrophobicContact CG-CE2 4.47Å; L15-F211 HydrophobicContact CD1-CB 4.31Å; L207-F211 HydrophobicContact CB-CE2 4.06Å; L207-F211 HydrophobicContact CB-CZ 4.15Å; L207-F211 HydrophobicContact CD2-CE1 4.45Å; L207-F211 HydrophobicContact CD2-CZ 4.16Å; L207-F211 WeakPolarHBondContact O-CB 3.48Å; L207-F211 WeakPolarHBondContact O-CD1 3.33Å; L207-F211 WeakPolarHBondContact O-CD2 3.38Å; L207-F211 WeakPolarHBondContact O-CG 3.33Å; L207-F211 PolarHBondContact O-N 3.03Å; I209-F211 VanDerWaalsContact C-N 3.31Å; I209-F211 PolarHBondContact O-N 3.42Å; F211-V213 PolarHBondContact O-N 3.05Å; F211-C214 PolarHBondContact O-N 3.06Å; F211-V215 WeakPolarHBondContact O-CB 3.37Å; F211-V215 VanDerWaalsContact O-CG2 3.28Å; F211-V215 WeakPolarHBondContact O-CG2 3.45Å; F211-V215 PolarHBondContact O-N 3.07Å
212A94.9Very high92.3Very high0 Ų052.2 Ų52.20%029%0.289CS..Hα-helixtrans-59.2-45.9174.400000111.5L15 L84 Y87 A88 S208 I209 V215 I216L15-A212 HydrophobicContact CD2-CB 4.48Å; L84-A212 HydrophobicContact CD2-CB 4.49Å; Y87-A212 HydrophobicContact CD1-CB 3.86Å; Y87-A212 HydrophobicContact CE1-CB 3.97Å; A88-A212 HydrophobicContact CB-CB 4.39Å; S208-A212 VanDerWaalsContact O-CB 3.27Å; S208-A212 WeakPolarHBondContact O-CB 3.18Å; S208-A212 PolarHBondContact O-N 3.29Å; I209-A212 PolarHBondContact O-N 3.44Å; A212-V215 PolarHBondContact O-N 2.68Å; A212-I216 WeakPolarHBondContact O-CB 3.13Å; A212-I216 WeakPolarHBondContact O-CD1 3.31Å; A212-I216 WeakPolarHBondContact O-CG1 3.46Å; A212-I216 PolarHBondContact O-N 3.18Å
213V94.7Very high91.3Very high52 Ų5256.9 Ų56.932%0.31531%0.31SS..Hα-helixtrans-64.3-42177.5172.50000111.6I209 V210 F211 I216 R217I209-V213 HydrophobicContact CG2-CG2 4.44Å; I209-V213 WeakPolarHBondContact O-CG2 3.41Å; I209-V213 PolarHBondContact O-N 3.12Å; V210-V213 PolarHBondContact O-N 3.47Å; F211-V213 PolarHBondContact O-N 3.05Å; V213-I216 PolarHBondContact O-N 3.41Å; V213-R217 WeakPolarHBondContact O-CB 3.28Å; V213-R217 WeakPolarHBondContact O-CG 3.47Å; V213-R217 PolarHBondContact O-N 2.97Å
214C92.5Very high89.9Confident57 Ų5758.4 Ų58.439%0.38533%0.327SS..Hα-helixtrans-60.3-45.7175-74.10000111.6V210 F211 R217 A218V210-C214 WeakPolarHBondContact O-CB 3.18Å; V210-C214 PolarHBondContact O-N 3.29Å; V210-C214 PolarHBondContact O-SG 3.1Å; F211-C214 PolarHBondContact O-N 3.06Å; C214-R217 PolarHBondContact O-N 3.35Å; C214-A218 WeakPolarHBondContact O-CB 3.44Å; C214-A218 PolarHBondContact O-N 3.31Å
215V91.8Very high87.8Confident7 Ų765 Ų654%0.04236%0.362CS..Hα-helixtrans-64.6-44.6177.6172.90000110.8Q12 L84 F211 A212 R217 A218 I219Q12-V215 HydrophobicContact CB-CG2 4.23Å; L84-V215 HydrophobicContact CD1-CB 4.37Å; L84-V215 HydrophobicContact CD1-CG1 3.65Å; F211-V215 WeakPolarHBondContact O-CB 3.37Å; F211-V215 VanDerWaalsContact O-CG2 3.28Å; F211-V215 WeakPolarHBondContact O-CG2 3.45Å; F211-V215 PolarHBondContact O-N 3.07Å; A212-V215 PolarHBondContact O-N 2.68Å; V215-R217 VanDerWaalsContact C-N 3.33Å; V215-R217 PolarHBondContact O-N 3.49Å; V215-A218 PolarHBondContact O-N 2.7Å; V215-I219 HydrophobicContact CG1-CD1 3.73Å; V215-I219 HydrophobicContact CG1-CG1 4.4Å; V215-I219 VanDerWaalsContact O-CG1 3.29Å; V215-I219 WeakPolarHBondContact O-CG1 3.46Å; V215-I219 PolarHBondContact O-N 3.32Å
216I93Very high87.5Confident17 Ų1766.9 Ų66.99%0.08737%0.374CS..Hα-helixtrans-56.1-47.6175-72.2160.9000111.1T81 L84 I85 A212 V213 I219 K220T81-I216 HydrophobicContact CG2-CG1 4.34Å; T81-I216 HydrophobicContact CG2-CG2 3.75Å; L84-I216 HydrophobicContact CB-CD1 3.74Å; L84-I216 HydrophobicContact CB-CG1 3.53Å; L84-I216 HydrophobicContact CD1-CG1 4.04Å; L84-I216 HydrophobicContact CG-CG1 4.42Å; I85-I216 HydrophobicContact CG1-CD1 3.84Å; A212-I216 WeakPolarHBondContact O-CB 3.13Å; A212-I216 WeakPolarHBondContact O-CD1 3.31Å; A212-I216 WeakPolarHBondContact O-CG1 3.46Å; A212-I216 PolarHBondContact O-N 3.18Å; V213-I216 PolarHBondContact O-N 3.41Å; I216-I219 PolarHBondContact O-N 3.24Å; I216-K220 HydrophobicContact CG2-CD 4.28Å; I216-K220 WeakPolarHBondContact O-CG 3.45Å; I216-K220 PolarHBondContact O-N 2.72Å
217R91.9Very high87.1Confident182 Ų18265.4 Ų65.469%0.68737%0.368SS*.Hα-helixtrans-63.4-42.1179.7-75.5-179.2176.8-178.8-0111.7V213 C214 V215 K220 S221V213-R217 WeakPolarHBondContact O-CB 3.28Å; V213-R217 WeakPolarHBondContact O-CG 3.47Å; V213-R217 PolarHBondContact O-N 2.97Å; C214-R217 PolarHBondContact O-N 3.35Å; V215-R217 VanDerWaalsContact C-N 3.33Å; V215-R217 PolarHBondContact O-N 3.49Å; R217-K220 PolarHBondContact O-N 3.35Å; R217-S221 PolarHBondContact O-N 2.86Å; R217-S221 PolarHBondContact O-OG 3.02Å
218A89.1Confident86.7Confident37 Ų3765 Ų6531%0.30637%0.367SS..Hα-helixtrans-64.9-38.9178.800000112.6C214 V215 S221 G222C214-A218 WeakPolarHBondContact O-CB 3.44Å; C214-A218 PolarHBondContact O-N 3.31Å; V215-A218 PolarHBondContact O-N 2.7Å; A218-S221 WeakPolarHBondContact CA-OG 3.4Å; A218-S221 PolarHBondContact O-OG 2.83Å; A218-G222 PolarHBondContact O-N 3.13Å; A218-G222 VanDerWaalsContact O-N 3.16Å
219I89Confident86.2Confident22 Ų2268.5 Ų68.511%0.11339%0.386CS..Hα-helixtrans-63.7-51.3174.5-65.6161.2000109.6K79 L84 V215 I216 S221 G222 D223K79-I219 HydrophobicContact CB-CD1 3.82Å; K79-I219 HydrophobicContact CB-CG1 4.14Å; K79-I219 HydrophobicContact CG-CD1 4.38Å; L84-I219 HydrophobicContact CD1-CD1 3.94Å; V215-I219 HydrophobicContact CG1-CD1 3.73Å; V215-I219 HydrophobicContact CG1-CG1 4.4Å; V215-I219 VanDerWaalsContact O-CG1 3.29Å; V215-I219 WeakPolarHBondContact O-CG1 3.46Å; V215-I219 PolarHBondContact O-N 3.32Å; I216-I219 PolarHBondContact O-N 3.24Å; I219-S221 VanDerWaalsContact C-N 3.32Å; I219-S221 PolarHBondContact O-N 3.31Å; I219-G222 PolarHBondContact O-N 3.32Å; I219-G222 VanDerWaalsContact O-N 3.12Å; I219-D223 PolarHBondContact O-N 3.4Å
220K90Very high85.6Confident113 Ų11371.1 Ų71.149%0.49140%0.401SS..Hα-helixtrans-61-36.9-179.5-73.3-174.9177.3-170.90113.8I216 R217 S224I216-K220 HydrophobicContact CG2-CD 4.28Å; I216-K220 WeakPolarHBondContact O-CG 3.45Å; I216-K220 PolarHBondContact O-N 2.72Å; R217-K220 PolarHBondContact O-N 3.35Å; K220-S224 PolarHBondContact O-N 3.4Å; K220-S224 PolarHBondContact O-OG 2.82Å
221S86.9Confident84.9Confident66 Ų6670.5 Ų70.546%0.46240%0.396SS..Hα-helixtrans-68.9-38.1176.257.90000112R217 A218 I219 D223 S224R217-S221 PolarHBondContact O-N 2.86Å; R217-S221 PolarHBondContact O-OG 3.02Å; A218-S221 WeakPolarHBondContact CA-OG 3.4Å; A218-S221 PolarHBondContact O-OG 2.83Å; I219-S221 VanDerWaalsContact C-N 3.32Å; I219-S221 PolarHBondContact O-N 3.31Å; S221-D223 VanDerWaalsContact C-N 3.32Å; S221-S224 PolarHBondContact O-N 3.03Å
222G80.4Confident84.3Confident44 Ų4473.3 Ų73.345%0.45441%0.414SS..Hα-helixtrans-71.6-24.417800000114A218 I219 S224A218-G222 PolarHBondContact O-N 3.13Å; A218-G222 VanDerWaalsContact O-N 3.16Å; I219-G222 PolarHBondContact O-N 3.32Å; I219-G222 VanDerWaalsContact O-N 3.12Å; G222-S224 VanDerWaalsContact C-N 3.29Å
223D72.4Confident83.5Confident129 Ų12978.9 Ų78.969%0.6945%0.446SS*.THydrogen-bonded Turntrans-79.2-12172.7-65.2-22.8000112.8I219 S221I219-D223 PolarHBondContact O-N 3.4Å; S221-D223 VanDerWaalsContact C-N 3.32Å
224S63.4Low82.6Confident101 Ų10181.2 Ų81.271%0.70646%0.457SS*.  trans-96.4-9.5-178.5-55.60000113.8K220 S221 G222K220-S224 PolarHBondContact O-N 3.4Å; K220-S224 PolarHBondContact O-OG 2.82Å; S221-S224 PolarHBondContact O-N 3.03Å; G222-S224 VanDerWaalsContact C-N 3.29Å
225D50.8Low81.7Confident199 Ų19983.4 Ų83.4100%1.06446%0.464SS*.  trans-93.60173.1-68.1-30.9000110.4

Retrieved 225 of 225 residues in 400.3 ms (Link to these results)

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